data_r5lo5sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2017-11-29 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      5lo5 
_cell.length_a      67.6000 
_cell.length_b      90.8930 
_cell.length_c      98.4690 
_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   1.435 
_diffrn_reflns.pdbx_d_res_low    45.446 
_diffrn_reflns.limit_h_max       46 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       63 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       68 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            55284 
_diffrn_reflns.pdbx_number_obs   55284 
# 
_entry.id   5lo5 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5lo5 
_symmetry.space_group_name_H-M   "I 2 2 2" 
_symmetry.Int_Tables_number      23 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 "X,  Y,  Z"               
2 "-X,  -Y,  Z"             
3 "X,  -Y,  -Z"             
4 "-X,  Y,  -Z"             
5 "X+1/2,  Y+1/2,  Z+1/2"   
6 "-X+1/2,  -Y+1/2,  Z+1/2" 
7 "X+1/2,  -Y+1/2,  -Z+1/2" 
8 "-X+1/2,  Y+1/2,  -Z+1/2" 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.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  6  o 22.85000 0.3367000 22.85000 0.3367000 22.85000 0.3367000 0.000000       0.000000  
1 1 1 0  0  8  o 116.5000 1.582000  116.5000 1.582000  116.5000 1.582000  0.000000       0.000000  
1 1 1 0  0  10 o 176.5000 2.394000  176.5000 2.394000  176.5000 2.394000  0.000000       0.000000  
1 1 1 0  0  12 o 111.8000 1.523000  111.8000 1.523000  111.8000 1.523000  0.000000       0.000000  
1 1 1 0  0  14 o 43.19000 0.8666000 43.19000 0.8666000 43.19000 0.8666000 0.000000       0.000000  
1 1 1 0  0  16 o 12.00000 0.3648000 12.00000 0.3648000 12.00000 0.3648000 0.000000       0.000000  
1 1 1 0  0  18 o 24.60000 0.4198000 24.60000 0.4198000 24.60000 0.4198000 0.000000       0.000000  
1 1 1 0  0  20 f 57.37000 0.8099000 57.37000 0.8099000 57.37000 0.8099000 0.000000       0.000000  
1 1 1 0  0  22 o 96.55000 1.327000  96.55000 1.327000  96.55000 1.327000  0.000000       0.000000  
1 1 1 0  0  24 o 110.7000 1.518000  110.7000 1.518000  110.7000 1.518000  0.000000       0.000000  
1 1 1 0  0  26 o 13.19000 0.6555000 13.19000 0.6555000 13.19000 0.6555000 0.000000       0.000000  
1 1 1 0  0  28 o 127.9000 2.475000  127.9000 2.475000  127.9000 2.475000  0.000000       0.000000  
1 1 1 0  0  30 o 38.29000 0.6207000 38.29000 0.6207000 38.29000 0.6207000 0.000000       0.000000  
1 1 1 0  0  32 o 67.74000 0.9690000 67.74000 0.9690000 67.74000 0.9690000 0.000000       0.000000  
1 1 1 0  0  34 o 106.9000 1.476000  106.9000 1.476000  106.9000 1.476000  0.000000       0.000000  
1 1 1 0  0  36 o 73.72000 1.048000  73.72000 1.048000  73.72000 1.048000  0.000000       0.000000  
1 1 1 0  0  38 o 39.86000 0.6712000 39.86000 0.6712000 39.86000 0.6712000 0.000000       0.000000  
1 1 1 0  0  40 o 5.625000 1.578000  5.625000 1.578000  5.625000 1.578000  0.000000       0.000000  
1 1 1 0  0  42 o 4.984000 1.735000  4.984000 1.735000  4.984000 1.735000  0.000000       0.000000  
1 1 1 0  0  44 o 42.28000 1.037000  42.28000 1.037000  42.28000 1.037000  0.000000       0.000000  
1 1 1 0  0  46 o 38.69000 0.9961000 38.69000 0.9961000 38.69000 0.9961000 0.000000       0.000000  
1 1 1 0  0  48 o 6.038000 1.851000  6.038000 1.851000  6.038000 1.851000  0.000000       0.000000  
1 1 1 0  0  50 o 7.808000 1.544000  7.808000 1.544000  7.808000 1.544000  0.000000       0.000000  
1 1 1 0  0  52 f 4.159000 1.680000  4.159000 1.680000  4.159000 1.680000  0.000000       0.000000  
1 1 1 0  0  54 o 18.44000 0.7640000 18.44000 0.7640000 18.44000 0.7640000 0.000000       0.000000  
1 1 1 0  0  56 o 33.85000 0.6990000 33.85000 0.6990000 33.85000 0.6990000 0.000000       0.000000  
1 1 1 0  0  58 o 3.297000 1.490000  3.297000 1.490000  3.297000 1.490000  0.000000       0.000000  
1 1 1 0  0  60 o 13.53000 0.9396000 13.53000 0.9396000 13.53000 0.9396000 0.000000       0.000000  
1 1 1 0  0  62 o 4.332000 1.673000  4.332000 1.673000  4.332000 1.673000  0.000000       0.000000  
1 1 1 0  0  64 o 3.922000 1.635000  3.922000 1.635000  3.922000 1.635000  0.000000       0.000000  
1 1 1 0  0  66 o 5.918000 1.879000  5.918000 1.879000  5.918000 1.879000  0.000000       0.000000  
1 1 1 0  0  68 o 3.935000 1.614000  3.935000 1.614000  3.935000 1.614000  0.000000       0.000000  
1 1 1 0  1  3  o 93.01000 1.263000  93.01000 1.263000  93.01000 1.263000  0.000000       0.000000  
1 1 1 0  1  5  o 33.36000 0.3291000 33.36000 0.3291000 33.36000 0.3291000 0.000000       0.000000  
1 1 1 0  1  7  o 38.35000 0.3793000 38.35000 0.3793000 38.35000 0.3793000 0.000000       0.000000  
1 1 1 0  1  9  o 59.27000 0.5770000 59.27000 0.5770000 59.27000 0.5770000 0.000000       0.000000  
1 1 1 0  1  11 o 54.50000 0.5342000 54.50000 0.5342000 54.50000 0.5342000 0.000000       0.000000  
1 1 1 0  1  13 o 57.30000 0.7945000 57.30000 0.7945000 57.30000 0.7945000 0.000000       0.000000  
1 1 1 0  1  15 o 95.66000 0.9252000 95.66000 0.9252000 95.66000 0.9252000 0.000000       0.000000  
1 1 1 0  1  17 f 3.277000 0.9602000 3.277000 0.9602000 3.277000 0.9602000 0.000000       0.000000  
1 1 1 0  1  19 o 27.03000 0.3178000 27.03000 0.3178000 27.03000 0.3178000 0.000000       0.000000  
1 1 1 0  1  21 o 16.39000 0.3013000 16.39000 0.3013000 16.39000 0.3013000 0.000000       0.000000  
1 1 1 0  1  23 o 35.65000 0.3971000 35.65000 0.3971000 35.65000 0.3971000 0.000000       0.000000  
1 1 1 0  1  25 o 51.77000 0.5336000 51.77000 0.5336000 51.77000 0.5336000 0.000000       0.000000  
1 1 1 0  1  27 o 15.87000 0.4939000 15.87000 0.4939000 15.87000 0.4939000 0.000000       0.000000  
1 1 1 0  1  29 o 57.97000 0.5947000 57.97000 0.5947000 57.97000 0.5947000 0.000000       0.000000  
1 1 1 0  1  31 o 42.75000 0.6904000 42.75000 0.6904000 42.75000 0.6904000 0.000000       0.000000  
1 1 1 0  1  33 o 31.80000 0.4221000 31.80000 0.4221000 31.80000 0.4221000 0.000000       0.000000  
1 1 1 0  1  35 o 91.53000 0.9025000 91.53000 0.9025000 91.53000 0.9025000 0.000000       0.000000  
1 1 1 0  1  37 o 47.36000 0.5204000 47.36000 0.5204000 47.36000 0.5204000 0.000000       0.000000  
1 1 1 0  1  39 o 4.794000 1.319000  4.794000 1.319000  4.794000 1.319000  0.000000       0.000000  
1 1 1 0  1  41 o 4.448000 1.704000  4.448000 1.704000  4.448000 1.704000  0.000000       0.000000  
1 1 1 0  1  43 o 3.356000 1.372000  3.356000 1.372000  3.356000 1.372000  0.000000       0.000000  
1 1 1 0  1  45 o 4.829000 1.813000  4.829000 1.813000  4.829000 1.813000  0.000000       0.000000  
1 1 1 0  1  47 o 5.325000 1.507000  5.325000 1.507000  5.325000 1.507000  0.000000       0.000000  
1 1 1 0  1  49 o 17.80000 0.6527000 17.80000 0.6527000 17.80000 0.6527000 0.000000       0.000000  
1 1 1 0  1  51 o 6.210000 1.314000  6.210000 1.314000  6.210000 1.314000  0.000000       0.000000  
1 1 1 0  1  53 o 12.03000 0.9524000 12.03000 0.9524000 12.03000 0.9524000 0.000000       0.000000  
1 1 1 0  1  55 f 18.68000 0.6092000 18.68000 0.6092000 18.68000 0.6092000 0.000000       0.000000  
1 1 1 0  1  57 o 13.33000 0.7139000 13.33000 0.7139000 13.33000 0.7139000 0.000000       0.000000  
1 1 1 0  1  59 o 11.11000 0.7094000 11.11000 0.7094000 11.11000 0.7094000 0.000000       0.000000  
1 1 1 0  1  61 o 2.919000 1.307000  2.919000 1.307000  2.919000 1.307000  0.000000       0.000000  
1 1 1 0  1  63 o 14.71000 0.8620000 14.71000 0.8620000 14.71000 0.8620000 0.000000       0.000000  
1 1 1 0  1  65 o 15.45000 0.9220000 15.45000 0.9220000 15.45000 0.9220000 0.000000       0.000000  
1 1 1 0  1  67 f 2.741000 1.257000  2.741000 1.257000  2.741000 1.257000  0.000000       0.000000  
1 1 1 0  2  0  o 150.3000 2.881000  150.3000 2.881000  150.3000 2.881000  0.000000       0.000000  
1 1 1 0  2  2  o 25.47000 0.2935000 25.47000 0.2935000 25.47000 0.2935000 0.000000       0.000000  
1 1 1 0  2  4  f 5.330000 0.1926000 5.330000 0.1926000 5.330000 0.1926000 0.000000       0.000000  
1 1 1 0  2  6  o 53.77000 0.5227000 53.77000 0.5227000 53.77000 0.5227000 0.000000       0.000000  
1 1 1 0  2  8  f 91.78000 0.8840000 91.78000 0.8840000 91.78000 0.8840000 0.000000       0.000000  
1 1 1 0  2  10 o 83.27000 0.8044000 83.27000 0.8044000 83.27000 0.8044000 0.000000       0.000000  
1 1 1 0  2  12 o 87.44000 0.9762000 87.44000 0.9762000 87.44000 0.9762000 0.000000       0.000000  
1 1 1 0  2  14 f 74.09000 0.8331000 74.09000 0.8331000 74.09000 0.8331000 0.000000       0.000000  
1 1 1 0  2  16 o 31.30000 0.3889000 31.30000 0.3889000 31.30000 0.3889000 0.000000       0.000000  
1 1 1 0  2  18 o 54.53000 0.6290000 54.53000 0.6290000 54.53000 0.6290000 0.000000       0.000000  
1 1 1 0  2  20 o 86.88000 0.8461000 86.88000 0.8461000 86.88000 0.8461000 0.000000       0.000000  
1 1 1 0  2  22 o 158.7000 1.527000  158.7000 1.527000  158.7000 1.527000  0.000000       0.000000  
1 1 1 0  2  24 o 51.02000 0.5263000 51.02000 0.5263000 51.02000 0.5263000 0.000000       0.000000  
1 1 1 0  2  26 f 11.76000 0.5066000 11.76000 0.5066000 11.76000 0.5066000 0.000000       0.000000  
1 1 1 0  2  28 o 4.517000 1.412000  4.517000 1.412000  4.517000 1.412000  0.000000       0.000000  
1 1 1 0  2  30 o 17.18000 0.5187000 17.18000 0.5187000 17.18000 0.5187000 0.000000       0.000000  
1 1 1 0  2  32 o 8.904000 0.8457000 8.904000 0.8457000 8.904000 0.8457000 0.000000       0.000000  
1 1 1 0  2  34 o 67.00000 0.6810000 67.00000 0.6810000 67.00000 0.6810000 0.000000       0.000000  
1 1 1 0  2  36 o 39.10000 0.4629000 39.10000 0.4629000 39.10000 0.4629000 0.000000       0.000000  
1 1 1 0  2  38 o 56.51000 0.5936000 56.51000 0.5936000 56.51000 0.5936000 0.000000       0.000000  
1 1 1 0  2  40 o 18.61000 0.5302000 18.61000 0.5302000 18.61000 0.5302000 0.000000       0.000000  
1 1 1 0  2  42 o 33.35000 0.6572000 33.35000 0.6572000 33.35000 0.6572000 0.000000       0.000000  
1 1 1 0  2  44 o 18.48000 0.5834000 18.48000 0.5834000 18.48000 0.5834000 0.000000       0.000000  
1 1 1 0  2  46 o 3.872000 1.488000  3.872000 1.488000  3.872000 1.488000  0.000000       0.000000  
1 1 1 0  2  48 o 33.41000 0.4841000 33.41000 0.4841000 33.41000 0.4841000 0.000000       0.000000  
1 1 1 0  2  50 f 27.81000 0.5364000 27.81000 0.5364000 27.81000 0.5364000 0.000000       0.000000  
1 1 1 0  2  52 o 11.07000 0.8564000 11.07000 0.8564000 11.07000 0.8564000 0.000000       0.000000  
1 1 1 0  2  54 o 3.475000 1.390000  3.475000 1.390000  3.475000 1.390000  0.000000       0.000000  
1 1 1 0  2  56 o 11.05000 0.8978000 11.05000 0.8978000 11.05000 0.8978000 0.000000       0.000000  
1 1 1 0  2  58 o 15.10000 0.5932000 15.10000 0.5932000 15.10000 0.5932000 0.000000       0.000000  
1 1 1 0  2  60 o 2.576000 1.196000  2.576000 1.196000  2.576000 1.196000  0.000000       0.000000  
1 1 1 0  2  62 o 2.770000 1.260000  2.770000 1.260000  2.770000 1.260000  0.000000       0.000000  
1 1 1 0  2  64 o 2.971000 1.265000  2.971000 1.265000  2.971000 1.265000  0.000000       0.000000  
1 1 1 0  2  66 o 2.504000 1.202000  2.504000 1.202000  2.504000 1.202000  0.000000       0.000000  
1 1 1 0  2  68 o 5.530000 1.419000  5.530000 1.419000  5.530000 1.419000  0.000000       0.000000  
1 1 1 0  3  1  o 41.25000 0.5669000 41.25000 0.5669000 41.25000 0.5669000 0.000000       0.000000  
1 1 1 0  3  3  o 147.4000 2.000000  147.4000 2.000000  147.4000 2.000000  0.000000       0.000000  
1 1 1 0  3  5  o 31.18000 0.3122000 31.18000 0.3122000 31.18000 0.3122000 0.000000       0.000000  
1 1 1 0  3  7  o 30.82000 0.3595000 30.82000 0.3595000 30.82000 0.3595000 0.000000       0.000000  
1 1 1 0  3  9  o 2.225000 0.6074000 2.225000 0.6074000 2.225000 0.6074000 0.000000       0.000000  
1 1 1 0  3  11 o 21.13000 0.2474000 21.13000 0.2474000 21.13000 0.2474000 0.000000       0.000000  
1 1 1 0  3  13 o 93.54000 0.9041000 93.54000 0.9041000 93.54000 0.9041000 0.000000       0.000000  
1 1 1 0  3  15 o 57.36000 0.5668000 57.36000 0.5668000 57.36000 0.5668000 0.000000       0.000000  
1 1 1 0  3  17 o 49.43000 0.4967000 49.43000 0.4967000 49.43000 0.4967000 0.000000       0.000000  
1 1 1 0  3  19 o 6.695000 0.4329000 6.695000 0.4329000 6.695000 0.4329000 0.000000       0.000000  
1 1 1 0  3  21 o 14.86000 0.3083000 14.86000 0.3083000 14.86000 0.3083000 0.000000       0.000000  
1 1 1 0  3  23 o 8.570000 0.4931000 8.570000 0.4931000 8.570000 0.4931000 0.000000       0.000000  
1 1 1 0  3  25 o 44.51000 0.4782000 44.51000 0.4782000 44.51000 0.4782000 0.000000       0.000000  
1 1 1 0  3  27 f 14.90000 0.6546000 14.90000 0.6546000 14.90000 0.6546000 0.000000       0.000000  
1 1 1 0  3  29 o 95.29000 1.078000  95.29000 1.078000  95.29000 1.078000  0.000000       0.000000  
1 1 1 0  3  31 o 19.20000 0.4086000 19.20000 0.4086000 19.20000 0.4086000 0.000000       0.000000  
1 1 1 0  3  33 o 6.152000 1.055000  6.152000 1.055000  6.152000 1.055000  0.000000       0.000000  
1 1 1 0  3  35 o 92.32000 0.9104000 92.32000 0.9104000 92.32000 0.9104000 0.000000       0.000000  
1 1 1 0  3  37 o 41.61000 0.4838000 41.61000 0.4838000 41.61000 0.4838000 0.000000       0.000000  
1 1 1 0  3  39 o 10.84000 0.6520000 10.84000 0.6520000 10.84000 0.6520000 0.000000       0.000000  
1 1 1 0  3  41 o 12.27000 0.8788000 12.27000 0.8788000 12.27000 0.8788000 0.000000       0.000000  
1 1 1 0  3  43 o 6.420000 1.419000  6.420000 1.419000  6.420000 1.419000  0.000000       0.000000  
1 1 1 0  3  45 o 24.26000 0.5495000 24.26000 0.5495000 24.26000 0.5495000 0.000000       0.000000  
1 1 1 0  3  47 o 4.889000 1.501000  4.889000 1.501000  4.889000 1.501000  0.000000       0.000000  
1 1 1 0  3  49 o 19.67000 0.6258000 19.67000 0.6258000 19.67000 0.6258000 0.000000       0.000000  
1 1 1 0  3  51 o 43.08000 0.5254000 43.08000 0.5254000 43.08000 0.5254000 0.000000       0.000000  
1 1 1 0  3  53 o 5.544000 1.256000  5.544000 1.256000  5.544000 1.256000  0.000000       0.000000  
1 1 1 0  3  55 o 43.60000 0.5309000 43.60000 0.5309000 43.60000 0.5309000 0.000000       0.000000  
1 1 1 0  3  57 o 9.167000 0.9172000 9.167000 0.9172000 9.167000 0.9172000 0.000000       0.000000  
1 1 1 0  3  59 o 4.889000 1.478000  4.889000 1.478000  4.889000 1.478000  0.000000       0.000000  
1 1 1 0  3  61 o 4.786000 1.454000  4.786000 1.454000  4.786000 1.454000  0.000000       0.000000  
1 1 1 0  3  63 o 3.890000 1.458000  3.890000 1.458000  3.890000 1.458000  0.000000       0.000000  
1 1 1 0  3  65 o 10.72000 0.8296000 10.72000 0.8296000 10.72000 0.8296000 0.000000       0.000000  
1 1 1 0  3  67 o 4.179000 1.519000  4.179000 1.519000  4.179000 1.519000  0.000000       0.000000  
1 1 1 0  4  2  o 2.742000 0.2416000 2.742000 0.2416000 2.742000 0.2416000 0.000000       0.000000  
1 1 1 0  4  4  o 6.842000 0.1586000 6.842000 0.1586000 6.842000 0.1586000 0.000000       0.000000  
1 1 1 0  4  6  o 5.321000 0.2794000 5.321000 0.2794000 5.321000 0.2794000 0.000000       0.000000  
1 1 1 0  4  8  o 9.391000 0.2583000 9.391000 0.2583000 9.391000 0.2583000 0.000000       0.000000  
1 1 1 0  4  10 o 25.65000 0.2794000 25.65000 0.2794000 25.65000 0.2794000 0.000000       0.000000  
1 1 1 0  4  12 o 6.872000 0.3368000 6.872000 0.3368000 6.872000 0.3368000 0.000000       0.000000  
1 1 1 0  4  14 o 21.55000 0.3117000 21.55000 0.3117000 21.55000 0.3117000 0.000000       0.000000  
1 1 1 0  4  16 o 32.90000 0.4071000 32.90000 0.4071000 32.90000 0.4071000 0.000000       0.000000  
1 1 1 0  4  18 o 38.91000 0.4713000 38.91000 0.4713000 38.91000 0.4713000 0.000000       0.000000  
1 1 1 0  4  20 o 190.6000 1.831000  190.6000 1.831000  190.6000 1.831000  0.000000       0.000000  
1 1 1 0  4  22 o 71.56000 0.7060000 71.56000 0.7060000 71.56000 0.7060000 0.000000       0.000000  
1 1 1 0  4  24 o 145.1000 1.398000  145.1000 1.398000  145.1000 1.398000  0.000000       0.000000  
1 1 1 0  4  26 o 63.89000 0.7416000 63.89000 0.7416000 63.89000 0.7416000 0.000000       0.000000  
1 1 1 0  4  28 o 34.54000 0.4856000 34.54000 0.4856000 34.54000 0.4856000 0.000000       0.000000  
1 1 1 0  4  30 f 54.23000 0.6573000 54.23000 0.6573000 54.23000 0.6573000 0.000000       0.000000  
1 1 1 0  4  32 o 5.051000 1.419000  5.051000 1.419000  5.051000 1.419000  0.000000       0.000000  
1 1 1 0  4  34 o 41.13000 0.5513000 41.13000 0.5513000 41.13000 0.5513000 0.000000       0.000000  
1 1 1 0  4  36 o 5.048000 1.315000  5.048000 1.315000  5.048000 1.315000  0.000000       0.000000  
1 1 1 0  4  38 o 17.41000 0.5477000 17.41000 0.5477000 17.41000 0.5477000 0.000000       0.000000  
1 1 1 0  4  40 o 6.406000 1.280000  6.406000 1.280000  6.406000 1.280000  0.000000       0.000000  
1 1 1 0  4  42 o 10.63000 0.8948000 10.63000 0.8948000 10.63000 0.8948000 0.000000       0.000000  
1 1 1 0  4  44 o 28.38000 0.4503000 28.38000 0.4503000 28.38000 0.4503000 0.000000       0.000000  
1 1 1 0  4  46 o 7.151000 1.222000  7.151000 1.222000  7.151000 1.222000  0.000000       0.000000  
1 1 1 0  4  48 o 24.82000 0.4811000 24.82000 0.4811000 24.82000 0.4811000 0.000000       0.000000  
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1 1 1 0  53 25 o 3.672000 1.407000  3.672000 1.407000  3.672000 1.407000  0.000000       0.000000  
1 1 1 0  53 27 f 3.221000 1.300000  3.221000 1.300000  3.221000 1.300000  0.000000       0.000000  
1 1 1 0  53 29 o 8.178000 0.8071000 8.178000 0.8071000 8.178000 0.8071000 0.000000       0.000000  
1 1 1 0  53 31 o 2.983000 1.262000  2.983000 1.262000  2.983000 1.262000  0.000000       0.000000  
1 1 1 0  53 33 o 4.218000 1.587000  4.218000 1.587000  4.218000 1.587000  0.000000       0.000000  
1 1 1 0  53 35 o 3.266000 1.283000  3.266000 1.283000  3.266000 1.283000  0.000000       0.000000  
1 1 1 0  53 37 o 8.085000 1.386000  8.085000 1.386000  8.085000 1.386000  0.000000       0.000000  
1 1 1 0  54 2  o 22.57000 0.5381000 22.57000 0.5381000 22.57000 0.5381000 0.000000       0.000000  
1 1 1 0  54 4  o 14.44000 0.5208000 14.44000 0.5208000 14.44000 0.5208000 0.000000       0.000000  
1 1 1 0  54 6  o 8.768000 0.7059000 8.768000 0.7059000 8.768000 0.7059000 0.000000       0.000000  
1 1 1 0  54 8  o 13.75000 0.5076000 13.75000 0.5076000 13.75000 0.5076000 0.000000       0.000000  
1 1 1 0  54 10 o 4.701000 1.379000  4.701000 1.379000  4.701000 1.379000  0.000000       0.000000  
1 1 1 0  54 12 o 4.201000 1.398000  4.201000 1.398000  4.201000 1.398000  0.000000       0.000000  
1 1 1 0  54 14 o 3.924000 1.366000  3.924000 1.366000  3.924000 1.366000  0.000000       0.000000  
1 1 1 0  54 16 o 14.21000 0.6907000 14.21000 0.6907000 14.21000 0.6907000 0.000000       0.000000  
1 1 1 0  54 18 o 5.548000 1.366000  5.548000 1.366000  5.548000 1.366000  0.000000       0.000000  
1 1 1 0  54 20 o 9.210000 0.8736000 9.210000 0.8736000 9.210000 0.8736000 0.000000       0.000000  
1 1 1 0  54 22 o 27.37000 0.5509000 27.37000 0.5509000 27.37000 0.5509000 0.000000       0.000000  
1 1 1 0  54 24 o 23.69000 0.4777000 23.69000 0.4777000 23.69000 0.4777000 0.000000       0.000000  
1 1 1 0  54 26 f 14.30000 0.5603000 14.30000 0.5603000 14.30000 0.5603000 0.000000       0.000000  
1 1 1 0  54 28 o 3.015000 1.250000  3.015000 1.250000  3.015000 1.250000  0.000000       0.000000  
1 1 1 0  54 30 o 11.27000 0.6424000 11.27000 0.6424000 11.27000 0.6424000 0.000000       0.000000  
1 1 1 0  54 32 o 10.05000 1.095000  10.05000 1.095000  10.05000 1.095000  0.000000       0.000000  
1 1 1 0  54 34 o 7.840000 0.9120000 7.840000 0.9120000 7.840000 0.9120000 0.000000       0.000000  
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1 1 1 0  55 3  o 3.593000 1.361000  3.593000 1.361000  3.593000 1.361000  0.000000       0.000000  
1 1 1 0  55 5  o 3.371000 1.378000  3.371000 1.378000  3.371000 1.378000  0.000000       0.000000  
1 1 1 0  55 7  o 7.136000 0.8404000 7.136000 0.8404000 7.136000 0.8404000 0.000000       0.000000  
1 1 1 0  55 9  o 7.843000 0.7565000 7.843000 0.7565000 7.843000 0.7565000 0.000000       0.000000  
1 1 1 0  55 11 o 13.54000 0.5339000 13.54000 0.5339000 13.54000 0.5339000 0.000000       0.000000  
1 1 1 0  55 13 o 3.016000 1.187000  3.016000 1.187000  3.016000 1.187000  0.000000       0.000000  
1 1 1 0  55 15 o 13.99000 0.5144000 13.99000 0.5144000 13.99000 0.5144000 0.000000       0.000000  
1 1 1 0  55 17 o 5.022000 1.211000  5.022000 1.211000  5.022000 1.211000  0.000000       0.000000  
1 1 1 0  55 19 o 8.553000 0.7542000 8.553000 0.7542000 8.553000 0.7542000 0.000000       0.000000  
1 1 1 0  55 21 o 6.869000 0.9596000 6.869000 0.9596000 6.869000 0.9596000 0.000000       0.000000  
1 1 1 0  55 23 o 3.941000 1.317000  3.941000 1.317000  3.941000 1.317000  0.000000       0.000000  
1 1 1 0  55 25 o 4.218000 1.327000  4.218000 1.327000  4.218000 1.327000  0.000000       0.000000  
1 1 1 0  55 27 o 9.557000 0.7552000 9.557000 0.7552000 9.557000 0.7552000 0.000000       0.000000  
1 1 1 0  55 29 o 5.810000 1.313000  5.810000 1.313000  5.810000 1.313000  0.000000       0.000000  
1 1 1 0  55 31 o 3.328000 1.460000  3.328000 1.460000  3.328000 1.460000  0.000000       0.000000  
1 1 1 0  55 33 o 2.785000 1.198000  2.785000 1.198000  2.785000 1.198000  0.000000       0.000000  
1 1 1 0  56 0  o 3.414000 1.443000  3.414000 1.443000  3.414000 1.443000  0.000000       0.000000  
1 1 1 0  56 2  o 7.073000 0.8935000 7.073000 0.8935000 7.073000 0.8935000 0.000000       0.000000  
1 1 1 0  56 4  o 3.530000 1.362000  3.530000 1.362000  3.530000 1.362000  0.000000       0.000000  
1 1 1 0  56 6  o 2.554000 1.144000  2.554000 1.144000  2.554000 1.144000  0.000000       0.000000  
1 1 1 0  56 8  o 4.538000 1.326000  4.538000 1.326000  4.538000 1.326000  0.000000       0.000000  
1 1 1 0  56 10 o 6.514000 1.051000  6.514000 1.051000  6.514000 1.051000  0.000000       0.000000  
1 1 1 0  56 12 o 9.511000 0.6901000 9.511000 0.6901000 9.511000 0.6901000 0.000000       0.000000  
1 1 1 0  56 14 f 7.315000 1.219000  7.315000 1.219000  7.315000 1.219000  0.000000       0.000000  
1 1 1 0  56 16 o 2.933000 1.212000  2.933000 1.212000  2.933000 1.212000  0.000000       0.000000  
1 1 1 0  56 18 o 4.743000 1.310000  4.743000 1.310000  4.743000 1.310000  0.000000       0.000000  
1 1 1 0  56 20 o 5.795000 1.139000  5.795000 1.139000  5.795000 1.139000  0.000000       0.000000  
1 1 1 0  56 22 o 3.925000 1.353000  3.925000 1.353000  3.925000 1.353000  0.000000       0.000000  
1 1 1 0  56 24 o 3.898000 1.333000  3.898000 1.333000  3.898000 1.333000  0.000000       0.000000  
1 1 1 0  56 26 o 5.632000 1.212000  5.632000 1.212000  5.632000 1.212000  0.000000       0.000000  
1 1 1 0  56 28 o 3.780000 1.428000  3.780000 1.428000  3.780000 1.428000  0.000000       0.000000  
1 1 1 0  56 30 o 6.480000 1.418000  6.480000 1.418000  6.480000 1.418000  0.000000       0.000000  
1 1 1 0  57 1  o 10.40000 0.6347000 10.40000 0.6347000 10.40000 0.6347000 0.000000       0.000000  
1 1 1 0  57 3  o 5.509000 1.197000  5.509000 1.197000  5.509000 1.197000  0.000000       0.000000  
1 1 1 0  57 5  o 5.398000 1.100000  5.398000 1.100000  5.398000 1.100000  0.000000       0.000000  
1 1 1 0  57 7  o 5.003000 1.300000  5.003000 1.300000  5.003000 1.300000  0.000000       0.000000  
1 1 1 0  57 9  o 10.84000 0.6714000 10.84000 0.6714000 10.84000 0.6714000 0.000000       0.000000  
1 1 1 0  57 11 o 7.331000 0.7903000 7.331000 0.7903000 7.331000 0.7903000 0.000000       0.000000  
1 1 1 0  57 13 o 2.966000 1.315000  2.966000 1.315000  2.966000 1.315000  0.000000       0.000000  
1 1 1 0  57 15 o 2.170000 1.024000  2.170000 1.024000  2.170000 1.024000  0.000000       0.000000  
1 1 1 0  57 17 o 7.179000 1.025000  7.179000 1.025000  7.179000 1.025000  0.000000       0.000000  
1 1 1 0  57 19 f 5.760000 1.123000  5.760000 1.123000  5.760000 1.123000  0.000000       0.000000  
1 1 1 0  57 21 o 8.798000 0.7520000 8.798000 0.7520000 8.798000 0.7520000 0.000000       0.000000  
1 1 1 0  57 23 o 3.470000 1.283000  3.470000 1.283000  3.470000 1.283000  0.000000       0.000000  
1 1 1 0  57 25 o 3.985000 1.394000  3.985000 1.394000  3.985000 1.394000  0.000000       0.000000  
1 1 1 0  57 27 o 4.554000 1.417000  4.554000 1.417000  4.554000 1.417000  0.000000       0.000000  
1 1 1 0  57 29 o 3.016000 1.322000  3.016000 1.322000  3.016000 1.322000  0.000000       0.000000  
1 1 1 0  58 0  o 3.475000 1.456000  3.475000 1.456000  3.475000 1.456000  0.000000       0.000000  
1 1 1 0  58 2  o 3.100000 1.260000  3.100000 1.260000  3.100000 1.260000  0.000000       0.000000  
1 1 1 0  58 4  o 4.861000 1.310000  4.861000 1.310000  4.861000 1.310000  0.000000       0.000000  
1 1 1 0  58 6  o 2.675000 1.161000  2.675000 1.161000  2.675000 1.161000  0.000000       0.000000  
1 1 1 0  58 8  o 2.463000 1.111000  2.463000 1.111000  2.463000 1.111000  0.000000       0.000000  
1 1 1 0  58 10 o 3.754000 1.383000  3.754000 1.383000  3.754000 1.383000  0.000000       0.000000  
1 1 1 0  58 12 o 4.215000 1.496000  4.215000 1.496000  4.215000 1.496000  0.000000       0.000000  
1 1 1 0  58 14 o 2.811000 1.208000  2.811000 1.208000  2.811000 1.208000  0.000000       0.000000  
1 1 1 0  58 16 o 6.506000 1.563000  6.506000 1.563000  6.506000 1.563000  0.000000       0.000000  
1 1 1 0  58 18 o 6.213000 1.459000  6.213000 1.459000  6.213000 1.459000  0.000000       0.000000  
1 1 1 0  58 20 o 3.314000 1.343000  3.314000 1.343000  3.314000 1.343000  0.000000       0.000000  
1 1 1 0  58 22 o 2.592000 1.195000  2.592000 1.195000  2.592000 1.195000  0.000000       0.000000  
1 1 1 0  58 24 o 3.548000 1.385000  3.548000 1.385000  3.548000 1.385000  0.000000       0.000000  
1 1 1 0  58 26 o 11.68000 0.6482000 11.68000 0.6482000 11.68000 0.6482000 0.000000       0.000000  
1 1 1 0  59 1  o 2.799000 1.165000  2.799000 1.165000  2.799000 1.165000  0.000000       0.000000  
1 1 1 0  59 3  o 5.743000 1.118000  5.743000 1.118000  5.743000 1.118000  0.000000       0.000000  
1 1 1 0  59 5  o 4.262000 1.237000  4.262000 1.237000  4.262000 1.237000  0.000000       0.000000  
1 1 1 0  59 7  o 2.662000 1.162000  2.662000 1.162000  2.662000 1.162000  0.000000       0.000000  
1 1 1 0  59 9  o 2.382000 1.080000  2.382000 1.080000  2.382000 1.080000  0.000000       0.000000  
1 1 1 0  59 11 o 6.492000 1.055000  6.492000 1.055000  6.492000 1.055000  0.000000       0.000000  
1 1 1 0  59 13 o 4.067000 1.418000  4.067000 1.418000  4.067000 1.418000  0.000000       0.000000  
1 1 1 0  59 15 o 3.677000 1.369000  3.677000 1.369000  3.677000 1.369000  0.000000       0.000000  
1 1 1 0  59 17 o 5.242000 1.143000  5.242000 1.143000  5.242000 1.143000  0.000000       0.000000  
1 1 1 0  59 19 o 4.929000 1.218000  4.929000 1.218000  4.929000 1.218000  0.000000       0.000000  
1 1 1 0  59 21 o 3.184000 1.293000  3.184000 1.293000  3.184000 1.293000  0.000000       0.000000  
1 1 1 0  59 23 o 3.137000 1.309000  3.137000 1.309000  3.137000 1.309000  0.000000       0.000000  
1 1 1 0  60 0  o 5.478000 1.492000  5.478000 1.492000  5.478000 1.492000  0.000000       0.000000  
1 1 1 0  60 2  o 4.124000 1.299000  4.124000 1.299000  4.124000 1.299000  0.000000       0.000000  
1 1 1 0  60 4  o 2.749000 1.188000  2.749000 1.188000  2.749000 1.188000  0.000000       0.000000  
1 1 1 0  60 6  o 2.938000 1.223000  2.938000 1.223000  2.938000 1.223000  0.000000       0.000000  
1 1 1 0  60 8  o 3.777000 1.348000  3.777000 1.348000  3.777000 1.348000  0.000000       0.000000  
1 1 1 0  60 10 o 3.472000 1.270000  3.472000 1.270000  3.472000 1.270000  0.000000       0.000000  
1 1 1 0  60 12 o 2.911000 1.198000  2.911000 1.198000  2.911000 1.198000  0.000000       0.000000  
1 1 1 0  60 14 o 3.987000 1.315000  3.987000 1.315000  3.987000 1.315000  0.000000       0.000000  
1 1 1 0  60 16 o 7.701000 0.8407000 7.701000 0.8407000 7.701000 0.8407000 0.000000       0.000000  
1 1 1 0  60 18 o 3.546000 1.314000  3.546000 1.314000  3.546000 1.314000  0.000000       0.000000  
1 1 1 0  60 20 o 5.772000 1.163000  5.772000 1.163000  5.772000 1.163000  0.000000       0.000000  
1 1 1 0  61 1  o 4.003000 1.279000  4.003000 1.279000  4.003000 1.279000  0.000000       0.000000  
1 1 1 0  61 3  o 9.085000 0.7566000 9.085000 0.7566000 9.085000 0.7566000 0.000000       0.000000  
1 1 1 0  61 5  o 5.207000 1.226000  5.207000 1.226000  5.207000 1.226000  0.000000       0.000000  
1 1 1 0  61 7  o 2.654000 1.205000  2.654000 1.205000  2.654000 1.205000  0.000000       0.000000  
1 1 1 0  61 9  o 2.716000 1.170000  2.716000 1.170000  2.716000 1.170000  0.000000       0.000000  
1 1 1 0  61 11 o 2.568000 1.152000  2.568000 1.152000  2.568000 1.152000  0.000000       0.000000  
1 1 1 0  61 13 o 2.453000 1.090000  2.453000 1.090000  2.453000 1.090000  0.000000       0.000000  
1 1 1 0  61 15 o 2.947000 1.189000  2.947000 1.189000  2.947000 1.189000  0.000000       0.000000  
1 1 1 0  61 17 o 3.127000 1.280000  3.127000 1.280000  3.127000 1.280000  0.000000       0.000000  
1 1 1 0  62 0  o 6.085000 1.380000  6.085000 1.380000  6.085000 1.380000  0.000000       0.000000  
1 1 1 0  62 2  f 3.249000 1.259000  3.249000 1.259000  3.249000 1.259000  0.000000       0.000000  
1 1 1 0  62 4  o 3.083000 1.298000  3.083000 1.298000  3.083000 1.298000  0.000000       0.000000  
1 1 1 0  62 6  o 3.142000 1.252000  3.142000 1.252000  3.142000 1.252000  0.000000       0.000000  
1 1 1 0  62 8  o 4.306000 1.276000  4.306000 1.276000  4.306000 1.276000  0.000000       0.000000  
1 1 1 0  62 10 o 4.704000 1.392000  4.704000 1.392000  4.704000 1.392000  0.000000       0.000000  
1 1 1 0  62 12 o 6.650000 0.9405000 6.650000 0.9405000 6.650000 0.9405000 0.000000       0.000000  
1 1 1 0  63 1  o 2.669000 1.162000  2.669000 1.162000  2.669000 1.162000  0.000000       0.000000  
1 1 1 0  63 3  o 4.665000 1.838000  4.665000 1.838000  4.665000 1.838000  0.000000       0.000000  
1 1 1 0  63 5  o 4.354000 1.535000  4.354000 1.535000  4.354000 1.535000  0.000000       0.000000  
1 1 1 1  0  3  o 104.4000 1.417000  104.4000 1.417000  104.4000 1.417000  0.000000       0.000000  
1 1 1 1  0  5  o 38.68000 0.3792000 38.68000 0.3792000 38.68000 0.3792000 0.000000       0.000000  
1 1 1 1  0  7  o 118.3000 1.136000  118.3000 1.136000  118.3000 1.136000  0.000000       0.000000  
1 1 1 1  0  9  o 91.47000 0.8815000 91.47000 0.8815000 91.47000 0.8815000 0.000000       0.000000  
1 1 1 1  0  11 o 6.960000 0.2650000 6.960000 0.2650000 6.960000 0.2650000 0.000000       0.000000  
1 1 1 1  0  13 o 3.001000 0.8550000 3.001000 0.8550000 3.001000 0.8550000 0.000000       0.000000  
1 1 1 1  0  15 o 75.44000 0.7346000 75.44000 0.7346000 75.44000 0.7346000 0.000000       0.000000  
1 1 1 1  0  17 o 1.843000 0.8273000 1.843000 0.8273000 1.843000 0.8273000 0.000000       0.000000  
1 1 1 1  0  19 o 4.436000 0.6051000 4.436000 0.6051000 4.436000 0.6051000 0.000000       0.000000  
1 1 1 1  0  21 o 132.3000 1.277000  132.3000 1.277000  132.3000 1.277000  0.000000       0.000000  
1 1 1 1  0  23 o 66.32000 0.6587000 66.32000 0.6587000 66.32000 0.6587000 0.000000       0.000000  
1 1 1 1  0  25 f 52.78000 0.5425000 52.78000 0.5425000 52.78000 0.5425000 0.000000       0.000000  
1 1 1 1  0  27 o 7.472000 0.9481000 7.472000 0.9481000 7.472000 0.9481000 0.000000       0.000000  
1 1 1 1  0  29 o 40.55000 0.4596000 40.55000 0.4596000 40.55000 0.4596000 0.000000       0.000000  
1 1 1 1  0  31 o 56.70000 0.8405000 56.70000 0.8405000 56.70000 0.8405000 0.000000       0.000000  
1 1 1 1  0  33 o 61.56000 0.6320000 61.56000 0.6320000 61.56000 0.6320000 0.000000       0.000000  
1 1 1 1  0  35 f 107.8000 1.053000  107.8000 1.053000  107.8000 1.053000  0.000000       0.000000  
1 1 1 1  0  37 o 31.62000 0.5988000 31.62000 0.5988000 31.62000 0.5988000 0.000000       0.000000  
1 1 1 1  0  39 o 15.35000 0.5217000 15.35000 0.5217000 15.35000 0.5217000 0.000000       0.000000  
1 1 1 1  0  41 o 12.13000 0.8602000 12.13000 0.8602000 12.13000 0.8602000 0.000000       0.000000  
1 1 1 1  0  43 o 33.08000 0.4701000 33.08000 0.4701000 33.08000 0.4701000 0.000000       0.000000  
1 1 1 1  0  45 o 3.024000 1.373000  3.024000 1.373000  3.024000 1.373000  0.000000       0.000000  
1 1 1 1  0  47 o 4.395000 1.516000  4.395000 1.516000  4.395000 1.516000  0.000000       0.000000  
1 1 1 1  0  49 o 14.57000 0.9461000 14.57000 0.9461000 14.57000 0.9461000 0.000000       0.000000  
1 1 1 1  0  51 o 8.110000 1.005000  8.110000 1.005000  8.110000 1.005000  0.000000       0.000000  
1 1 1 1  0  53 o 12.40000 0.9363000 12.40000 0.9363000 12.40000 0.9363000 0.000000       0.000000  
1 1 1 1  0  55 o 15.79000 0.6688000 15.79000 0.6688000 15.79000 0.6688000 0.000000       0.000000  
1 1 1 1  0  57 o 4.619000 1.453000  4.619000 1.453000  4.619000 1.453000  0.000000       0.000000  
1 1 1 1  0  59 o 6.087000 1.209000  6.087000 1.209000  6.087000 1.209000  0.000000       0.000000  
1 1 1 1  0  61 o 4.141000 1.476000  4.141000 1.476000  4.141000 1.476000  0.000000       0.000000  
1 1 1 1  0  63 o 11.83000 1.026000  11.83000 1.026000  11.83000 1.026000  0.000000       0.000000  
1 1 1 1  0  65 o 15.97000 0.7230000 15.97000 0.7230000 15.97000 0.7230000 0.000000       0.000000  
1 1 1 1  0  67 o 3.364000 1.349000  3.364000 1.349000  3.364000 1.349000  0.000000       0.000000  
1 1 1 1  1  2  f 88.73000 0.7792000 89.21000 1.212000  88.25000 0.9795000 0.9577000      1.558000  
1 1 1 1  1  4  o 14.45000 0.1264000 14.49000 0.1914000 14.41000 0.1652000 0.7741000E-01  0.2529000 
1 1 1 1  1  6  o 63.81000 0.4708000 63.69000 0.7103000 63.92000 0.6181000 -0.2278000     0.9416000 
1 1 1 1  1  8  o 28.74000 0.2088000 28.98000 0.2975000 28.50000 0.2931000 0.4719000      0.4176000 
1 1 1 1  1  10 o 101.5000 0.6920000 102.0000 0.9832000 101.1000 0.9742000 0.9343000      1.384000  
1 1 1 1  1  12 o 30.54000 0.2458000 30.51000 0.3224000 30.57000 0.3713000 -0.6023000E-01 0.4917000 
1 1 1 1  1  14 o 99.11000 0.7311000 99.19000 0.9583000 99.03000 1.104000  0.1612000      1.462000  
1 1 1 1  1  16 o 30.10000 0.2522000 30.45000 0.3843000 29.74000 0.3268000 0.7018000      0.5045000 
1 1 1 1  1  18 o 37.82000 0.3033000 37.62000 0.4577000 38.01000 0.3980000 -0.3887000     0.6065000 
1 1 1 1  1  20 o 88.96000 0.6119000 88.54000 0.8616000 89.37000 0.8691000 -0.8265000     1.224000  
1 1 1 1  1  22 o 88.16000 0.6085000 88.47000 0.8642000 87.85000 0.8569000 0.6236000      1.217000  
1 1 1 1  1  24 o 35.96000 0.2868000 35.78000 0.4042000 36.14000 0.4071000 -0.3581000     0.5737000 
1 1 1 1  1  26 o 40.35000 0.3176000 40.18000 0.4478000 40.51000 0.4504000 -0.3272000     0.6351000 
1 1 1 1  1  28 o 96.28000 0.8577000 96.08000 1.326000  96.48000 1.088000  -0.3928000     1.715000  
1 1 1 1  1  30 f 52.54000 0.4213000 52.41000 0.6370000 52.67000 0.5517000 -0.2561000     0.8427000 
1 1 1 1  1  32 o 37.62000 0.3448000 37.43000 0.5212000 37.81000 0.4514000 -0.3799000     0.6895000 
1 1 1 1  1  34 o 72.17000 0.5535000 71.78000 0.8324000 72.55000 0.7296000 -0.7718000     1.107000  
1 1 1 1  1  36 o 25.00000 0.2923000 25.08000 0.4159000 24.92000 0.4107000 0.1554000      0.5845000 
1 1 1 1  1  38 o 27.74000 0.2986000 27.66000 0.4219000 27.82000 0.4227000 -0.1577000     0.5972000 
1 1 1 1  1  40 o 24.08000 0.3286000 23.50000 0.4375000 24.65000 0.4905000 -1.142000      0.6573000 
1 1 1 1  1  42 o 23.03000 0.3784000 23.80000 0.5312000 22.25000 0.5391000 1.548000       0.7568000 
1 1 1 1  1  44 o 43.79000 0.5242000 44.35000 0.7475000 43.23000 0.7350000 1.114000       1.048000  
1 1 1 1  1  46 o 24.14000 0.4457000 23.84000 0.5658000 24.44000 0.6887000 -0.5977000     0.8913000 
1 1 1 1  1  48 o 20.34000 0.3629000 19.72000 0.5254000 20.96000 0.5009000 -1.240000      0.7259000 
1 1 1 1  1  50 o 17.04000 0.4306000 17.73000 0.6362000 16.34000 0.5803000 1.399000       0.8612000 
1 1 1 1  1  52 o 15.20000 0.4580000 15.22000 0.5894000 15.19000 0.7012000 0.2423000E-01  0.9160000 
1 1 1 1  1  54 o 13.74000 0.4441000 13.85000 0.6383000 13.63000 0.6177000 0.2174000      0.8882000 
1 1 1 1  1  56 o 20.58000 0.3974000 20.89000 0.6010000 20.27000 0.5201000 0.6200000      0.7948000 
1 1 1 1  1  58 o 8.003000 0.7167000 8.397000 0.9490000 7.609000 1.074000  0.7880000      1.433000  
1 1 1 1  1  60 o 3.930000 0.9946000 4.336000 1.449000  3.523000 1.362000  0.8125000      1.989000  
1 1 1 1  1  62 o 8.924000 0.6187000 9.407000 0.8422000 8.441000 0.9065000 0.9665000      1.237000  
1 1 1 1  1  64 o 8.949000 0.7591000 9.400000 1.115000  8.497000 1.031000  0.9024000      1.518000  
1 1 1 1  1  66 o 3.789000 1.008000  3.343000 1.399000  4.235000 1.450000  -0.8915000     2.015000  
1 1 1 1  1  68 o 3.251000 0.9674000 3.421000 1.388000  3.082000 1.348000  0.3383000      1.935000  
1 1 1 1  2  1  o 49.39000 0.4379000 50.59000 0.6915000 48.19000 0.5377000 2.403000       0.8759000 
1 1 1 1  2  3  o 95.15000 0.7462000 95.61000 1.061000  94.69000 1.050000  0.9196000      1.492000  
1 1 1 1  2  5  o 75.05000 0.5113000 75.46000 0.7271000 74.65000 0.7191000 0.8112000      1.023000  
1 1 1 1  2  7  o 117.3000 0.7968000 117.0000 1.124000  117.6000 1.130000  -0.6526000     1.594000  
1 1 1 1  2  9  o 111.1000 0.7555000 111.5000 1.073000  110.6000 1.064000  0.9142000      1.511000  
1 1 1 1  2  11 o 70.37000 0.4836000 70.54000 0.6855000 70.20000 0.6823000 0.3349000      0.9672000 
1 1 1 1  2  13 o 29.77000 0.2901000 29.88000 0.4505000 29.66000 0.3656000 0.2145000      0.5801000 
1 1 1 1  2  15 o 28.34000 0.2213000 28.42000 0.3147000 28.26000 0.3113000 0.1588000      0.4427000 
1 1 1 1  2  17 o 13.20000 0.2383000 13.04000 0.3121000 13.36000 0.3602000 -0.3191000     0.4766000 
1 1 1 1  2  19 o 37.08000 0.2786000 36.83000 0.3917000 37.32000 0.3962000 -0.4899000     0.5571000 
1 1 1 1  2  21 o 87.19000 0.6012000 87.04000 0.8485000 87.34000 0.8520000 -0.2952000     1.202000  
1 1 1 1  2  23 o 103.8000 0.7129000 103.9000 1.009000  103.7000 1.007000  0.2340000      1.426000  
1 1 1 1  2  25 o 40.36000 0.3141000 40.30000 0.4452000 40.42000 0.4431000 -0.1230000     0.6281000 
1 1 1 1  2  27 o 53.02000 0.5036000 53.30000 0.7834000 52.74000 0.6331000 0.5644000      1.007000  
1 1 1 1  2  29 o 18.85000 0.3178000 18.95000 0.4049000 18.74000 0.4899000 0.2106000      0.6356000 
1 1 1 1  2  31 o 44.86000 0.4306000 44.61000 0.4925000 45.10000 0.7065000 -0.4906000     0.8612000 
1 1 1 1  2  33 o 36.93000 0.3150000 37.09000 0.4458000 36.78000 0.4453000 0.3145000      0.6301000 
1 1 1 1  2  35 o 7.298000 0.6669000 6.688000 1.013000  7.907000 0.8681000 -1.219000      1.334000  
1 1 1 1  2  37 o 21.51000 0.3064000 21.51000 0.4342000 21.51000 0.4325000 0.7345000E-02  0.6129000 
1 1 1 1  2  39 o 33.51000 0.3128000 33.88000 0.4455000 33.15000 0.4392000 0.7363000      0.6255000 
1 1 1 1  2  41 o 12.45000 0.5663000 12.77000 0.8364000 12.14000 0.7639000 0.6258000      1.133000  
1 1 1 1  2  43 o 18.69000 0.4687000 18.62000 0.6081000 18.76000 0.7133000 -0.1450000     0.9373000 
1 1 1 1  2  45 o 9.706000 0.7568000 9.744000 1.159000  9.668000 0.9741000 0.7601000E-01  1.514000  
1 1 1 1  2  47 o 19.05000 0.3758000 19.32000 0.5379000 18.79000 0.5250000 0.5309000      0.7516000 
1 1 1 1  2  49 o 5.047000 0.9948000 6.003000 1.347000  4.091000 1.464000  1.912000       1.990000  
1 1 1 1  2  51 o 13.43000 0.4877000 13.74000 0.6731000 13.12000 0.7058000 0.6185000      0.9753000 
1 1 1 1  2  53 o 4.415000 1.253000  5.158000 2.018000  3.673000 1.484000  1.485000       2.505000  
1 1 1 1  2  55 o 13.34000 0.5392000 13.39000 0.6342000 13.29000 0.8722000 0.9834000E-01  1.078000  
1 1 1 1  2  57 o 13.01000 0.4569000 13.13000 0.6172000 12.90000 0.6738000 0.2298000      0.9138000 
1 1 1 1  2  59 o 4.165000 0.9862000 3.132000 1.359000  5.197000 1.429000  -2.066000      1.972000  
1 1 1 1  2  61 o 13.08000 0.4518000 13.13000 0.6601000 13.02000 0.6172000 0.1117000      0.9036000 
1 1 1 1  2  63 o 12.34000 0.6565000 12.24000 1.089000  12.44000 0.7328000 -0.2023000     1.313000  
1 1 1 1  2  65 o 4.373000 0.9931000 5.730000 1.449000  3.017000 1.358000  2.713000       1.986000  
1 1 1 1  2  67 o 4.273000 0.9767000 4.163000 1.423000  4.383000 1.338000  -0.2198000     1.953000  
1 1 1 1  3  0  o 75.14000 1.022000  75.14000 1.022000  75.14000 1.022000  0.000000       0.000000  
1 1 1 1  3  2  o 88.74000 0.7775000 89.50000 0.9935000 87.99000 1.196000  1.505000       1.555000  
1 1 1 1  3  4  o 90.77000 0.6674000 91.11000 1.013000  90.44000 0.8698000 0.6724000      1.335000  
1 1 1 1  3  6  o 63.67000 0.4358000 63.75000 0.6172000 63.58000 0.6155000 0.1649000      0.8717000 
1 1 1 1  3  8  o 23.57000 0.1796000 23.59000 0.2551000 23.55000 0.2529000 0.3366000E-01  0.3592000 
1 1 1 1  3  10 o 58.62000 0.4052000 58.52000 0.5721000 58.72000 0.5740000 -0.2082000     0.8104000 
1 1 1 1  3  12 o 36.48000 0.3042000 36.34000 0.4282000 36.61000 0.4321000 -0.2775000     0.6084000 
1 1 1 1  3  14 o 30.93000 0.2721000 30.71000 0.3824000 31.14000 0.3873000 -0.4311000     0.5443000 
1 1 1 1  3  16 o 9.793000 0.2357000 9.834000 0.3323000 9.751000 0.3342000 0.8323000E-01  0.4713000 
1 1 1 1  3  18 o 47.01000 0.3653000 47.04000 0.5533000 46.99000 0.4771000 0.5317000E-01  0.7306000 
1 1 1 1  3  20 o 83.16000 0.5739000 82.99000 0.8102000 83.33000 0.8131000 -0.3350000     1.148000  
1 1 1 1  3  22 o 82.67000 0.5728000 82.21000 0.8060000 83.13000 0.8140000 -0.9228000     1.146000  
1 1 1 1  3  24 o 72.90000 0.5094000 72.72000 0.7182000 73.08000 0.7227000 -0.3617000     1.019000  
1 1 1 1  3  26 o 78.74000 0.5933000 79.04000 0.7802000 78.43000 0.8941000 0.6082000      1.187000  
1 1 1 1  3  28 o 141.5000 1.044000  140.6000 1.569000  142.5000 1.376000  -1.834000      2.087000  
1 1 1 1  3  30 o 48.27000 0.4250000 47.92000 0.5964000 48.62000 0.6058000 -0.7035000     0.8501000 
1 1 1 1  3  32 o 48.01000 0.4282000 48.19000 0.6085000 47.82000 0.6028000 0.3755000      0.8565000 
1 1 1 1  3  34 o 60.61000 0.4426000 60.99000 0.6297000 60.24000 0.6222000 0.7509000      0.8852000 
1 1 1 1  3  36 o 37.38000 0.3493000 37.32000 0.5274000 37.45000 0.4582000 -0.1301000     0.6986000 
1 1 1 1  3  38 o 15.61000 0.3762000 15.61000 0.5871000 15.61000 0.4704000 0.1019000E-02  0.7523000 
1 1 1 1  3  40 o 19.31000 0.3831000 18.81000 0.5435000 19.81000 0.5401000 -1.003000      0.7663000 
1 1 1 1  3  42 o 43.92000 0.4637000 43.58000 0.5841000 44.27000 0.7203000 -0.6916000     0.9274000 
1 1 1 1  3  44 o 21.18000 0.3746000 21.59000 0.4868000 20.77000 0.5696000 0.8160000      0.7492000 
1 1 1 1  3  46 o 19.46000 0.3588000 20.12000 0.5111000 18.81000 0.5037000 1.306000       0.7176000 
1 1 1 1  3  48 o 15.87000 0.4276000 15.92000 0.6021000 15.81000 0.6073000 0.1106000      0.8551000 
1 1 1 1  3  50 o 11.26000 0.6471000 10.59000 0.9444000 11.92000 0.8850000 -1.326000      1.294000  
1 1 1 1  3  52 o 16.20000 0.4612000 16.08000 0.6687000 16.32000 0.6353000 -0.2431000     0.9224000 
1 1 1 1  3  54 o 14.28000 0.4904000 14.53000 0.6796000 14.04000 0.7073000 0.4876000      0.9808000 
1 1 1 1  3  56 o 14.32000 0.4770000 14.79000 0.7060000 13.84000 0.6417000 0.9489000      0.9540000 
1 1 1 1  3  58 o 18.16000 0.3781000 18.03000 0.5345000 18.30000 0.5350000 -0.2693000     0.7562000 
1 1 1 1  3  60 o 4.835000 1.010000  4.799000 1.449000  4.872000 1.409000  -0.7274000E-01 2.021000  
1 1 1 1  3  62 f 6.066000 1.050000  6.122000 1.366000  6.011000 1.593000  0.1110000      2.099000  
1 1 1 1  3  64 o 5.675000 1.198000  5.126000 1.505000  6.224000 1.863000  -1.098000      2.395000  
1 1 1 1  3  66 f 3.280000 0.9894000 3.314000 1.440000  3.245000 1.357000  0.6927000E-01  1.979000  
1 1 1 1  3  68 o 8.197000 0.7085000 8.244000 0.9901000 8.150000 1.014000  0.9435000E-01  1.417000  
1 1 1 1  4  1  o 23.48000 0.2188000 23.60000 0.2776000 23.37000 0.3382000 0.2281000      0.4376000 
1 1 1 1  4  3  o 13.19000 0.1366000 13.17000 0.1923000 13.21000 0.1939000 -0.4093000E-01 0.2731000 
1 1 1 1  4  5  o 54.43000 0.3741000 54.35000 0.5282000 54.52000 0.5300000 -0.1669000     0.7482000 
1 1 1 1  4  7  o 81.58000 0.6019000 82.15000 0.9147000 81.02000 0.7828000 1.133000       1.204000  
1 1 1 1  4  9  o 42.88000 0.3016000 42.96000 0.4273000 42.79000 0.4257000 0.1713000      0.6031000 
1 1 1 1  4  11 o 66.15000 0.4566000 66.43000 0.6477000 65.88000 0.6437000 0.5574000      0.9132000 
1 1 1 1  4  13 o 61.06000 0.4589000 61.27000 0.6957000 60.85000 0.5985000 0.4131000      0.9177000 
1 1 1 1  4  15 o 12.06000 0.2121000 12.34000 0.2870000 11.78000 0.3125000 0.5621000      0.4242000 
1 1 1 1  4  17 o 57.99000 0.4392000 58.38000 0.5783000 57.60000 0.6610000 0.7788000      0.8783000 
1 1 1 1  4  19 o 40.12000 0.2982000 39.84000 0.4197000 40.40000 0.4238000 -0.5609000     0.5964000 
1 1 1 1  4  21 o 106.0000 0.7267000 105.9000 1.026000  106.2000 1.030000  -0.3800000     1.453000  
1 1 1 1  4  23 o 43.85000 0.3285000 43.85000 0.4649000 43.85000 0.4643000 0.3445000E-02  0.6570000 
1 1 1 1  4  25 o 86.37000 0.5997000 86.27000 0.8473000 86.48000 0.8490000 -0.2078000     1.199000  
1 1 1 1  4  27 o 77.45000 0.5851000 77.68000 0.8850000 77.22000 0.7658000 0.4556000      1.170000  
1 1 1 1  4  29 o 50.42000 0.4087000 50.27000 0.5365000 50.57000 0.6168000 -0.2975000     0.8174000 
1 1 1 1  4  31 o 7.871000 0.6642000 7.698000 0.8558000 8.045000 1.016000  -0.3470000     1.328000  
1 1 1 1  4  33 o 34.98000 0.3976000 34.71000 0.6128000 35.26000 0.5067000 -0.5414000     0.7951000 
1 1 1 1  4  35 o 40.33000 0.3337000 40.31000 0.4703000 40.34000 0.4735000 -0.3957000E-01 0.6674000 
1 1 1 1  4  37 o 12.33000 0.4513000 12.54000 0.5524000 12.12000 0.7138000 0.4273000      0.9026000 
1 1 1 1  4  39 o 14.70000 0.3706000 14.76000 0.5200000 14.64000 0.5280000 0.1111000      0.7411000 
1 1 1 1  4  41 o 30.69000 0.3602000 30.99000 0.5016000 30.39000 0.5169000 0.6059000      0.7203000 
1 1 1 1  4  43 o 22.00000 0.3886000 22.23000 0.5517000 21.77000 0.5476000 0.4594000      0.7773000 
1 1 1 1  4  45 o 5.974000 0.9931000 6.190000 1.491000  5.758000 1.312000  0.4319000      1.986000  
1 1 1 1  4  47 o 5.076000 1.057000  5.084000 1.500000  5.069000 1.489000  0.1542000E-01  2.113000  
1 1 1 1  4  49 o 8.102000 0.7525000 8.173000 1.054000  8.031000 1.075000  0.1421000      1.505000  
1 1 1 1  4  51 o 26.94000 0.3604000 27.31000 0.4714000 26.57000 0.5453000 0.7317000      0.7209000 
1 1 1 1  4  53 o 8.658000 0.7838000 7.113000 1.361000  10.20000 0.7786000 -3.088000      1.568000  
1 1 1 1  4  55 o 16.21000 0.4497000 16.13000 0.5713000 16.29000 0.6945000 -0.1638000     0.8993000 
1 1 1 1  4  57 o 11.87000 0.4836000 11.23000 0.7237000 12.51000 0.6416000 -1.277000      0.9672000 
1 1 1 1  4  59 o 6.417000 0.8690000 6.940000 1.131000  5.893000 1.320000  1.047000       1.738000  
1 1 1 1  4  61 o 11.97000 0.5262000 12.21000 0.7197000 11.73000 0.7679000 0.4839000      1.052000  
1 1 1 1  4  63 o 12.81000 0.4965000 13.00000 0.6556000 12.62000 0.7457000 0.3869000      0.9930000 
1 1 1 1  4  65 o 5.525000 1.023000  4.613000 1.520000  6.438000 1.369000  -1.825000      2.045000  
1 1 1 1  4  67 o 3.913000 0.9542000 2.973000 1.329000  4.853000 1.370000  -1.880000      1.908000  
1 1 1 1  5  0  o 150.3000 1.442000  150.3000 1.442000  150.3000 1.442000  0.000000       0.000000  
1 1 1 1  5  2  o 97.78000 0.7181000 97.96000 1.087000  97.61000 0.9383000 0.3449000      1.436000  
1 1 1 1  5  4  o 100.2000 0.6819000 101.5000 0.9761000 98.87000 0.9524000 2.590000       1.364000  
1 1 1 1  5  6  o 47.25000 0.3281000 47.10000 0.4625000 47.39000 0.4655000 -0.2935000     0.6562000 
1 1 1 1  5  8  o 72.23000 0.5115000 72.51000 0.8104000 71.94000 0.6243000 0.5671000      1.023000  
1 1 1 1  5  10 o 58.21000 0.4033000 57.96000 0.5679000 58.45000 0.5729000 -0.4902000     0.8067000 
1 1 1 1  5  12 o 86.91000 0.6865000 86.17000 0.9621000 87.64000 0.9796000 -1.473000      1.373000  
1 1 1 1  5  14 o 46.81000 0.3857000 47.60000 0.5529000 46.02000 0.5379000 1.582000       0.7713000 
1 1 1 1  5  16 o 36.04000 0.2688000 35.85000 0.3781000 36.23000 0.3821000 -0.3821000     0.5376000 
1 1 1 1  5  18 o 59.88000 0.4551000 60.30000 0.6926000 59.46000 0.5907000 0.8428000      0.9103000 
1 1 1 1  5  20 o 100.9000 0.6923000 100.7000 0.9773000 101.1000 0.9808000 -0.4132000     1.385000  
1 1 1 1  5  22 o 27.27000 0.2436000 27.33000 0.3454000 27.21000 0.3436000 0.1147000      0.4872000 
1 1 1 1  5  24 o 100.3000 0.6909000 100.7000 0.9804000 99.94000 0.9738000 0.7421000      1.382000  
1 1 1 1  5  26 o 63.03000 0.5177000 63.23000 0.7333000 62.83000 0.7309000 0.3941000      1.035000  
1 1 1 1  5  28 o 50.49000 0.4086000 50.69000 0.6194000 50.30000 0.5331000 0.3915000      0.8172000 
1 1 1 1  5  30 o 7.560000 0.6660000 7.905000 0.7553000 7.216000 1.097000  0.6886000      1.332000  
1 1 1 1  5  32 o 25.71000 0.3356000 25.64000 0.4753000 25.78000 0.4738000 -0.1451000     0.6711000 
1 1 1 1  5  34 o 51.39000 0.5008000 51.31000 0.7738000 51.46000 0.6360000 -0.1477000     1.002000  
1 1 1 1  5  36 o 28.32000 0.3005000 28.41000 0.4200000 28.24000 0.4299000 0.1711000      0.6010000 
1 1 1 1  5  38 o 15.53000 0.3789000 14.99000 0.5372000 16.06000 0.5346000 -1.068000      0.7578000 
1 1 1 1  5  40 o 24.25000 0.3237000 24.21000 0.4874000 24.29000 0.4262000 -0.8127000E-01 0.6475000 
1 1 1 1  5  42 o 22.54000 0.4120000 22.21000 0.6393000 22.86000 0.5200000 -0.6563000     0.8241000 
1 1 1 1  5  44 o 29.22000 0.3541000 29.60000 0.5270000 28.84000 0.4731000 0.7651000      0.7082000 
1 1 1 1  5  46 o 20.63000 0.3554000 20.76000 0.4954000 20.51000 0.5095000 0.2458000      0.7107000 
1 1 1 1  5  48 o 27.15000 0.3359000 26.37000 0.4751000 27.92000 0.4749000 -1.550000      0.6718000 
1 1 1 1  5  50 o 18.98000 0.3646000 18.69000 0.5254000 19.26000 0.5058000 -0.5723000     0.7293000 
1 1 1 1  5  52 o 18.95000 0.3938000 19.03000 0.5831000 18.87000 0.5293000 0.1673000      0.7876000 
1 1 1 1  5  54 o 17.02000 0.6454000 18.00000 1.012000  16.04000 0.8007000 1.958000       1.291000  
1 1 1 1  5  56 o 14.10000 0.4607000 13.70000 0.6097000 14.49000 0.6907000 -0.7893000     0.9213000 
1 1 1 1  5  58 o 10.87000 0.6458000 12.28000 0.8268000 9.469000 0.9923000 2.808000       1.292000  
1 1 1 1  5  60 o 8.672000 0.6712000 8.444000 0.9278000 8.900000 0.9701000 -0.4555000     1.342000  
1 1 1 1  5  62 o 5.878000 1.013000  6.242000 1.358000  5.514000 1.503000  0.7282000      2.026000  
1 1 1 1  5  64 o 7.462000 1.046000  6.722000 1.325000  8.202000 1.619000  -1.480000      2.092000  
1 1 1 1  5  66 o 4.268000 1.119000  4.233000 1.666000  4.303000 1.494000  -0.6991000E-01 2.237000  
1 1 1 1  5  68 o 3.994000 1.021000  4.338000 1.455000  3.650000 1.432000  0.6886000      2.041000  
1 1 1 1  6  1  o 90.70000 0.6170000 91.21000 0.8773000 90.19000 0.8677000 1.022000       1.234000  
1 1 1 1  6  3  o 105.6000 0.7180000 105.4000 1.013000  105.8000 1.018000  -0.4820000     1.436000  
1 1 1 1  6  5  o 26.86000 0.1978000 27.02000 0.2806000 26.70000 0.2788000 0.3227000      0.3956000 
1 1 1 1  6  7  o 118.8000 0.8075000 118.7000 1.141000  118.9000 1.143000  -0.2539000     1.615000  
1 1 1 1  6  9  o 100.4000 0.7078000 101.0000 1.123000  99.85000 0.8617000 1.201000       1.416000  
1 1 1 1  6  11 o 80.22000 0.6344000 79.55000 0.8891000 80.88000 0.9052000 -1.331000      1.269000  
1 1 1 1  6  13 o 25.87000 0.2266000 25.65000 0.3433000 26.09000 0.2959000 -0.4400000     0.4532000 
1 1 1 1  6  15 o 43.99000 0.4095000 43.72000 0.5137000 44.26000 0.6378000 -0.5384000     0.8189000 
1 1 1 1  6  17 o 19.46000 0.2103000 19.31000 0.2766000 19.62000 0.3170000 -0.3159000     0.4207000 
1 1 1 1  6  19 o 38.61000 0.3153000 38.91000 0.4802000 38.30000 0.4088000 0.6124000      0.6306000 
1 1 1 1  6  21 o 97.37000 0.6705000 97.69000 0.9505000 97.06000 0.9460000 0.6300000      1.341000  
1 1 1 1  6  23 o 48.29000 0.3549000 47.94000 0.4987000 48.64000 0.5051000 -0.7010000     0.7098000 
1 1 1 1  6  25 o 63.85000 0.4901000 63.42000 0.6392000 64.28000 0.7430000 -0.8582000     0.9801000 
1 1 1 1  6  27 o 84.13000 0.5869000 84.89000 0.8366000 83.38000 0.8234000 1.503000       1.174000  
1 1 1 1  6  29 o 23.48000 0.4246000 23.36000 0.5882000 23.60000 0.6123000 -0.2324000     0.8491000 
1 1 1 1  6  31 o 103.8000 0.7177000 104.0000 1.017000  103.7000 1.013000  0.3245000      1.435000  
1 1 1 1  6  33 o 17.79000 0.3750000 18.13000 0.5334000 17.45000 0.5274000 0.6767000      0.7501000 
1 1 1 1  6  35 o 19.55000 0.3222000 19.69000 0.4492000 19.41000 0.4621000 0.2839000      0.6445000 
1 1 1 1  6  37 o 9.617000 0.5991000 9.062000 0.9066000 10.17000 0.7833000 -1.109000      1.198000  
1 1 1 1  6  39 o 30.31000 0.3500000 29.79000 0.4882000 30.82000 0.5016000 -1.026000      0.7000000 
1 1 1 1  6  41 o 17.72000 0.3548000 17.54000 0.4996000 17.91000 0.5039000 -0.3791000     0.7096000 
1 1 1 1  6  43 o 18.47000 0.3719000 18.45000 0.5018000 18.49000 0.5489000 -0.4508000E-01 0.7437000 
1 1 1 1  6  45 o 18.57000 0.3986000 18.65000 0.5191000 18.50000 0.6051000 0.1487000      0.7973000 
1 1 1 1  6  47 o 12.88000 0.4826000 12.80000 0.6863000 12.96000 0.6786000 -0.1647000     0.9652000 
1 1 1 1  6  49 o 8.045000 0.7455000 8.534000 0.9713000 7.556000 1.131000  0.9787000      1.491000  
1 1 1 1  6  51 o 5.261000 1.103000  5.770000 1.551000  4.752000 1.570000  1.017000       2.207000  
1 1 1 1  6  53 o 7.469000 0.7835000 7.748000 1.124000  7.191000 1.092000  0.5571000      1.567000  
1 1 1 1  6  55 o 5.976000 0.9744000 6.371000 1.281000  5.580000 1.468000  0.7912000      1.949000  
1 1 1 1  6  57 o 13.05000 0.4921000 12.40000 0.7729000 13.69000 0.6093000 -1.288000      0.9842000 
1 1 1 1  6  59 o 7.359000 0.8129000 7.416000 1.273000  7.301000 1.011000  0.1153000      1.626000  
1 1 1 1  6  61 o 10.79000 0.5802000 10.78000 0.7259000 10.81000 0.9053000 -0.2741000E-01 1.160000  
1 1 1 1  6  63 o 3.734000 1.020000  3.158000 1.410000  4.309000 1.474000  -1.151000      2.039000  
1 1 1 1  6  65 o 4.568000 1.076000  4.039000 1.520000  5.098000 1.525000  -1.060000      2.153000  
1 1 1 1  6  67 o 5.785000 0.9875000 4.718000 1.552000  6.853000 1.222000  -2.135000      1.975000  
1 1 1 1  7  0  o 70.08000 0.6770000 70.08000 0.6770000 70.08000 0.6770000 0.000000       0.000000  
1 1 1 1  7  2  o 84.39000 0.5756000 83.85000 0.8096000 84.92000 0.8183000 -1.077000      1.151000  
1 1 1 1  7  4  o 99.48000 0.7008000 98.83000 0.8513000 100.1000 1.113000  -1.293000      1.402000  
1 1 1 1  7  6  o 99.64000 0.6790000 100.3000 0.9662000 99.01000 0.9541000 1.262000       1.358000  
1 1 1 1  7  8  f 66.24000 0.4710000 66.42000 0.7450000 66.06000 0.5765000 0.3556000      0.9421000 
1 1 1 1  7  10 o 109.0000 0.8575000 109.7000 1.220000  108.3000 1.205000  1.440000       1.715000  
1 1 1 1  7  12 o 107.0000 0.7304000 106.9000 1.032000  107.1000 1.034000  -0.2521000     1.461000  
1 1 1 1  7  14 o 24.07000 0.2624000 24.13000 0.4107000 24.02000 0.3266000 0.1169000      0.5247000 
1 1 1 1  7  16 o 32.34000 0.2495000 32.50000 0.3531000 32.19000 0.3526000 0.3092000      0.4990000 
1 1 1 1  7  18 o 99.69000 0.6844000 100.1000 0.9702000 99.32000 0.9658000 0.7385000      1.369000  
1 1 1 1  7  20 o 67.82000 0.4751000 67.81000 0.6721000 67.83000 0.6715000 -0.2048000E-01 0.9501000 
1 1 1 1  7  22 o 59.51000 0.4231000 59.56000 0.5986000 59.47000 0.5982000 0.8849000E-01  0.8463000 
1 1 1 1  7  24 o 31.39000 0.3133000 31.46000 0.4455000 31.33000 0.4406000 0.1282000      0.6266000 
1 1 1 1  7  26 o 56.47000 0.4415000 56.06000 0.6619000 56.89000 0.5843000 -0.8252000     0.8829000 
1 1 1 1  7  28 o 43.90000 0.3727000 44.05000 0.5667000 43.75000 0.4843000 0.3018000      0.7455000 
1 1 1 1  7  30 o 81.61000 0.6630000 81.00000 0.9329000 82.22000 0.9424000 -1.222000      1.326000  
1 1 1 1  7  32 o 41.55000 0.3677000 41.72000 0.4830000 41.37000 0.5547000 0.3471000      0.7355000 
1 1 1 1  7  34 o 63.46000 0.4983000 63.67000 0.6535000 63.26000 0.7525000 0.4098000      0.9966000 
1 1 1 1  7  36 o 17.15000 0.3630000 16.72000 0.5544000 17.58000 0.4689000 -0.8621000     0.7260000 
1 1 1 1  7  38 o 56.44000 0.4214000 56.17000 0.5941000 56.72000 0.5978000 -0.5478000     0.8428000 
1 1 1 1  7  40 o 24.41000 0.3141000 23.83000 0.4437000 24.98000 0.4447000 -1.153000      0.6282000 
1 1 1 1  7  42 o 24.99000 0.4073000 24.58000 0.6222000 25.40000 0.5258000 -0.8167000     0.8146000 
1 1 1 1  7  44 o 3.883000 1.006000  3.330000 1.393000  4.436000 1.452000  -1.106000      2.012000  
1 1 1 1  7  46 o 9.260000 0.7035000 9.817000 1.016000  8.704000 0.9733000 1.113000       1.407000  
1 1 1 1  7  48 o 18.18000 0.3814000 17.48000 0.5591000 18.88000 0.5189000 -1.404000      0.7628000 
1 1 1 1  7  50 o 12.01000 0.5137000 12.48000 0.7036000 11.53000 0.7488000 0.9541000      1.027000  
1 1 1 1  7  52 o 7.736000 0.7057000 7.784000 1.005000  7.688000 0.9907000 0.9528000E-01  1.411000  
1 1 1 1  7  54 o 23.96000 0.3617000 24.10000 0.5356000 23.82000 0.4862000 0.2817000      0.7233000 
1 1 1 1  7  56 o 12.72000 0.4815000 12.60000 0.6609000 12.85000 0.7003000 -0.2466000     0.9629000 
1 1 1 1  7  58 o 6.400000 0.8943000 7.541000 1.177000  5.259000 1.346000  2.283000       1.789000  
1 1 1 1  7  60 o 4.155000 1.007000  4.054000 1.427000  4.255000 1.420000  -0.2011000     2.013000  
1 1 1 1  7  62 o 9.573000 0.7349000 9.423000 1.038000  9.724000 1.040000  -0.3012000     1.470000  
1 1 1 1  7  64 o 4.229000 1.094000  4.089000 1.604000  4.369000 1.489000  -0.2807000     2.188000  
1 1 1 1  7  66 o 6.668000 1.004000  7.003000 1.289000  6.333000 1.539000  0.6698000      2.007000  
1 1 1 1  8  1  o 101.4000 0.6899000 101.3000 0.9747000 101.5000 0.9766000 -0.1347000     1.380000  
1 1 1 1  8  3  o 61.54000 0.4232000 62.49000 0.6077000 60.58000 0.5892000 1.911000       0.8464000 
1 1 1 1  8  5  o 93.91000 0.6627000 93.16000 0.8042000 94.67000 1.053000  -1.510000      1.325000  
1 1 1 1  8  7  o 129.5000 0.8807000 129.5000 1.245000  129.5000 1.246000  0.1772000E-01  1.761000  
1 1 1 1  8  9  o 51.56000 0.3894000 51.79000 0.5889000 51.34000 0.5097000 0.4456000      0.7789000 
1 1 1 1  8  11 o 59.75000 0.4280000 59.38000 0.6719000 60.11000 0.5305000 -0.7323000     0.8561000 
1 1 1 1  8  13 o 34.71000 0.2989000 34.67000 0.4251000 34.75000 0.4204000 -0.7970000E-01 0.5979000 
1 1 1 1  8  15 o 65.84000 0.4961000 65.65000 0.6459000 66.03000 0.7533000 -0.3775000     0.9923000 
1 1 1 1  8  17 o 55.37000 0.4233000 56.04000 0.5604000 54.71000 0.6345000 1.331000       0.8465000 
1 1 1 1  8  19 o 75.16000 0.5656000 75.59000 0.8590000 74.72000 0.7361000 0.8656000      1.131000  
1 1 1 1  8  21 o 82.92000 0.5743000 83.00000 0.8129000 82.83000 0.8113000 0.1651000      1.149000  
1 1 1 1  8  23 o 29.13000 0.2620000 29.19000 0.3693000 29.07000 0.3717000 0.1261000      0.5240000 
1 1 1 1  8  25 o 100.1000 0.7959000 100.5000 1.130000  99.68000 1.121000  0.8347000      1.592000  
1 1 1 1  8  27 o 41.89000 0.3599000 41.59000 0.5430000 42.19000 0.4723000 -0.6045000     0.7197000 
1 1 1 1  8  29 o 46.26000 0.4637000 45.44000 0.7140000 47.08000 0.5918000 -1.641000      0.9274000 
1 1 1 1  8  31 o 60.91000 0.4446000 61.12000 0.6296000 60.71000 0.6280000 0.4144000      0.8893000 
1 1 1 1  8  33 o 13.18000 0.5246000 12.68000 0.8330000 13.68000 0.6380000 -1.002000      1.049000  
1 1 1 1  8  35 o 18.00000 0.3291000 17.77000 0.4719000 18.23000 0.4588000 -0.4649000     0.6581000 
1 1 1 1  8  37 o 13.34000 0.3904000 12.99000 0.5811000 13.68000 0.5214000 -0.6886000     0.7807000 
1 1 1 1  8  39 o 33.37000 0.3365000 33.08000 0.5019000 33.67000 0.4485000 -0.5840000     0.6731000 
1 1 1 1  8  41 o 32.34000 0.3459000 32.82000 0.5247000 31.86000 0.4508000 0.9586000      0.6917000 
1 1 1 1  8  43 o 21.01000 0.3593000 20.12000 0.4762000 21.89000 0.5381000 -1.774000      0.7186000 
1 1 1 1  8  45 o 33.83000 0.3607000 34.39000 0.4744000 33.28000 0.5436000 1.118000       0.7215000 
1 1 1 1  8  47 o 14.43000 0.4600000 15.12000 0.6196000 13.74000 0.6801000 1.377000       0.9200000 
1 1 1 1  8  49 o 10.29000 0.5598000 9.952000 0.8282000 10.62000 0.7532000 -0.6715000     1.120000  
1 1 1 1  8  51 o 14.04000 0.4725000 14.44000 0.6838000 13.63000 0.6522000 0.8060000      0.9449000 
1 1 1 1  8  53 o 8.219000 0.7948000 7.807000 1.218000  8.630000 1.021000  -0.8229000     1.590000  
1 1 1 1  8  55 o 6.370000 0.9124000 6.494000 1.183000  6.245000 1.389000  0.2487000      1.825000  
1 1 1 1  8  57 o 11.24000 0.5237000 12.25000 0.7301000 10.23000 0.7511000 2.021000       1.047000  
1 1 1 1  8  59 o 4.717000 1.056000  3.720000 1.470000  5.715000 1.518000  -1.995000      2.113000  
1 1 1 1  8  61 o 7.513000 0.9506000 6.139000 1.544000  8.887000 1.110000  -2.749000      1.901000  
1 1 1 1  8  63 o 7.221000 1.008000  6.942000 1.509000  7.500000 1.338000  -0.5576000     2.017000  
1 1 1 1  8  65 o 3.996000 1.079000  3.604000 1.419000  4.388000 1.627000  -0.7840000     2.159000  
1 1 1 1  8  67 o 6.088000 0.9936000 6.660000 1.363000  5.515000 1.446000  1.145000       1.987000  
1 1 1 1  9  0  o 6.373000 0.2512000 6.373000 0.2512000 6.373000 0.2512000 0.000000       0.000000  
1 1 1 1  9  2  o 140.0000 0.9512000 140.8000 1.352000  139.2000 1.338000  1.656000       1.902000  
1 1 1 1  9  4  o 35.45000 0.2543000 35.55000 0.3607000 35.36000 0.3585000 0.1889000      0.5085000 
1 1 1 1  9  6  o 89.71000 0.6323000 90.17000 0.7801000 89.26000 0.9954000 0.9045000      1.265000  
1 1 1 1  9  8  o 71.66000 0.5807000 71.87000 0.6259000 71.45000 0.9784000 0.4238000      1.161000  
1 1 1 1  9  10 o 70.32000 0.5239000 70.78000 0.7950000 69.85000 0.6825000 0.9351000      1.048000  
1 1 1 1  9  12 o 65.56000 0.5388000 65.72000 0.9108000 65.40000 0.5758000 0.3276000      1.078000  
1 1 1 1  9  14 o 19.94000 0.1933000 20.13000 0.3047000 19.76000 0.2380000 0.3716000      0.3866000 
1 1 1 1  9  16 o 83.56000 0.5760000 83.56000 0.8147000 83.56000 0.8144000 -0.1144000E-02 1.152000  
1 1 1 1  9  18 o 152.7000 1.040000  153.6000 1.479000  151.9000 1.463000  1.718000       2.080000  
1 1 1 1  9  20 o 57.62000 0.4101000 57.53000 0.5794000 57.72000 0.5805000 -0.1901000     0.8202000 
1 1 1 1  9  22 o 26.36000 0.2520000 26.62000 0.3566000 26.11000 0.3562000 0.5195000      0.5041000 
1 1 1 1  9  24 o 71.70000 0.5799000 71.89000 0.8223000 71.51000 0.8180000 0.3823000      1.160000  
1 1 1 1  9  26 o 80.84000 0.6546000 80.89000 0.9278000 80.79000 0.9237000 0.1016000      1.309000  
1 1 1 1  9  28 f 91.45000 0.8222000 91.43000 1.274000  91.46000 1.039000  -0.2838000E-01 1.644000  
1 1 1 1  9  30 o 51.95000 0.4827000 51.41000 0.5462000 52.48000 0.7960000 -1.069000      0.9654000 
1 1 1 1  9  32 o 27.35000 0.3203000 26.88000 0.4207000 27.83000 0.4832000 -0.9505000     0.6407000 
1 1 1 1  9  34 o 55.14000 0.4123000 54.88000 0.5817000 55.40000 0.5845000 -0.5176000     0.8246000 
1 1 1 1  9  36 o 45.03000 0.3579000 44.88000 0.5082000 45.18000 0.5042000 -0.2924000     0.7159000 
1 1 1 1  9  38 o 24.01000 0.3418000 23.45000 0.4895000 24.58000 0.4772000 -1.133000      0.6836000 
1 1 1 1  9  40 o 7.978000 0.6695000 7.727000 1.010000  8.229000 0.8789000 -0.5026000     1.339000  
1 1 1 1  9  42 o 6.739000 0.8931000 6.993000 1.324000  6.484000 1.199000  0.5090000      1.786000  
1 1 1 1  9  44 f 26.18000 0.3228000 26.39000 0.4595000 25.96000 0.4535000 0.4299000      0.6456000 
1 1 1 1  9  46 o 11.76000 0.5534000 11.77000 0.8202000 11.75000 0.7433000 0.1723000E-01  1.107000  
1 1 1 1  9  48 o 22.05000 0.3565000 21.88000 0.5068000 22.23000 0.5014000 -0.3442000     0.7129000 
1 1 1 1  9  50 o 5.658000 1.061000  6.262000 1.435000  5.055000 1.564000  1.208000       2.123000  
1 1 1 1  9  52 o 15.88000 0.4122000 16.01000 0.6203000 15.74000 0.5430000 0.2720000      0.8244000 
1 1 1 1  9  54 o 16.69000 0.4252000 16.72000 0.6480000 16.67000 0.5506000 0.5358000E-01  0.8503000 
1 1 1 1  9  56 o 6.836000 0.7518000 7.548000 0.9613000 6.124000 1.156000  1.424000       1.504000  
1 1 1 1  9  58 o 9.484000 0.5710000 9.082000 0.8140000 9.887000 0.8010000 -0.8055000     1.142000  
1 1 1 1  9  60 o 12.19000 0.5748000 12.30000 0.7142000 12.09000 0.9009000 0.2182000      1.150000  
1 1 1 1  9  62 o 6.098000 1.008000  6.759000 1.358000  5.437000 1.491000  1.322000       2.017000  
1 1 1 1  9  64 o 5.176000 1.047000  4.047000 1.628000  6.305000 1.318000  -2.258000      2.095000  
1 1 1 1  9  66 o 3.522000 1.012000  3.734000 1.429000  3.310000 1.433000  0.4244000      2.024000  
1 1 1 1  10 1  o 113.7000 0.7737000 113.0000 1.087000  114.5000 1.101000  -1.520000      1.547000  
1 1 1 1  10 3  o 38.05000 0.2715000 38.19000 0.3854000 37.91000 0.3825000 0.2883000      0.5430000 
1 1 1 1  10 5  o 15.63000 0.1526000 15.49000 0.2158000 15.77000 0.2159000 -0.2720000     0.3052000 
1 1 1 1  10 7  o 31.91000 0.2749000 32.06000 0.3026000 31.75000 0.4590000 0.3111000      0.5498000 
1 1 1 1  10 9  o 44.55000 0.3418000 44.19000 0.4451000 44.91000 0.5188000 -0.7196000     0.6836000 
1 1 1 1  10 11 o 11.05000 0.1821000 11.28000 0.2780000 10.82000 0.2353000 0.4611000      0.3642000 
1 1 1 1  10 13 o 42.02000 0.4675000 42.44000 0.8521000 41.61000 0.3848000 0.8361000      0.9349000 
1 1 1 1  10 15 o 63.74000 0.4808000 63.41000 0.7206000 64.07000 0.6367000 -0.6633000     0.9616000 
1 1 1 1  10 17 o 74.37000 0.5583000 74.59000 0.7323000 74.15000 0.8430000 0.4363000      1.117000  
1 1 1 1  10 19 o 54.23000 0.4201000 54.08000 0.6349000 54.38000 0.5505000 -0.3003000     0.8403000 
1 1 1 1  10 21 o 69.78000 0.4900000 69.70000 0.6920000 69.85000 0.6938000 -0.1489000     0.9799000 
1 1 1 1  10 23 o 95.80000 0.7154000 95.31000 1.078000  96.30000 0.9408000 -0.9900000     1.431000  
1 1 1 1  10 25 o 42.06000 0.3579000 43.09000 0.4763000 41.02000 0.5343000 2.068000       0.7158000 
1 1 1 1  10 27 o 48.27000 0.4232000 48.03000 0.5971000 48.51000 0.5999000 -0.4838000     0.8464000 
1 1 1 1  10 29 o 97.93000 0.7849000 97.82000 1.109000  98.04000 1.111000  -0.2187000     1.570000  
1 1 1 1  10 31 o 77.37000 0.5464000 77.49000 0.7740000 77.24000 0.7713000 0.2490000      1.093000  
1 1 1 1  10 33 f 49.85000 0.4137000 50.06000 0.6301000 49.64000 0.5363000 0.4145000      0.8274000 
1 1 1 1  10 35 o 63.06000 0.4592000 62.85000 0.6484000 63.27000 0.6505000 -0.4171000     0.9185000 
1 1 1 1  10 37 o 29.88000 0.3012000 30.48000 0.4326000 29.28000 0.4193000 1.198000       0.6024000 
1 1 1 1  10 39 o 32.87000 0.3162000 32.87000 0.4499000 32.87000 0.4443000 -0.1278000E-02 0.6323000 
1 1 1 1  10 41 o 24.42000 0.3782000 24.74000 0.5353000 24.11000 0.5344000 0.6348000      0.7564000 
1 1 1 1  10 43 o 45.40000 0.4283000 45.80000 0.6078000 45.00000 0.6037000 0.8047000      0.8566000 
1 1 1 1  10 45 f 26.30000 0.3533000 25.58000 0.4728000 27.02000 0.5252000 -1.432000      0.7066000 
1 1 1 1  10 47 o 24.71000 0.3413000 24.86000 0.4831000 24.57000 0.4823000 0.2919000      0.6827000 
1 1 1 1  10 49 o 15.98000 0.4238000 15.96000 0.6015000 16.00000 0.5972000 -0.3647000E-01 0.8476000 
1 1 1 1  10 51 o 15.19000 0.4060000 14.69000 0.6051000 15.69000 0.5414000 -0.9947000     0.8120000 
1 1 1 1  10 53 o 10.26000 0.5584000 10.30000 0.7550000 10.22000 0.8229000 0.7307000E-01  1.117000  
1 1 1 1  10 55 o 13.12000 0.4779000 12.64000 0.6410000 13.61000 0.7092000 -0.9675000     0.9559000 
1 1 1 1  10 57 o 7.491000 0.7611000 7.910000 0.9122000 7.072000 1.219000  0.8388000      1.522000  
1 1 1 1  10 59 o 6.467000 0.8665000 6.872000 1.104000  6.063000 1.336000  0.8088000      1.733000  
1 1 1 1  10 61 o 10.09000 0.6128000 9.594000 0.9274000 10.59000 0.8012000 -0.9984000     1.226000  
1 1 1 1  10 63 o 5.586000 1.121000  4.860000 1.674000  6.311000 1.492000  -1.450000      2.243000  
1 1 1 1  10 65 o 5.094000 1.027000  4.493000 1.475000  5.694000 1.428000  -1.201000      2.053000  
1 1 1 1  10 67 o 3.697000 1.103000  4.187000 1.686000  3.208000 1.422000  0.9789000      2.205000  
1 1 1 1  11 0  o 28.79000 0.3026000 28.79000 0.3026000 28.79000 0.3026000 0.000000       0.000000  
1 1 1 1  11 2  o 80.17000 0.5488000 80.13000 0.7761000 80.20000 0.7762000 -0.6850000E-01 1.098000  
1 1 1 1  11 4  o 38.22000 0.2743000 38.05000 0.3869000 38.38000 0.3888000 -0.3363000     0.5485000 
1 1 1 1  11 6  o 38.97000 0.3018000 38.94000 0.3969000 39.00000 0.4547000 -0.5804000E-01 0.6035000 
1 1 1 1  11 8  o 32.00000 0.2594000 31.89000 0.3394000 32.12000 0.3924000 -0.2347000     0.5189000 
1 1 1 1  11 10 o 31.92000 0.2493000 31.82000 0.3078000 32.02000 0.3922000 -0.1978000     0.4986000 
1 1 1 1  11 12 o 45.05000 0.5037000 44.94000 0.8964000 45.16000 0.4596000 -0.2205000     1.007000  
1 1 1 1  11 14 o 31.24000 0.2660000 31.48000 0.3960000 31.01000 0.3553000 0.4648000      0.5320000 
1 1 1 1  11 16 o 79.25000 0.5661000 79.65000 0.8965000 78.84000 0.6915000 0.8072000      1.132000  
1 1 1 1  11 18 o 36.01000 0.3357000 35.80000 0.5400000 36.21000 0.3990000 -0.4167000     0.6714000 
1 1 1 1  11 20 o 51.07000 0.3721000 51.25000 0.5262000 50.89000 0.5264000 0.3545000      0.7443000 
1 1 1 1  11 22 o 69.61000 0.5694000 68.87000 0.7964000 70.34000 0.8140000 -1.464000      1.139000  
1 1 1 1  11 24 o 63.85000 0.5237000 63.65000 0.7378000 64.05000 0.7435000 -0.3950000     1.047000  
1 1 1 1  11 26 o 11.94000 0.4643000 11.96000 0.6582000 11.92000 0.6551000 0.4769000E-01  0.9286000 
1 1 1 1  11 28 o 70.07000 0.5407000 70.35000 0.8215000 69.78000 0.7032000 0.5688000      1.081000  
1 1 1 1  11 30 o 78.97000 0.6020000 78.98000 0.7878000 78.96000 0.9105000 0.2483000E-01  1.204000  
1 1 1 1  11 32 o 20.74000 0.3197000 20.72000 0.4158000 20.77000 0.4858000 -0.5012000E-01 0.6395000 
1 1 1 1  11 34 f 24.22000 0.3196000 24.29000 0.4871000 24.15000 0.4141000 0.1385000      0.6393000 
1 1 1 1  11 36 o 52.78000 0.4003000 52.48000 0.5637000 53.08000 0.5686000 -0.6043000     0.8007000 
1 1 1 1  11 38 o 33.52000 0.3157000 33.29000 0.4489000 33.75000 0.4440000 -0.4651000     0.6314000 
1 1 1 1  11 40 o 21.34000 0.3804000 21.35000 0.5420000 21.33000 0.5339000 0.2082000E-01  0.7608000 
1 1 1 1  11 42 o 34.90000 0.3602000 35.26000 0.5483000 34.55000 0.4672000 0.7158000      0.7203000 
1 1 1 1  11 44 o 24.48000 0.3652000 24.59000 0.4820000 24.36000 0.5489000 0.2289000      0.7305000 
1 1 1 1  11 46 o 23.95000 0.3861000 23.26000 0.5512000 24.64000 0.5409000 -1.378000      0.7722000 
1 1 1 1  11 48 o 22.75000 0.3482000 23.02000 0.4862000 22.48000 0.4985000 0.5380000      0.6964000 
1 1 1 1  11 50 o 10.90000 0.5874000 10.93000 0.8705000 10.88000 0.7888000 0.4210000E-01  1.175000  
1 1 1 1  11 52 o 15.68000 0.4715000 15.41000 0.6946000 15.94000 0.6378000 -0.5292000     0.9430000 
1 1 1 1  11 54 o 3.571000 0.9621000 2.746000 1.262000  4.395000 1.453000  -1.650000      1.924000  
1 1 1 1  11 56 o 6.820000 0.8076000 7.002000 1.062000  6.638000 1.217000  0.3631000      1.615000  
1 1 1 1  11 58 o 13.61000 0.4458000 13.00000 0.6533000 14.22000 0.6066000 -1.217000      0.8915000 
1 1 1 1  11 60 o 11.47000 0.6230000 12.29000 0.8187000 10.66000 0.9393000 1.627000       1.246000  
1 1 1 1  11 62 o 5.669000 1.093000  5.645000 1.621000  5.693000 1.467000  -0.4793000E-01 2.186000  
1 1 1 1  11 64 o 4.869000 1.074000  4.885000 1.422000  4.852000 1.611000  0.3277000E-01  2.149000  
1 1 1 1  11 66 o 4.004000 0.9729000 4.800000 1.421000  3.207000 1.330000  1.592000       1.946000  
1 1 1 1  12 1  f 86.24000 0.5896000 85.94000 0.8309000 86.55000 0.8368000 -0.6037000     1.179000  
1 1 1 1  12 3  f 17.97000 0.1642000 18.08000 0.2331000 17.86000 0.2314000 0.2220000      0.3284000 
1 1 1 1  12 5  o 11.72000 0.1683000 12.13000 0.2253000 11.31000 0.2500000 0.8244000      0.3365000 
1 1 1 1  12 7  o 55.63000 0.4198000 55.26000 0.6313000 56.00000 0.5535000 -0.7372000     0.8396000 
1 1 1 1  12 9  o 88.81000 0.6289000 88.86000 0.7715000 88.76000 0.9933000 0.1084000      1.258000  
1 1 1 1  12 11 o 42.20000 0.3928000 41.97000 0.6073000 42.43000 0.4982000 -0.4578000     0.7855000 
1 1 1 1  12 13 o 30.96000 0.2603000 30.89000 0.3896000 31.02000 0.3453000 -0.1304000     0.5206000 
1 1 1 1  12 15 o 72.98000 0.5470000 72.30000 0.8177000 73.66000 0.7268000 -1.360000      1.094000  
1 1 1 1  12 17 o 62.76000 0.4773000 63.12000 0.7213000 62.41000 0.6253000 0.7076000      0.9546000 
1 1 1 1  12 19 o 73.81000 0.6348000 74.95000 1.044000  72.67000 0.7227000 2.280000       1.270000  
1 1 1 1  12 21 o 44.03000 0.3338000 43.65000 0.4686000 44.42000 0.4755000 -0.7720000     0.6676000 
1 1 1 1  12 23 o 51.33000 0.4351000 51.22000 0.6120000 51.44000 0.6186000 -0.2287000     0.8701000 
1 1 1 1  12 25 o 25.92000 0.3221000 26.00000 0.4477000 25.84000 0.4631000 0.1595000      0.6441000 
1 1 1 1  12 27 o 27.30000 0.3302000 27.63000 0.4713000 26.97000 0.4628000 0.6569000      0.6605000 
1 1 1 1  12 29 o 54.96000 0.4421000 55.49000 0.6738000 54.43000 0.5726000 1.066000       0.8842000 
1 1 1 1  12 31 o 66.50000 0.4795000 66.24000 0.6747000 66.76000 0.6816000 -0.5199000     0.9590000 
1 1 1 1  12 33 o 78.38000 0.6412000 77.67000 0.8996000 79.09000 0.9140000 -1.426000      1.282000  
1 1 1 1  12 35 o 32.68000 0.3069000 32.86000 0.4349000 32.51000 0.4331000 0.3480000      0.6137000 
1 1 1 1  12 37 o 39.60000 0.3763000 39.54000 0.5318000 39.66000 0.5326000 -0.1230000     0.7526000 
1 1 1 1  12 39 o 45.11000 0.3651000 44.69000 0.5163000 45.54000 0.5162000 -0.8498000     0.7301000 
1 1 1 1  12 41 f 10.28000 0.5434000 9.955000 0.7837000 10.60000 0.7529000 -0.6479000     1.087000  
1 1 1 1  12 43 o 15.13000 0.4620000 15.04000 0.7171000 15.22000 0.5826000 -0.1803000     0.9239000 
1 1 1 1  12 45 o 28.00000 0.3559000 28.19000 0.4733000 27.82000 0.5316000 0.3703000      0.7118000 
1 1 1 1  12 47 o 19.62000 0.3897000 19.41000 0.5914000 19.82000 0.5078000 -0.4054000     0.7795000 
1 1 1 1  12 49 o 20.96000 0.4040000 21.33000 0.5557000 20.60000 0.5864000 0.7321000      0.8079000 
1 1 1 1  12 51 o 16.10000 0.4286000 16.66000 0.6299000 15.55000 0.5813000 1.110000       0.8572000 
1 1 1 1  12 53 o 11.91000 0.4862000 11.27000 0.7261000 12.55000 0.6467000 -1.278000      0.9724000 
1 1 1 1  12 55 o 21.53000 0.3711000 21.31000 0.4826000 21.74000 0.5638000 -0.4252000     0.7421000 
1 1 1 1  12 57 o 23.65000 0.3666000 23.32000 0.4846000 23.99000 0.5503000 -0.6744000     0.7332000 
1 1 1 1  12 59 o 4.062000 0.9300000 5.462000 1.443000  2.662000 1.174000  2.800000       1.860000  
1 1 1 1  12 61 o 2.667000 0.8783000 2.534000 1.227000  2.800000 1.257000  -0.2651000     1.757000  
1 1 1 1  12 63 o 10.22000 0.5789000 11.30000 0.7389000 9.129000 0.8913000 2.176000       1.158000  
1 1 1 1  12 65 o 8.729000 0.7112000 9.916000 1.036000  7.543000 0.9745000 2.373000       1.422000  
1 1 1 1  12 67 o 4.845000 1.068000  5.312000 1.546000  4.378000 1.473000  0.9340000      2.136000  
1 1 1 1  13 0  o 35.14000 0.3618000 35.14000 0.3618000 35.14000 0.3618000 0.000000       0.000000  
1 1 1 1  13 2  o 37.28000 0.2696000 37.04000 0.3792000 37.52000 0.3834000 -0.4785000     0.5392000 
1 1 1 1  13 4  o 16.15000 0.1755000 16.43000 0.2325000 15.86000 0.2630000 0.5697000      0.3510000 
1 1 1 1  13 6  o 62.44000 0.4683000 62.53000 0.7087000 62.34000 0.6124000 0.1872000      0.9366000 
1 1 1 1  13 8  o 40.89000 0.3054000 41.06000 0.3777000 40.72000 0.4799000 0.3410000      0.6107000 
1 1 1 1  13 10 o 54.03000 0.4404000 54.00000 0.6232000 54.06000 0.6223000 -0.6162000E-01 0.8808000 
1 1 1 1  13 12 o 37.11000 0.2783000 37.41000 0.3955000 36.81000 0.3916000 0.6000000      0.5566000 
1 1 1 1  13 14 o 35.70000 0.2963000 35.92000 0.3860000 35.48000 0.4496000 0.4418000      0.5926000 
1 1 1 1  13 16 o 18.85000 0.2697000 19.72000 0.4317000 17.99000 0.3236000 1.728000       0.5395000 
1 1 1 1  13 18 o 76.67000 0.6532000 76.28000 1.060000  77.06000 0.7631000 -0.7828000     1.306000  
1 1 1 1  13 20 o 105.5000 0.7498000 106.0000 1.188000  105.0000 0.9153000 1.001000       1.500000  
1 1 1 1  13 22 o 75.04000 0.7429000 75.05000 1.050000  75.03000 1.052000  0.1475000E-01  1.486000  
1 1 1 1  13 24 o 53.46000 0.3946000 53.81000 0.5613000 53.12000 0.5548000 0.6952000      0.7892000 
1 1 1 1  13 26 o 23.81000 0.3274000 23.78000 0.4548000 23.85000 0.4710000 -0.6777000E-01 0.6547000 
1 1 1 1  13 28 o 33.20000 0.3277000 33.36000 0.4995000 33.04000 0.4244000 0.3195000      0.6555000 
1 1 1 1  13 30 o 52.77000 0.4312000 51.88000 0.5540000 53.66000 0.6609000 -1.778000      0.8624000 
1 1 1 1  13 32 o 62.99000 0.5596000 62.53000 0.6431000 63.45000 0.9160000 -0.9118000     1.119000  
1 1 1 1  13 34 o 22.34000 0.3276000 22.75000 0.4930000 21.94000 0.4316000 0.8081000      0.6552000 
1 1 1 1  13 36 f 27.42000 0.3332000 27.34000 0.4699000 27.50000 0.4724000 -0.1607000     0.6663000 
1 1 1 1  13 38 o 26.25000 0.3113000 26.04000 0.4448000 26.46000 0.4357000 -0.4203000     0.6227000 
1 1 1 1  13 40 o 23.64000 0.3435000 23.16000 0.4479000 24.12000 0.5208000 -0.9568000     0.6870000 
1 1 1 1  13 42 o 38.05000 0.3672000 37.54000 0.5521000 38.56000 0.4844000 -1.016000      0.7344000 
1 1 1 1  13 44 o 22.43000 0.3770000 22.33000 0.4900000 22.52000 0.5730000 -0.1911000     0.7539000 
1 1 1 1  13 46 o 26.26000 0.3580000 25.48000 0.4777000 27.04000 0.5333000 -1.567000      0.7160000 
1 1 1 1  13 48 o 22.41000 0.3759000 22.06000 0.4936000 22.76000 0.5670000 -0.7000000     0.7518000 
1 1 1 1  13 50 o 22.53000 0.3436000 22.28000 0.4818000 22.79000 0.4899000 -0.5079000     0.6872000 
1 1 1 1  13 52 o 23.37000 0.3344000 23.35000 0.4717000 23.38000 0.4741000 -0.2935000E-01 0.6688000 
1 1 1 1  13 54 o 10.29000 0.5213000 9.965000 0.7584000 10.62000 0.7155000 -0.6582000     1.043000  
1 1 1 1  13 56 o 11.75000 0.4852000 11.42000 0.7123000 12.08000 0.6590000 -0.6602000     0.9704000 
1 1 1 1  13 58 o 4.078000 1.031000  4.859000 1.536000  3.297000 1.376000  1.562000       2.062000  
1 1 1 1  13 60 o 8.350000 0.6554000 8.251000 0.9629000 8.449000 0.8894000 -0.1979000     1.311000  
1 1 1 1  13 62 o 3.390000 0.9569000 2.776000 1.264000  4.005000 1.437000  -1.229000      1.914000  
1 1 1 1  13 64 o 2.902000 0.9055000 2.845000 1.271000  2.958000 1.290000  -0.1122000     1.811000  
1 1 1 1  13 66 o 2.898000 0.8970000 3.048000 1.323000  2.747000 1.212000  0.3003000      1.794000  
1 1 1 1  14 1  o 51.44000 0.3606000 51.33000 0.5086000 51.54000 0.5113000 -0.2102000     0.7212000 
1 1 1 1  14 3  o 57.92000 0.4663000 58.01000 0.6611000 57.82000 0.6578000 0.1844000      0.9326000 
1 1 1 1  14 5  o 55.13000 0.4167000 54.92000 0.6278000 55.33000 0.5480000 -0.4126000     0.8333000 
1 1 1 1  14 7  o 91.02000 0.6244000 91.22000 0.8850000 90.82000 0.8811000 0.3997000      1.249000  
1 1 1 1  14 9  o 38.32000 0.3269000 38.35000 0.4654000 38.28000 0.4591000 0.6582000E-01  0.6538000 
1 1 1 1  14 11 o 83.59000 0.6226000 83.47000 0.8156000 83.71000 0.9410000 -0.2398000     1.245000  
1 1 1 1  14 13 o 159.8000 1.175000  160.4000 1.544000  159.2000 1.771000  1.242000       2.350000  
1 1 1 1  14 15 o 43.53000 0.3743000 44.02000 0.5321000 43.05000 0.5266000 0.9754000      0.7486000 
1 1 1 1  14 17 o 123.5000 0.9131000 123.6000 1.380000  123.4000 1.196000  0.1907000      1.826000  
1 1 1 1  14 19 o 82.93000 0.7056000 82.71000 1.149000  83.15000 0.8197000 -0.4360000     1.411000  
1 1 1 1  14 21 o 60.18000 0.5303000 60.91000 0.8695000 59.45000 0.6074000 1.458000       1.061000  
1 1 1 1  14 23 o 13.16000 0.3570000 13.32000 0.5554000 12.99000 0.4485000 0.3276000      0.7139000 
1 1 1 1  14 25 o 46.77000 0.4547000 46.92000 0.7016000 46.62000 0.5787000 0.3021000      0.9094000 
1 1 1 1  14 27 o 42.12000 0.3372000 42.83000 0.4805000 41.41000 0.4734000 1.419000       0.6745000 
1 1 1 1  14 29 o 22.10000 0.3250000 22.00000 0.4921000 22.20000 0.4247000 -0.2007000     0.6500000 
1 1 1 1  14 31 o 15.04000 0.3606000 15.02000 0.5143000 15.06000 0.5057000 -0.3497000E-01 0.7212000 
1 1 1 1  14 33 o 56.78000 0.4883000 57.73000 0.6985000 55.84000 0.6827000 1.886000       0.9767000 
1 1 1 1  14 35 o 16.33000 0.3441000 16.68000 0.4743000 15.98000 0.4987000 0.6989000      0.6882000 
1 1 1 1  14 37 o 43.78000 0.3886000 43.70000 0.5918000 43.85000 0.5039000 -0.1407000     0.7772000 
1 1 1 1  14 39 o 25.37000 0.3616000 25.57000 0.5173000 25.17000 0.5053000 0.3932000      0.7231000 
1 1 1 1  14 41 o 10.95000 0.5263000 10.99000 0.7202000 10.92000 0.7677000 0.7068000E-01  1.053000  
1 1 1 1  14 43 o 29.79000 0.3580000 29.37000 0.5466000 30.21000 0.4626000 -0.8418000     0.7161000 
1 1 1 1  14 45 o 32.16000 0.3591000 32.70000 0.5478000 31.62000 0.4645000 1.084000       0.7182000 
1 1 1 1  14 47 o 15.15000 0.4679000 14.29000 0.7372000 16.01000 0.5764000 -1.720000      0.9358000 
1 1 1 1  14 49 o 9.691000 0.6034000 9.700000 0.8949000 9.682000 0.8098000 0.1824000E-01  1.207000  
1 1 1 1  14 51 o 7.865000 0.8055000 7.035000 1.276000  8.695000 0.9835000 -1.660000      1.611000  
1 1 1 1  14 53 o 12.55000 0.4431000 12.85000 0.6037000 12.26000 0.6489000 0.5884000      0.8863000 
1 1 1 1  14 55 o 10.04000 0.5702000 9.985000 0.8623000 10.10000 0.7464000 -0.1146000     1.140000  
1 1 1 1  14 57 o 6.366000 0.8837000 5.130000 1.436000  7.602000 1.031000  -2.472000      1.767000  
1 1 1 1  14 59 o 3.480000 1.015000  3.630000 1.470000  3.331000 1.399000  0.2995000      2.029000  
1 1 1 1  14 61 o 11.71000 0.5542000 11.88000 0.6655000 11.55000 0.8865000 0.3286000      1.108000  
1 1 1 1  14 63 o 9.071000 0.6390000 9.237000 0.9402000 8.905000 0.8657000 0.3316000      1.278000  
1 1 1 1  14 65 o 8.251000 0.8065000 8.233000 1.277000  8.270000 0.9858000 -0.3679000E-01 1.613000  
1 1 1 1  15 0  o 37.03000 0.4405000 37.03000 0.4405000 37.03000 0.4405000 0.000000       0.000000  
1 1 1 1  15 2  o 36.29000 0.2878000 36.48000 0.3780000 36.09000 0.4340000 0.3827000      0.5755000 
1 1 1 1  15 4  o 76.47000 0.5690000 76.52000 0.8606000 76.43000 0.7446000 0.8486000E-01  1.138000  
1 1 1 1  15 6  o 73.76000 0.5509000 73.69000 0.8328000 73.84000 0.7213000 -0.1499000     1.102000  
1 1 1 1  15 8  o 135.9000 1.133000  135.3000 1.845000  136.5000 1.316000  -1.125000      2.266000  
1 1 1 1  15 10 o 66.64000 0.5010000 67.79000 0.6706000 65.50000 0.7444000 2.283000       1.002000  
1 1 1 1  15 12 o 53.61000 0.4700000 53.63000 0.5439000 53.59000 0.7667000 0.4475000E-01  0.9400000 
1 1 1 1  15 14 o 79.82000 0.5992000 79.90000 0.7829000 79.75000 0.9075000 0.1458000      1.198000  
1 1 1 1  15 16 o 15.16000 0.2558000 15.14000 0.3268000 15.19000 0.3935000 -0.5411000E-01 0.5115000 
1 1 1 1  15 18 o 89.27000 0.7627000 90.38000 1.257000  88.15000 0.8644000 2.232000       1.525000  
1 1 1 1  15 20 o 82.78000 0.6232000 83.09000 0.9433000 82.46000 0.8146000 0.6254000      1.246000  
1 1 1 1  15 22 o 59.20000 0.4605000 59.03000 0.6917000 59.37000 0.6081000 -0.3446000     0.9210000 
1 1 1 1  15 24 o 35.59000 0.3094000 35.45000 0.4829000 35.73000 0.3869000 -0.2726000     0.6188000 
1 1 1 1  15 26 o 26.06000 0.2894000 26.50000 0.4476000 25.61000 0.3671000 0.8906000      0.5788000 
1 1 1 1  15 28 o 21.15000 0.3684000 21.40000 0.5977000 20.91000 0.4310000 0.4884000      0.7369000 
1 1 1 1  15 30 o 25.25000 0.3205000 25.82000 0.4161000 24.68000 0.4876000 1.140000       0.6410000 
1 1 1 1  15 32 o 27.31000 0.3482000 26.81000 0.5009000 27.80000 0.4838000 -0.9908000     0.6964000 
1 1 1 1  15 34 o 16.99000 0.3659000 17.50000 0.5384000 16.48000 0.4957000 1.022000       0.7318000 
1 1 1 1  15 36 o 39.94000 0.3810000 40.23000 0.5391000 39.66000 0.5385000 0.5664000      0.7619000 
1 1 1 1  15 38 o 9.589000 0.5281000 8.806000 0.7952000 10.37000 0.6952000 -1.566000      1.056000  
1 1 1 1  15 40 o 28.35000 0.3158000 28.72000 0.4524000 27.97000 0.4407000 0.7447000      0.6315000 
1 1 1 1  15 42 o 20.40000 0.3802000 20.27000 0.5646000 20.53000 0.5093000 -0.2552000     0.7604000 
1 1 1 1  15 44 o 26.25000 0.3652000 25.93000 0.4717000 26.58000 0.5577000 -0.6489000     0.7304000 
1 1 1 1  15 46 o 5.131000 1.106000  4.967000 1.530000  5.295000 1.598000  -0.3282000     2.213000  
1 1 1 1  15 48 o 9.650000 0.6870000 10.38000 0.9224000 8.923000 1.018000  1.454000       1.374000  
1 1 1 1  15 50 f 5.543000 1.081000  5.724000 1.502000  5.362000 1.556000  0.3621000      2.163000  
1 1 1 1  15 52 o 20.45000 0.3404000 20.23000 0.4917000 20.66000 0.4708000 -0.4306000     0.6808000 
1 1 1 1  15 54 o 6.076000 0.8537000 4.943000 1.410000  7.208000 0.9626000 -2.264000      1.707000  
1 1 1 1  15 56 o 16.68000 0.4033000 16.75000 0.5306000 16.61000 0.6076000 0.1350000      0.8067000 
1 1 1 1  15 58 o 5.807000 0.9552000 5.573000 1.378000  6.040000 1.323000  -0.4667000     1.910000  
1 1 1 1  15 60 o 5.606000 1.034000  6.783000 1.540000  4.429000 1.379000  2.354000       2.067000  
1 1 1 1  15 62 o 4.128000 1.049000  4.013000 1.506000  4.243000 1.461000  -0.2305000     2.098000  
1 1 1 1  15 64 o 5.594000 0.9304000 5.616000 1.376000  5.572000 1.253000  0.4374000E-01  1.861000  
1 1 1 1  15 66 o 4.152000 1.080000  3.491000 1.426000  4.813000 1.623000  -1.322000      2.160000  
1 1 1 1  16 1  o 59.69000 0.4500000 59.74000 0.6806000 59.64000 0.5888000 0.1075000      0.9000000 
1 1 1 1  16 3  o 48.49000 0.4232000 48.84000 0.6935000 48.14000 0.4852000 0.6928000      0.8464000 
1 1 1 1  16 5  o 80.20000 0.5970000 80.04000 0.9014000 80.35000 0.7830000 -0.3030000     1.194000  
1 1 1 1  16 7  o 80.11000 0.6777000 80.50000 1.110000  79.72000 0.7775000 0.7819000      1.355000  
1 1 1 1  16 9  o 86.46000 0.6459000 87.69000 0.9890000 85.22000 0.8311000 2.470000       1.292000  
1 1 1 1  16 11 o 29.26000 0.2457000 29.06000 0.3037000 29.46000 0.3863000 -0.4048000     0.4914000 
1 1 1 1  16 13 o 90.33000 0.7660000 89.56000 0.8734000 91.10000 1.259000  -1.538000      1.532000  
1 1 1 1  16 15 o 158.7000 1.249000  158.7000 1.767000  158.7000 1.767000  0.8331000E-02  2.498000  
1 1 1 1  16 17 o 87.55000 0.6562000 87.83000 0.9947000 87.28000 0.8562000 0.5514000      1.312000  
1 1 1 1  16 19 o 20.65000 0.2571000 20.99000 0.3630000 20.31000 0.3641000 0.6763000      0.5141000 
1 1 1 1  16 21 o 105.3000 0.8361000 105.1000 1.180000  105.5000 1.185000  -0.4298000     1.672000  
1 1 1 1  16 23 o 106.8000 0.7611000 107.1000 1.205000  106.5000 0.9306000 0.6490000      1.522000  
1 1 1 1  16 25 o 27.12000 0.3234000 26.90000 0.5347000 27.34000 0.3641000 -0.4379000     0.6469000 
1 1 1 1  16 27 o 32.63000 0.3057000 32.45000 0.4782000 32.81000 0.3810000 -0.3657000     0.6114000 
1 1 1 1  16 29 o 28.25000 0.3564000 27.73000 0.5722000 28.77000 0.4251000 -1.041000      0.7128000 
1 1 1 1  16 31 o 28.13000 0.3402000 28.31000 0.5733000 27.95000 0.3666000 0.3600000      0.6805000 
1 1 1 1  16 33 o 36.85000 0.3175000 36.34000 0.4430000 37.37000 0.4548000 -1.036000      0.6350000 
1 1 1 1  16 35 o 22.92000 0.3392000 22.85000 0.4853000 23.00000 0.4740000 -0.1492000     0.6784000 
1 1 1 1  16 37 o 42.64000 0.3536000 42.80000 0.5011000 42.47000 0.4989000 0.3387000      0.7071000 
1 1 1 1  16 39 f 28.96000 0.3130000 28.85000 0.4427000 29.06000 0.4426000 -0.2131000     0.6260000 
1 1 1 1  16 41 o 28.66000 0.3193000 29.14000 0.4520000 28.17000 0.4512000 0.9722000      0.6387000 
1 1 1 1  16 43 f 19.76000 0.3951000 19.29000 0.5951000 20.23000 0.5198000 -0.9462000     0.7901000 
1 1 1 1  16 45 o 37.44000 0.3764000 36.93000 0.4876000 37.95000 0.5736000 -1.016000      0.7528000 
1 1 1 1  16 47 o 29.59000 0.4198000 29.70000 0.6502000 29.49000 0.5313000 0.2072000      0.8396000 
1 1 1 1  16 49 o 21.87000 0.3404000 22.09000 0.4793000 21.64000 0.4835000 0.4533000      0.6808000 
1 1 1 1  16 51 o 16.98000 0.3778000 16.86000 0.5428000 17.09000 0.5257000 -0.2331000     0.7557000 
1 1 1 1  16 53 f 12.46000 0.4517000 12.44000 0.6645000 12.48000 0.6120000 -0.3275000E-01 0.9034000 
1 1 1 1  16 55 o 14.41000 0.4535000 14.68000 0.6915000 14.15000 0.5869000 0.5237000      0.9069000 
1 1 1 1  16 57 o 20.85000 0.3730000 20.77000 0.5114000 20.93000 0.5430000 -0.1601000     0.7459000 
1 1 1 1  16 59 o 23.90000 0.3459000 23.74000 0.4816000 24.06000 0.4967000 -0.3188000     0.6918000 
1 1 1 1  16 61 o 9.878000 0.5739000 10.19000 0.7853000 9.570000 0.8371000 0.6164000      1.148000  
1 1 1 1  16 63 o 4.289000 1.075000  4.161000 1.568000  4.417000 1.472000  -0.2555000     2.151000  
1 1 1 1  16 65 o 9.609000 0.8026000 9.235000 1.464000  9.983000 0.6584000 -0.7477000     1.605000  
1 1 1 1  17 0  o 48.35000 0.5627000 48.35000 0.5627000 48.35000 0.5627000 0.000000       0.000000  
1 1 1 1  17 2  o 42.87000 0.3349000 43.31000 0.5096000 42.44000 0.4346000 0.8632000      0.6698000 
1 1 1 1  17 4  o 36.93000 0.2974000 36.43000 0.4467000 37.43000 0.3927000 -1.001000      0.5948000 
1 1 1 1  17 6  o 103.0000 0.7611000 102.3000 1.143000  103.8000 1.006000  -1.520000      1.522000  
1 1 1 1  17 8  o 34.84000 0.3302000 34.70000 0.3778000 34.99000 0.5417000 -0.2900000     0.6605000 
1 1 1 1  17 10 o 61.33000 0.5098000 62.14000 0.5539000 60.53000 0.8561000 1.616000       1.020000  
1 1 1 1  17 12 o 51.30000 0.5806000 51.30000 0.4693000 51.29000 1.062000  0.6676000E-02  1.161000  
1 1 1 1  17 14 o 73.98000 0.5990000 73.07000 0.8382000 74.89000 0.8560000 -1.824000      1.198000  
1 1 1 1  17 16 o 114.9000 0.7886000 115.3000 1.117000  114.6000 1.113000  0.6804000      1.577000  
1 1 1 1  17 18 o 137.9000 1.017000  135.9000 1.518000  139.9000 1.353000  -4.045000      2.033000  
1 1 1 1  17 20 o 111.2000 0.8824000 111.0000 1.246000  111.4000 1.250000  -0.4162000     1.765000  
1 1 1 1  17 22 o 13.23000 0.3340000 13.01000 0.4835000 13.45000 0.4609000 -0.4404000     0.6679000 
1 1 1 1  17 24 o 42.45000 0.4248000 42.64000 0.6532000 42.25000 0.5432000 0.3962000      0.8496000 
1 1 1 1  17 26 o 53.29000 0.4095000 53.20000 0.6430000 53.38000 0.5073000 -0.1838000     0.8190000 
1 1 1 1  17 28 o 35.48000 0.3613000 34.98000 0.6035000 35.99000 0.3973000 -1.010000      0.7225000 
1 1 1 1  17 30 o 28.14000 0.3199000 28.49000 0.4688000 27.80000 0.4355000 0.6925000      0.6399000 
1 1 1 1  17 32 o 32.56000 0.3477000 33.50000 0.4906000 31.63000 0.4929000 1.871000       0.6954000 
1 1 1 1  17 34 o 6.271000 0.9225000 6.716000 1.362000  5.827000 1.244000  0.8890000      1.845000  
1 1 1 1  17 36 f 25.73000 0.3108000 26.32000 0.4842000 25.15000 0.3899000 1.170000       0.6216000 
1 1 1 1  17 38 o 6.088000 0.9958000 6.718000 1.237000  5.458000 1.561000  1.260000       1.992000  
1 1 1 1  17 40 o 25.12000 0.3166000 25.23000 0.4481000 25.00000 0.4473000 0.2219000      0.6331000 
1 1 1 1  17 42 o 16.77000 0.3766000 16.31000 0.5322000 17.23000 0.5330000 -0.9223000     0.7532000 
1 1 1 1  17 44 o 32.05000 0.3651000 31.63000 0.4728000 32.48000 0.5565000 -0.8483000     0.7302000 
1 1 1 1  17 46 o 21.68000 0.3948000 21.21000 0.5191000 22.16000 0.5948000 -0.9521000     0.7895000 
1 1 1 1  17 48 o 3.340000 0.9622000 3.786000 1.432000  2.895000 1.286000  0.8905000      1.924000  
1 1 1 1  17 50 o 12.40000 0.4629000 13.13000 0.6262000 11.67000 0.6819000 1.459000       0.9258000 
1 1 1 1  17 52 o 21.35000 0.3374000 21.45000 0.4660000 21.25000 0.4880000 0.2046000      0.6747000 
1 1 1 1  17 54 o 18.01000 0.3611000 18.10000 0.5122000 17.92000 0.5092000 0.1846000      0.7222000 
1 1 1 1  17 56 o 21.18000 0.3672000 21.34000 0.4813000 21.02000 0.5546000 0.3271000      0.7343000 
1 1 1 1  17 58 o 5.535000 1.051000  5.935000 1.511000  5.134000 1.460000  0.8003000      2.102000  
1 1 1 1  17 60 o 10.65000 0.5939000 10.41000 0.9056000 10.90000 0.7685000 -0.4861000     1.188000  
1 1 1 1  17 62 o 3.165000 0.9209000 2.828000 1.298000  3.503000 1.307000  -0.6743000     1.842000  
1 1 1 1  17 64 o 3.560000 1.020000  4.030000 1.571000  3.089000 1.301000  0.9411000      2.040000  
1 1 1 1  18 1  o 132.0000 1.039000  132.0000 1.468000  132.1000 1.470000  -0.7138000E-01 2.078000  
1 1 1 1  18 3  o 89.79000 0.6677000 90.64000 1.017000  88.95000 0.8659000 1.691000       1.335000  
1 1 1 1  18 5  o 47.72000 0.3978000 47.85000 0.5634000 47.58000 0.5618000 0.2742000      0.7956000 
1 1 1 1  18 7  o 86.63000 0.6448000 86.95000 0.8491000 86.30000 0.9706000 0.6531000      1.290000  
1 1 1 1  18 9  o 46.65000 0.3694000 45.95000 0.4751000 47.35000 0.5657000 -1.400000      0.7388000 
1 1 1 1  18 11 o 58.22000 0.5099000 57.97000 0.5873000 58.46000 0.8337000 -0.4886000     1.020000  
1 1 1 1  18 13 f 52.68000 0.4518000 52.26000 0.4793000 53.10000 0.7660000 -0.8442000     0.9036000 
1 1 1 1  18 15 o 122.6000 0.8398000 123.2000 1.192000  122.1000 1.183000  1.060000       1.680000  
1 1 1 1  18 17 o 90.06000 0.6751000 90.09000 1.021000  90.03000 0.8834000 0.6247000E-01  1.350000  
1 1 1 1  18 19 o 25.56000 0.2969000 25.60000 0.4177000 25.53000 0.4220000 0.7006000E-01  0.5937000 
1 1 1 1  18 21 o 41.05000 0.3247000 41.24000 0.4612000 40.87000 0.4573000 0.3645000      0.6495000 
1 1 1 1  18 23 o 30.81000 0.3305000 30.49000 0.4681000 31.13000 0.4668000 -0.6437000     0.6611000 
1 1 1 1  18 25 o 41.36000 0.3347000 41.37000 0.4709000 41.36000 0.4756000 0.1881000E-01  0.6693000 
1 1 1 1  18 27 o 27.10000 0.3126000 27.29000 0.4699000 26.90000 0.4124000 0.3939000      0.6252000 
1 1 1 1  18 29 o 42.60000 0.3519000 43.01000 0.5531000 42.19000 0.4353000 0.8218000      0.7039000 
1 1 1 1  18 31 o 6.466000 0.7596000 6.342000 1.217000  6.589000 0.9095000 -0.2473000     1.519000  
1 1 1 1  18 33 o 35.99000 0.3697000 35.72000 0.6176000 36.26000 0.4066000 -0.5402000     0.7394000 
1 1 1 1  18 35 o 43.65000 0.4134000 43.30000 0.6902000 44.00000 0.4551000 -0.6990000     0.8267000 
1 1 1 1  18 37 o 17.72000 0.4149000 17.41000 0.6723000 18.03000 0.4865000 -0.6212000     0.8299000 
1 1 1 1  18 39 o 32.87000 0.3268000 33.45000 0.5123000 32.28000 0.4059000 1.173000       0.6536000 
1 1 1 1  18 41 o 13.98000 0.4358000 14.19000 0.7042000 13.78000 0.5135000 0.4149000      0.8715000 
1 1 1 1  18 43 o 24.85000 0.4925000 25.69000 0.8675000 24.02000 0.4666000 1.666000       0.9850000 
1 1 1 1  18 45 o 29.43000 0.3545000 29.48000 0.5334000 29.39000 0.4670000 0.8358000E-01  0.7089000 
1 1 1 1  18 47 o 27.99000 0.3809000 28.46000 0.6337000 27.53000 0.4227000 0.9326000      0.7618000 
1 1 1 1  18 49 o 22.37000 0.4079000 22.16000 0.6668000 22.57000 0.4701000 -0.4105000     0.8158000 
1 1 1 1  18 51 o 16.23000 0.3842000 16.16000 0.6095000 16.30000 0.4680000 -0.1423000     0.7684000 
1 1 1 1  18 53 o 12.47000 0.4479000 12.51000 0.7054000 12.42000 0.5521000 0.8669000E-01  0.8958000 
1 1 1 1  18 55 o 7.033000 0.8275000 7.909000 1.288000  6.157000 1.039000  1.752000       1.655000  
1 1 1 1  18 57 o 15.84000 0.4769000 15.84000 0.6084000 15.84000 0.7345000 -0.1473000E-02 0.9538000 
1 1 1 1  18 59 o 15.16000 0.5782000 14.96000 0.9695000 15.36000 0.6304000 -0.4047000     1.156000  
1 1 1 1  18 61 f 4.615000 1.017000  3.786000 1.518000  5.445000 1.355000  -1.659000      2.034000  
1 1 1 1  18 63 o 9.266000 0.6438000 9.498000 1.000000  9.034000 0.8110000 0.4638000      1.288000  
1 1 1 1  18 65 o 7.342000 1.000000  6.698000 1.841000  7.986000 0.7827000 -1.288000      2.000000  
1 1 1 1  19 0  o 28.02000 0.3259000 28.02000 0.3259000 28.02000 0.3259000 0.000000       0.000000  
1 1 1 1  19 2  o 32.13000 0.3252000 32.54000 0.5062000 31.73000 0.4083000 0.8107000      0.6504000 
1 1 1 1  19 4  o 52.45000 0.4047000 52.45000 0.5284000 52.45000 0.6130000 0.4593000E-02  0.8093000 
1 1 1 1  19 6  o 90.80000 0.7663000 90.67000 0.8833000 90.92000 1.252000  -0.2421000     1.533000  
1 1 1 1  19 8  o 21.42000 0.2877000 20.88000 0.3520000 21.97000 0.4552000 -1.093000      0.5754000 
1 1 1 1  19 10 o 99.00000 0.7374000 98.67000 0.9616000 99.32000 1.118000  -0.6446000     1.475000  
1 1 1 1  19 12 o 51.86000 0.4459000 51.84000 0.4781000 51.88000 0.7528000 -0.4169000E-01 0.8918000 
1 1 1 1  19 14 o 103.3000 0.7338000 103.3000 0.8995000 103.2000 1.160000  0.6503000E-01  1.468000  
1 1 1 1  19 16 o 46.43000 0.3779000 46.32000 0.5722000 46.53000 0.4939000 -0.2052000     0.7558000 
1 1 1 1  19 18 o 43.39000 0.3867000 43.07000 0.5482000 43.70000 0.5455000 -0.6313000     0.7734000 
1 1 1 1  19 20 f 46.74000 0.3872000 45.74000 0.4933000 47.74000 0.5971000 -2.007000      0.7745000 
1 1 1 1  19 22 o 18.19000 0.3286000 18.01000 0.4605000 18.38000 0.4689000 -0.3689000     0.6573000 
1 1 1 1  19 24 o 39.25000 0.3218000 39.30000 0.4521000 39.19000 0.4581000 0.1087000      0.6437000 
1 1 1 1  19 26 o 45.08000 0.3532000 45.11000 0.4981000 45.05000 0.5010000 0.5837000E-01  0.7065000 
1 1 1 1  19 28 o 32.60000 0.3274000 32.94000 0.5010000 32.25000 0.4217000 0.6873000      0.6549000 
1 1 1 1  19 30 o 44.50000 0.3832000 44.51000 0.4970000 44.48000 0.5835000 0.3138000E-01  0.7665000 
1 1 1 1  19 32 o 37.91000 0.3479000 37.37000 0.5137000 38.45000 0.4694000 -1.083000      0.6959000 
1 1 1 1  19 34 o 6.646000 0.8815000 6.391000 1.472000  6.901000 0.9699000 -0.5097000     1.763000  
1 1 1 1  19 36 o 24.99000 0.3238000 25.51000 0.4710000 24.46000 0.4446000 1.051000       0.6477000 
1 1 1 1  19 38 o 27.65000 0.3194000 27.96000 0.4978000 27.33000 0.4005000 0.6295000      0.6389000 
1 1 1 1  19 40 o 7.489000 0.7374000 7.637000 1.144000  7.341000 0.9314000 0.2961000      1.475000  
1 1 1 1  19 42 o 37.79000 0.4026000 38.60000 0.6795000 36.97000 0.4319000 1.630000       0.8051000 
1 1 1 1  19 44 o 36.59000 0.3682000 35.97000 0.5474000 37.21000 0.4927000 -1.233000      0.7364000 
1 1 1 1  19 46 o 14.71000 0.5399000 14.94000 0.6734000 14.48000 0.8442000 0.4573000      1.080000  
1 1 1 1  19 48 o 21.98000 0.3438000 21.95000 0.5313000 22.01000 0.4365000 -0.5512000E-01 0.6877000 
1 1 1 1  19 50 f 11.21000 0.4771000 11.39000 0.7430000 11.03000 0.5986000 0.3670000      0.9542000 
1 1 1 1  19 52 o 11.40000 0.4750000 10.78000 0.7662000 12.03000 0.5616000 -1.246000      0.9499000 
1 1 1 1  19 54 o 11.55000 0.4937000 11.53000 0.7692000 11.56000 0.6189000 -0.2667000E-01 0.9873000 
1 1 1 1  19 56 o 9.079000 0.6257000 9.563000 0.8466000 8.594000 0.9216000 0.9697000      1.251000  
1 1 1 1  19 58 o 4.932000 1.024000  4.876000 1.595000  4.987000 1.285000  -0.1114000     2.048000  
1 1 1 1  19 60 o 6.785000 0.8127000 7.650000 1.195000  5.919000 1.102000  1.731000       1.625000  
1 1 1 1  19 62 o 4.717000 1.034000  5.077000 1.585000  4.356000 1.329000  0.7212000      2.068000  
1 1 1 1  19 64 o 5.982000 0.9962000 5.914000 1.531000  6.050000 1.275000  -0.1359000     1.992000  
1 1 1 1  20 1  o 28.35000 0.3885000 28.00000 0.3809000 28.69000 0.6771000 -0.6877000     0.7769000 
1 1 1 1  20 3  o 123.2000 0.9076000 124.4000 1.201000  122.0000 1.361000  2.442000       1.815000  
1 1 1 1  20 5  o 71.48000 0.6455000 71.64000 0.8178000 71.33000 0.9989000 0.3084000      1.291000  
1 1 1 1  20 7  o 46.79000 0.3715000 46.79000 0.4853000 46.78000 0.5628000 0.4986000E-02  0.7431000 
1 1 1 1  20 9  o 41.31000 0.3367000 41.46000 0.4423000 41.16000 0.5079000 0.2979000      0.6735000 
1 1 1 1  20 11 o 80.88000 0.6875000 81.23000 0.7982000 80.54000 1.120000  0.6917000      1.375000  
1 1 1 1  20 13 o 44.58000 0.3468000 44.05000 0.4234000 45.11000 0.5494000 -1.068000      0.6936000 
1 1 1 1  20 15 o 76.56000 0.5798000 75.96000 0.8716000 77.15000 0.7649000 -1.189000      1.160000  
1 1 1 1  20 17 o 24.23000 0.2780000 24.37000 0.3681000 24.09000 0.4168000 0.2854000      0.5561000 
1 1 1 1  20 19 o 80.36000 0.5639000 80.47000 0.7978000 80.25000 0.7971000 0.2247000      1.128000  
1 1 1 1  20 21 o 71.73000 0.5488000 71.85000 0.7202000 71.62000 0.8282000 0.2296000      1.098000  
1 1 1 1  20 23 o 30.82000 0.3060000 30.81000 0.4609000 30.83000 0.4027000 -0.1838000E-01 0.6120000 
1 1 1 1  20 25 o 30.01000 0.2868000 29.85000 0.4000000 30.17000 0.4110000 -0.3111000     0.5735000 
1 1 1 1  20 27 o 61.70000 0.4856000 61.83000 0.7349000 61.57000 0.6349000 0.2611000      0.9711000 
1 1 1 1  20 29 o 44.79000 0.3835000 45.49000 0.5037000 44.08000 0.5785000 1.411000       0.7671000 
1 1 1 1  20 31 f 27.39000 0.3179000 27.44000 0.4127000 27.33000 0.4836000 0.1104000      0.6358000 
1 1 1 1  20 33 o 46.53000 0.4672000 46.55000 0.7253000 46.51000 0.5892000 0.4758000E-01  0.9344000 
1 1 1 1  20 35 o 26.25000 0.3024000 26.29000 0.4313000 26.21000 0.4240000 0.7892000E-01  0.6048000 
1 1 1 1  20 37 o 46.74000 0.3819000 46.38000 0.5959000 47.10000 0.4776000 -0.7186000     0.7637000 
1 1 1 1  20 39 o 42.11000 0.3603000 41.66000 0.5630000 42.57000 0.4498000 -0.9152000     0.7206000 
1 1 1 1  20 41 o 28.82000 0.3282000 28.63000 0.5076000 29.02000 0.4163000 -0.3950000     0.6564000 
1 1 1 1  20 43 o 5.197000 1.021000  5.948000 1.474000  4.446000 1.414000  1.502000       2.043000  
1 1 1 1  20 45 o 3.647000 0.9607000 4.902000 1.558000  2.392000 1.125000  2.510000       1.921000  
1 1 1 1  20 47 o 16.18000 0.4307000 16.55000 0.6988000 15.82000 0.5035000 0.7291000      0.8613000 
1 1 1 1  20 49 o 5.851000 0.8913000 5.228000 1.446000  6.474000 1.043000  -1.246000      1.783000  
1 1 1 1  20 51 o 4.768000 0.9170000 4.156000 1.430000  5.380000 1.149000  -1.224000      1.834000  
1 1 1 1  20 53 o 12.38000 0.4338000 12.52000 0.6729000 12.24000 0.5477000 0.2773000      0.8676000 
1 1 1 1  20 55 o 14.60000 0.4629000 14.65000 0.7671000 14.54000 0.5184000 0.1152000      0.9258000 
1 1 1 1  20 57 o 4.106000 0.9932000 3.800000 1.424000  4.411000 1.385000  -0.6107000     1.986000  
1 1 1 1  20 59 o 4.915000 1.016000  5.293000 1.438000  4.537000 1.436000  0.7559000      2.032000  
1 1 1 1  20 61 o 5.971000 0.8821000 5.464000 1.326000  6.478000 1.164000  -1.014000      1.764000  
1 1 1 1  20 63 o 5.791000 0.9038000 6.137000 1.249000  5.445000 1.307000  0.6917000      1.808000  
1 1 1 1  21 0  o 8.310000 0.4151000 8.310000 0.4151000 8.310000 0.4151000 0.000000       0.000000  
1 1 1 1  21 2  o 27.20000 0.3735000 27.40000 0.3848000 26.99000 0.6403000 0.4110000      0.7470000 
1 1 1 1  21 4  o 105.2000 0.8341000 105.6000 1.184000  104.8000 1.176000  0.7647000      1.668000  
1 1 1 1  21 6  o 28.58000 0.2648000 28.62000 0.3468000 28.54000 0.4002000 0.7594000E-01  0.5296000 
1 1 1 1  21 8  o 70.47000 0.5338000 70.85000 0.7024000 70.09000 0.8040000 0.7569000      1.068000  
1 1 1 1  21 10 o 76.00000 0.5745000 75.44000 0.7465000 76.57000 0.8735000 -1.134000      1.149000  
1 1 1 1  21 12 o 52.72000 0.3977000 52.08000 0.4832000 53.37000 0.6319000 -1.286000      0.7955000 
1 1 1 1  21 14 o 67.20000 0.5148000 67.50000 0.6800000 66.89000 0.7732000 0.6130000      1.030000  
1 1 1 1  21 16 o 37.27000 0.3510000 37.73000 0.5051000 36.81000 0.4875000 0.9225000      0.7020000 
1 1 1 1  21 18 o 133.4000 0.9875000 134.1000 1.497000  132.7000 1.288000  1.326000       1.975000  
1 1 1 1  21 20 o 135.2000 0.9989000 135.9000 1.317000  134.4000 1.502000  1.467000       1.998000  
1 1 1 1  21 22 o 30.23000 0.3048000 29.59000 0.4478000 30.88000 0.4135000 -1.295000      0.6095000 
1 1 1 1  21 24 o 17.05000 0.3090000 16.51000 0.4423000 17.60000 0.4317000 -1.095000      0.6181000 
1 1 1 1  21 26 o 36.85000 0.3447000 36.70000 0.4436000 36.99000 0.5276000 -0.2906000     0.6893000 
1 1 1 1  21 28 o 34.37000 0.3302000 33.88000 0.4931000 34.86000 0.4394000 -0.9745000     0.6605000 
1 1 1 1  21 30 o 15.34000 0.3600000 14.86000 0.4783000 15.81000 0.5380000 -0.9461000     0.7199000 
1 1 1 1  21 32 o 32.35000 0.3876000 32.64000 0.4865000 32.06000 0.6035000 0.5745000      0.7752000 
1 1 1 1  21 34 o 29.16000 0.3249000 28.67000 0.4895000 29.65000 0.4272000 -0.9813000     0.6497000 
1 1 1 1  21 36 o 23.09000 0.3399000 23.37000 0.5186000 22.81000 0.4396000 0.5635000      0.6798000 
1 1 1 1  21 38 o 19.27000 0.3345000 19.33000 0.4739000 19.21000 0.4724000 0.1246000      0.6691000 
1 1 1 1  21 40 o 23.82000 0.3222000 24.03000 0.4435000 23.62000 0.4676000 0.4022000      0.6445000 
1 1 1 1  21 42 o 32.97000 0.3545000 33.23000 0.5312000 32.71000 0.4697000 0.5203000      0.7091000 
1 1 1 1  21 44 o 38.81000 0.3788000 38.48000 0.4931000 39.14000 0.5753000 -0.6530000     0.7577000 
1 1 1 1  21 46 o 19.31000 0.3958000 19.60000 0.5580000 19.02000 0.5616000 0.5788000      0.7917000 
1 1 1 1  21 48 o 16.07000 0.4665000 16.01000 0.7198000 16.14000 0.5935000 -0.1253000     0.9329000 
1 1 1 1  21 50 o 7.257000 0.6468000 7.063000 0.9560000 7.450000 0.8714000 -0.3868000     1.294000  
1 1 1 1  21 52 o 5.310000 0.8121000 4.304000 1.289000  6.315000 0.9876000 -2.011000      1.624000  
1 1 1 1  21 54 f 8.539000 0.5832000 7.722000 0.8883000 9.356000 0.7557000 -1.634000      1.166000  
1 1 1 1  21 56 o 4.145000 1.076000  3.625000 1.422000  4.665000 1.616000  -1.040000      2.153000  
1 1 1 1  21 58 o 4.175000 1.120000  4.270000 1.597000  4.080000 1.570000  0.1902000      2.240000  
1 1 1 1  21 60 o 3.194000 0.9487000 3.275000 1.344000  3.113000 1.339000  0.1618000      1.897000  
1 1 1 1  21 62 o 4.347000 1.017000  3.664000 1.438000  5.029000 1.437000  -1.365000      2.033000  
1 1 1 1  21 64 o 3.459000 0.9580000 3.752000 1.400000  3.167000 1.308000  0.5848000      1.916000  
1 1 1 1  22 1  f 71.39000 0.5766000 72.77000 0.8318000 70.00000 0.7988000 2.772000       1.153000  
1 1 1 1  22 3  o 69.44000 0.4865000 69.67000 0.6902000 69.20000 0.6857000 0.4676000      0.9729000 
1 1 1 1  22 5  o 84.82000 0.6792000 83.97000 0.9511000 85.67000 0.9699000 -1.700000      1.358000  
1 1 1 1  22 7  o 138.5000 0.9462000 138.3000 1.336000  138.8000 1.340000  -0.4862000     1.892000  
1 1 1 1  22 9  o 97.36000 0.6713000 96.93000 0.9453000 97.79000 0.9533000 -0.8588000     1.343000  
1 1 1 1  22 11 o 59.29000 0.4253000 59.37000 0.6024000 59.21000 0.6005000 0.1630000      0.8506000 
1 1 1 1  22 13 o 72.69000 0.5524000 73.00000 0.7297000 72.38000 0.8295000 0.6214000      1.105000  
1 1 1 1  22 15 o 149.5000 1.256000  147.2000 1.424000  151.9000 2.070000  -4.777000      2.513000  
1 1 1 1  22 17 o 89.00000 0.6692000 89.30000 1.013000  88.70000 0.8746000 0.6065000      1.338000  
1 1 1 1  22 19 f 71.98000 0.5115000 71.63000 0.7195000 72.33000 0.7272000 -0.6987000     1.023000  
1 1 1 1  22 21 o 56.61000 0.4483000 57.39000 0.6818000 55.82000 0.5823000 1.575000       0.8967000 
1 1 1 1  22 23 o 38.20000 0.3172000 38.39000 0.4499000 38.01000 0.4471000 0.3777000      0.6343000 
1 1 1 1  22 25 f 37.08000 0.3136000 36.82000 0.4410000 37.34000 0.4460000 -0.5267000     0.6272000 
1 1 1 1  22 27 o 78.28000 0.5985000 77.63000 0.9005000 78.94000 0.7886000 -1.310000      1.197000  
1 1 1 1  22 29 o 43.98000 0.3822000 43.84000 0.4966000 44.11000 0.5811000 -0.2613000     0.7644000 
1 1 1 1  22 31 o 42.72000 0.4200000 42.17000 0.4842000 43.28000 0.6863000 -1.114000      0.8399000 
1 1 1 1  22 33 o 15.55000 0.3843000 15.08000 0.5799000 16.01000 0.5045000 -0.9262000     0.7686000 
1 1 1 1  22 35 o 12.32000 0.5056000 12.34000 0.7260000 12.29000 0.7039000 0.4857000E-01  1.011000  
1 1 1 1  22 37 o 38.80000 0.3363000 38.77000 0.4776000 38.83000 0.4737000 -0.6807000E-01 0.6727000 
1 1 1 1  22 39 o 28.93000 0.3154000 28.57000 0.4419000 29.29000 0.4500000 -0.7262000     0.6307000 
1 1 1 1  22 41 o 24.36000 0.3318000 24.80000 0.4639000 23.92000 0.4746000 0.8870000      0.6636000 
1 1 1 1  22 43 o 21.47000 0.3486000 20.97000 0.5032000 21.96000 0.4825000 -0.9837000     0.6971000 
1 1 1 1  22 45 o 30.49000 0.3520000 30.31000 0.4608000 30.67000 0.5323000 -0.3593000     0.7040000 
1 1 1 1  22 47 o 16.01000 0.4999000 15.51000 0.8158000 16.50000 0.5781000 -0.9822000     0.9998000 
1 1 1 1  22 49 o 6.307000 0.7725000 6.580000 0.9922000 6.033000 1.184000  0.5467000      1.545000  
1 1 1 1  22 51 o 7.921000 0.6097000 7.685000 0.8681000 8.156000 0.8563000 -0.4709000     1.219000  
1 1 1 1  22 53 o 6.763000 0.7239000 6.464000 1.076000  7.061000 0.9688000 -0.5972000     1.448000  
1 1 1 1  22 55 o 13.04000 0.5455000 13.06000 0.8333000 13.02000 0.7042000 0.4142000E-01  1.091000  
1 1 1 1  22 57 o 11.87000 0.6383000 11.08000 0.9019000 12.66000 0.9035000 -1.582000      1.277000  
1 1 1 1  22 59 o 8.670000 0.5852000 8.498000 0.8231000 8.841000 0.8320000 -0.3428000     1.170000  
1 1 1 1  22 61 o 4.919000 0.9261000 4.199000 1.354000  5.640000 1.264000  -1.441000      1.852000  
1 1 1 1  22 63 o 4.987000 1.002000  4.874000 1.479000  5.100000 1.353000  -0.2254000     2.005000  
1 1 1 1  23 0  o 56.76000 0.6631000 56.76000 0.6631000 56.76000 0.6631000 0.000000       0.000000  
1 1 1 1  23 2  o 33.10000 0.3459000 33.38000 0.5352000 32.82000 0.4382000 0.5536000      0.6917000 
1 1 1 1  23 4  o 40.13000 0.3069000 40.06000 0.4326000 40.20000 0.4353000 -0.1401000     0.6137000 
1 1 1 1  23 6  o 80.47000 0.6056000 79.72000 0.9109000 81.22000 0.7984000 -1.504000      1.211000  
1 1 1 1  23 8  o 38.78000 0.3483000 38.81000 0.4931000 38.76000 0.4920000 0.5761000E-01  0.6966000 
1 1 1 1  23 10 o 90.31000 0.6769000 90.32000 1.025000  90.30000 0.8848000 0.2744000E-01  1.354000  
1 1 1 1  23 12 o 91.92000 0.6883000 91.01000 1.033000  92.83000 0.9102000 -1.815000      1.377000  
1 1 1 1  23 14 o 23.26000 0.2994000 24.09000 0.3775000 22.42000 0.4650000 1.670000       0.5989000 
1 1 1 1  23 16 o 46.06000 0.3784000 46.33000 0.5719000 45.78000 0.4955000 0.5530000      0.7567000 
1 1 1 1  23 18 o 91.36000 0.6363000 91.36000 0.8989000 91.35000 0.9009000 0.7507000E-02  1.273000  
1 1 1 1  23 20 o 16.50000 0.3140000 16.95000 0.4560000 16.04000 0.4317000 0.9019000      0.6279000 
1 1 1 1  23 22 o 39.71000 0.3246000 39.85000 0.4606000 39.57000 0.4575000 0.2799000      0.6492000 
1 1 1 1  23 24 o 10.89000 0.3998000 10.79000 0.5634000 10.99000 0.5673000 -0.1940000     0.7995000 
1 1 1 1  23 26 o 48.79000 0.4050000 48.71000 0.6113000 48.87000 0.5313000 -0.1591000     0.8100000 
1 1 1 1  23 28 o 44.24000 0.3503000 43.94000 0.4907000 44.54000 0.5001000 -0.6010000     0.7006000 
1 1 1 1  23 30 o 12.64000 0.3907000 12.98000 0.5484000 12.29000 0.5567000 0.6896000      0.7814000 
1 1 1 1  23 32 o 43.52000 0.3540000 44.15000 0.5048000 42.88000 0.4963000 1.272000       0.7079000 
1 1 1 1  23 34 o 38.85000 0.3819000 38.75000 0.5396000 38.94000 0.5405000 -0.1851000     0.7637000 
1 1 1 1  23 36 o 16.01000 0.3789000 16.33000 0.5312000 15.69000 0.5405000 0.6371000      0.7579000 
1 1 1 1  23 38 o 14.71000 0.3957000 14.44000 0.5833000 14.99000 0.5347000 -0.5473000     0.7913000 
1 1 1 1  23 40 o 10.48000 0.5609000 10.53000 0.7937000 10.43000 0.7928000 0.1008000      1.122000  
1 1 1 1  23 42 o 29.31000 0.3559000 28.96000 0.5449000 29.65000 0.4580000 -0.6870000     0.7118000 
1 1 1 1  23 44 o 32.76000 0.4201000 32.39000 0.5337000 33.13000 0.6488000 -0.7471000     0.8401000 
1 1 1 1  23 46 o 27.45000 0.3930000 27.27000 0.4495000 27.63000 0.6448000 -0.3584000     0.7860000 
1 1 1 1  23 48 o 8.826000 0.5721000 9.057000 0.7729000 8.594000 0.8437000 0.4634000      1.144000  
1 1 1 1  23 50 o 9.219000 0.5341000 9.213000 0.7001000 9.225000 0.8068000 -0.1201000E-01 1.068000  
1 1 1 1  23 52 o 5.025000 0.9197000 5.499000 1.207000  4.552000 1.388000  0.9471000      1.839000  
1 1 1 1  23 54 o 10.17000 0.5151000 10.19000 0.7327000 10.15000 0.7240000 0.3819000E-01  1.030000  
1 1 1 1  23 56 o 8.678000 0.6723000 9.857000 0.7988000 7.498000 1.082000  2.359000       1.345000  
1 1 1 1  23 58 o 6.227000 0.8940000 7.367000 1.163000  5.087000 1.359000  2.280000       1.788000  
1 1 1 1  23 60 o 5.675000 0.9498000 4.834000 1.431000  6.515000 1.249000  -1.681000      1.900000  
1 1 1 1  23 62 o 4.558000 1.009000  5.106000 1.435000  4.009000 1.419000  1.097000       2.019000  
1 1 1 1  24 1  o 77.89000 0.5429000 77.77000 0.7667000 78.01000 0.7689000 -0.2378000     1.086000  
1 1 1 1  24 3  o 46.44000 0.3732000 46.18000 0.5619000 46.69000 0.4912000 -0.5091000     0.7463000 
1 1 1 1  24 5  o 103.8000 0.9203000 102.4000 1.408000  105.2000 1.185000  -2.897000      1.841000  
1 1 1 1  24 7  o 127.9000 0.9476000 129.2000 1.445000  126.6000 1.226000  2.616000       1.895000  
1 1 1 1  24 9  o 140.5000 1.040000  142.2000 1.587000  138.7000 1.343000  3.420000       2.079000  
1 1 1 1  24 11 o 100.9000 0.8984000 100.7000 1.391000  101.0000 1.138000  -0.3532000     1.797000  
1 1 1 1  24 13 o 34.47000 0.3343000 34.61000 0.3746000 34.33000 0.5539000 0.2805000      0.6687000 
1 1 1 1  24 15 o 50.43000 0.4047000 50.75000 0.5345000 50.12000 0.6077000 0.6372000      0.8094000 
1 1 1 1  24 17 o 50.04000 0.3767000 49.91000 0.5311000 50.17000 0.5342000 -0.2567000     0.7533000 
1 1 1 1  24 19 o 16.25000 0.3131000 16.23000 0.4606000 16.26000 0.4243000 -0.3213000E-01 0.6262000 
1 1 1 1  24 21 o 20.28000 0.2957000 20.67000 0.3891000 19.90000 0.4453000 0.7638000      0.5914000 
1 1 1 1  24 23 o 43.81000 0.3442000 43.88000 0.4850000 43.75000 0.4885000 0.1328000      0.6884000 
1 1 1 1  24 25 o 32.37000 0.3238000 32.17000 0.4910000 32.56000 0.4223000 -0.3887000     0.6476000 
1 1 1 1  24 27 o 33.09000 0.3299000 32.69000 0.4235000 33.48000 0.5060000 -0.7904000     0.6598000 
1 1 1 1  24 29 o 18.79000 0.3417000 18.39000 0.4424000 19.20000 0.5209000 -0.8092000     0.6834000 
1 1 1 1  24 31 o 40.86000 0.3895000 40.75000 0.5458000 40.97000 0.5557000 -0.2237000     0.7789000 
1 1 1 1  24 33 o 23.45000 0.3523000 23.61000 0.5027000 23.29000 0.4939000 0.3178000      0.7047000 
1 1 1 1  24 35 o 20.66000 0.3290000 20.83000 0.4669000 20.48000 0.4635000 0.3478000      0.6579000 
1 1 1 1  24 37 o 24.46000 0.3152000 24.82000 0.4514000 24.10000 0.4400000 0.7164000      0.6304000 
1 1 1 1  24 39 o 18.79000 0.3636000 18.72000 0.5141000 18.85000 0.5144000 -0.1301000     0.7272000 
1 1 1 1  24 41 o 9.183000 0.6477000 8.640000 0.9859000 9.727000 0.8403000 -1.086000      1.295000  
1 1 1 1  24 43 f 20.28000 0.4478000 20.69000 0.5658000 19.88000 0.6943000 0.8114000      0.8956000 
1 1 1 1  24 45 o 35.32000 0.3605000 34.95000 0.4688000 35.68000 0.5477000 -0.7330000     0.7210000 
1 1 1 1  24 47 o 12.13000 0.4728000 11.87000 0.7068000 12.40000 0.6282000 -0.5260000     0.9456000 
1 1 1 1  24 49 o 11.76000 0.4367000 11.52000 0.5960000 12.00000 0.6384000 -0.4728000     0.8733000 
1 1 1 1  24 51 o 8.196000 0.5951000 8.867000 0.7326000 7.525000 0.9380000 1.342000       1.190000  
1 1 1 1  24 53 o 17.16000 0.3508000 16.91000 0.4966000 17.40000 0.4955000 -0.4834000     0.7015000 
1 1 1 1  24 55 o 5.327000 0.8695000 6.038000 1.143000  4.616000 1.310000  1.422000       1.739000  
1 1 1 1  24 57 o 6.642000 0.8222000 7.106000 1.070000  6.177000 1.249000  0.9285000      1.644000  
1 1 1 1  24 59 o 6.034000 0.9428000 6.086000 1.344000  5.982000 1.323000  0.1045000      1.886000  
1 1 1 1  24 61 o 10.35000 0.6317000 9.313000 0.8968000 11.39000 0.8898000 -2.080000      1.263000  
1 1 1 1  24 63 o 3.607000 1.069000  3.734000 1.505000  3.480000 1.518000  0.2541000      2.137000  
1 1 1 1  25 0  o 18.95000 0.4228000 18.95000 0.4228000 18.95000 0.4228000 0.000000       0.000000  
1 1 1 1  25 2  o 43.46000 0.3301000 43.21000 0.4637000 43.72000 0.4699000 -0.5118000     0.6601000 
1 1 1 1  25 4  o 58.71000 0.4205000 59.02000 0.5967000 58.40000 0.5925000 0.6185000      0.8409000 
1 1 1 1  25 6  o 74.45000 0.5648000 74.43000 0.8544000 74.46000 0.7391000 -0.3104000E-01 1.130000  
1 1 1 1  25 8  o 27.75000 0.3211000 27.58000 0.5235000 27.91000 0.3719000 -0.3306000     0.6421000 
1 1 1 1  25 10 o 23.12000 0.2570000 22.65000 0.3637000 23.59000 0.3631000 -0.9376000     0.5139000 
1 1 1 1  25 12 o 92.44000 0.7400000 92.65000 1.050000  92.22000 1.043000  0.4328000      1.480000  
1 1 1 1  25 14 o 94.30000 0.7551000 93.96000 1.064000  94.65000 1.072000  -0.6889000     1.510000  
1 1 1 1  25 16 o 71.58000 0.5233000 71.80000 0.6451000 71.37000 0.8242000 0.4317000      1.047000  
1 1 1 1  25 18 o 38.38000 0.3378000 38.70000 0.5104000 38.07000 0.4427000 0.6243000      0.6756000 
1 1 1 1  25 20 o 21.78000 0.2727000 21.89000 0.3851000 21.66000 0.3862000 0.2256000      0.5454000 
1 1 1 1  25 22 o 21.33000 0.3417000 20.99000 0.3914000 21.67000 0.5602000 -0.6787000     0.6834000 
1 1 1 1  25 24 o 20.37000 0.2873000 19.89000 0.4087000 20.85000 0.4039000 -0.9608000     0.5746000 
1 1 1 1  25 26 o 39.93000 0.3588000 39.97000 0.5428000 39.90000 0.4693000 0.6921000E-01  0.7176000 
1 1 1 1  25 28 o 19.82000 0.3285000 19.93000 0.4186000 19.72000 0.5063000 0.2135000      0.6569000 
1 1 1 1  25 30 o 20.45000 0.3944000 21.05000 0.6047000 19.85000 0.5066000 1.206000       0.7889000 
1 1 1 1  25 32 o 24.26000 0.3415000 24.20000 0.5208000 24.31000 0.4419000 -0.1126000     0.6830000 
1 1 1 1  25 34 o 7.694000 0.6673000 7.052000 1.030000  8.336000 0.8486000 -1.284000      1.335000  
1 1 1 1  25 36 o 25.80000 0.3185000 25.62000 0.4539000 25.97000 0.4470000 -0.3476000     0.6371000 
1 1 1 1  25 38 o 14.49000 0.4079000 14.77000 0.5660000 14.21000 0.5876000 0.5648000      0.8158000 
1 1 1 1  25 40 o 19.34000 0.3643000 19.65000 0.5088000 19.03000 0.5213000 0.6207000      0.7285000 
1 1 1 1  25 42 o 20.19000 0.3778000 20.37000 0.5824000 20.01000 0.4814000 0.3577000      0.7557000 
1 1 1 1  25 44 o 4.686000 1.025000  3.790000 1.378000  5.582000 1.517000  -1.793000      2.049000  
1 1 1 1  25 46 o 5.870000 0.8613000 7.246000 0.9355000 4.495000 1.446000  2.751000       1.723000  
1 1 1 1  25 48 o 6.524000 0.7267000 6.537000 1.014000  6.511000 1.041000  0.2608000E-01  1.453000  
1 1 1 1  25 50 o 17.65000 0.3447000 17.12000 0.5053000 18.19000 0.4688000 -1.071000      0.6893000 
1 1 1 1  25 52 o 4.274000 0.9467000 3.701000 1.372000  4.846000 1.305000  -1.145000      1.893000  
1 1 1 1  25 54 o 12.57000 0.5732000 12.87000 0.8915000 12.27000 0.7206000 0.5988000      1.146000  
1 1 1 1  25 56 o 11.51000 0.6602000 12.11000 0.8298000 10.91000 1.027000  1.199000       1.320000  
1 1 1 1  25 58 o 3.829000 1.016000  3.828000 1.499000  3.829000 1.371000  -0.1225000E-02 2.032000  
1 1 1 1  25 60 o 6.572000 0.8534000 5.871000 1.251000  7.273000 1.161000  -1.402000      1.707000  
1 1 1 1  25 62 o 3.345000 0.9661000 3.531000 1.402000  3.159000 1.329000  0.3718000      1.932000  
1 1 1 1  26 1  o 75.71000 0.5307000 75.31000 0.7455000 76.11000 0.7554000 -0.8051000     1.061000  
1 1 1 1  26 3  o 117.0000 0.8025000 116.6000 1.131000  117.3000 1.139000  -0.7204000     1.605000  
1 1 1 1  26 5  o 16.53000 0.3583000 16.70000 0.5057000 16.37000 0.5079000 0.3312000      0.7167000 
1 1 1 1  26 7  o 78.55000 0.5502000 79.11000 0.7836000 77.99000 0.7725000 1.119000       1.100000  
1 1 1 1  26 9  o 26.86000 0.2835000 26.90000 0.3784000 26.82000 0.4224000 0.8492000E-01  0.5671000 
1 1 1 1  26 11 o 79.17000 0.6399000 79.57000 0.9098000 78.77000 0.9001000 0.8025000      1.280000  
1 1 1 1  26 13 o 40.67000 0.3683000 40.85000 0.5242000 40.49000 0.5176000 0.3630000      0.7367000 
1 1 1 1  26 15 o 50.87000 0.4651000 51.21000 0.5430000 50.53000 0.7553000 0.6829000      0.9303000 
1 1 1 1  26 17 o 41.25000 0.3754000 41.31000 0.5320000 41.20000 0.5297000 0.1078000      0.7507000 
1 1 1 1  26 19 o 43.82000 0.3444000 44.25000 0.4900000 43.38000 0.4841000 0.8751000      0.6888000 
1 1 1 1  26 21 o 20.16000 0.2757000 20.01000 0.3852000 20.31000 0.3944000 -0.2952000     0.5514000 
1 1 1 1  26 23 o 40.69000 0.3303000 40.69000 0.4663000 40.69000 0.4680000 -0.8389000E-02 0.6606000 
1 1 1 1  26 25 o 9.131000 0.5251000 8.864000 0.8057000 9.398000 0.6735000 -0.5344000     1.050000  
1 1 1 1  26 27 o 14.86000 0.3324000 14.91000 0.4716000 14.80000 0.4685000 0.1142000      0.6647000 
1 1 1 1  26 29 o 37.38000 0.4148000 36.73000 0.5115000 38.02000 0.6531000 -1.296000      0.8296000 
1 1 1 1  26 31 o 29.44000 0.3054000 29.07000 0.4304000 29.80000 0.4334000 -0.7304000     0.6108000 
1 1 1 1  26 33 o 38.32000 0.4093000 37.59000 0.6664000 39.04000 0.4753000 -1.448000      0.8185000 
1 1 1 1  26 35 o 5.661000 0.9462000 4.931000 1.443000  6.392000 1.224000  -1.461000      1.892000  
1 1 1 1  26 37 o 4.931000 0.9627000 5.009000 1.380000  4.853000 1.343000  0.1566000      1.925000  
1 1 1 1  26 39 o 10.51000 0.5598000 10.59000 0.7831000 10.43000 0.8002000 0.1653000      1.120000  
1 1 1 1  26 41 o 4.347000 0.9073000 2.923000 1.284000  5.771000 1.282000  -2.848000      1.815000  
1 1 1 1  26 43 o 17.36000 0.3987000 17.21000 0.5047000 17.51000 0.6173000 -0.2950000     0.7974000 
1 1 1 1  26 45 o 11.59000 0.6003000 11.98000 0.7367000 11.19000 0.9481000 0.7952000      1.201000  
1 1 1 1  26 47 o 4.817000 0.9511000 5.343000 1.386000  4.292000 1.303000  1.051000       1.902000  
1 1 1 1  26 49 o 2.957000 0.8894000 2.810000 1.239000  3.104000 1.276000  -0.2936000     1.779000  
1 1 1 1  26 51 o 9.019000 0.5424000 9.457000 0.7733000 8.580000 0.7609000 0.8770000      1.085000  
1 1 1 1  26 53 o 6.889000 0.8980000 6.381000 1.338000  7.398000 1.198000  -1.018000      1.796000  
1 1 1 1  26 55 o 4.218000 1.052000  4.521000 1.388000  3.915000 1.581000  0.6063000      2.104000  
1 1 1 1  26 57 o 5.170000 1.058000  4.715000 1.515000  5.624000 1.478000  -0.9085000     2.116000  
1 1 1 1  26 59 o 3.737000 1.014000  3.442000 1.413000  4.032000 1.455000  -0.5896000     2.028000  
1 1 1 1  26 61 o 5.153000 1.009000  6.219000 1.456000  4.088000 1.396000  2.131000       2.018000  
1 1 1 1  27 0  o 33.60000 0.4011000 33.60000 0.4011000 33.60000 0.4011000 0.000000       0.000000  
1 1 1 1  27 2  o 41.94000 0.3249000 42.34000 0.4628000 41.53000 0.4562000 0.8075000      0.6499000 
1 1 1 1  27 4  o 75.53000 0.5300000 75.64000 0.7508000 75.42000 0.7482000 0.2156000      1.060000  
1 1 1 1  27 6  o 133.2000 0.9121000 133.1000 1.289000  133.3000 1.291000  -0.2249000     1.824000  
1 1 1 1  27 8  o 24.98000 0.2860000 24.74000 0.3728000 25.21000 0.4339000 -0.4668000     0.5721000 
1 1 1 1  27 10 o 116.5000 0.8642000 117.1000 1.138000  116.0000 1.301000  1.106000       1.728000  
1 1 1 1  27 12 o 73.24000 0.5970000 72.29000 0.8339000 74.19000 0.8546000 -1.902000      1.194000  
1 1 1 1  27 14 o 35.35000 0.3220000 35.08000 0.4269000 35.63000 0.4822000 -0.5534000     0.6440000 
1 1 1 1  27 16 o 35.72000 0.3451000 35.63000 0.4876000 35.82000 0.4885000 -0.1892000     0.6902000 
1 1 1 1  27 18 o 77.62000 0.6673000 77.79000 1.087000  77.44000 0.7745000 0.3466000      1.335000  
1 1 1 1  27 20 o 41.19000 0.3323000 41.45000 0.4706000 40.92000 0.4691000 0.5315000      0.6645000 
1 1 1 1  27 22 o 20.84000 0.3367000 21.51000 0.4731000 20.18000 0.4793000 1.330000       0.6735000 
1 1 1 1  27 24 o 51.07000 0.4216000 51.21000 0.6405000 50.94000 0.5483000 0.2649000      0.8431000 
1 1 1 1  27 26 f 64.71000 0.4715000 64.58000 0.6637000 64.84000 0.6699000 -0.2614000     0.9430000 
1 1 1 1  27 28 o 7.245000 0.7991000 6.355000 1.136000  8.134000 1.124000  -1.779000      1.598000  
1 1 1 1  27 30 o 3.827000 0.9847000 3.193000 1.306000  4.462000 1.474000  -1.269000      1.969000  
1 1 1 1  27 32 o 37.47000 0.4082000 36.61000 0.6648000 38.32000 0.4740000 -1.707000      0.8164000 
1 1 1 1  27 34 f 23.60000 0.3182000 24.08000 0.4528000 23.13000 0.4472000 0.9499000      0.6364000 
1 1 1 1  27 36 o 31.58000 0.3217000 31.99000 0.4586000 31.17000 0.4514000 0.8241000      0.6435000 
1 1 1 1  27 38 o 20.42000 0.3446000 20.43000 0.4886000 20.41000 0.4860000 0.1973000E-01  0.6891000 
1 1 1 1  27 40 o 14.61000 0.4094000 14.63000 0.5995000 14.59000 0.5579000 0.4015000E-01  0.8189000 
1 1 1 1  27 42 o 18.99000 0.4150000 19.51000 0.6718000 18.48000 0.4873000 1.032000       0.8300000 
1 1 1 1  27 44 o 18.71000 0.3900000 18.93000 0.5646000 18.50000 0.5383000 0.4309000      0.7801000 
1 1 1 1  27 46 o 3.227000 0.9024000 3.536000 1.326000  2.917000 1.224000  0.6189000      1.805000  
1 1 1 1  27 48 o 9.466000 0.5480000 9.364000 0.7841000 9.568000 0.7657000 -0.2044000     1.096000  
1 1 1 1  27 50 o 4.055000 0.9340000 4.773000 1.341000  3.338000 1.300000  1.436000       1.868000  
1 1 1 1  27 52 o 12.20000 0.4567000 12.34000 0.6344000 12.06000 0.6572000 0.2739000      0.9134000 
1 1 1 1  27 54 o 4.455000 1.051000  3.781000 1.477000  5.129000 1.496000  -1.349000      2.102000  
1 1 1 1  27 56 o 6.840000 0.9219000 6.084000 1.365000  7.597000 1.239000  -1.513000      1.844000  
1 1 1 1  27 58 o 6.928000 0.9026000 7.974000 1.203000  5.881000 1.346000  2.093000       1.805000  
1 1 1 1  27 60 o 7.577000 0.8623000 8.762000 1.156000  6.392000 1.280000  2.370000       1.725000  
1 1 1 1  28 1  o 19.66000 0.2610000 19.53000 0.3692000 19.78000 0.3689000 -0.2517000     0.5219000 
1 1 1 1  28 3  o 81.55000 0.5694000 81.41000 0.8041000 81.68000 0.8064000 -0.2678000     1.139000  
1 1 1 1  28 5  o 55.61000 0.4060000 56.14000 0.5798000 55.09000 0.5683000 1.048000       0.8119000 
1 1 1 1  28 7  o 41.68000 0.3265000 41.55000 0.4601000 41.82000 0.4634000 -0.2771000     0.6530000 
1 1 1 1  28 9  o 37.86000 0.3318000 37.84000 0.4348000 37.89000 0.5014000 -0.4273000E-01 0.6636000 
1 1 1 1  28 11 o 50.01000 0.4052000 50.13000 0.6141000 49.89000 0.5287000 0.2435000      0.8103000 
1 1 1 1  28 13 o 47.39000 0.3609000 47.72000 0.5142000 47.06000 0.5064000 0.6532000      0.7217000 
1 1 1 1  28 15 o 56.46000 0.5282000 56.83000 0.6786000 56.08000 0.8095000 0.7454000      1.056000  
1 1 1 1  28 17 o 34.72000 0.3234000 34.95000 0.4323000 34.50000 0.4810000 0.4515000      0.6467000 
1 1 1 1  28 19 o 17.46000 0.2851000 17.37000 0.4040000 17.54000 0.4024000 -0.1647000     0.5702000 
1 1 1 1  28 21 o 34.49000 0.3593000 34.13000 0.5739000 34.86000 0.4324000 -0.7302000     0.7186000 
1 1 1 1  28 23 o 35.54000 0.3351000 35.24000 0.5055000 35.85000 0.4401000 -0.6079000     0.6702000 
1 1 1 1  28 25 o 78.66000 0.5580000 78.61000 0.7885000 78.71000 0.7898000 -0.1035000     1.116000  
1 1 1 1  28 27 o 32.84000 0.3732000 32.97000 0.4377000 32.71000 0.6046000 0.2615000      0.7464000 
1 1 1 1  28 29 o 21.93000 0.3571000 21.79000 0.5033000 22.08000 0.5068000 -0.2931000     0.7142000 
1 1 1 1  28 31 o 23.46000 0.3530000 23.32000 0.4951000 23.60000 0.5033000 -0.2756000     0.7060000 
1 1 1 1  28 33 o 46.66000 0.3734000 47.05000 0.5330000 46.26000 0.5230000 0.7851000      0.7467000 
1 1 1 1  28 35 o 7.909000 0.7185000 7.930000 1.010000  7.887000 1.022000  0.4318000E-01  1.437000  
1 1 1 1  28 37 o 33.62000 0.3247000 33.76000 0.4529000 33.48000 0.4654000 0.2732000      0.6494000 
1 1 1 1  28 39 o 28.02000 0.3233000 27.64000 0.4642000 28.41000 0.4502000 -0.7733000     0.6467000 
1 1 1 1  28 41 o 19.33000 0.4272000 19.33000 0.6756000 19.34000 0.5232000 -0.1196000E-01 0.8545000 
1 1 1 1  28 43 o 3.160000 0.9327000 3.016000 1.274000  3.304000 1.363000  -0.2877000     1.865000  
1 1 1 1  28 45 o 5.810000 0.9119000 5.581000 1.259000  6.039000 1.319000  -0.4583000     1.824000  
1 1 1 1  28 47 o 11.00000 0.5057000 10.93000 0.7761000 11.07000 0.6486000 -0.1426000     1.011000  
1 1 1 1  28 49 o 6.735000 0.7157000 6.185000 1.078000  7.285000 0.9412000 -1.100000      1.431000  
1 1 1 1  28 51 o 6.939000 0.7061000 6.783000 1.028000  7.094000 0.9683000 -0.3114000     1.412000  
1 1 1 1  28 53 o 2.898000 0.8873000 2.724000 1.203000  3.073000 1.305000  -0.3491000     1.775000  
1 1 1 1  28 55 o 3.650000 1.010000  3.476000 1.376000  3.824000 1.478000  -0.3483000     2.019000  
1 1 1 1  28 57 o 9.655000 0.6090000 9.717000 0.7920000 9.592000 0.9253000 0.1252000      1.218000  
1 1 1 1  28 59 o 8.969000 0.6022000 8.556000 0.8965000 9.383000 0.8044000 -0.8276000     1.204000  
1 1 1 1  28 61 o 5.785000 1.065000  6.873000 1.445000  4.696000 1.567000  2.177000       2.131000  
1 1 1 1  29 0  o 54.89000 0.5678000 54.89000 0.5678000 54.89000 0.5678000 0.000000       0.000000  
1 1 1 1  29 2  o 12.78000 0.3217000 12.68000 0.4543000 12.88000 0.4557000 -0.1971000     0.6434000 
1 1 1 1  29 4  o 37.10000 0.3048000 37.06000 0.4292000 37.14000 0.4330000 -0.8369000E-01 0.6097000 
1 1 1 1  29 6  f 26.14000 0.2693000 26.41000 0.3828000 25.87000 0.3788000 0.5377000      0.5385000 
1 1 1 1  29 8  o 51.69000 0.4147000 51.75000 0.5439000 51.64000 0.6262000 0.1108000      0.8295000 
1 1 1 1  29 10 o 33.67000 0.3149000 33.90000 0.4777000 33.45000 0.4105000 0.4570000      0.6299000 
1 1 1 1  29 12 o 20.59000 0.2713000 20.38000 0.3844000 20.79000 0.3829000 -0.4055000     0.5426000 
1 1 1 1  29 14 o 20.49000 0.2866000 20.84000 0.3794000 20.14000 0.4296000 0.6969000      0.5732000 
1 1 1 1  29 16 o 37.86000 0.3211000 38.30000 0.4015000 37.43000 0.5013000 0.8676000      0.6422000 
1 1 1 1  29 18 o 31.67000 0.3430000 31.80000 0.4169000 31.54000 0.5448000 0.2600000      0.6860000 
1 1 1 1  29 20 o 17.39000 0.2988000 17.71000 0.4172000 17.08000 0.4277000 0.6328000      0.5975000 
1 1 1 1  29 22 o 17.92000 0.3270000 18.03000 0.5037000 17.81000 0.4170000 0.2201000      0.6539000 
1 1 1 1  29 24 o 46.47000 0.5649000 46.75000 1.005000  46.19000 0.5156000 0.5689000      1.130000  
1 1 1 1  29 26 o 27.32000 0.3608000 27.38000 0.4132000 27.26000 0.5917000 0.1208000      0.7217000 
1 1 1 1  29 28 o 6.647000 0.8238000 6.047000 1.092000  7.246000 1.234000  -1.199000      1.648000  
1 1 1 1  29 30 o 11.29000 0.5162000 11.22000 0.7224000 11.37000 0.7377000 -0.1445000     1.032000  
1 1 1 1  29 32 o 15.50000 0.4173000 14.81000 0.6630000 16.19000 0.5069000 -1.379000      0.8346000 
1 1 1 1  29 34 o 34.34000 0.3299000 34.73000 0.4664000 33.94000 0.4668000 0.7949000      0.6599000 
1 1 1 1  29 36 o 22.08000 0.3203000 22.20000 0.4528000 21.97000 0.4530000 0.2283000      0.6405000 
1 1 1 1  29 38 o 11.31000 0.5057000 11.48000 0.7016000 11.13000 0.7286000 0.3542000      1.011000  
1 1 1 1  29 40 o 15.11000 0.4435000 15.04000 0.6532000 15.18000 0.6000000 -0.1402000     0.8869000 
1 1 1 1  29 42 o 10.51000 0.4939000 10.30000 0.7262000 10.72000 0.6696000 -0.4206000     0.9877000 
1 1 1 1  29 44 o 23.27000 0.3522000 23.45000 0.4548000 23.08000 0.5379000 0.3701000      0.7045000 
1 1 1 1  29 46 o 13.80000 0.4327000 13.49000 0.6518000 14.11000 0.5692000 -0.6261000     0.8653000 
1 1 1 1  29 48 o 11.03000 0.4421000 11.02000 0.6299000 11.03000 0.6205000 -0.6014000E-02 0.8842000 
1 1 1 1  29 50 o 7.725000 0.6292000 7.829000 0.8686000 7.621000 0.9106000 0.2071000      1.258000  
1 1 1 1  29 52 o 3.809000 1.055000  3.916000 1.496000  3.702000 1.488000  0.2141000      2.110000  
1 1 1 1  29 54 o 6.183000 1.161000  6.771000 1.650000  5.594000 1.635000  1.177000       2.322000  
1 1 1 1  29 56 o 5.394000 1.116000  5.000000 1.448000  5.788000 1.699000  -0.7877000     2.233000  
1 1 1 1  29 58 o 4.721000 0.9940000 3.687000 1.474000  5.755000 1.334000  -2.067000      1.988000  
1 1 1 1  29 60 o 6.079000 0.8444000 6.029000 1.173000  6.129000 1.215000  -0.9998000E-01 1.689000  
1 1 1 1  30 1  o 62.57000 0.4496000 62.89000 0.6392000 62.25000 0.6324000 0.6464000      0.8992000 
1 1 1 1  30 3  o 34.17000 0.2936000 34.23000 0.4173000 34.10000 0.4131000 0.1374000      0.5872000 
1 1 1 1  30 5  o 48.46000 0.3958000 48.55000 0.5204000 48.37000 0.5965000 0.1738000      0.7916000 
1 1 1 1  30 7  o 26.91000 0.2924000 26.99000 0.3817000 26.83000 0.4430000 0.1540000      0.5848000 
1 1 1 1  30 9  o 32.12000 0.3095000 32.68000 0.4739000 31.56000 0.3981000 1.111000       0.6189000 
1 1 1 1  30 11 o 24.66000 0.2861000 24.42000 0.4309000 24.90000 0.3766000 -0.4746000     0.5723000 
1 1 1 1  30 13 o 17.20000 0.3080000 16.70000 0.4093000 17.69000 0.4604000 -0.9940000     0.6160000 
1 1 1 1  30 15 f 36.12000 0.3139000 36.41000 0.3932000 35.82000 0.4894000 0.5936000      0.6278000 
1 1 1 1  30 17 o 40.01000 0.3334000 40.09000 0.4128000 39.94000 0.5236000 0.1443000      0.6667000 
1 1 1 1  30 19 o 53.79000 0.4047000 54.42000 0.5764000 53.16000 0.5683000 1.260000       0.8094000 
1 1 1 1  30 21 o 28.82000 0.3615000 29.53000 0.4866000 28.10000 0.5346000 1.432000       0.7229000 
1 1 1 1  30 23 o 63.32000 0.5029000 63.49000 0.7636000 63.15000 0.6546000 0.3450000      1.006000  
1 1 1 1  30 25 o 50.18000 0.4763000 50.66000 0.5500000 49.70000 0.7778000 0.9625000      0.9526000 
1 1 1 1  30 27 o 19.88000 0.4314000 19.82000 0.5785000 19.94000 0.6401000 -0.1292000     0.8628000 
1 1 1 1  30 29 o 27.73000 0.3356000 27.50000 0.4350000 27.96000 0.5111000 -0.4676000     0.6712000 
1 1 1 1  30 31 o 18.19000 0.3695000 18.09000 0.5497000 18.30000 0.4939000 -0.2115000     0.7390000 
1 1 1 1  30 33 o 52.52000 0.4082000 52.76000 0.5790000 52.28000 0.5756000 0.4808000      0.8164000 
1 1 1 1  30 35 o 30.79000 0.3183000 31.01000 0.4568000 30.57000 0.4434000 0.4444000      0.6366000 
1 1 1 1  30 37 o 5.195000 0.9571000 4.082000 1.444000  6.307000 1.257000  -2.225000      1.914000  
1 1 1 1  30 39 o 9.608000 0.5938000 9.973000 0.7751000 9.243000 0.8998000 0.7301000      1.188000  
1 1 1 1  30 41 o 9.807000 0.5287000 10.06000 0.7680000 9.553000 0.7268000 0.5080000      1.057000  
1 1 1 1  30 43 o 16.84000 0.4328000 16.64000 0.6255000 17.03000 0.5983000 -0.3836000     0.8655000 
1 1 1 1  30 45 o 23.77000 0.3212000 23.71000 0.4527000 23.83000 0.4560000 -0.1188000     0.6425000 
1 1 1 1  30 47 o 11.91000 0.4291000 11.93000 0.6104000 11.89000 0.6033000 0.3738000E-01  0.8582000 
1 1 1 1  30 49 o 14.34000 0.3959000 14.50000 0.5561000 14.18000 0.5637000 0.3161000      0.7918000 
1 1 1 1  30 51 o 5.017000 1.096000  4.765000 1.614000  5.268000 1.484000  -0.5033000     2.192000  
1 1 1 1  30 53 o 4.281000 1.128000  4.672000 1.638000  3.891000 1.552000  0.7807000      2.256000  
1 1 1 1  30 55 o 3.439000 0.9771000 4.192000 1.515000  2.686000 1.235000  1.506000       1.954000  
1 1 1 1  30 57 o 3.860000 0.9545000 4.642000 1.416000  3.077000 1.280000  1.565000       1.909000  
1 1 1 1  30 59 o 5.635000 0.8510000 7.307000 1.006000  3.963000 1.373000  3.344000       1.702000  
1 1 1 1  31 0  o 43.48000 0.4793000 43.48000 0.4793000 43.48000 0.4793000 0.000000       0.000000  
1 1 1 1  31 2  o 76.31000 0.5379000 76.34000 0.7611000 76.29000 0.7604000 0.4768000E-01  1.076000  
1 1 1 1  31 4  o 59.46000 0.4674000 58.70000 0.6043000 60.21000 0.7132000 -1.507000      0.9348000 
1 1 1 1  31 6  o 58.47000 0.4261000 58.36000 0.6016000 58.58000 0.6036000 -0.2187000     0.8522000 
1 1 1 1  31 8  o 21.92000 0.2882000 21.84000 0.4335000 22.00000 0.3800000 -0.1595000     0.5764000 
1 1 1 1  31 10 o 29.52000 0.2983000 29.45000 0.4494000 29.59000 0.3925000 -0.1393000     0.5967000 
1 1 1 1  31 12 o 28.81000 0.2989000 28.66000 0.3981000 28.95000 0.4460000 -0.2878000     0.5979000 
1 1 1 1  31 14 o 20.73000 0.2882000 20.76000 0.3827000 20.70000 0.4310000 0.5991000E-01  0.5763000 
1 1 1 1  31 16 o 22.54000 0.2893000 23.00000 0.3942000 22.09000 0.4235000 0.9174000      0.5786000 
1 1 1 1  31 18 o 15.54000 0.3047000 15.73000 0.4243000 15.35000 0.4374000 0.3728000      0.6094000 
1 1 1 1  31 20 o 44.49000 0.3857000 44.75000 0.5859000 44.23000 0.5017000 0.5233000      0.7713000 
1 1 1 1  31 22 o 37.59000 0.3489000 37.48000 0.5276000 37.70000 0.4567000 -0.2261000     0.6978000 
1 1 1 1  31 24 o 35.61000 0.3749000 36.00000 0.4472000 35.22000 0.6018000 0.7759000      0.7497000 
1 1 1 1  31 26 o 9.711000 0.5642000 10.13000 0.7337000 9.295000 0.8574000 0.8328000      1.128000  
1 1 1 1  31 28 o 12.26000 0.5243000 11.64000 0.6248000 12.89000 0.8420000 -1.252000      1.049000  
1 1 1 1  31 30 o 20.99000 0.4880000 19.99000 0.8642000 21.99000 0.4538000 -1.998000      0.9761000 
1 1 1 1  31 32 o 11.50000 0.4932000 11.05000 0.7063000 11.95000 0.6886000 -0.8964000     0.9865000 
1 1 1 1  31 34 o 5.105000 0.9677000 5.515000 1.346000  4.695000 1.391000  0.8195000      1.935000  
1 1 1 1  31 36 o 18.20000 0.3806000 18.11000 0.5610000 18.30000 0.5144000 -0.1943000     0.7612000 
1 1 1 1  31 38 o 4.592000 0.9732000 4.071000 1.449000  5.113000 1.299000  -1.042000      1.946000  
1 1 1 1  31 40 o 11.71000 0.4660000 12.14000 0.6668000 11.28000 0.6510000 0.8598000      0.9319000 
1 1 1 1  31 42 o 4.582000 1.006000  4.616000 1.481000  4.548000 1.362000  0.6765000E-01  2.012000  
1 1 1 1  31 44 o 8.095000 0.6222000 8.337000 0.8216000 7.852000 0.9345000 0.4846000      1.244000  
1 1 1 1  31 46 o 10.07000 0.5229000 9.654000 0.8280000 10.48000 0.6387000 -0.8267000     1.046000  
1 1 1 1  31 48 o 4.533000 0.9742000 4.685000 1.380000  4.382000 1.375000  0.3027000      1.948000  
1 1 1 1  31 50 o 6.095000 1.005000  5.291000 1.441000  6.900000 1.403000  -1.609000      2.011000  
1 1 1 1  31 52 o 4.130000 0.9912000 4.099000 1.387000  4.161000 1.417000  -0.6196000E-01 1.982000  
1 1 1 1  31 54 o 4.550000 0.9556000 3.865000 1.395000  5.235000 1.306000  -1.370000      1.911000  
1 1 1 1  31 56 o 12.17000 0.5114000 11.81000 0.6573000 12.53000 0.7837000 -0.7211000     1.023000  
1 1 1 1  31 58 o 5.028000 0.9122000 5.387000 1.287000  4.670000 1.293000  0.7173000      1.824000  
1 1 1 1  32 1  o 51.49000 0.4705000 51.92000 0.5491000 51.06000 0.7642000 0.8518000      0.9411000 
1 1 1 1  32 3  o 8.865000 0.4935000 8.394000 0.6403000 9.337000 0.7510000 -0.9423000     0.9869000 
1 1 1 1  32 5  o 39.68000 0.3466000 39.85000 0.5273000 39.52000 0.4501000 0.3292000      0.6933000 
1 1 1 1  32 7  o 32.37000 0.3125000 32.73000 0.4757000 32.01000 0.4055000 0.7215000      0.6251000 
1 1 1 1  32 9  o 63.80000 0.4954000 63.63000 0.7452000 63.96000 0.6530000 -0.3294000     0.9909000 
1 1 1 1  32 11 o 36.27000 0.3277000 36.23000 0.4322000 36.31000 0.4926000 -0.8146000E-01 0.6554000 
1 1 1 1  32 13 o 48.93000 0.3718000 49.17000 0.5283000 48.69000 0.5234000 0.4859000      0.7437000 
1 1 1 1  32 15 o 28.48000 0.2875000 28.54000 0.3596000 28.42000 0.4488000 0.1152000      0.5751000 
1 1 1 1  32 17 o 58.76000 0.4454000 59.00000 0.5506000 58.52000 0.7002000 0.4816000      0.8907000 
1 1 1 1  32 19 o 34.33000 0.3323000 34.40000 0.5071000 34.26000 0.4296000 0.1366000      0.6646000 
1 1 1 1  32 21 o 59.10000 0.4754000 59.52000 0.7241000 58.67000 0.6162000 0.8491000      0.9508000 
1 1 1 1  32 23 o 34.46000 0.3341000 34.16000 0.4385000 34.76000 0.5043000 -0.5918000     0.6683000 
1 1 1 1  32 25 o 19.65000 0.3632000 19.39000 0.4953000 19.90000 0.5312000 -0.5093000     0.7263000 
1 1 1 1  32 27 o 4.676000 1.138000  4.538000 1.337000  4.814000 1.841000  -0.2755000     2.275000  
1 1 1 1  32 29 o 11.60000 0.4641000 12.14000 0.6148000 11.06000 0.6953000 1.083000       0.9281000 
1 1 1 1  32 31 o 18.35000 0.3812000 18.35000 0.5860000 18.36000 0.4876000 -0.1080000E-01 0.7623000 
1 1 1 1  32 33 o 29.15000 0.3420000 28.95000 0.5076000 29.36000 0.4585000 -0.4028000     0.6840000 
1 1 1 1  32 35 o 7.743000 0.6818000 7.524000 0.9790000 7.963000 0.9491000 -0.4385000     1.364000  
1 1 1 1  32 37 o 6.773000 0.7775000 5.910000 1.279000  7.635000 0.8847000 -1.725000      1.555000  
1 1 1 1  32 39 f 12.41000 0.4693000 12.27000 0.6993000 12.54000 0.6262000 -0.2764000     0.9387000 
1 1 1 1  32 41 o 11.88000 0.5142000 11.10000 0.7911000 12.66000 0.6571000 -1.561000      1.028000  
1 1 1 1  32 43 o 12.83000 0.4340000 13.27000 0.5706000 12.38000 0.6541000 0.8866000      0.8680000 
1 1 1 1  32 45 o 6.467000 0.7335000 6.585000 1.066000  6.349000 1.008000  0.2366000      1.467000  
1 1 1 1  32 47 o 5.977000 0.8473000 5.311000 1.314000  6.643000 1.070000  -1.332000      1.695000  
1 1 1 1  32 49 o 10.68000 0.5499000 11.41000 0.6406000 9.948000 0.8939000 1.458000       1.100000  
1 1 1 1  32 51 o 3.163000 0.9221000 3.007000 1.249000  3.318000 1.357000  -0.3118000     1.844000  
1 1 1 1  32 53 o 4.584000 0.9449000 4.609000 1.355000  4.560000 1.317000  0.4893000E-01  1.890000  
1 1 1 1  32 55 o 4.187000 1.005000  4.685000 1.424000  3.690000 1.418000  0.9951000      2.010000  
1 1 1 1  32 57 o 4.230000 0.9713000 5.185000 1.371000  3.274000 1.376000  1.911000       1.943000  
1 1 1 1  33 0  f 27.14000 0.4523000 27.14000 0.4523000 27.14000 0.4523000 0.000000       0.000000  
1 1 1 1  33 2  o 45.43000 0.3820000 44.78000 0.4919000 46.08000 0.5847000 -1.307000      0.7641000 
1 1 1 1  33 4  o 16.17000 0.3285000 16.42000 0.5017000 15.91000 0.4241000 0.5075000      0.6569000 
1 1 1 1  33 6  o 30.10000 0.2829000 30.31000 0.3978000 29.89000 0.4023000 0.4227000      0.5657000 
1 1 1 1  33 8  o 6.083000 0.7035000 5.373000 1.160000  6.792000 0.7969000 -1.419000      1.407000  
1 1 1 1  33 10 o 17.99000 0.3027000 18.16000 0.4029000 17.82000 0.4520000 0.3349000      0.6055000 
1 1 1 1  33 12 o 25.12000 0.3429000 24.97000 0.5653000 25.27000 0.3882000 -0.3011000     0.6857000 
1 1 1 1  33 14 o 48.62000 0.3713000 49.05000 0.5300000 48.19000 0.5201000 0.8580000      0.7426000 
1 1 1 1  33 16 o 24.68000 0.2819000 24.47000 0.3519000 24.90000 0.4405000 -0.4254000     0.5638000 
1 1 1 1  33 18 o 15.93000 0.3526000 15.60000 0.5512000 16.26000 0.4398000 -0.6644000     0.7051000 
1 1 1 1  33 20 o 45.19000 0.3593000 45.14000 0.5092000 45.24000 0.5071000 -0.1015000     0.7187000 
1 1 1 1  33 22 o 46.33000 0.3665000 46.75000 0.5226000 45.92000 0.5141000 0.8295000      0.7331000 
1 1 1 1  33 24 o 23.57000 0.3476000 23.32000 0.4702000 23.81000 0.5120000 -0.4881000     0.6952000 
1 1 1 1  33 26 o 15.23000 0.3827000 15.95000 0.4790000 14.51000 0.5970000 1.447000       0.7655000 
1 1 1 1  33 28 o 17.42000 0.3748000 17.67000 0.5430000 17.17000 0.5168000 0.5035000      0.7496000 
1 1 1 1  33 30 o 3.744000 1.048000  4.357000 1.568000  3.132000 1.392000  1.226000       2.097000  
1 1 1 1  33 32 o 9.951000 0.5633000 9.794000 0.8043000 10.11000 0.7889000 -0.3155000     1.127000  
1 1 1 1  33 34 o 17.04000 0.3742000 17.01000 0.5290000 17.08000 0.5295000 -0.6293000E-01 0.7485000 
1 1 1 1  33 36 o 18.00000 0.3853000 17.80000 0.5882000 18.19000 0.4978000 -0.3870000     0.7706000 
1 1 1 1  33 38 o 13.33000 0.5159000 12.95000 0.8515000 13.72000 0.5825000 -0.7704000     1.032000  
1 1 1 1  33 40 o 6.936000 0.7738000 6.747000 1.183000  7.125000 0.9976000 -0.3779000     1.548000  
1 1 1 1  33 42 o 9.636000 0.5597000 9.563000 0.7639000 9.708000 0.8184000 -0.1446000     1.119000  
1 1 1 1  33 44 o 12.22000 0.4467000 12.18000 0.6206000 12.26000 0.6428000 -0.8114000E-01 0.8935000 
1 1 1 1  33 46 o 8.394000 0.6292000 8.188000 0.9300000 8.599000 0.8478000 -0.4104000     1.258000  
1 1 1 1  33 48 o 3.463000 0.9282000 3.168000 1.259000  3.758000 1.364000  -0.5895000     1.856000  
1 1 1 1  33 50 o 3.255000 0.9218000 3.187000 1.343000  3.323000 1.263000  -0.1360000     1.844000  
1 1 1 1  33 52 o 4.443000 0.9807000 5.047000 1.391000  3.839000 1.382000  1.208000       1.961000  
1 1 1 1  33 54 o 7.896000 0.7425000 7.932000 1.042000  7.861000 1.059000  0.7047000E-01  1.485000  
1 1 1 1  33 56 o 4.544000 1.091000  4.092000 1.483000  4.995000 1.602000  -0.9028000     2.183000  
1 1 1 1  33 58 o 3.766000 1.054000  2.734000 1.264000  4.798000 1.688000  -2.064000      2.108000  
1 1 1 1  34 1  o 32.42000 0.3229000 32.68000 0.4932000 32.16000 0.4168000 0.5218000      0.6458000 
1 1 1 1  34 3  o 43.64000 0.4208000 43.04000 0.6841000 44.23000 0.4901000 -1.187000      0.8415000 
1 1 1 1  34 5  o 32.86000 0.3570000 32.57000 0.5783000 33.15000 0.4188000 -0.5785000     0.7141000 
1 1 1 1  34 7  o 32.25000 0.3109000 32.47000 0.4669000 32.03000 0.4107000 0.4389000      0.6218000 
1 1 1 1  34 9  o 50.73000 0.4119000 51.11000 0.5444000 50.35000 0.6182000 0.7536000      0.8237000 
1 1 1 1  34 11 o 37.46000 0.3131000 37.11000 0.4413000 37.81000 0.4441000 -0.7032000     0.6261000 
1 1 1 1  34 13 o 12.65000 0.3365000 12.70000 0.4709000 12.59000 0.4809000 0.1128000      0.6731000 
1 1 1 1  34 15 o 28.97000 0.3517000 28.90000 0.4107000 29.04000 0.5712000 -0.1417000     0.7035000 
1 1 1 1  34 17 o 36.61000 0.3415000 36.60000 0.4537000 36.62000 0.5105000 -0.2783000E-01 0.6829000 
1 1 1 1  34 19 o 21.06000 0.2951000 21.20000 0.4187000 20.91000 0.4161000 0.2845000      0.5902000 
1 1 1 1  34 21 o 26.25000 0.2995000 26.46000 0.4256000 26.04000 0.4215000 0.4183000      0.5990000 
1 1 1 1  34 23 o 23.64000 0.3501000 23.91000 0.4734000 23.36000 0.5159000 0.5448000      0.7002000 
1 1 1 1  34 25 o 8.715000 0.5999000 8.799000 0.7530000 8.630000 0.9339000 0.1686000      1.200000  
1 1 1 1  34 27 o 21.99000 0.3439000 21.73000 0.5127000 22.24000 0.4584000 -0.5086000     0.6877000 
1 1 1 1  34 29 o 17.29000 0.3880000 17.84000 0.5849000 16.74000 0.5099000 1.093000       0.7759000 
1 1 1 1  34 31 o 9.319000 0.5786000 9.249000 0.8134000 9.388000 0.8230000 -0.1392000     1.157000  
1 1 1 1  34 33 o 28.89000 0.3766000 28.61000 0.4424000 29.17000 0.6097000 -0.5595000     0.7533000 
1 1 1 1  34 35 o 4.729000 0.9649000 4.419000 1.375000  5.039000 1.354000  -0.6193000     1.930000  
1 1 1 1  34 37 o 4.143000 0.9606000 5.174000 1.374000  3.112000 1.342000  2.062000       1.921000  
1 1 1 1  34 39 o 13.52000 0.5411000 13.25000 0.8746000 13.79000 0.6373000 -0.5400000     1.082000  
1 1 1 1  34 41 o 18.15000 0.3851000 18.01000 0.5776000 18.29000 0.5096000 -0.2882000     0.7703000 
1 1 1 1  34 43 o 11.58000 0.4738000 11.24000 0.6373000 11.91000 0.7012000 -0.6711000     0.9476000 
1 1 1 1  34 45 o 9.368000 0.6104000 8.751000 0.8016000 9.985000 0.9209000 -1.234000      1.221000  
1 1 1 1  34 47 o 12.47000 0.4222000 12.27000 0.5932000 12.67000 0.6010000 -0.4020000     0.8444000 
1 1 1 1  34 49 o 5.212000 1.012000  6.423000 1.543000  4.001000 1.311000  2.422000       2.024000  
1 1 1 1  34 51 o 9.417000 0.7093000 8.932000 1.004000  9.902000 1.002000  -0.9706000     1.419000  
1 1 1 1  34 53 o 6.617000 0.9209000 7.226000 1.279000  6.008000 1.325000  1.218000       1.842000  
1 1 1 1  34 55 o 6.289000 0.9334000 6.766000 1.203000  5.813000 1.427000  0.9530000      1.867000  
1 1 1 1  34 57 o 2.742000 0.8503000 2.216000 1.056000  3.268000 1.333000  -1.053000      1.701000  
1 1 1 1  35 0  o 103.5000 1.173000  103.5000 1.173000  103.5000 1.173000  0.000000       0.000000  
1 1 1 1  35 2  o 88.58000 0.6722000 89.83000 1.028000  87.33000 0.8661000 2.502000       1.344000  
1 1 1 1  35 4  o 26.19000 0.3388000 26.26000 0.5501000 26.11000 0.3956000 0.1532000      0.6776000 
1 1 1 1  35 6  o 20.05000 0.3433000 19.67000 0.5633000 20.42000 0.3927000 -0.7562000     0.6867000 
1 1 1 1  35 8  o 16.58000 0.3446000 16.85000 0.5053000 16.31000 0.4688000 0.5411000      0.6893000 
1 1 1 1  35 10 o 22.46000 0.4227000 21.79000 0.7508000 23.13000 0.3885000 -1.346000      0.8454000 
1 1 1 1  35 12 o 24.46000 0.3101000 24.59000 0.4806000 24.33000 0.3921000 0.2561000      0.6203000 
1 1 1 1  35 14 o 55.11000 0.4446000 54.72000 0.6698000 55.51000 0.5847000 -0.7855000     0.8891000 
1 1 1 1  35 16 o 14.62000 0.3570000 14.62000 0.4876000 14.62000 0.5216000 0.1273000E-02  0.7140000 
1 1 1 1  35 18 o 6.044000 0.7632000 6.781000 0.8568000 5.307000 1.263000  1.474000       1.526000  
1 1 1 1  35 20 o 21.50000 0.2958000 22.38000 0.4116000 20.63000 0.4249000 1.753000       0.5915000 
1 1 1 1  35 22 o 25.32000 0.3574000 25.32000 0.4785000 25.32000 0.5310000 -0.9727000E-04 0.7148000 
1 1 1 1  35 24 o 31.41000 0.3405000 31.57000 0.4460000 31.24000 0.5148000 0.3338000      0.6811000 
1 1 1 1  35 26 o 25.56000 0.3332000 25.26000 0.4947000 25.85000 0.4466000 -0.5871000     0.6665000 
1 1 1 1  35 28 o 6.590000 0.8346000 6.255000 1.339000  6.925000 0.9970000 -0.6697000     1.669000  
1 1 1 1  35 30 o 19.31000 0.3448000 19.37000 0.4756000 19.24000 0.4994000 0.1277000      0.6897000 
1 1 1 1  35 32 o 8.825000 0.6003000 9.069000 0.8238000 8.580000 0.8732000 0.4892000      1.201000  
1 1 1 1  35 34 o 11.46000 0.4735000 11.21000 0.6903000 11.70000 0.6484000 -0.4859000     0.9471000 
1 1 1 1  35 36 o 4.884000 0.9726000 5.211000 1.341000  4.557000 1.409000  0.6546000      1.945000  
1 1 1 1  35 38 o 25.35000 0.3789000 25.40000 0.5415000 25.30000 0.5303000 0.9295000E-01  0.7579000 
1 1 1 1  35 40 o 18.95000 0.3551000 18.65000 0.5141000 19.24000 0.4900000 -0.5893000     0.7102000 
1 1 1 1  35 42 o 5.542000 0.8585000 5.279000 1.146000  5.806000 1.279000  -0.5271000     1.717000  
1 1 1 1  35 44 o 3.902000 1.053000  4.280000 1.558000  3.523000 1.417000  0.7565000      2.106000  
1 1 1 1  35 46 o 3.666000 0.9511000 3.816000 1.347000  3.516000 1.343000  0.3002000      1.902000  
1 1 1 1  35 48 o 6.036000 0.9836000 5.183000 1.503000  6.889000 1.270000  -1.706000      1.967000  
1 1 1 1  35 50 o 6.035000 1.064000  6.453000 1.401000  5.617000 1.601000  0.8361000      2.127000  
1 1 1 1  35 52 o 5.265000 0.9635000 5.484000 1.329000  5.046000 1.396000  0.4383000      1.927000  
1 1 1 1  35 54 o 4.350000 0.9696000 4.238000 1.363000  4.462000 1.380000  -0.2236000     1.939000  
1 1 1 1  35 56 o 6.078000 0.8674000 5.680000 1.216000  6.476000 1.237000  -0.7957000     1.735000  
1 1 1 1  36 1  f 35.67000 0.3364000 36.00000 0.4461000 35.34000 0.5038000 0.6638000      0.6729000 
1 1 1 1  36 3  o 43.57000 0.3733000 43.42000 0.5605000 43.72000 0.4932000 -0.2993000     0.7466000 
1 1 1 1  36 5  o 59.67000 0.4734000 60.89000 0.6325000 58.45000 0.7045000 2.447000       0.9468000 
1 1 1 1  36 7  o 48.37000 0.4023000 47.64000 0.5205000 49.11000 0.6137000 -1.467000      0.8047000 
1 1 1 1  36 9  o 26.38000 0.3064000 26.49000 0.4682000 26.27000 0.3953000 0.2131000      0.6128000 
1 1 1 1  36 11 o 48.55000 0.4046000 48.31000 0.6103000 48.78000 0.5315000 -0.4710000     0.8092000 
1 1 1 1  36 13 o 57.05000 0.4233000 56.90000 0.5984000 57.19000 0.5989000 -0.2869000     0.8466000 
1 1 1 1  36 15 o 26.96000 0.2944000 27.22000 0.3624000 26.70000 0.4640000 0.5212000      0.5887000 
1 1 1 1  36 17 o 25.04000 0.2977000 25.35000 0.3761000 24.73000 0.4616000 0.6170000      0.5954000 
1 1 1 1  36 19 o 22.68000 0.3343000 22.61000 0.4244000 22.75000 0.5167000 -0.1323000     0.6687000 
1 1 1 1  36 21 o 34.40000 0.4257000 34.35000 0.5111000 34.46000 0.6810000 -0.1158000     0.8515000 
1 1 1 1  36 23 o 18.30000 0.3685000 18.28000 0.4807000 18.31000 0.5587000 -0.2389000E-01 0.7370000 
1 1 1 1  36 25 o 33.45000 0.3445000 33.06000 0.5169000 33.84000 0.4555000 -0.7812000     0.6890000 
1 1 1 1  36 27 f 7.681000 0.7040000 7.918000 1.088000  7.445000 0.8943000 0.4729000      1.408000  
1 1 1 1  36 29 o 18.52000 0.3419000 18.42000 0.4853000 18.61000 0.4819000 -0.1930000     0.6839000 
1 1 1 1  36 31 o 21.98000 0.3284000 21.82000 0.4607000 22.14000 0.4682000 -0.3248000     0.6569000 
1 1 1 1  36 33 o 22.03000 0.3293000 21.53000 0.4708000 22.52000 0.4606000 -0.9846000     0.6586000 
1 1 1 1  36 35 o 8.607000 0.6098000 8.299000 0.7809000 8.915000 0.9368000 -0.6157000     1.220000  
1 1 1 1  36 37 o 8.994000 0.5539000 9.031000 0.7780000 8.958000 0.7885000 0.7269000E-01  1.108000  
1 1 1 1  36 39 o 17.55000 0.4678000 17.29000 0.7545000 17.81000 0.5530000 -0.5245000     0.9355000 
1 1 1 1  36 41 o 10.04000 0.6717000 10.62000 0.6998000 9.455000 1.147000  1.162000       1.343000  
1 1 1 1  36 43 o 5.028000 0.9817000 4.909000 1.409000  5.148000 1.367000  -0.2390000     1.963000  
1 1 1 1  36 45 f 8.877000 0.6786000 8.035000 1.167000  9.719000 0.6928000 -1.684000      1.357000  
1 1 1 1  36 47 o 5.406000 1.116000  5.062000 1.710000  5.749000 1.433000  -0.6870000     2.231000  
1 1 1 1  36 49 o 5.618000 1.003000  4.344000 1.466000  6.892000 1.370000  -2.547000      2.006000  
1 1 1 1  36 51 o 5.469000 0.8950000 5.270000 1.262000  5.668000 1.270000  -0.3976000     1.790000  
1 1 1 1  36 53 o 4.615000 0.9575000 5.151000 1.340000  4.078000 1.368000  1.072000       1.915000  
1 1 1 1  36 55 o 7.472000 0.7469000 7.768000 0.9936000 7.175000 1.116000  0.5932000      1.494000  
1 1 1 1  37 0  o 17.65000 0.4882000 17.65000 0.4882000 17.65000 0.4882000 0.000000       0.000000  
1 1 1 1  37 2  o 34.63000 0.3559000 34.46000 0.5005000 34.80000 0.5062000 -0.3480000     0.7119000 
1 1 1 1  37 4  o 47.25000 0.4490000 47.96000 0.5245000 46.54000 0.7288000 1.425000       0.8979000 
1 1 1 1  37 6  o 15.94000 0.3942000 16.26000 0.4430000 15.61000 0.6522000 0.6589000      0.7884000 
1 1 1 1  37 8  o 34.92000 0.3084000 34.81000 0.4333000 35.04000 0.4389000 -0.2293000     0.6168000 
1 1 1 1  37 10 o 29.52000 0.2885000 29.68000 0.4114000 29.36000 0.4046000 0.3188000      0.5771000 
1 1 1 1  37 12 o 24.23000 0.3073000 24.60000 0.3991000 23.85000 0.4673000 0.7550000      0.6145000 
1 1 1 1  37 14 o 15.55000 0.3277000 15.71000 0.4562000 15.39000 0.4706000 0.3235000      0.6554000 
1 1 1 1  37 16 o 20.13000 0.3678000 20.16000 0.3871000 20.10000 0.6256000 0.5815000E-01  0.7356000 
1 1 1 1  37 18 o 43.91000 0.5521000 43.67000 0.4539000 44.16000 1.007000  -0.4905000     1.104000  
1 1 1 1  37 20 o 15.39000 0.5005000 14.62000 0.6011000 16.16000 0.8005000 -1.542000      1.001000  
1 1 1 1  37 22 o 54.81000 0.4545000 54.77000 0.5925000 54.85000 0.6893000 -0.7801000E-01 0.9090000 
1 1 1 1  37 24 f 41.43000 0.3780000 41.40000 0.5682000 41.46000 0.4986000 -0.6012000E-01 0.7560000 
1 1 1 1  37 26 o 19.07000 0.3494000 18.87000 0.5292000 19.28000 0.4565000 -0.4040000     0.6989000 
1 1 1 1  37 28 o 22.76000 0.3509000 22.41000 0.5380000 23.11000 0.4506000 -0.6967000     0.7018000 
1 1 1 1  37 30 o 22.20000 0.3236000 22.69000 0.4572000 21.71000 0.4580000 0.9781000      0.6472000 
1 1 1 1  37 32 o 15.09000 0.3819000 15.11000 0.5398000 15.07000 0.5402000 0.3576000E-01  0.7637000 
1 1 1 1  37 34 o 17.19000 0.3756000 17.24000 0.4883000 17.15000 0.5710000 0.8421000E-01  0.7513000 
1 1 1 1  37 36 o 20.44000 0.3327000 20.44000 0.4741000 20.44000 0.4668000 -0.2298000E-02 0.6653000 
1 1 1 1  37 38 o 15.92000 0.4707000 16.08000 0.7675000 15.76000 0.5450000 0.3260000      0.9413000 
1 1 1 1  37 40 o 6.296000 0.7964000 6.027000 0.9974000 6.566000 1.242000  -0.5386000     1.593000  
1 1 1 1  37 42 o 8.319000 0.7039000 8.359000 0.8496000 8.279000 1.123000  0.7969000E-01  1.408000  
1 1 1 1  37 44 o 9.194000 0.6096000 8.595000 0.8183000 9.792000 0.9039000 -1.197000      1.219000  
1 1 1 1  37 46 o 5.546000 0.9582000 5.503000 1.319000  5.590000 1.390000  -0.8723000E-01 1.916000  
1 1 1 1  37 48 o 12.39000 0.4610000 12.91000 0.6290000 11.87000 0.6741000 1.043000       0.9220000 
1 1 1 1  37 50 o 11.21000 0.5140000 11.99000 0.7542000 10.43000 0.6985000 1.555000       1.028000  
1 1 1 1  37 52 o 6.534000 0.9952000 5.444000 1.731000  7.624000 0.9829000 -2.180000      1.990000  
1 1 1 1  37 54 o 11.44000 0.5539000 11.19000 0.8247000 11.70000 0.7397000 -0.5064000     1.108000  
1 1 1 1  38 1  o 11.60000 0.4234000 11.71000 0.5527000 11.48000 0.6416000 0.2287000      0.8469000 
1 1 1 1  38 3  o 30.31000 0.3604000 29.97000 0.4220000 30.65000 0.5845000 -0.6800000     0.7209000 
1 1 1 1  38 5  o 11.11000 0.4507000 11.21000 0.5824000 11.01000 0.6881000 0.1948000      0.9015000 
1 1 1 1  38 7  o 23.09000 0.3204000 22.61000 0.4081000 23.57000 0.4939000 -0.9589000     0.6407000 
1 1 1 1  38 9  o 34.33000 0.3362000 34.51000 0.4334000 34.14000 0.5141000 0.3669000      0.6724000 
1 1 1 1  38 11 o 15.59000 0.3595000 15.48000 0.4685000 15.70000 0.5455000 -0.2148000     0.7191000 
1 1 1 1  38 13 o 23.41000 0.3219000 23.14000 0.4040000 23.69000 0.5014000 -0.5525000     0.6439000 
1 1 1 1  38 15 o 33.08000 0.3707000 33.38000 0.3969000 32.77000 0.6263000 0.6125000      0.7414000 
1 1 1 1  38 17 o 18.15000 0.5045000 19.31000 0.4134000 16.99000 0.9205000 2.321000       1.009000  
1 1 1 1  38 19 o 10.39000 0.5561000 10.32000 0.7762000 10.46000 0.7964000 -0.1399000     1.112000  
1 1 1 1  38 21 o 25.83000 0.3370000 26.05000 0.4372000 25.61000 0.5130000 0.4443000      0.6740000 
1 1 1 1  38 23 o 16.88000 0.3688000 17.00000 0.5388000 16.76000 0.5038000 0.2351000      0.7376000 
1 1 1 1  38 25 o 6.099000 0.8885000 6.448000 1.289000  5.750000 1.224000  0.6983000      1.777000  
1 1 1 1  38 27 o 19.99000 0.3514000 20.16000 0.5220000 19.81000 0.4707000 0.3508000      0.7029000 
1 1 1 1  38 29 o 17.38000 0.3462000 16.53000 0.4999000 18.22000 0.4789000 -1.694000      0.6923000 
1 1 1 1  38 31 o 12.71000 0.4062000 13.00000 0.5817000 12.42000 0.5670000 0.5822000      0.8123000 
1 1 1 1  38 33 o 22.99000 0.3429000 23.09000 0.4539000 22.89000 0.5141000 0.2011000      0.6858000 
1 1 1 1  38 35 o 9.710000 0.5264000 9.988000 0.7231000 9.433000 0.7650000 0.5548000      1.053000  
1 1 1 1  38 37 o 6.434000 1.072000  6.177000 1.888000  6.691000 1.017000  -0.5138000     2.144000  
1 1 1 1  38 39 o 9.613000 0.5334000 9.660000 0.7427000 9.565000 0.7660000 0.9499000E-01  1.067000  
1 1 1 1  38 41 o 10.81000 0.5504000 10.83000 0.7884000 10.79000 0.7682000 0.3897000E-01  1.101000  
1 1 1 1  38 43 o 7.026000 0.7333000 7.920000 0.8382000 6.132000 1.204000  1.788000       1.467000  
1 1 1 1  38 45 o 4.587000 0.9693000 5.442000 1.367000  3.732000 1.375000  1.711000       1.939000  
1 1 1 1  38 47 o 8.515000 0.6938000 8.770000 0.8847000 8.261000 1.069000  0.5090000      1.388000  
1 1 1 1  38 49 o 4.738000 0.8991000 3.603000 1.375000  5.873000 1.159000  -2.270000      1.798000  
1 1 1 1  38 51 o 3.750000 0.9195000 2.392000 1.138000  5.108000 1.444000  -2.716000      1.839000  
1 1 1 1  38 53 o 4.859000 1.084000  4.673000 1.638000  5.044000 1.419000  -0.3707000     2.167000  
1 1 1 1  39 0  o 11.11000 0.6169000 11.11000 0.6169000 11.11000 0.6169000 0.000000       0.000000  
1 1 1 1  39 2  o 64.75000 0.5105000 65.20000 0.6738000 64.29000 0.7671000 0.9043000      1.021000  
1 1 1 1  39 4  o 48.26000 0.4061000 47.59000 0.5254000 48.92000 0.6195000 -1.336000      0.8123000 
1 1 1 1  39 6  o 46.00000 0.3930000 46.19000 0.5178000 45.81000 0.5913000 0.3800000      0.7860000 
1 1 1 1  39 8  o 37.48000 0.4040000 37.60000 0.4592000 37.37000 0.6649000 0.2257000      0.8081000 
1 1 1 1  39 10 o 9.395000 0.6515000 9.603000 0.6772000 9.186000 1.113000  0.4171000      1.303000  
1 1 1 1  39 12 o 32.53000 0.3831000 32.50000 0.4283000 32.56000 0.6353000 -0.5986000E-01 0.7661000 
1 1 1 1  39 14 o 9.777000 0.6115000 10.07000 0.6518000 9.482000 1.035000  0.5902000      1.223000  
1 1 1 1  39 16 o 14.84000 0.5097000 14.81000 0.4650000 14.87000 0.9072000 -0.5782000E-01 1.019000  
1 1 1 1  39 18 o 20.51000 0.3673000 20.59000 0.4468000 20.43000 0.5832000 0.1652000      0.7347000 
1 1 1 1  39 20 o 29.76000 0.3123000 29.56000 0.4408000 29.97000 0.4426000 -0.4087000     0.6247000 
1 1 1 1  39 22 o 35.34000 0.3499000 35.19000 0.5235000 35.49000 0.4644000 -0.3015000     0.6999000 
1 1 1 1  39 24 o 53.15000 0.4459000 54.04000 0.6812000 52.26000 0.5755000 1.784000       0.8918000 
1 1 1 1  39 26 o 36.07000 0.3576000 35.66000 0.5362000 36.48000 0.4733000 -0.8168000     0.7152000 
1 1 1 1  39 28 o 27.37000 0.3118000 27.26000 0.4359000 27.49000 0.4460000 -0.2341000     0.6236000 
1 1 1 1  39 30 o 24.84000 0.3046000 25.03000 0.4331000 24.65000 0.4285000 0.3810000      0.6093000 
1 1 1 1  39 32 f 14.14000 0.4199000 14.54000 0.5529000 13.74000 0.6322000 0.7986000      0.8399000 
1 1 1 1  39 34 o 9.417000 0.5392000 9.249000 0.7889000 9.585000 0.7353000 -0.3355000     1.078000  
1 1 1 1  39 36 o 3.686000 1.025000  2.776000 1.268000  4.595000 1.612000  -1.819000      2.051000  
1 1 1 1  39 38 o 4.510000 0.9364000 4.763000 1.335000  4.257000 1.313000  0.5058000      1.873000  
1 1 1 1  39 40 f 13.72000 0.4601000 13.66000 0.6582000 13.78000 0.6431000 -0.1212000     0.9202000 
1 1 1 1  39 42 o 5.818000 0.8133000 5.657000 1.183000  5.980000 1.117000  -0.3227000     1.627000  
1 1 1 1  39 44 o 13.00000 0.4586000 12.36000 0.7293000 13.65000 0.5563000 -1.290000      0.9172000 
1 1 1 1  39 46 o 12.27000 0.4563000 12.45000 0.6565000 12.10000 0.6339000 0.3489000      0.9126000 
1 1 1 1  39 48 o 7.542000 0.7468000 7.696000 1.073000  7.388000 1.039000  0.3080000      1.494000  
1 1 1 1  39 50 o 6.414000 1.019000  6.195000 1.192000  6.633000 1.653000  -0.4377000     2.038000  
1 1 1 1  39 52 o 4.440000 0.9544000 5.553000 1.389000  3.327000 1.310000  2.226000       1.909000  
1 1 1 1  40 1  f 30.94000 0.3871000 30.60000 0.5913000 31.28000 0.4997000 -0.6838000     0.7742000 
1 1 1 1  40 3  o 12.77000 0.3990000 13.01000 0.5455000 12.52000 0.5825000 0.4991000      0.7980000 
1 1 1 1  40 5  f 30.80000 0.3084000 30.54000 0.4336000 31.06000 0.4387000 -0.5223000     0.6168000 
1 1 1 1  40 7  o 56.59000 0.4576000 57.27000 0.6069000 55.91000 0.6850000 1.362000       0.9152000 
1 1 1 1  40 9  o 59.17000 0.4769000 58.86000 0.6210000 59.49000 0.7240000 -0.6350000     0.9538000 
1 1 1 1  40 11 o 5.839000 0.8571000 5.455000 1.235000  6.223000 1.189000  -0.7682000     1.714000  
1 1 1 1  40 13 f 24.40000 0.3255000 23.94000 0.4213000 24.87000 0.4962000 -0.9340000     0.6510000 
1 1 1 1  40 15 o 30.95000 0.4515000 31.20000 0.4050000 30.70000 0.8071000 0.5009000      0.9030000 
1 1 1 1  40 17 o 31.25000 0.3351000 30.94000 0.4420000 31.56000 0.5039000 -0.6250000     0.6702000 
1 1 1 1  40 19 o 39.30000 0.3661000 39.26000 0.4895000 39.33000 0.5445000 -0.7107000E-01 0.7322000 
1 1 1 1  40 21 o 18.54000 0.3579000 18.99000 0.5331000 18.09000 0.4777000 0.9066000      0.7158000 
1 1 1 1  40 23 o 12.91000 0.4401000 13.31000 0.6389000 12.50000 0.6055000 0.8094000      0.8802000 
1 1 1 1  40 25 o 4.249000 0.9350000 4.134000 1.299000  4.364000 1.346000  -0.2303000     1.870000  
1 1 1 1  40 27 o 8.270000 0.5853000 8.647000 0.8026000 7.893000 0.8521000 0.7534000      1.171000  
1 1 1 1  40 29 o 12.60000 0.4083000 12.65000 0.5871000 12.54000 0.5676000 0.1131000      0.8166000 
1 1 1 1  40 31 o 5.857000 0.7769000 6.511000 1.024000  5.203000 1.169000  1.309000       1.554000  
1 1 1 1  40 33 o 23.74000 0.3822000 24.30000 0.6136000 23.17000 0.4558000 1.132000       0.7643000 
1 1 1 1  40 35 o 28.45000 0.4222000 28.29000 0.5278000 28.61000 0.6591000 -0.3191000     0.8443000 
1 1 1 1  40 37 o 6.918000 0.7361000 7.093000 1.113000  6.742000 0.9636000 0.3516000      1.472000  
1 1 1 1  40 39 o 5.207000 0.8655000 5.459000 1.171000  4.955000 1.275000  0.5047000      1.731000  
1 1 1 1  40 41 o 7.330000 0.7433000 7.067000 0.9476000 7.594000 1.145000  -0.5279000     1.487000  
1 1 1 1  40 43 o 14.47000 0.3964000 14.72000 0.5743000 14.23000 0.5465000 0.4894000      0.7927000 
1 1 1 1  40 45 o 10.46000 0.5626000 10.05000 0.8810000 10.87000 0.7001000 -0.8141000     1.125000  
1 1 1 1  40 47 o 10.12000 0.5662000 10.58000 0.8174000 9.650000 0.7838000 0.9304000      1.132000  
1 1 1 1  40 49 o 4.788000 0.9093000 5.895000 1.194000  3.681000 1.372000  2.215000       1.819000  
1 1 1 1  40 51 o 3.816000 0.9224000 3.573000 1.289000  4.060000 1.320000  -0.4875000     1.845000  
1 1 1 1  41 0  o 20.39000 0.5108000 20.39000 0.5108000 20.39000 0.5108000 0.000000       0.000000  
1 1 1 1  41 2  o 38.09000 0.3593000 37.74000 0.5375000 38.44000 0.4770000 -0.6989000     0.7187000 
1 1 1 1  41 4  o 17.94000 0.3653000 18.47000 0.5462000 17.40000 0.4852000 1.072000       0.7306000 
1 1 1 1  41 6  o 24.49000 0.3037000 24.22000 0.4298000 24.76000 0.4291000 -0.5394000     0.6073000 
1 1 1 1  41 8  o 51.66000 0.3992000 51.75000 0.5662000 51.57000 0.5631000 0.1878000      0.7985000 
1 1 1 1  41 10 f 45.88000 0.3682000 45.47000 0.5165000 46.28000 0.5248000 -0.8108000     0.7364000 
1 1 1 1  41 12 o 10.02000 0.4844000 9.919000 0.7079000 10.13000 0.6614000 -0.2120000     0.9688000 
1 1 1 1  41 14 o 7.750000 0.6507000 7.487000 0.9080000 8.012000 0.9324000 -0.5246000     1.301000  
1 1 1 1  41 16 o 7.083000 0.7561000 7.705000 0.9905000 6.461000 1.143000  1.244000       1.512000  
1 1 1 1  41 18 o 22.99000 0.3374000 23.06000 0.4508000 22.91000 0.5021000 0.1490000      0.6748000 
1 1 1 1  41 20 o 25.36000 0.3757000 25.88000 0.6023000 24.84000 0.4492000 1.038000       0.7513000 
1 1 1 1  41 22 o 7.911000 0.6390000 8.284000 0.9204000 7.537000 0.8866000 0.7478000      1.278000  
1 1 1 1  41 24 o 14.96000 0.3609000 14.82000 0.5120000 15.09000 0.5087000 -0.2649000     0.7217000 
1 1 1 1  41 26 o 16.59000 0.3428000 16.68000 0.4653000 16.49000 0.5035000 0.1953000      0.6855000 
1 1 1 1  41 28 o 17.53000 0.3312000 17.47000 0.4804000 17.58000 0.4560000 -0.1097000     0.6623000 
1 1 1 1  41 30 o 19.56000 0.3272000 19.72000 0.4814000 19.39000 0.4433000 0.3338000      0.6544000 
1 1 1 1  41 32 o 20.28000 0.3752000 20.18000 0.5214000 20.38000 0.5396000 -0.1983000     0.7503000 
1 1 1 1  41 34 f 3.245000 0.9534000 3.281000 1.285000  3.208000 1.409000  0.7261000E-01  1.907000  
1 1 1 1  41 36 o 6.532000 0.8188000 6.038000 1.301000  7.027000 0.9941000 -0.9894000     1.638000  
1 1 1 1  41 38 o 7.060000 0.6935000 7.531000 0.8592000 6.589000 1.089000  0.9414000      1.387000  
1 1 1 1  41 40 o 3.777000 0.9648000 4.482000 1.341000  3.072000 1.388000  1.409000       1.930000  
1 1 1 1  41 42 o 8.782000 0.5829000 8.109000 0.8907000 9.455000 0.7521000 -1.345000      1.166000  
1 1 1 1  41 44 o 4.220000 1.017000  3.734000 1.489000  4.707000 1.384000  -0.9734000     2.033000  
1 1 1 1  41 46 o 7.163000 0.8281000 6.980000 1.220000  7.346000 1.120000  -0.3656000     1.656000  
1 1 1 1  41 48 o 3.585000 0.9400000 3.385000 1.328000  3.785000 1.331000  -0.4007000     1.880000  
1 1 1 1  41 50 o 4.010000 0.9398000 3.946000 1.324000  4.073000 1.334000  -0.1267000     1.880000  
1 1 1 1  41 52 o 4.452000 1.332000  3.192000 1.562000  5.711000 2.159000  -2.520000      2.664000  
1 1 1 1  42 1  o 11.31000 0.4610000 11.23000 0.6597000 11.39000 0.6442000 -0.1555000     0.9220000 
1 1 1 1  42 3  o 5.654000 0.8625000 4.626000 1.339000  6.683000 1.088000  -2.058000      1.725000  
1 1 1 1  42 5  o 30.04000 0.3325000 30.19000 0.5004000 29.88000 0.4379000 0.3099000      0.6650000 
1 1 1 1  42 7  f 4.035000 0.9345000 3.092000 1.328000  4.977000 1.316000  -1.885000      1.869000  
1 1 1 1  42 9  o 31.96000 0.3418000 32.07000 0.5152000 31.85000 0.4494000 0.2224000      0.6836000 
1 1 1 1  42 11 o 47.11000 0.3778000 47.33000 0.5366000 46.88000 0.5319000 0.4480000      0.7555000 
1 1 1 1  42 13 f 23.47000 0.3328000 23.95000 0.4391000 23.00000 0.5001000 0.9518000      0.6655000 
1 1 1 1  42 15 o 22.91000 0.3429000 22.91000 0.4576000 22.92000 0.5108000 -0.6542000E-02 0.6858000 
1 1 1 1  42 17 o 15.40000 0.4169000 15.71000 0.5919000 15.09000 0.5872000 0.6161000      0.8338000 
1 1 1 1  42 19 o 11.20000 0.5131000 11.68000 0.7884000 10.73000 0.6569000 0.9498000      1.026000  
1 1 1 1  42 21 f 12.56000 0.4449000 12.35000 0.6842000 12.78000 0.5689000 -0.4321000     0.8898000 
1 1 1 1  42 23 o 18.48000 0.3160000 18.52000 0.4506000 18.44000 0.4431000 0.8389000E-01  0.6320000 
1 1 1 1  42 25 o 9.237000 0.5094000 9.438000 0.6884000 9.037000 0.7511000 0.4008000      1.019000  
1 1 1 1  42 27 o 15.39000 0.3547000 16.06000 0.4724000 14.73000 0.5293000 1.330000       0.7095000 
1 1 1 1  42 29 o 3.760000 0.9449000 3.814000 1.343000  3.706000 1.330000  0.1075000      1.890000  
1 1 1 1  42 31 o 10.41000 0.5308000 10.23000 0.8389000 10.59000 0.6505000 -0.3554000     1.062000  
1 1 1 1  42 33 o 9.766000 0.5318000 10.08000 0.7593000 9.446000 0.7449000 0.6385000      1.064000  
1 1 1 1  42 35 f 8.846000 0.5765000 9.360000 0.8463000 8.332000 0.7830000 1.028000       1.153000  
1 1 1 1  42 37 o 9.997000 0.4988000 9.836000 0.7092000 10.16000 0.7015000 -0.3219000     0.9975000 
1 1 1 1  42 39 o 3.276000 0.9326000 2.732000 1.207000  3.820000 1.422000  -1.088000      1.865000  
1 1 1 1  42 41 o 14.41000 0.3920000 14.31000 0.5350000 14.51000 0.5731000 -0.1963000     0.7840000 
1 1 1 1  42 43 o 3.384000 0.9938000 3.607000 1.462000  3.161000 1.346000  0.4457000      1.988000  
1 1 1 1  42 45 o 5.568000 0.9273000 5.356000 1.272000  5.781000 1.350000  -0.4250000     1.855000  
1 1 1 1  42 47 o 3.249000 0.9229000 3.174000 1.313000  3.324000 1.298000  -0.1500000     1.846000  
1 1 1 1  42 49 o 3.646000 0.9418000 3.835000 1.323000  3.458000 1.341000  0.3777000      1.884000  
1 1 1 1  42 51 o 5.703000 1.213000  4.477000 1.875000  6.928000 1.538000  -2.451000      2.425000  
1 1 1 1  43 0  o 33.47000 0.5259000 33.47000 0.5259000 33.47000 0.5259000 0.000000       0.000000  
1 1 1 1  43 2  o 17.34000 0.3590000 16.94000 0.5032000 17.74000 0.5121000 -0.8003000     0.7179000 
1 1 1 1  43 4  o 19.24000 0.3346000 19.35000 0.4686000 19.12000 0.4778000 0.2321000      0.6693000 
1 1 1 1  43 6  o 18.50000 0.3329000 18.53000 0.4606000 18.47000 0.4807000 0.6303000E-01  0.6658000 
1 1 1 1  43 8  o 33.89000 0.3487000 34.47000 0.5337000 33.31000 0.4490000 1.151000       0.6974000 
1 1 1 1  43 10 o 15.57000 0.3935000 15.40000 0.6036000 15.74000 0.5049000 -0.3431000     0.7870000 
1 1 1 1  43 12 f 18.34000 0.3778000 18.70000 0.5434000 17.98000 0.5249000 0.7186000      0.7555000 
1 1 1 1  43 14 o 31.42000 0.3868000 32.03000 0.6377000 30.80000 0.4379000 1.234000       0.7736000 
1 1 1 1  43 16 o 15.44000 0.4150000 16.11000 0.5639000 14.77000 0.6090000 1.340000       0.8300000 
1 1 1 1  43 18 o 25.06000 0.3809000 24.84000 0.5858000 25.28000 0.4871000 -0.4398000     0.7618000 
1 1 1 1  43 20 o 20.48000 0.3132000 20.36000 0.4434000 20.60000 0.4424000 -0.2404000     0.6264000 
1 1 1 1  43 22 o 26.28000 0.3049000 26.60000 0.4358000 25.95000 0.4265000 0.6452000      0.6098000 
1 1 1 1  43 24 o 24.22000 0.2987000 24.29000 0.4234000 24.15000 0.4214000 0.1475000      0.5974000 
1 1 1 1  43 26 o 24.67000 0.3286000 24.81000 0.4909000 24.53000 0.4370000 0.2760000      0.6572000 
1 1 1 1  43 28 o 9.822000 0.5421000 9.698000 0.6596000 9.947000 0.8605000 -0.2496000     1.084000  
1 1 1 1  43 30 o 14.80000 0.4415000 15.11000 0.6487000 14.49000 0.5990000 0.6214000      0.8829000 
1 1 1 1  43 32 o 5.452000 0.9806000 5.109000 1.410000  5.794000 1.363000  -0.6850000     1.961000  
1 1 1 1  43 34 o 11.81000 0.4638000 11.70000 0.6939000 11.92000 0.6156000 -0.2286000     0.9276000 
1 1 1 1  43 36 o 12.66000 0.4082000 12.56000 0.5810000 12.75000 0.5736000 -0.1952000     0.8165000 
1 1 1 1  43 38 o 11.87000 0.4913000 12.09000 0.6063000 11.64000 0.7732000 0.4535000      0.9825000 
1 1 1 1  43 40 o 8.168000 0.6131000 7.878000 0.8025000 8.458000 0.9272000 -0.5794000     1.226000  
1 1 1 1  43 42 o 6.738000 0.7908000 6.091000 1.187000  7.385000 1.045000  -1.294000      1.582000  
1 1 1 1  43 44 o 3.688000 0.9783000 3.835000 1.385000  3.540000 1.382000  0.2956000      1.957000  
1 1 1 1  43 46 o 3.357000 0.9329000 2.909000 1.262000  3.806000 1.374000  -0.8966000     1.866000  
1 1 1 1  43 48 o 3.806000 0.8853000 2.699000 1.188000  4.914000 1.313000  -2.216000      1.771000  
1 1 1 1  43 50 o 5.981000 1.052000  5.818000 1.498000  6.144000 1.479000  -0.3260000     2.105000  
1 1 1 1  44 1  f 18.65000 0.3758000 18.62000 0.5614000 18.67000 0.4996000 -0.5209000E-01 0.7515000 
1 1 1 1  44 3  o 28.69000 0.3455000 29.17000 0.5256000 28.20000 0.4485000 0.9741000      0.6910000 
1 1 1 1  44 5  o 32.07000 0.3202000 31.78000 0.4553000 32.36000 0.4502000 -0.5743000     0.6403000 
1 1 1 1  44 7  o 21.29000 0.3214000 21.33000 0.4518000 21.25000 0.4573000 0.7626000E-01  0.6428000 
1 1 1 1  44 9  o 29.79000 0.3409000 29.65000 0.4532000 29.94000 0.5095000 -0.2865000     0.6819000 
1 1 1 1  44 11 o 4.198000 0.9784000 4.549000 1.389000  3.846000 1.378000  0.7022000      1.957000  
1 1 1 1  44 13 o 24.11000 0.3403000 24.19000 0.5191000 24.03000 0.4401000 0.1581000      0.6805000 
1 1 1 1  44 15 o 20.11000 0.3556000 20.24000 0.4980000 19.98000 0.5079000 0.2554000      0.7113000 
1 1 1 1  44 17 o 23.06000 0.3383000 22.40000 0.4515000 23.73000 0.5038000 -1.327000      0.6765000 
1 1 1 1  44 19 o 6.658000 0.6673000 6.715000 0.9770000 6.601000 0.9092000 0.1146000      1.335000  
1 1 1 1  44 21 o 7.412000 0.5902000 7.615000 0.8049000 7.210000 0.8635000 0.4050000      1.180000  
1 1 1 1  44 23 o 8.676000 0.5020000 8.559000 0.7278000 8.792000 0.6917000 -0.2338000     1.004000  
1 1 1 1  44 25 o 10.48000 0.4786000 10.58000 0.6351000 10.38000 0.7162000 0.1968000      0.9572000 
1 1 1 1  44 27 o 2.910000 0.8544000 2.782000 1.178000  3.038000 1.238000  -0.2556000     1.709000  
1 1 1 1  44 29 o 14.03000 0.4626000 14.00000 0.7705000 14.06000 0.5122000 -0.6295000E-01 0.9253000 
1 1 1 1  44 31 o 2.842000 0.8714000 2.832000 1.212000  2.851000 1.253000  -0.1941000E-01 1.743000  
1 1 1 1  44 33 o 3.995000 0.9931000 4.183000 1.471000  3.807000 1.335000  0.3761000      1.986000  
1 1 1 1  44 35 o 4.926000 0.8697000 4.074000 1.342000  5.778000 1.106000  -1.704000      1.739000  
1 1 1 1  44 37 o 12.47000 0.4500000 12.62000 0.5606000 12.32000 0.7040000 0.2990000      0.8999000 
1 1 1 1  44 39 o 4.506000 0.9580000 4.571000 1.314000  4.441000 1.394000  0.1303000      1.916000  
1 1 1 1  44 41 o 2.576000 0.8256000 2.225000 1.066000  2.927000 1.261000  -0.7019000     1.651000  
1 1 1 1  44 43 o 10.69000 0.5112000 10.67000 0.6548000 10.71000 0.7852000 -0.4139000E-01 1.022000  
1 1 1 1  44 45 o 10.23000 0.5166000 10.46000 0.6956000 9.995000 0.7640000 0.4649000      1.033000  
1 1 1 1  44 47 o 4.259000 0.8375000 5.606000 1.149000  2.911000 1.219000  2.695000       1.675000  
1 1 1 1  44 49 o 4.240000 1.215000  4.503000 1.652000  3.977000 1.782000  0.5255000      2.430000  
1 1 1 1  45 0  o 42.82000 0.5189000 42.82000 0.5189000 42.82000 0.5189000 0.000000       0.000000  
1 1 1 1  45 2  o 18.52000 0.3552000 18.45000 0.5145000 18.58000 0.4899000 -0.1299000     0.7104000 
1 1 1 1  45 4  o 25.66000 0.3447000 25.43000 0.4503000 25.89000 0.5219000 -0.4624000     0.6893000 
1 1 1 1  45 6  o 16.64000 0.3546000 16.94000 0.5117000 16.35000 0.4910000 0.5951000      0.7092000 
1 1 1 1  45 8  o 19.89000 0.3518000 20.01000 0.4625000 19.78000 0.5302000 0.2235000      0.7036000 
1 1 1 1  45 10 o 7.296000 0.6638000 6.986000 0.9886000 7.606000 0.8860000 -0.6201000     1.328000  
1 1 1 1  45 12 o 16.91000 0.3418000 17.06000 0.4836000 16.76000 0.4831000 0.3022000      0.6836000 
1 1 1 1  45 14 o 23.70000 0.3275000 24.14000 0.4976000 23.26000 0.4259000 0.8812000      0.6550000 
1 1 1 1  45 16 o 10.92000 0.4718000 11.32000 0.6106000 10.51000 0.7195000 0.8122000      0.9437000 
1 1 1 1  45 18 o 9.225000 0.5525000 8.348000 0.8007000 10.10000 0.7616000 -1.755000      1.105000  
1 1 1 1  45 20 o 12.16000 0.3847000 11.79000 0.5738000 12.52000 0.5126000 -0.7341000     0.7694000 
1 1 1 1  45 22 o 5.060000 0.8640000 5.327000 1.223000  4.794000 1.220000  0.5322000      1.728000  
1 1 1 1  45 24 o 4.600000 0.8951000 4.690000 1.263000  4.510000 1.269000  0.1801000      1.790000  
1 1 1 1  45 26 o 7.227000 0.6437000 7.074000 0.8971000 7.380000 0.9232000 -0.3060000     1.287000  
1 1 1 1  45 28 o 4.960000 0.8890000 4.744000 1.323000  5.177000 1.188000  -0.4331000     1.778000  
1 1 1 1  45 30 o 3.605000 0.9235000 3.399000 1.232000  3.811000 1.376000  -0.4117000     1.847000  
1 1 1 1  45 32 o 5.543000 0.8568000 4.989000 1.375000  6.096000 1.022000  -1.107000      1.714000  
1 1 1 1  45 34 o 7.541000 0.6141000 8.007000 0.8079000 7.074000 0.9252000 0.9328000      1.228000  
1 1 1 1  45 36 o 6.617000 0.6714000 6.672000 0.9057000 6.562000 0.9913000 0.1101000      1.343000  
1 1 1 1  45 38 o 5.667000 0.8546000 5.259000 1.217000  6.075000 1.200000  -0.8161000     1.709000  
1 1 1 1  45 40 o 7.055000 0.7340000 6.914000 0.9292000 7.195000 1.136000  -0.2817000     1.468000  
1 1 1 1  45 42 o 6.376000 0.7918000 5.774000 1.258000  6.979000 0.9625000 -1.205000      1.584000  
1 1 1 1  45 44 o 3.021000 0.8514000 3.754000 1.327000  2.287000 1.067000  1.467000       1.703000  
1 1 1 1  45 46 o 7.923000 0.6236000 8.429000 0.8652000 7.417000 0.8982000 1.012000       1.247000  
1 1 1 1  45 48 o 6.409000 1.520000  6.264000 2.196000  6.554000 2.102000  -0.2901000     3.040000  
1 1 1 1  46 1  f 20.01000 0.3867000 19.61000 0.5521000 20.40000 0.5416000 -0.7844000     0.7734000 
1 1 1 1  46 3  o 10.36000 0.5126000 9.659000 0.8063000 11.06000 0.6332000 -1.401000      1.025000  
1 1 1 1  46 5  o 23.51000 0.3167000 23.40000 0.4545000 23.63000 0.4411000 -0.2325000     0.6334000 
1 1 1 1  46 7  o 30.77000 0.3429000 30.73000 0.4518000 30.82000 0.5161000 -0.9259000E-01 0.6859000 
1 1 1 1  46 9  o 19.67000 0.3514000 20.14000 0.5349000 19.21000 0.4558000 0.9328000      0.7028000 
1 1 1 1  46 11 o 6.529000 0.7143000 6.646000 0.9869000 6.411000 1.033000  0.2352000      1.429000  
1 1 1 1  46 13 o 10.49000 0.4974000 10.51000 0.7475000 10.46000 0.6564000 0.5457000E-01  0.9948000 
1 1 1 1  46 15 o 18.07000 0.3826000 17.89000 0.4654000 18.24000 0.6073000 -0.3436000     0.7651000 
1 1 1 1  46 17 o 15.06000 0.3517000 14.67000 0.4453000 15.45000 0.5445000 -0.7788000     0.7034000 
1 1 1 1  46 19 o 15.64000 0.3730000 15.50000 0.5515000 15.78000 0.5024000 -0.2830000     0.7460000 
1 1 1 1  46 21 o 7.455000 0.5731000 6.997000 0.8436000 7.912000 0.7759000 -0.9159000     1.146000  
1 1 1 1  46 23 o 6.543000 0.6625000 5.948000 0.9630000 7.138000 0.9101000 -1.190000      1.325000  
1 1 1 1  46 25 o 10.25000 0.4998000 10.27000 0.7704000 10.24000 0.6370000 0.3410000E-01  0.9996000 
1 1 1 1  46 27 o 22.34000 0.3239000 22.66000 0.4853000 22.02000 0.4292000 0.6411000      0.6479000 
1 1 1 1  46 29 o 11.27000 0.4525000 11.24000 0.6068000 11.29000 0.6714000 -0.5367000E-01 0.9050000 
1 1 1 1  46 31 o 13.26000 0.4155000 12.87000 0.6436000 13.66000 0.5258000 -0.7833000     0.8311000 
1 1 1 1  46 33 f 4.050000 0.9869000 4.319000 1.400000  3.781000 1.391000  0.5377000      1.974000  
1 1 1 1  46 35 o 4.511000 0.9648000 4.197000 1.409000  4.825000 1.319000  -0.6276000     1.930000  
1 1 1 1  46 37 o 3.194000 0.9650000 3.200000 1.304000  3.188000 1.423000  0.1216000E-01  1.930000  
1 1 1 1  46 39 o 3.667000 0.9115000 2.412000 1.099000  4.921000 1.455000  -2.509000      1.823000  
1 1 1 1  46 41 o 2.731000 0.8496000 2.798000 1.254000  2.665000 1.147000  0.1331000      1.699000  
1 1 1 1  46 43 o 5.502000 0.8710000 5.253000 1.322000  5.750000 1.134000  -0.4970000     1.742000  
1 1 1 1  46 45 o 9.065000 0.6023000 7.700000 0.9495000 10.43000 0.7414000 -2.730000      1.205000  
1 1 1 1  47 0  o 18.58000 0.5934000 18.58000 0.5934000 18.58000 0.5934000 0.000000       0.000000  
1 1 1 1  47 2  o 32.40000 0.3781000 32.12000 0.5512000 32.67000 0.5177000 -0.5528000     0.7562000 
1 1 1 1  47 4  f 10.23000 0.5065000 10.16000 0.6836000 10.30000 0.7474000 -0.1394000     1.013000  
1 1 1 1  47 6  o 31.50000 0.3419000 31.60000 0.4496000 31.40000 0.5152000 0.1923000      0.6838000 
1 1 1 1  47 8  o 16.37000 0.3777000 16.99000 0.5701000 15.75000 0.4957000 1.242000       0.7555000 
1 1 1 1  47 10 o 18.93000 0.3397000 19.07000 0.5120000 18.79000 0.4465000 0.2812000      0.6793000 
1 1 1 1  47 12 f 22.00000 0.3102000 22.03000 0.4383000 21.97000 0.4392000 0.5872000E-01  0.6204000 
1 1 1 1  47 14 o 11.81000 0.4219000 12.29000 0.5439000 11.33000 0.6452000 0.9590000      0.8438000 
1 1 1 1  47 16 o 7.892000 0.5473000 7.532000 0.7040000 8.253000 0.8380000 -0.7210000     1.095000  
1 1 1 1  47 18 o 6.607000 0.7351000 6.591000 0.9469000 6.623000 1.125000  -0.3202000E-01 1.470000  
1 1 1 1  47 20 o 13.26000 0.3807000 13.65000 0.5244000 12.87000 0.5519000 0.7788000      0.7613000 
1 1 1 1  47 22 o 13.29000 0.4109000 13.72000 0.6155000 12.85000 0.5445000 0.8649000      0.8217000 
1 1 1 1  47 24 o 13.08000 0.3659000 13.37000 0.5071000 12.79000 0.5276000 0.5796000      0.7318000 
1 1 1 1  47 26 o 2.473000 0.7798000 2.160000 1.036000  2.787000 1.166000  -0.6266000     1.560000  
1 1 1 1  47 28 o 5.189000 0.8621000 5.796000 1.026000  4.581000 1.386000  1.215000       1.724000  
1 1 1 1  47 30 o 4.336000 0.9260000 3.534000 1.376000  5.139000 1.239000  -1.606000      1.852000  
1 1 1 1  47 32 o 5.906000 0.7757000 5.200000 1.195000  6.613000 0.9891000 -1.414000      1.551000  
1 1 1 1  47 34 o 4.391000 0.9220000 4.649000 1.224000  4.133000 1.380000  0.5164000      1.844000  
1 1 1 1  47 36 o 14.69000 0.5049000 14.44000 0.6415000 14.93000 0.7800000 -0.4834000     1.010000  
1 1 1 1  47 38 o 11.39000 0.5029000 11.79000 0.6384000 10.99000 0.7772000 0.7973000      1.006000  
1 1 1 1  47 40 o 4.516000 0.9696000 5.079000 1.428000  3.953000 1.312000  1.127000       1.939000  
1 1 1 1  47 42 o 4.407000 1.007000  4.392000 1.520000  4.421000 1.322000  -0.2886000E-01 2.015000  
1 1 1 1  47 44 o 4.197000 0.9128000 3.878000 1.285000  4.516000 1.297000  -0.6377000     1.826000  
1 1 1 1  48 1  o 31.84000 0.3489000 31.45000 0.5268000 32.23000 0.4577000 -0.7838000     0.6979000 
1 1 1 1  48 3  o 21.66000 0.3444000 21.92000 0.4408000 21.41000 0.5293000 0.5104000      0.6888000 
1 1 1 1  48 5  o 15.06000 0.3465000 15.10000 0.4843000 15.02000 0.4956000 0.7348000E-01  0.6929000 
1 1 1 1  48 7  o 21.32000 0.3358000 21.58000 0.5123000 21.05000 0.4343000 0.5258000      0.6716000 
1 1 1 1  48 9  f 14.47000 0.3870000 14.25000 0.5880000 14.69000 0.5035000 -0.4318000     0.7741000 
1 1 1 1  48 11 o 6.180000 0.7027000 5.549000 1.102000  6.811000 0.8722000 -1.262000      1.405000  
1 1 1 1  48 13 o 8.355000 0.5463000 8.906000 0.7386000 7.804000 0.8050000 1.102000       1.093000  
1 1 1 1  48 15 o 24.35000 0.3743000 24.41000 0.3898000 24.29000 0.6391000 0.1131000      0.7486000 
1 1 1 1  48 17 o 8.143000 0.5189000 8.100000 0.6826000 8.185000 0.7817000 -0.8437000E-01 1.038000  
1 1 1 1  48 19 o 9.921000 0.5102000 9.628000 0.7475000 10.21000 0.6945000 -0.5857000     1.020000  
1 1 1 1  48 21 o 5.489000 0.7965000 5.540000 1.099000  5.438000 1.153000  0.1012000      1.593000  
1 1 1 1  48 23 o 7.869000 0.5979000 7.533000 0.8082000 8.205000 0.8813000 -0.6728000     1.196000  
1 1 1 1  48 25 o 18.42000 0.3394000 18.15000 0.5070000 18.69000 0.4514000 -0.5335000     0.6788000 
1 1 1 1  48 27 o 10.75000 0.4662000 11.73000 0.5805000 9.770000 0.7296000 1.962000       0.9324000 
1 1 1 1  48 29 o 18.61000 0.3700000 18.58000 0.5639000 18.64000 0.4792000 -0.5928000E-01 0.7400000 
1 1 1 1  48 31 o 2.722000 0.8412000 2.905000 1.226000  2.539000 1.152000  0.3661000      1.682000  
1 1 1 1  48 33 o 3.711000 0.9153000 3.036000 1.232000  4.386000 1.354000  -1.351000      1.831000  
1 1 1 1  48 35 o 6.781000 0.7713000 5.876000 1.048000  7.687000 1.132000  -1.810000      1.543000  
1 1 1 1  48 37 o 4.127000 1.010000  3.409000 1.308000  4.844000 1.540000  -1.435000      2.020000  
1 1 1 1  48 39 o 3.660000 0.9342000 3.299000 1.315000  4.021000 1.328000  -0.7229000     1.868000  
1 1 1 1  48 41 o 3.606000 0.9387000 3.074000 1.312000  4.138000 1.343000  -1.065000      1.877000  
1 1 1 1  48 43 o 3.739000 0.9063000 4.368000 1.308000  3.109000 1.255000  1.260000       1.813000  
1 1 1 1  49 0  o 5.182000 1.396000  5.182000 1.396000  5.182000 1.396000  0.000000       0.000000  
1 1 1 1  49 2  o 6.647000 0.7149000 6.797000 0.8852000 6.497000 1.123000  0.2998000      1.430000  
1 1 1 1  49 4  o 9.173000 0.4660000 8.752000 0.6499000 9.594000 0.6679000 -0.8423000     0.9319000 
1 1 1 1  49 6  o 11.71000 0.4724000 10.98000 0.7660000 12.43000 0.5531000 -1.451000      0.9448000 
1 1 1 1  49 8  o 13.75000 0.3854000 13.99000 0.5725000 13.50000 0.5162000 0.4846000      0.7708000 
1 1 1 1  49 10 o 5.123000 0.8472000 4.983000 1.212000  5.262000 1.185000  -0.2788000     1.694000  
1 1 1 1  49 12 o 12.92000 0.4241000 13.15000 0.5506000 12.69000 0.6451000 0.4591000      0.8481000 
1 1 1 1  49 14 o 3.995000 0.9127000 3.935000 1.254000  4.056000 1.326000  -0.1208000     1.825000  
1 1 1 1  49 16 o 5.050000 0.8209000 6.178000 0.8412000 3.921000 1.410000  2.257000       1.642000  
1 1 1 1  49 18 o 19.59000 0.3108000 19.90000 0.4470000 19.29000 0.4319000 0.6147000      0.6216000 
1 1 1 1  49 20 o 13.19000 0.3718000 12.94000 0.5308000 13.44000 0.5206000 -0.4945000     0.7435000 
1 1 1 1  49 22 o 8.938000 0.5609000 9.235000 0.6989000 8.641000 0.8776000 0.5933000      1.122000  
1 1 1 1  49 24 o 4.271000 0.9098000 3.711000 1.377000  4.832000 1.189000  -1.121000      1.820000  
1 1 1 1  49 26 o 11.97000 0.4318000 11.46000 0.5696000 12.47000 0.6492000 -1.004000      0.8636000 
1 1 1 1  49 28 f 14.60000 0.4075000 14.28000 0.6430000 14.92000 0.5006000 -0.6432000     0.8149000 
1 1 1 1  49 30 o 8.190000 0.5855000 7.198000 0.9150000 9.183000 0.7308000 -1.985000      1.171000  
1 1 1 1  49 32 o 2.661000 0.8279000 2.887000 1.228000  2.435000 1.111000  0.4521000      1.656000  
1 1 1 1  49 34 o 2.789000 0.8950000 2.228000 1.044000  3.349000 1.454000  -1.121000      1.790000  
1 1 1 1  49 36 o 3.596000 0.9679000 3.609000 1.291000  3.583000 1.442000  0.2600000E-01  1.936000  
1 1 1 1  49 38 o 2.896000 0.8626000 2.655000 1.175000  3.138000 1.264000  -0.4831000     1.725000  
1 1 1 1  49 40 o 8.598000 0.7679000 9.408000 1.217000  7.789000 0.9374000 1.619000       1.536000  
1 1 1 1  49 42 o 2.847000 0.8568000 2.926000 1.220000  2.768000 1.204000  0.1582000      1.714000  
1 1 1 1  50 1  o 13.52000 0.4143000 13.05000 0.6281000 14.00000 0.5405000 -0.9450000     0.8286000 
1 1 1 1  50 3  o 8.986000 0.7244000 8.182000 1.308000  9.790000 0.6233000 -1.608000      1.449000  
1 1 1 1  50 5  o 2.833000 0.8458000 3.113000 1.263000  2.553000 1.125000  0.5596000      1.692000  
1 1 1 1  50 7  o 5.888000 0.7264000 4.872000 1.146000  6.904000 0.8929000 -2.032000      1.453000  
1 1 1 1  50 9  o 10.30000 0.5670000 10.60000 0.6807000 9.996000 0.9069000 0.6064000      1.134000  
1 1 1 1  50 11 o 11.24000 0.4040000 11.44000 0.5793000 11.04000 0.5634000 0.3979000      0.8081000 
1 1 1 1  50 13 o 14.85000 0.3746000 14.95000 0.5044000 14.76000 0.5540000 0.1823000      0.7492000 
1 1 1 1  50 15 o 8.673000 0.5180000 8.680000 0.6399000 8.667000 0.8148000 0.1342000E-01  1.036000  
1 1 1 1  50 17 o 2.919000 0.7941000 1.953000 0.9208000 3.885000 1.294000  -1.932000      1.588000  
1 1 1 1  50 19 o 7.246000 0.5650000 7.388000 0.7677000 7.104000 0.8292000 0.2834000      1.130000  
1 1 1 1  50 21 o 11.58000 0.4477000 11.60000 0.5698000 11.56000 0.6906000 0.4138000E-01  0.8953000 
1 1 1 1  50 23 o 5.698000 0.8422000 5.304000 1.330000  6.093000 1.034000  -0.7882000     1.684000  
1 1 1 1  50 25 o 6.896000 0.7336000 7.085000 1.033000  6.707000 1.042000  0.3783000      1.467000  
1 1 1 1  50 27 o 12.78000 0.4470000 12.57000 0.6893000 12.99000 0.5692000 -0.4228000     0.8939000 
1 1 1 1  50 29 o 10.72000 0.4565000 10.85000 0.6205000 10.59000 0.6698000 0.2638000      0.9131000 
1 1 1 1  50 31 o 11.42000 0.4454000 11.44000 0.6555000 11.40000 0.6033000 0.3911000E-01  0.8909000 
1 1 1 1  50 33 o 3.027000 0.9155000 3.109000 1.241000  2.945000 1.346000  0.1638000      1.831000  
1 1 1 1  50 35 o 4.505000 0.9622000 4.620000 1.318000  4.389000 1.402000  0.2312000      1.924000  
1 1 1 1  50 37 o 9.346000 0.6002000 8.642000 0.9446000 10.05000 0.7407000 -1.408000      1.200000  
1 1 1 1  50 39 o 6.858000 0.9029000 5.949000 1.517000  7.766000 0.9802000 -1.817000      1.806000  
1 1 1 1  50 41 o 3.762000 0.9167000 3.379000 1.259000  4.145000 1.332000  -0.7667000     1.833000  
1 1 1 1  51 0  o 16.64000 0.4929000 16.64000 0.4929000 16.64000 0.4929000 0.000000       0.000000  
1 1 1 1  51 2  f 5.708000 0.8219000 6.012000 1.258000  5.404000 1.058000  0.6077000      1.644000  
1 1 1 1  51 4  o 4.907000 0.9122000 4.361000 1.484000  5.452000 1.061000  -1.091000      1.824000  
1 1 1 1  51 6  o 4.509000 1.057000  4.708000 1.515000  4.310000 1.475000  0.3982000      2.115000  
1 1 1 1  51 8  o 7.626000 0.6008000 7.463000 0.8449000 7.788000 0.8542000 -0.3253000     1.202000  
1 1 1 1  51 10 o 9.561000 0.4765000 9.156000 0.6478000 9.966000 0.6989000 -0.8101000     0.9530000 
1 1 1 1  51 12 o 18.82000 0.3452000 19.15000 0.5220000 18.50000 0.4519000 0.6554000      0.6904000 
1 1 1 1  51 14 o 8.261000 0.5143000 8.789000 0.6099000 7.734000 0.8284000 1.056000       1.029000  
1 1 1 1  51 16 o 4.247000 0.8284000 5.054000 1.048000  3.440000 1.283000  1.614000       1.657000  
1 1 1 1  51 18 o 8.947000 0.4739000 9.272000 0.6541000 8.621000 0.6858000 0.6510000      0.9477000 
1 1 1 1  51 20 o 3.625000 0.8975000 3.076000 1.196000  4.175000 1.338000  -1.098000      1.795000  
1 1 1 1  51 22 o 6.435000 0.9074000 6.487000 1.543000  6.382000 0.9554000 0.1055000      1.815000  
1 1 1 1  51 24 o 7.900000 0.6682000 7.912000 0.9724000 7.888000 0.9166000 0.2463000E-01  1.336000  
1 1 1 1  51 26 o 7.225000 0.6184000 7.210000 0.8789000 7.240000 0.8700000 -0.3055000E-01 1.237000  
1 1 1 1  51 28 o 12.12000 0.4284000 12.00000 0.6025000 12.25000 0.6092000 -0.2469000     0.8568000 
1 1 1 1  51 30 f 7.605000 0.6282000 8.373000 0.7706000 6.837000 0.9924000 1.537000       1.256000  
1 1 1 1  51 32 o 3.696000 0.9541000 3.942000 1.309000  3.450000 1.388000  0.4920000      1.908000  
1 1 1 1  51 34 o 3.032000 0.8476000 2.520000 1.139000  3.543000 1.256000  -1.024000      1.695000  
1 1 1 1  51 36 f 3.128000 0.8860000 3.880000 1.372000  2.375000 1.122000  1.505000       1.772000  
1 1 1 1  51 38 o 3.842000 1.040000  3.872000 1.592000  3.812000 1.339000  0.5949000E-01  2.080000  
1 1 1 1  51 40 o 4.723000 1.004000  5.506000 1.388000  3.939000 1.451000  1.567000       2.008000  
1 1 1 1  52 1  o 11.70000 0.5001000 12.11000 0.6846000 11.28000 0.7292000 0.8354000      1.000000  
1 1 1 1  52 3  o 14.53000 0.4327000 14.31000 0.5933000 14.75000 0.6302000 -0.4352000     0.8655000 
1 1 1 1  52 5  o 4.142000 0.9132000 4.267000 1.275000  4.017000 1.308000  0.2497000      1.826000  
1 1 1 1  52 7  f 11.31000 0.4991000 11.02000 0.6847000 11.59000 0.7263000 -0.5745000     0.9982000 
1 1 1 1  52 9  o 16.70000 0.3687000 16.62000 0.5593000 16.79000 0.4805000 -0.1730000     0.7374000 
1 1 1 1  52 11 o 2.565000 0.8126000 2.968000 1.276000  2.162000 1.006000  0.8060000      1.625000  
1 1 1 1  52 13 o 17.42000 0.3431000 17.55000 0.5336000 17.29000 0.4312000 0.2594000      0.6861000 
1 1 1 1  52 15 o 6.025000 0.7855000 5.143000 1.238000  6.907000 0.9677000 -1.765000      1.571000  
1 1 1 1  52 17 o 6.894000 0.7190000 6.397000 1.185000  7.392000 0.8150000 -0.9950000     1.438000  
1 1 1 1  52 19 o 3.680000 0.9634000 3.450000 1.395000  3.911000 1.329000  -0.4614000     1.927000  
1 1 1 1  52 21 o 7.060000 0.7851000 7.106000 1.301000  7.015000 0.8795000 0.9105000E-01  1.570000  
1 1 1 1  52 23 o 12.90000 0.4070000 12.79000 0.5321000 13.01000 0.6161000 -0.2210000     0.8141000 
1 1 1 1  52 25 f 7.357000 0.6765000 6.258000 1.092000  8.456000 0.7983000 -2.198000      1.353000  
1 1 1 1  52 27 o 6.477000 0.6787000 6.115000 1.013000  6.838000 0.9033000 -0.7230000     1.357000  
1 1 1 1  52 29 o 5.820000 0.7554000 5.138000 1.226000  6.503000 0.8830000 -1.365000      1.511000  
1 1 1 1  52 31 o 3.920000 0.9994000 4.195000 1.341000  3.645000 1.482000  0.5492000      1.999000  
1 1 1 1  52 33 o 4.325000 0.9327000 3.116000 1.258000  5.533000 1.378000  -2.418000      1.865000  
1 1 1 1  52 35 o 3.611000 0.9619000 3.876000 1.422000  3.345000 1.295000  0.5313000      1.924000  
1 1 1 1  52 37 o 3.966000 1.092000  4.676000 1.742000  3.255000 1.318000  1.420000       2.185000  
1 1 1 1  52 39 o 4.115000 1.325000  4.514000 1.980000  3.717000 1.762000  0.7969000      2.650000  
1 1 1 1  53 0  o 7.818000 1.308000  7.818000 1.308000  7.818000 1.308000  0.000000       0.000000  
1 1 1 1  53 2  o 19.03000 0.4294000 19.52000 0.4830000 18.53000 0.7100000 0.9856000      0.8587000 
1 1 1 1  53 4  o 21.68000 0.4831000 22.22000 0.4532000 21.13000 0.8534000 1.091000       0.9663000 
1 1 1 1  53 6  o 5.833000 0.8447000 4.498000 1.419000  7.169000 0.9173000 -2.671000      1.689000  
1 1 1 1  53 8  f 6.276000 0.6461000 5.344000 1.021000  7.208000 0.7921000 -1.864000      1.292000  
1 1 1 1  53 10 o 5.807000 0.7313000 5.776000 1.036000  5.837000 1.032000  -0.6123000E-01 1.463000  
1 1 1 1  53 12 o 11.72000 0.3765000 11.34000 0.5282000 12.10000 0.5365000 -0.7577000     0.7529000 
1 1 1 1  53 14 o 7.309000 0.6524000 7.572000 0.8435000 7.046000 0.9954000 0.5257000      1.305000  
1 1 1 1  53 16 f 7.709000 0.6290000 7.512000 0.8323000 7.906000 0.9433000 -0.3945000     1.258000  
1 1 1 1  53 18 o 5.259000 0.9374000 6.238000 1.248000  4.280000 1.399000  1.958000       1.875000  
1 1 1 1  53 20 o 3.909000 0.9184000 4.301000 1.358000  3.517000 1.237000  0.7849000      1.837000  
1 1 1 1  53 22 o 7.907000 0.5807000 8.397000 0.7546000 7.417000 0.8828000 0.9808000      1.161000  
1 1 1 1  53 24 o 5.060000 0.8697000 5.485000 1.173000  4.636000 1.285000  0.8495000      1.739000  
1 1 1 1  53 26 o 12.86000 0.4211000 12.51000 0.5959000 13.22000 0.5951000 -0.7092000     0.8422000 
1 1 1 1  53 28 o 8.569000 0.5850000 8.761000 0.7654000 8.377000 0.8850000 0.3840000      1.170000  
1 1 1 1  53 30 o 3.813000 1.003000  3.681000 1.296000  3.944000 1.531000  -0.2626000     2.006000  
1 1 1 1  53 32 o 5.278000 0.9105000 6.366000 1.140000  4.190000 1.420000  2.176000       1.821000  
1 1 1 1  53 34 o 3.492000 0.9633000 4.141000 1.481000  2.843000 1.232000  1.298000       1.927000  
1 1 1 1  53 36 o 4.910000 1.119000  4.973000 1.769000  4.847000 1.370000  0.1260000      2.238000  
1 1 1 1  54 1  o 4.571000 0.8515000 3.295000 1.274000  5.847000 1.130000  -2.552000      1.703000  
1 1 1 1  54 3  o 11.09000 0.5738000 11.01000 0.8001000 11.17000 0.8228000 -0.1637000     1.148000  
1 1 1 1  54 5  o 3.644000 0.9898000 3.068000 1.250000  4.220000 1.535000  -1.151000      1.980000  
1 1 1 1  54 7  o 5.813000 0.8031000 5.092000 1.176000  6.533000 1.094000  -1.441000      1.606000  
1 1 1 1  54 9  o 3.335000 0.8502000 3.752000 1.236000  2.919000 1.168000  0.8323000      1.700000  
1 1 1 1  54 11 o 4.455000 0.7970000 5.537000 0.9716000 3.374000 1.264000  2.163000       1.594000  
1 1 1 1  54 13 o 3.285000 0.8584000 2.592000 1.118000  3.979000 1.303000  -1.386000      1.717000  
1 1 1 1  54 15 o 12.10000 0.4468000 12.75000 0.5133000 11.46000 0.7314000 1.294000       0.8936000 
1 1 1 1  54 17 o 12.71000 0.3886000 12.46000 0.5460000 12.97000 0.5530000 -0.5078000     0.7771000 
1 1 1 1  54 19 o 3.864000 0.8598000 4.748000 1.202000  2.979000 1.230000  1.769000       1.720000  
1 1 1 1  54 21 f 6.241000 0.7286000 5.238000 1.167000  7.243000 0.8724000 -2.005000      1.457000  
1 1 1 1  54 23 o 4.039000 0.9406000 4.257000 1.319000  3.820000 1.342000  0.4371000      1.881000  
1 1 1 1  54 25 o 3.967000 0.9547000 4.394000 1.297000  3.539000 1.402000  0.8555000      1.909000  
1 1 1 1  54 27 o 5.782000 0.9888000 5.977000 1.085000  5.588000 1.653000  0.3890000      1.978000  
1 1 1 1  54 29 o 4.533000 0.9926000 4.383000 1.395000  4.684000 1.412000  -0.3008000     1.985000  
1 1 1 1  54 31 o 9.091000 0.6180000 9.134000 0.7937000 9.047000 0.9476000 0.8717000E-01  1.236000  
1 1 1 1  54 33 o 6.288000 0.8399000 5.026000 1.384000  7.549000 0.9520000 -2.523000      1.680000  
1 1 1 1  54 35 o 4.805000 1.273000  5.065000 2.104000  4.546000 1.434000  0.5190000      2.547000  
1 1 1 1  55 0  o 3.595000 1.413000  3.595000 1.413000  3.595000 1.413000  0.000000       0.000000  
1 1 1 1  55 2  o 4.097000 0.8551000 3.038000 1.307000  5.155000 1.103000  -2.117000      1.710000  
1 1 1 1  55 4  o 2.805000 0.8405000 2.650000 1.179000  2.961000 1.199000  -0.3109000     1.681000  
1 1 1 1  55 6  o 3.205000 0.8746000 2.445000 1.111000  3.966000 1.351000  -1.521000      1.749000  
1 1 1 1  55 8  o 7.363000 1.022000  6.419000 1.522000  8.307000 1.363000  -1.888000      2.043000  
1 1 1 1  55 10 o 3.435000 0.9057000 3.592000 1.218000  3.277000 1.340000  0.3148000      1.811000  
1 1 1 1  55 12 o 3.961000 0.9288000 4.255000 1.274000  3.667000 1.352000  0.5883000      1.858000  
1 1 1 1  55 14 o 4.846000 0.9001000 3.864000 1.213000  5.828000 1.330000  -1.964000      1.800000  
1 1 1 1  55 16 o 12.30000 0.4327000 12.35000 0.5920000 12.24000 0.6312000 0.1086000      0.8654000 
1 1 1 1  55 18 o 4.664000 0.8500000 4.822000 1.215000  4.507000 1.190000  0.3149000      1.700000  
1 1 1 1  55 20 o 7.695000 0.5757000 8.437000 0.7447000 6.953000 0.8782000 1.484000       1.151000  
1 1 1 1  55 22 o 9.476000 0.5893000 10.33000 0.6847000 8.622000 0.9594000 1.707000       1.179000  
1 1 1 1  55 24 o 10.64000 0.5917000 10.73000 0.6478000 10.54000 0.9902000 0.1846000      1.183000  
1 1 1 1  55 26 o 4.641000 0.8900000 6.029000 1.070000  3.253000 1.422000  2.776000       1.780000  
1 1 1 1  55 28 o 3.546000 0.9279000 2.878000 1.216000  4.214000 1.402000  -1.336000      1.856000  
1 1 1 1  55 30 o 8.038000 0.7057000 7.422000 1.012000  8.654000 0.9834000 -1.231000      1.411000  
1 1 1 1  55 32 o 4.210000 0.9970000 5.049000 1.485000  3.371000 1.331000  1.678000       1.994000  
1 1 1 1  56 1  o 3.290000 0.9077000 3.189000 1.307000  3.390000 1.260000  -0.2018000     1.815000  
1 1 1 1  56 3  f 11.52000 0.4633000 11.55000 0.6460000 11.48000 0.6643000 0.6222000E-01  0.9266000 
1 1 1 1  56 5  o 7.135000 0.6814000 7.066000 0.9121000 7.204000 1.013000  -0.1382000     1.363000  
1 1 1 1  56 7  o 6.718000 0.6652000 6.620000 0.9940000 6.817000 0.8842000 -0.1974000     1.330000  
1 1 1 1  56 9  o 8.557000 0.5431000 8.800000 0.6693000 8.314000 0.8554000 0.4863000      1.086000  
1 1 1 1  56 11 o 6.888000 0.9132000 7.444000 1.007000  6.332000 1.523000  1.113000       1.826000  
1 1 1 1  56 13 o 4.511000 1.286000  4.511000 1.286000  ?        ?         ?              ?         
1 1 1 1  56 15 o 5.770000 1.026000  4.830000 1.028000  6.710000 1.776000  -1.881000      2.053000  
1 1 1 1  56 17 o 5.860000 1.063000  5.577000 1.109000  6.144000 1.814000  -0.5662000     2.126000  
1 1 1 1  56 19 o 4.440000 0.9576000 5.501000 1.249000  3.379000 1.452000  2.122000       1.915000  
1 1 1 1  56 21 o 6.900000 0.8944000 8.159000 0.8031000 5.641000 1.598000  2.518000       1.789000  
1 1 1 1  56 23 o 7.828000 0.7873000 8.130000 0.8331000 7.527000 1.336000  0.6036000      1.575000  
1 1 1 1  56 25 o 4.611000 0.9287000 4.809000 1.267000  4.413000 1.358000  0.3961000      1.857000  
1 1 1 1  56 27 o 3.924000 0.9220000 4.732000 1.324000  3.116000 1.283000  1.616000       1.844000  
1 1 1 1  56 29 o 3.519000 0.9706000 3.593000 1.332000  3.445000 1.412000  0.1481000      1.941000  
1 1 1 1  56 31 o 3.906000 0.9963000 4.365000 1.480000  3.446000 1.334000  0.9199000      1.993000  
1 1 1 1  57 0  o 4.035000 1.280000  4.035000 1.280000  4.035000 1.280000  0.000000       0.000000  
1 1 1 1  57 2  o 3.606000 0.8955000 3.007000 1.254000  4.204000 1.278000  -1.197000      1.791000  
1 1 1 1  57 4  o 5.068000 0.8437000 6.436000 1.058000  3.699000 1.315000  2.737000       1.687000  
1 1 1 1  57 6  o 10.21000 0.4658000 10.60000 0.6473000 9.822000 0.6699000 0.7795000      0.9316000 
1 1 1 1  57 8  o 3.537000 0.8952000 2.602000 1.127000  4.473000 1.392000  -1.871000      1.790000  
1 1 1 1  57 10 o 7.477000 0.6419000 7.179000 0.9233000 7.775000 0.8920000 -0.5966000     1.284000  
1 1 1 1  57 12 o 8.962000 0.6193000 9.202000 0.7083000 8.721000 1.016000  0.4803000      1.239000  
1 1 1 1  57 14 o 7.381000 0.7196000 6.621000 1.007000  8.141000 1.028000  -1.520000      1.439000  
1 1 1 1  57 16 o 3.975000 0.9715000 3.010000 1.283000  4.940000 1.459000  -1.930000      1.943000  
1 1 1 1  57 18 o 4.605000 0.9585000 5.003000 1.303000  4.207000 1.406000  0.7961000      1.917000  
1 1 1 1  57 20 o 4.281000 0.9058000 5.023000 1.297000  3.538000 1.265000  1.486000       1.812000  
1 1 1 1  57 22 o 3.459000 0.9158000 3.768000 1.308000  3.149000 1.283000  0.6189000      1.832000  
1 1 1 1  57 24 o 4.029000 0.9549000 3.938000 1.350000  4.119000 1.351000  -0.1807000     1.910000  
1 1 1 1  57 26 o 5.356000 0.8558000 5.342000 1.166000  5.369000 1.253000  -0.2707000E-01 1.712000  
1 1 1 1  57 28 o 11.02000 0.5223000 11.68000 0.6454000 10.37000 0.8214000 1.307000       1.045000  
1 1 1 1  58 1  o 10.20000 0.4791000 9.880000 0.7064000 10.52000 0.6473000 -0.6379000     0.9581000 
1 1 1 1  58 3  o 9.211000 0.5308000 8.587000 0.7850000 9.835000 0.7147000 -1.247000      1.062000  
1 1 1 1  58 5  o 3.677000 0.8897000 4.266000 1.311000  3.089000 1.203000  1.177000       1.779000  
1 1 1 1  58 7  o 6.200000 0.7818000 6.240000 1.172000  6.160000 1.034000  0.7994000E-01  1.564000  
1 1 1 1  58 9  o 4.282000 0.8763000 4.392000 1.204000  4.172000 1.273000  0.2203000      1.753000  
1 1 1 1  58 11 o 6.013000 0.7088000 5.374000 1.048000  6.652000 0.9548000 -1.279000      1.418000  
1 1 1 1  58 13 o 4.979000 0.9200000 3.486000 1.306000  6.471000 1.296000  -2.985000      1.840000  
1 1 1 1  58 15 o 9.007000 0.5468000 9.231000 0.7277000 8.782000 0.8164000 0.4488000      1.094000  
1 1 1 1  58 17 o 5.075000 0.8896000 4.698000 1.357000  5.452000 1.151000  -0.7543000     1.779000  
1 1 1 1  58 19 o 4.947000 0.8939000 4.662000 1.287000  5.231000 1.240000  -0.5694000     1.788000  
1 1 1 1  58 21 o 5.005000 0.9221000 4.236000 1.443000  5.774000 1.148000  -1.538000      1.844000  
1 1 1 1  58 23 o 3.187000 0.9183000 3.031000 1.311000  3.343000 1.287000  -0.3124000     1.837000  
1 1 1 1  58 25 o 3.312000 0.8994000 3.791000 1.321000  2.834000 1.221000  0.9573000      1.799000  
1 1 1 1  58 27 o 8.171000 1.295000  6.525000 2.071000  9.816000 1.557000  -3.291000      2.591000  
1 1 1 1  59 0  o 2.982000 1.227000  2.982000 1.227000  2.982000 1.227000  0.000000       0.000000  
1 1 1 1  59 2  o 6.515000 0.6722000 6.402000 1.003000  6.629000 0.8954000 -0.2267000     1.344000  
1 1 1 1  59 4  o 4.393000 0.8577000 5.013000 1.148000  3.773000 1.275000  1.240000       1.715000  
1 1 1 1  59 6  o 3.677000 0.9004000 3.714000 1.284000  3.640000 1.263000  0.7388000E-01  1.801000  
1 1 1 1  59 8  o 3.209000 0.8903000 3.625000 1.317000  2.793000 1.199000  0.8319000      1.781000  
1 1 1 1  59 10 f 3.551000 0.9171000 3.245000 1.288000  3.857000 1.306000  -0.6123000     1.834000  
1 1 1 1  59 12 o 5.061000 0.9554000 5.096000 1.376000  5.026000 1.326000  0.6978000E-01  1.911000  
1 1 1 1  59 14 o 3.020000 0.8330000 3.558000 1.217000  2.483000 1.137000  1.075000       1.666000  
1 1 1 1  59 16 o 3.919000 0.9460000 4.396000 1.377000  3.442000 1.298000  0.9544000      1.892000  
1 1 1 1  59 18 o 6.704000 0.7443000 6.675000 1.019000  6.732000 1.085000  -0.5704000E-01 1.489000  
1 1 1 1  59 20 o 3.346000 0.9285000 2.826000 1.213000  3.866000 1.406000  -1.040000      1.857000  
1 1 1 1  59 22 o 4.089000 0.9085000 4.905000 1.274000  3.273000 1.295000  1.632000       1.817000  
1 1 1 1  59 24 o 2.999000 0.9701000 2.700000 1.282000  3.298000 1.456000  -0.5980000     1.940000  
1 1 1 1  60 1  o 3.335000 0.9031000 3.295000 1.268000  3.376000 1.287000  -0.8131000E-01 1.806000  
1 1 1 1  60 3  o 6.640000 0.6798000 6.627000 0.9569000 6.652000 0.9660000 -0.2521000E-01 1.360000  
1 1 1 1  60 5  o 7.049000 0.6290000 6.956000 0.9238000 7.143000 0.8539000 -0.1866000     1.258000  
1 1 1 1  60 7  o 7.172000 0.6884000 7.125000 0.9375000 7.219000 1.008000  -0.9343000E-01 1.377000  
1 1 1 1  60 9  o 3.833000 0.8889000 3.261000 1.258000  4.406000 1.256000  -1.145000      1.778000  
1 1 1 1  60 11 o 2.683000 0.8341000 2.322000 1.074000  3.044000 1.277000  -0.7216000     1.668000  
1 1 1 1  60 13 o 6.928000 0.7362000 7.655000 0.8696000 6.201000 1.188000  1.454000       1.472000  
1 1 1 1  60 15 o 3.991000 0.9115000 5.063000 1.373000  2.919000 1.199000  2.144000       1.823000  
1 1 1 1  60 17 o 2.998000 0.8942000 3.148000 1.312000  2.847000 1.215000  0.3010000      1.788000  
1 1 1 1  60 19 o 5.223000 0.9182000 5.167000 1.417000  5.280000 1.168000  -0.1136000     1.836000  
1 1 1 1  60 21 o 4.110000 1.117000  3.520000 1.527000  4.700000 1.630000  -1.180000      2.233000  
1 1 1 1  61 0  o 3.669000 1.279000  3.669000 1.279000  3.669000 1.279000  0.000000       0.000000  
1 1 1 1  61 2  f 2.670000 0.8198000 2.657000 1.167000  2.682000 1.151000  -0.2481000E-01 1.640000  
1 1 1 1  61 4  o 4.261000 0.9569000 4.255000 1.279000  4.267000 1.423000  -0.1191000E-01 1.914000  
1 1 1 1  61 6  o 11.20000 0.4590000 11.33000 0.6562000 11.06000 0.6421000 0.2702000      0.9181000 
1 1 1 1  61 8  o 8.774000 0.5692000 9.144000 0.8424000 8.405000 0.7658000 0.7392000      1.138000  
1 1 1 1  61 10 o 3.380000 0.8720000 2.818000 1.223000  3.941000 1.243000  -1.123000      1.744000  
1 1 1 1  61 12 o 3.792000 0.8957000 3.503000 1.137000  4.081000 1.384000  -0.5774000     1.791000  
1 1 1 1  61 14 o 6.063000 0.8740000 5.080000 1.342000  7.046000 1.121000  -1.965000      1.748000  
1 1 1 1  61 16 o 3.118000 0.8793000 3.176000 1.264000  3.061000 1.222000  0.1152000      1.759000  
1 1 1 1  62 1  o 3.608000 0.8964000 3.905000 1.297000  3.311000 1.238000  0.5941000      1.793000  
1 1 1 1  62 3  o 2.792000 0.8496000 2.486000 1.115000  3.097000 1.283000  -0.6115000     1.699000  
1 1 1 1  62 5  o 4.434000 0.8795000 5.039000 1.206000  3.829000 1.281000  1.210000       1.759000  
1 1 1 1  62 7  o 3.437000 0.8719000 2.627000 1.187000  4.247000 1.277000  -1.621000      1.744000  
1 1 1 1  62 9  o 3.334000 0.9174000 3.756000 1.371000  2.912000 1.219000  0.8437000      1.835000  
1 1 1 1  62 11 o 6.401000 0.7494000 5.988000 1.032000  6.814000 1.087000  -0.8262000     1.499000  
1 1 1 1  62 13 o 6.970000 1.198000  7.623000 1.648000  6.317000 1.740000  1.305000       2.396000  
1 1 1 1  63 0  o 4.234000 1.404000  4.234000 1.404000  4.234000 1.404000  0.000000       0.000000  
1 1 1 1  63 2  o 5.474000 1.096000  4.921000 1.598000  6.027000 1.500000  -1.106000      2.192000  
1 1 1 1  63 4  o 5.616000 0.9039000 3.484000 1.373000  7.747000 1.176000  -4.263000      1.808000  
1 1 1 2  0  0  o 84.85000 1.630000  84.85000 1.630000  84.85000 1.630000  0.000000       0.000000  
1 1 1 2  0  2  o 26.07000 0.2589000 26.07000 0.2589000 26.07000 0.2589000 0.000000       0.000000  
1 1 1 2  0  4  o 46.83000 0.4550000 46.83000 0.4550000 46.83000 0.4550000 0.000000       0.000000  
1 1 1 2  0  6  o 16.93000 0.1968000 16.93000 0.1968000 16.93000 0.1968000 0.000000       0.000000  
1 1 1 2  0  8  o 9.271000 0.2247000 9.271000 0.2247000 9.271000 0.2247000 0.000000       0.000000  
1 1 1 2  0  10 o 33.47000 0.3422000 33.47000 0.3422000 33.47000 0.3422000 0.000000       0.000000  
1 1 1 2  0  12 o 7.778000 0.3191000 7.778000 0.3191000 7.778000 0.3191000 0.000000       0.000000  
1 1 1 2  0  14 o 28.12000 0.3554000 28.12000 0.3554000 28.12000 0.3554000 0.000000       0.000000  
1 1 1 2  0  16 o 38.16000 0.4575000 38.16000 0.4575000 38.16000 0.4575000 0.000000       0.000000  
1 1 1 2  0  18 o 5.767000 0.5503000 5.767000 0.5503000 5.767000 0.5503000 0.000000       0.000000  
1 1 1 2  0  20 o 187.2000 1.799000  187.2000 1.799000  187.2000 1.799000  0.000000       0.000000  
1 1 1 2  0  22 o 121.0000 1.170000  121.0000 1.170000  121.0000 1.170000  0.000000       0.000000  
1 1 1 2  0  24 o 9.335000 0.5119000 9.335000 0.5119000 9.335000 0.5119000 0.000000       0.000000  
1 1 1 2  0  26 o 39.94000 0.4496000 39.94000 0.4496000 39.94000 0.4496000 0.000000       0.000000  
1 1 1 2  0  28 o 70.06000 0.8092000 70.06000 0.8092000 70.06000 0.8092000 0.000000       0.000000  
1 1 1 2  0  30 o 11.02000 0.6510000 11.02000 0.6510000 11.02000 0.6510000 0.000000       0.000000  
1 1 1 2  0  32 o 25.21000 0.4733000 25.21000 0.4733000 25.21000 0.4733000 0.000000       0.000000  
1 1 1 2  0  34 o 17.79000 0.5282000 17.79000 0.5282000 17.79000 0.5282000 0.000000       0.000000  
1 1 1 2  0  36 o 39.70000 0.4665000 39.70000 0.4665000 39.70000 0.4665000 0.000000       0.000000  
1 1 1 2  0  38 o 43.32000 0.4933000 43.32000 0.4933000 43.32000 0.4933000 0.000000       0.000000  
1 1 1 2  0  40 o 10.09000 0.8269000 10.09000 0.8269000 10.09000 0.8269000 0.000000       0.000000  
1 1 1 2  0  42 o 10.31000 1.110000  10.31000 1.110000  10.31000 1.110000  0.000000       0.000000  
1 1 1 2  0  44 o 49.16000 0.7944000 49.16000 0.7944000 49.16000 0.7944000 0.000000       0.000000  
1 1 1 2  0  46 f 20.77000 0.5190000 20.77000 0.5190000 20.77000 0.5190000 0.000000       0.000000  
1 1 1 2  0  48 o 3.061000 1.358000  3.061000 1.358000  3.061000 1.358000  0.000000       0.000000  
1 1 1 2  0  50 o 8.334000 1.203000  8.334000 1.203000  8.334000 1.203000  0.000000       0.000000  
1 1 1 2  0  52 o 37.29000 0.5629000 37.29000 0.5629000 37.29000 0.5629000 0.000000       0.000000  
1 1 1 2  0  54 o 35.57000 0.5610000 35.57000 0.5610000 35.57000 0.5610000 0.000000       0.000000  
1 1 1 2  0  56 o 5.494000 1.449000  5.494000 1.449000  5.494000 1.449000  0.000000       0.000000  
1 1 1 2  0  58 o 17.53000 0.5795000 17.53000 0.5795000 17.53000 0.5795000 0.000000       0.000000  
1 1 1 2  0  60 o 2.645000 1.207000  2.645000 1.207000  2.645000 1.207000  0.000000       0.000000  
1 1 1 2  0  62 o 4.797000 1.396000  4.797000 1.396000  4.797000 1.396000  0.000000       0.000000  
1 1 1 2  0  64 o 4.000000 1.592000  4.000000 1.592000  4.000000 1.592000  0.000000       0.000000  
1 1 1 2  0  66 o 3.418000 1.445000  3.418000 1.445000  3.418000 1.445000  0.000000       0.000000  
1 1 1 2  0  68 o 3.497000 1.375000  3.497000 1.375000  3.497000 1.375000  0.000000       0.000000  
1 1 1 2  1  1  o 48.41000 0.3824000 47.63000 0.5316000 49.18000 0.5498000 -1.549000      0.7647000 
1 1 1 2  1  3  o 53.35000 0.3944000 53.03000 0.5128000 53.67000 0.5993000 -0.6356000     0.7887000 
1 1 1 2  1  5  o 49.88000 0.3434000 49.70000 0.4839000 50.06000 0.4872000 -0.3646000     0.6867000 
1 1 1 2  1  7  o 47.71000 0.3306000 47.55000 0.4661000 47.87000 0.4692000 -0.3245000     0.6613000 
1 1 1 2  1  9  o 123.6000 0.8406000 123.2000 1.185000  124.1000 1.193000  -0.8878000     1.681000  
1 1 1 2  1  11 o 106.6000 0.7268000 105.4000 1.017000  107.8000 1.039000  -2.368000      1.454000  
1 1 1 2  1  13 o 45.01000 0.3894000 44.76000 0.6332000 45.25000 0.4534000 -0.4889000     0.7788000 
1 1 1 2  1  15 o 75.98000 0.5235000 75.52000 0.7363000 76.44000 0.7444000 -0.9187000     1.047000  
1 1 1 2  1  17 o 30.58000 0.2556000 31.00000 0.3402000 30.15000 0.3816000 0.8427000      0.5112000 
1 1 1 2  1  19 o 45.33000 0.3283000 44.98000 0.4610000 45.67000 0.4675000 -0.6881000     0.6566000 
1 1 1 2  1  21 o 15.81000 0.2228000 15.44000 0.3130000 16.19000 0.3172000 -0.7552000     0.4456000 
1 1 1 2  1  23 o 79.22000 0.5502000 79.52000 0.7807000 78.92000 0.7755000 0.5964000      1.100000  
1 1 1 2  1  25 o 65.99000 0.4664000 66.24000 0.6616000 65.74000 0.6577000 0.5056000      0.9329000 
1 1 1 2  1  27 o 68.86000 0.5618000 68.60000 0.7916000 69.12000 0.7974000 -0.5166000     1.124000  
1 1 1 2  1  29 o 56.19000 0.4436000 56.17000 0.5806000 56.21000 0.6709000 -0.3945000E-01 0.8872000 
1 1 1 2  1  31 o 21.41000 0.3840000 21.19000 0.4829000 21.64000 0.5972000 -0.4480000     0.7680000 
1 1 1 2  1  33 o 43.55000 0.3462000 43.38000 0.4903000 43.72000 0.4889000 -0.3414000     0.6924000 
1 1 1 2  1  35 o 87.66000 0.6142000 89.12000 0.8817000 86.21000 0.8552000 2.915000       1.228000  
1 1 1 2  1  37 o 38.88000 0.3823000 38.98000 0.5428000 38.78000 0.5384000 0.2005000      0.7645000 
1 1 1 2  1  39 o 71.63000 0.5571000 72.07000 0.8474000 71.20000 0.7236000 0.8663000      1.114000  
1 1 1 2  1  41 o 29.86000 0.3778000 30.42000 0.6179000 29.29000 0.4349000 1.137000       0.7556000 
1 1 1 2  1  43 o 31.92000 0.3761000 32.59000 0.5381000 31.26000 0.5257000 1.335000       0.7523000 
1 1 1 2  1  45 o 4.019000 1.075000  4.696000 1.625000  3.342000 1.407000  1.355000       2.149000  
1 1 1 2  1  47 o 27.27000 0.3370000 27.30000 0.4788000 27.24000 0.4743000 0.6413000E-01  0.6740000 
1 1 1 2  1  49 f 30.13000 0.3860000 30.01000 0.5466000 30.25000 0.5453000 -0.2461000     0.7721000 
1 1 1 2  1  51 o 24.84000 0.3368000 25.11000 0.4715000 24.58000 0.4811000 0.5310000      0.6736000 
1 1 1 2  1  53 o 4.355000 1.160000  4.242000 1.691000  4.467000 1.587000  -0.2251000     2.319000  
1 1 1 2  1  55 o 11.64000 0.5295000 12.49000 0.6893000 10.79000 0.8039000 1.698000       1.059000  
1 1 1 2  1  57 o 14.61000 0.4392000 15.54000 0.5846000 13.68000 0.6556000 1.857000       0.8784000 
1 1 1 2  1  59 o 6.501000 0.8533000 6.285000 1.275000  6.717000 1.135000  -0.4315000     1.707000  
1 1 1 2  1  61 o 4.384000 1.018000  4.605000 1.406000  4.163000 1.473000  0.4420000      2.036000  
1 1 1 2  1  63 f 19.51000 0.4554000 19.93000 0.7236000 19.09000 0.5530000 0.8367000      0.9107000 
1 1 1 2  1  65 o 4.399000 1.074000  3.485000 1.427000  5.313000 1.606000  -1.828000      2.148000  
1 1 1 2  1  67 o 3.575000 1.005000  3.585000 1.428000  3.564000 1.414000  0.2082000E-01  2.010000  
1 1 1 2  2  0  o 118.1000 1.308000  118.1000 1.308000  118.1000 1.308000  0.000000       0.000000  
1 1 1 2  2  2  o 94.24000 0.6917000 93.75000 0.9003000 94.74000 1.050000  -0.9955000     1.383000  
1 1 1 2  2  4  o 39.36000 0.2730000 39.90000 0.3911000 38.83000 0.3811000 1.064000       0.5460000 
1 1 1 2  2  6  o 77.14000 0.5680000 77.24000 0.8595000 77.04000 0.7428000 0.2001000      1.136000  
1 1 1 2  2  8  f 103.2000 0.7021000 103.5000 0.9963000 102.8000 0.9897000 0.6775000      1.404000  
1 1 1 2  2  10 o 46.85000 0.3281000 46.67000 0.4627000 47.02000 0.4652000 -0.3548000     0.6561000 
1 1 1 2  2  12 o 64.52000 0.5150000 64.15000 0.7245000 64.89000 0.7319000 -0.7471000     1.030000  
1 1 1 2  2  14 o 54.28000 0.4107000 54.27000 0.5375000 54.30000 0.6210000 -0.3227000E-01 0.8213000 
1 1 1 2  2  16 o 35.63000 0.3064000 35.84000 0.4352000 35.42000 0.4315000 0.4125000      0.6128000 
1 1 1 2  2  18 o 45.23000 0.3537000 44.71000 0.5319000 45.76000 0.4664000 -1.056000      0.7074000 
1 1 1 2  2  20 o 110.3000 0.7553000 109.5000 1.061000  111.1000 1.075000  -1.650000      1.511000  
1 1 1 2  2  22 o 16.19000 0.2345000 16.56000 0.3286000 15.82000 0.3347000 0.7400000      0.4691000 
1 1 1 2  2  24 o 48.71000 0.3582000 48.84000 0.5085000 48.58000 0.5046000 0.2617000      0.7163000 
1 1 1 2  2  26 o 20.67000 0.3136000 20.13000 0.4466000 21.21000 0.4405000 -1.083000      0.6272000 
1 1 1 2  2  28 o 25.12000 0.3350000 25.09000 0.5390000 25.15000 0.3978000 -0.6194000E-01 0.6699000 
1 1 1 2  2  30 o 65.00000 0.5044000 64.75000 0.7610000 65.26000 0.6620000 -0.5020000     1.009000  
1 1 1 2  2  32 o 94.84000 0.7130000 95.14000 1.081000  94.54000 0.9301000 0.5922000      1.426000  
1 1 1 2  2  34 o 109.7000 0.7578000 109.3000 1.067000  110.1000 1.076000  -0.8203000     1.516000  
1 1 1 2  2  36 o 47.06000 0.3653000 46.68000 0.5124000 47.44000 0.5209000 -0.7561000     0.7307000 
1 1 1 2  2  38 o 42.77000 0.4008000 43.09000 0.5738000 42.45000 0.5597000 0.6386000      0.8015000 
1 1 1 2  2  40 o 16.80000 0.3853000 16.80000 0.5053000 16.81000 0.5818000 -0.4013000E-02 0.7706000 
1 1 1 2  2  42 o 52.22000 0.4355000 52.61000 0.5742000 51.83000 0.6549000 0.7795000      0.8710000 
1 1 1 2  2  44 o 38.94000 0.4240000 38.27000 0.4891000 39.61000 0.6928000 -1.340000      0.8481000 
1 1 1 2  2  46 o 14.40000 0.5443000 13.92000 0.7614000 14.87000 0.7781000 -0.9492000     1.089000  
1 1 1 2  2  48 o 25.80000 0.3616000 25.67000 0.5477000 25.93000 0.4723000 -0.2620000     0.7232000 
1 1 1 2  2  50 o 33.06000 0.3375000 33.25000 0.4783000 32.86000 0.4762000 0.3927000      0.6750000 
1 1 1 2  2  52 o 23.59000 0.3792000 23.45000 0.5028000 23.73000 0.5678000 -0.2735000     0.7584000 
1 1 1 2  2  54 o 24.47000 0.3966000 24.30000 0.5611000 24.63000 0.5607000 -0.3300000     0.7932000 
1 1 1 2  2  56 o 16.36000 0.4455000 16.21000 0.6730000 16.51000 0.5840000 -0.2944000     0.8910000 
1 1 1 2  2  58 o 24.38000 0.3453000 24.70000 0.4841000 24.07000 0.4926000 0.6335000      0.6907000 
1 1 1 2  2  60 o 10.46000 0.5520000 10.22000 0.7980000 10.70000 0.7629000 -0.4891000     1.104000  
1 1 1 2  2  62 o 9.088000 0.7415000 8.948000 0.9716000 9.229000 1.120000  -0.2809000     1.483000  
1 1 1 2  2  64 f 11.47000 0.6437000 11.71000 0.9581000 11.22000 0.8599000 0.4903000      1.287000  
1 1 1 2  2  66 o 6.622000 0.9622000 6.052000 1.470000  7.193000 1.242000  -1.141000      1.924000  
1 1 1 2  2  68 o 4.526000 1.003000  3.485000 1.400000  5.566000 1.437000  -2.081000      2.007000  
1 1 1 2  3  1  o 127.0000 0.9963000 128.1000 1.424000  125.8000 1.393000  2.259000       1.993000  
1 1 1 2  3  3  o 80.64000 0.6342000 81.45000 0.9059000 79.83000 0.8877000 1.617000       1.268000  
1 1 1 2  3  5  o 103.6000 0.7041000 103.7000 0.9966000 103.5000 0.9949000 0.2202000      1.408000  
1 1 1 2  3  7  o 173.9000 1.400000  175.2000 2.376000  172.6000 1.482000  2.542000       2.801000  
1 1 1 2  3  9  o 37.31000 0.2659000 37.42000 0.3773000 37.21000 0.3748000 0.2117000      0.5319000 
1 1 1 2  3  11 o 141.9000 0.9645000 142.7000 1.371000  141.1000 1.357000  1.638000       1.929000  
1 1 1 2  3  13 o 47.49000 0.4078000 47.00000 0.6604000 47.98000 0.4785000 -0.9800000     0.8156000 
1 1 1 2  3  15 o 35.46000 0.3036000 35.18000 0.4262000 35.74000 0.4325000 -0.5578000     0.6072000 
1 1 1 2  3  17 o 18.34000 0.2031000 18.86000 0.2640000 17.83000 0.3088000 1.023000       0.4063000 
1 1 1 2  3  19 o 41.00000 0.3275000 41.51000 0.4997000 40.50000 0.4233000 1.007000       0.6549000 
1 1 1 2  3  21 o 115.7000 0.7920000 114.2000 1.106000  117.3000 1.134000  -3.056000      1.584000  
1 1 1 2  3  23 o 111.3000 0.7633000 111.7000 1.084000  110.9000 1.075000  0.7623000      1.527000  
1 1 1 2  3  25 o 66.38000 0.4696000 66.33000 0.6635000 66.42000 0.6647000 -0.9010000E-01 0.9391000 
1 1 1 2  3  27 o 34.09000 0.3560000 34.62000 0.5786000 33.55000 0.4151000 1.073000       0.7121000 
1 1 1 2  3  29 o 68.80000 0.5286000 68.11000 0.6857000 69.49000 0.8046000 -1.377000      1.057000  
1 1 1 2  3  31 o 26.65000 0.3783000 26.23000 0.4792000 27.08000 0.5856000 -0.8518000     0.7567000 
1 1 1 2  3  33 o 44.82000 0.4078000 45.25000 0.5842000 44.38000 0.5692000 0.8672000      0.8157000 
1 1 1 2  3  35 o 100.5000 0.7528000 100.3000 1.136000  100.6000 0.9874000 -0.2722000     1.506000  
1 1 1 2  3  37 o 9.120000 0.5184000 8.851000 0.7415000 9.388000 0.7247000 -0.5369000     1.037000  
1 1 1 2  3  39 o 39.22000 0.3341000 39.09000 0.4691000 39.35000 0.4759000 -0.2592000     0.6683000 
1 1 1 2  3  41 o 27.79000 0.4446000 26.73000 0.6063000 28.85000 0.6503000 -2.125000      0.8891000 
1 1 1 2  3  43 o 42.43000 0.4149000 43.64000 0.5946000 41.23000 0.5789000 2.403000       0.8299000 
1 1 1 2  3  45 o 18.88000 0.4918000 18.89000 0.7794000 18.86000 0.6000000 0.2756000E-01  0.9836000 
1 1 1 2  3  47 o 15.45000 0.4433000 16.04000 0.5709000 14.86000 0.6784000 1.177000       0.8867000 
1 1 1 2  3  49 o 18.54000 0.3936000 18.16000 0.5689000 18.91000 0.5441000 -0.7412000     0.7872000 
1 1 1 2  3  51 o 32.55000 0.3639000 32.59000 0.4777000 32.50000 0.5491000 0.9239000E-01  0.7278000 
1 1 1 2  3  53 o 5.903000 0.9912000 6.447000 1.412000  5.358000 1.392000  1.089000       1.982000  
1 1 1 2  3  55 o 12.60000 0.6156000 12.30000 0.7110000 12.91000 1.005000  -0.6113000     1.231000  
1 1 1 2  3  57 o 17.40000 0.4478000 17.55000 0.6264000 17.25000 0.6400000 0.3053000      0.8955000 
1 1 1 2  3  59 o 5.658000 0.9675000 5.259000 1.442000  6.057000 1.291000  -0.7981000     1.935000  
1 1 1 2  3  61 o 8.577000 0.6564000 8.812000 0.8526000 8.342000 0.9983000 0.4703000      1.313000  
1 1 1 2  3  63 o 3.300000 1.027000  4.058000 1.679000  2.543000 1.183000  1.515000       2.054000  
1 1 1 2  3  65 o 4.396000 1.088000  4.105000 1.548000  4.686000 1.528000  -0.5808000     2.175000  
1 1 1 2  3  67 f 3.593000 0.9723000 2.546000 1.175000  4.641000 1.550000  -2.095000      1.945000  
1 1 1 2  4  0  o 46.17000 0.5184000 46.17000 0.5184000 46.17000 0.5184000 0.000000       0.000000  
1 1 1 2  4  2  o 78.10000 0.6141000 77.90000 0.8661000 78.30000 0.8708000 -0.4076000     1.228000  
1 1 1 2  4  4  o 63.17000 0.4996000 63.15000 0.7061000 63.19000 0.7069000 -0.4299000E-01 0.9992000 
1 1 1 2  4  6  o 105.9000 0.7196000 106.2000 1.021000  105.5000 1.014000  0.6817000      1.439000  
1 1 1 2  4  8  f 93.05000 0.6548000 93.06000 1.034000  93.05000 0.8032000 0.1375000E-01  1.310000  
1 1 1 2  4  10 o 33.60000 0.2448000 33.41000 0.3443000 33.78000 0.3481000 -0.3711000     0.4896000 
1 1 1 2  4  12 o 25.46000 0.2573000 25.80000 0.3987000 25.12000 0.3252000 0.6766000      0.5145000 
1 1 1 2  4  14 o 57.83000 0.4041000 57.95000 0.5730000 57.72000 0.5701000 0.2311000      0.8083000 
1 1 1 2  4  16 o 37.56000 0.3390000 37.58000 0.3933000 37.53000 0.5523000 0.5001000E-01  0.6781000 
1 1 1 2  4  18 o 88.03000 0.6053000 87.94000 0.8556000 88.13000 0.8565000 -0.1942000     1.211000  
1 1 1 2  4  20 o 53.06000 0.3790000 52.98000 0.5354000 53.15000 0.5367000 -0.1710000     0.7581000 
1 1 1 2  4  22 o 110.8000 0.7596000 110.0000 1.067000  111.6000 1.082000  -1.601000      1.519000  
1 1 1 2  4  24 o 44.37000 0.3617000 44.24000 0.4718000 44.50000 0.5484000 -0.2642000     0.7234000 
1 1 1 2  4  26 o 69.34000 0.5285000 69.41000 0.6936000 69.27000 0.7976000 0.1439000      1.057000  
1 1 1 2  4  28 o 89.71000 0.6739000 89.85000 1.019000  89.58000 0.8818000 0.2791000      1.348000  
1 1 1 2  4  30 o 48.85000 0.4786000 49.53000 0.6122000 48.17000 0.7357000 1.362000       0.9571000 
1 1 1 2  4  32 o 63.68000 0.4597000 64.12000 0.6534000 63.24000 0.6469000 0.8855000      0.9194000 
1 1 1 2  4  34 o 76.23000 0.6241000 76.46000 0.8860000 76.01000 0.8791000 0.4499000      1.248000  
1 1 1 2  4  36 o 33.89000 0.3121000 33.95000 0.4370000 33.83000 0.4457000 0.1174000      0.6242000 
1 1 1 2  4  38 o 40.40000 0.3370000 39.72000 0.4713000 41.08000 0.4818000 -1.365000      0.6740000 
1 1 1 2  4  40 o 20.27000 0.3414000 20.74000 0.5001000 19.80000 0.4649000 0.9372000      0.6828000 
1 1 1 2  4  42 o 8.514000 0.7069000 8.063000 1.087000  8.964000 0.9046000 -0.9010000     1.414000  
1 1 1 2  4  44 o 36.52000 0.3897000 36.45000 0.5488000 36.59000 0.5534000 -0.1446000     0.7794000 
1 1 1 2  4  46 f 28.65000 0.3615000 29.10000 0.5569000 28.20000 0.4609000 0.8938000      0.7229000 
1 1 1 2  4  48 o 9.986000 0.6176000 10.23000 0.8693000 9.737000 0.8776000 0.4968000      1.235000  
1 1 1 2  4  50 o 26.55000 0.3864000 26.28000 0.5344000 26.82000 0.5582000 -0.5312000     0.7728000 
1 1 1 2  4  52 o 5.235000 1.035000  4.802000 1.573000  5.668000 1.344000  -0.8658000     2.069000  
1 1 1 2  4  54 o 19.48000 0.4216000 20.09000 0.5758000 18.88000 0.6159000 1.216000       0.8431000 
1 1 1 2  4  56 o 22.18000 0.3626000 22.65000 0.5053000 21.71000 0.5202000 0.9402000      0.7252000 
1 1 1 2  4  58 o 2.899000 0.8966000 2.606000 1.211000  3.192000 1.323000  -0.5863000     1.793000  
1 1 1 2  4  60 o 11.63000 0.5202000 12.19000 0.7080000 11.08000 0.7623000 1.115000       1.040000  
1 1 1 2  4  62 o 10.69000 0.5648000 10.21000 0.7319000 11.17000 0.8605000 -0.9543000     1.130000  
1 1 1 2  4  64 o 4.089000 0.9952000 5.157000 1.522000  3.021000 1.283000  2.136000       1.990000  
1 1 1 2  4  66 o 3.643000 1.036000  3.315000 1.382000  3.972000 1.544000  -0.6568000     2.072000  
1 1 1 2  4  68 f 7.980000 0.7669000 6.958000 1.153000  9.003000 1.011000  -2.045000      1.534000  
1 1 1 2  5  1  o 131.0000 1.027000  131.3000 1.455000  130.6000 1.448000  0.7538000      2.053000  
1 1 1 2  5  3  o 132.3000 1.037000  132.7000 1.470000  131.8000 1.461000  0.8634000      2.073000  
1 1 1 2  5  5  o 34.15000 0.2417000 34.01000 0.3404000 34.29000 0.3432000 -0.2833000     0.4834000 
1 1 1 2  5  7  o 49.77000 0.3453000 50.12000 0.4912000 49.42000 0.4854000 0.7003000      0.6905000 
1 1 1 2  5  9  o 33.10000 0.2480000 33.21000 0.3903000 32.98000 0.3059000 0.2313000      0.4959000 
1 1 1 2  5  11 o 31.14000 0.2671000 31.14000 0.3750000 31.14000 0.3805000 -0.5083000E-02 0.5342000 
1 1 1 2  5  13 o 86.09000 0.6388000 86.86000 0.9734000 85.32000 0.8277000 1.546000       1.278000  
1 1 1 2  5  15 o 17.94000 0.2384000 17.94000 0.3004000 17.95000 0.3703000 -0.9001000E-02 0.4768000 
1 1 1 2  5  17 f 43.90000 0.3435000 44.00000 0.4499000 43.80000 0.5192000 0.2019000      0.6870000 
1 1 1 2  5  19 o 15.18000 0.2279000 15.26000 0.3474000 15.10000 0.2950000 0.1674000      0.4557000 
1 1 1 2  5  21 o 5.962000 0.4362000 6.097000 0.5904000 5.827000 0.6423000 0.2701000      0.8724000 
1 1 1 2  5  23 o 55.35000 0.3976000 55.91000 0.5678000 54.78000 0.5567000 1.132000       0.7952000 
1 1 1 2  5  25 o 89.25000 0.6182000 89.22000 0.8743000 89.28000 0.8744000 -0.5843000E-01 1.236000  
1 1 1 2  5  27 o 19.66000 0.2897000 19.06000 0.4074000 20.26000 0.4118000 -1.199000      0.5793000 
1 1 1 2  5  29 f 83.45000 0.6739000 83.18000 0.9504000 83.72000 0.9556000 -0.5392000     1.348000  
1 1 1 2  5  31 o 27.30000 0.3836000 26.55000 0.5877000 28.04000 0.4930000 -1.487000      0.7671000 
1 1 1 2  5  33 o 58.77000 0.4657000 58.98000 0.7067000 58.56000 0.6066000 0.4216000      0.9313000 
1 1 1 2  5  35 o 64.54000 0.4682000 64.26000 0.6588000 64.83000 0.6654000 -0.5710000     0.9363000 
1 1 1 2  5  37 o 54.90000 0.4119000 54.63000 0.5808000 55.17000 0.5841000 -0.5312000     0.8237000 
1 1 1 2  5  39 o 31.38000 0.3325000 31.02000 0.4327000 31.74000 0.5049000 -0.7172000     0.6649000 
1 1 1 2  5  41 o 18.89000 0.5539000 18.93000 0.6780000 18.85000 0.8761000 0.7535000E-01  1.108000  
1 1 1 2  5  43 o 27.10000 0.4033000 26.87000 0.4412000 27.34000 0.6754000 -0.4685000     0.8067000 
1 1 1 2  5  45 o 22.69000 0.3392000 23.15000 0.4834000 22.23000 0.4760000 0.9228000      0.6785000 
1 1 1 2  5  47 o 14.87000 0.4464000 15.03000 0.6154000 14.70000 0.6469000 0.3253000      0.8928000 
1 1 1 2  5  49 o 16.71000 0.4082000 17.31000 0.5535000 16.10000 0.6001000 1.205000       0.8164000 
1 1 1 2  5  51 o 3.684000 1.052000  4.014000 1.476000  3.354000 1.499000  0.6602000      2.104000  
1 1 1 2  5  53 o 18.28000 0.4696000 18.47000 0.7705000 18.09000 0.5372000 0.3842000      0.9393000 
1 1 1 2  5  55 o 3.088000 0.9582000 2.870000 1.269000  3.305000 1.436000  -0.4353000     1.916000  
1 1 1 2  5  57 o 20.98000 0.3856000 20.20000 0.6011000 21.76000 0.4831000 -1.554000      0.7711000 
1 1 1 2  5  59 o 8.542000 0.6280000 8.084000 0.9255000 9.000000 0.8491000 -0.9166000     1.256000  
1 1 1 2  5  61 o 5.172000 1.080000  5.488000 1.430000  4.856000 1.618000  0.6317000      2.159000  
1 1 1 2  5  63 o 9.562000 0.7637000 10.10000 1.204000  9.021000 0.9403000 1.082000       1.527000  
1 1 1 2  5  65 o 6.621000 1.008000  6.657000 1.160000  6.584000 1.649000  0.7254000E-01  2.016000  
1 1 1 2  5  67 o 3.755000 0.9943000 3.991000 1.373000  3.519000 1.439000  0.4714000      1.989000  
1 1 1 2  6  0  o 58.71000 0.5689000 58.71000 0.5689000 58.71000 0.5689000 0.000000       0.000000  
1 1 1 2  6  2  o 74.22000 0.5865000 74.62000 0.8335000 73.82000 0.8252000 0.8059000      1.173000  
1 1 1 2  6  4  o 36.31000 0.2562000 36.85000 0.3668000 35.78000 0.3576000 1.076000       0.5123000 
1 1 1 2  6  6  o 90.53000 0.6180000 90.61000 0.8736000 90.45000 0.8744000 0.1576000      1.236000  
1 1 1 2  6  8  o 54.97000 0.3809000 55.24000 0.5411000 54.71000 0.5364000 0.5260000      0.7619000 
1 1 1 2  6  10 o 19.73000 0.1827000 19.97000 0.2740000 19.50000 0.2419000 0.4652000      0.3655000 
1 1 1 2  6  12 o 37.24000 0.3204000 37.58000 0.5406000 36.90000 0.3439000 0.6828000      0.6407000 
1 1 1 2  6  14 o 16.86000 0.2027000 16.80000 0.2897000 16.91000 0.2835000 -0.1114000     0.4053000 
1 1 1 2  6  16 o 60.21000 0.5188000 60.41000 0.5984000 60.02000 0.8476000 0.3961000      1.038000  
1 1 1 2  6  18 o 24.35000 0.2167000 24.58000 0.3069000 24.12000 0.3061000 0.4600000      0.4334000 
1 1 1 2  6  20 o 42.98000 0.3186000 42.67000 0.4469000 43.28000 0.4544000 -0.6107000     0.6373000 
1 1 1 2  6  22 o 97.04000 0.6678000 96.46000 0.9389000 97.61000 0.9500000 -1.145000      1.336000  
1 1 1 2  6  24 o 89.75000 0.6222000 89.73000 0.8804000 89.78000 0.8796000 -0.4742000E-01 1.244000  
1 1 1 2  6  26 o 48.50000 0.4174000 48.42000 0.5881000 48.58000 0.5923000 -0.1616000     0.8347000 
1 1 1 2  6  28 f 96.91000 0.7250000 97.08000 1.098000  96.74000 0.9471000 0.3497000      1.450000  
1 1 1 2  6  30 o 29.25000 0.3831000 28.22000 0.4757000 30.29000 0.6005000 -2.080000      0.7661000 
1 1 1 2  6  32 o 74.65000 0.5724000 74.86000 0.7508000 74.44000 0.8641000 0.4261000      1.145000  
1 1 1 2  6  34 o 25.59000 0.2983000 26.07000 0.4189000 25.10000 0.4248000 0.9712000      0.5966000 
1 1 1 2  6  36 o 26.48000 0.3144000 26.48000 0.4168000 26.47000 0.4708000 0.9401000E-02  0.6288000 
1 1 1 2  6  38 o 21.18000 0.3153000 21.09000 0.4446000 21.28000 0.4473000 -0.1875000     0.6307000 
1 1 1 2  6  40 o 37.79000 0.3998000 37.78000 0.6500000 37.80000 0.4656000 -0.2393000E-01 0.7996000 
1 1 1 2  6  42 o 22.70000 0.4215000 23.61000 0.6627000 21.79000 0.5211000 1.828000       0.8431000 
1 1 1 2  6  44 o 10.68000 0.5907000 10.38000 0.7788000 10.99000 0.8883000 -0.6115000     1.181000  
1 1 1 2  6  46 o 9.448000 0.6884000 9.479000 1.025000  9.417000 0.9193000 0.6240000E-01  1.377000  
1 1 1 2  6  48 o 24.14000 0.3492000 23.52000 0.5047000 24.76000 0.4828000 -1.248000      0.6985000 
1 1 1 2  6  50 o 8.180000 0.7122000 8.371000 0.9688000 7.988000 1.044000  0.3836000      1.424000  
1 1 1 2  6  52 o 23.22000 0.3298000 23.05000 0.4585000 23.38000 0.4743000 -0.3297000     0.6596000 
1 1 1 2  6  54 o 12.14000 0.5679000 12.55000 0.7524000 11.72000 0.8509000 0.8317000      1.136000  
1 1 1 2  6  56 o 9.074000 0.6062000 9.645000 0.7841000 8.503000 0.9246000 1.143000       1.212000  
1 1 1 2  6  58 o 3.913000 1.009000  4.084000 1.419000  3.742000 1.436000  0.3414000      2.019000  
1 1 1 2  6  60 o 12.61000 0.4969000 12.59000 0.7191000 12.62000 0.6861000 -0.3726000E-01 0.9939000 
1 1 1 2  6  62 f 6.890000 1.110000  7.387000 1.620000  6.394000 1.517000  0.9930000      2.219000  
1 1 1 2  6  64 o 5.607000 1.067000  5.189000 1.435000  6.025000 1.579000  -0.8364000     2.134000  
1 1 1 2  6  66 o 2.918000 0.9107000 2.884000 1.277000  2.952000 1.299000  -0.6865000E-01 1.821000  
1 1 1 2  7  1  o 128.2000 0.8706000 127.9000 1.228000  128.5000 1.235000  -0.6609000     1.741000  
1 1 1 2  7  3  o 131.7000 0.9270000 130.1000 1.118000  133.4000 1.479000  -3.336000      1.854000  
1 1 1 2  7  5  o 86.44000 0.5899000 86.25000 0.8322000 86.62000 0.8363000 -0.3685000     1.180000  
1 1 1 2  7  7  o 35.82000 0.2570000 36.04000 0.3650000 35.59000 0.3620000 0.4489000      0.5140000 
1 1 1 2  7  9  o 94.76000 0.6987000 94.44000 0.9118000 95.07000 1.059000  -0.6280000     1.397000  
1 1 1 2  7  11 o 22.43000 0.2024000 22.52000 0.3006000 22.35000 0.2710000 0.1633000      0.4047000 
1 1 1 2  7  13 o 23.16000 0.2307000 23.49000 0.3882000 22.82000 0.2494000 0.6729000      0.4614000 
1 1 1 2  7  15 o 4.664000 0.4293000 4.468000 0.5530000 4.859000 0.6568000 -0.3903000     0.8586000 
1 1 1 2  7  17 o 113.5000 0.8391000 112.2000 1.085000  114.7000 1.280000  -2.455000      1.678000  
1 1 1 2  7  19 o 128.3000 1.011000  127.8000 1.426000  128.7000 1.433000  -0.9284000     2.022000  
1 1 1 2  7  21 o 74.12000 0.5166000 74.50000 0.7344000 73.73000 0.7268000 0.7704000      1.033000  
1 1 1 2  7  23 o 9.737000 0.3639000 9.035000 0.5448000 10.44000 0.4824000 -1.404000      0.7277000 
1 1 1 2  7  25 o 68.46000 0.5572000 68.95000 0.7923000 67.96000 0.7837000 0.9890000      1.114000  
1 1 1 2  7  27 o 70.76000 0.5422000 70.93000 0.8217000 70.59000 0.7077000 0.3430000      1.084000  
1 1 1 2  7  29 o 33.92000 0.4383000 33.84000 0.6175000 34.01000 0.6221000 -0.1692000     0.8766000 
1 1 1 2  7  31 o 126.3000 0.9381000 125.2000 1.217000  127.4000 1.428000  -2.239000      1.876000  
1 1 1 2  7  33 o 54.18000 0.4399000 54.04000 0.6648000 54.33000 0.5764000 -0.2857000     0.8798000 
1 1 1 2  7  35 f 55.70000 0.4152000 56.10000 0.5909000 55.31000 0.5834000 0.7855000      0.8303000 
1 1 1 2  7  37 f 23.37000 0.3453000 23.93000 0.5001000 22.81000 0.4764000 1.121000       0.6907000 
1 1 1 2  7  39 o 36.09000 0.3692000 35.73000 0.5192000 36.46000 0.5251000 -0.7378000     0.7384000 
1 1 1 2  7  41 o 28.12000 0.3930000 28.29000 0.6545000 27.94000 0.4352000 0.3524000      0.7860000 
1 1 1 2  7  43 o 20.59000 0.3782000 20.88000 0.4804000 20.30000 0.5843000 0.5736000      0.7564000 
1 1 1 2  7  45 o 32.89000 0.3548000 32.78000 0.4639000 33.00000 0.5368000 -0.2149000     0.7095000 
1 1 1 2  7  47 o 17.79000 0.3979000 17.46000 0.5764000 18.12000 0.5488000 -0.6528000     0.7959000 
1 1 1 2  7  49 o 18.63000 0.3784000 18.71000 0.5354000 18.54000 0.5350000 0.1777000      0.7568000 
1 1 1 2  7  51 o 8.522000 0.7355000 8.564000 1.115000  8.480000 0.9592000 0.8353000E-01  1.471000  
1 1 1 2  7  53 o 12.82000 0.5480000 13.01000 0.8916000 12.63000 0.6373000 0.3848000      1.096000  
1 1 1 2  7  55 o 10.14000 0.7987000 11.45000 0.8230000 8.838000 1.369000  2.608000       1.597000  
1 1 1 2  7  57 o 12.19000 0.4939000 12.46000 0.7362000 11.93000 0.6587000 0.5295000      0.9878000 
1 1 1 2  7  59 o 11.85000 0.5220000 12.30000 0.7115000 11.39000 0.7639000 0.9113000      1.044000  
1 1 1 2  7  61 o 6.554000 0.9906000 5.979000 1.411000  7.129000 1.391000  -1.149000      1.981000  
1 1 1 2  7  63 o 5.072000 1.087000  6.008000 1.484000  4.136000 1.589000  1.872000       2.174000  
1 1 1 2  7  65 o 3.976000 1.061000  3.619000 1.417000  4.334000 1.578000  -0.7150000     2.121000  
1 1 1 2  7  67 o 4.881000 1.003000  5.732000 1.336000  4.029000 1.497000  1.702000       2.006000  
1 1 1 2  8  0  o 149.6000 1.436000  149.6000 1.436000  149.6000 1.436000  0.000000       0.000000  
1 1 1 2  8  2  o 39.37000 0.2765000 39.48000 0.3918000 39.27000 0.3902000 0.2079000      0.5530000 
1 1 1 2  8  4  o 116.9000 0.8209000 117.5000 1.010000  116.4000 1.294000  1.052000       1.642000  
1 1 1 2  8  6  o 116.4000 0.7922000 116.7000 1.123000  116.1000 1.117000  0.6549000      1.584000  
1 1 1 2  8  8  f 7.667000 0.1823000 7.759000 0.2405000 7.574000 0.2740000 0.1849000      0.3646000 
1 1 1 2  8  10 o 63.99000 0.4778000 64.23000 0.6281000 63.75000 0.7202000 0.4760000      0.9556000 
1 1 1 2  8  12 o 26.46000 0.2475000 26.58000 0.4142000 26.35000 0.2710000 0.2258000      0.4950000 
1 1 1 2  8  14 o 34.12000 0.2988000 33.94000 0.4999000 34.29000 0.3274000 -0.3436000     0.5976000 
1 1 1 2  8  16 o 44.34000 0.4176000 44.50000 0.5217000 44.18000 0.6523000 0.3270000      0.8353000 
1 1 1 2  8  18 o 133.2000 0.9091000 131.5000 1.270000  134.9000 1.301000  -3.371000      1.818000  
1 1 1 2  8  20 o 113.0000 0.8361000 112.5000 1.260000  113.4000 1.100000  -0.9286000     1.672000  
1 1 1 2  8  22 o 33.21000 0.2723000 33.08000 0.3855000 33.34000 0.3846000 -0.2594000     0.5446000 
1 1 1 2  8  24 o 94.85000 0.6552000 95.11000 0.9296000 94.59000 0.9236000 0.5222000      1.310000  
1 1 1 2  8  26 f 86.94000 0.6991000 86.70000 0.9870000 87.18000 0.9905000 -0.4771000     1.398000  
1 1 1 2  8  28 o 87.23000 0.7860000 87.25000 1.219000  87.21000 0.9922000 0.4696000E-01  1.572000  
1 1 1 2  8  30 o 46.14000 0.3877000 46.21000 0.5086000 46.06000 0.5851000 0.1504000      0.7753000 
1 1 1 2  8  32 o 29.77000 0.3258000 29.83000 0.4312000 29.71000 0.4884000 0.1263000      0.6515000 
1 1 1 2  8  34 o 3.980000 0.9559000 3.271000 1.377000  4.688000 1.326000  -1.417000      1.912000  
1 1 1 2  8  36 o 38.93000 0.3561000 39.06000 0.5413000 38.80000 0.4627000 0.2587000      0.7121000 
1 1 1 2  8  38 f 27.77000 0.3228000 27.73000 0.4234000 27.82000 0.4874000 -0.9301000E-01 0.6456000 
1 1 1 2  8  40 o 25.46000 0.3133000 25.38000 0.4458000 25.54000 0.4403000 -0.1533000     0.6266000 
1 1 1 2  8  42 o 40.34000 0.4033000 39.13000 0.5678000 41.56000 0.5729000 -2.433000      0.8066000 
1 1 1 2  8  44 o 22.43000 0.3701000 23.20000 0.4802000 21.67000 0.5631000 1.532000       0.7401000 
1 1 1 2  8  46 o 42.85000 0.4216000 42.37000 0.5885000 43.32000 0.6039000 -0.9461000     0.8432000 
1 1 1 2  8  48 o 10.17000 0.5977000 10.26000 0.8082000 10.09000 0.8809000 0.1633000      1.195000  
1 1 1 2  8  50 o 35.31000 0.3685000 35.55000 0.4902000 35.07000 0.5503000 0.4807000      0.7369000 
1 1 1 2  8  52 o 28.68000 0.3312000 29.02000 0.4752000 28.34000 0.4615000 0.6759000      0.6624000 
1 1 1 2  8  54 o 3.911000 0.9679000 4.117000 1.344000  3.704000 1.393000  0.4130000      1.936000  
1 1 1 2  8  56 o 11.94000 0.5267000 12.94000 0.6298000 10.95000 0.8444000 1.989000       1.053000  
1 1 1 2  8  58 o 2.439000 0.8071000 2.076000 1.019000  2.801000 1.252000  -0.7244000     1.614000  
1 1 1 2  8  60 o 7.780000 0.7460000 8.371000 0.9648000 7.189000 1.138000  1.182000       1.492000  
1 1 1 2  8  62 o 7.973000 0.7749000 7.906000 1.235000  8.040000 0.9370000 -0.1344000     1.550000  
1 1 1 2  8  64 o 5.728000 1.015000  4.832000 1.567000  6.625000 1.291000  -1.793000      2.031000  
1 1 1 2  8  66 o 4.297000 1.057000  3.153000 1.361000  5.441000 1.617000  -2.288000      2.113000  
1 1 1 2  9  1  o 44.03000 0.3077000 43.97000 0.4349000 44.09000 0.4355000 -0.1215000     0.6155000 
1 1 1 2  9  3  o 145.9000 0.9908000 144.9000 1.391000  146.9000 1.411000  -2.043000      1.982000  
1 1 1 2  9  5  o 97.71000 0.6892000 97.10000 0.8383000 98.31000 1.094000  -1.205000      1.378000  
1 1 1 2  9  7  o 72.41000 0.5372000 72.86000 0.7083000 71.97000 0.8078000 0.8808000      1.074000  
1 1 1 2  9  9  o 39.42000 0.3054000 39.56000 0.4023000 39.27000 0.4596000 0.2855000      0.6108000 
1 1 1 2  9  11 o 29.52000 0.2764000 29.61000 0.4487000 29.43000 0.3229000 0.1803000      0.5528000 
1 1 1 2  9  13 o 55.32000 0.4743000 55.99000 0.7774000 54.65000 0.5437000 1.342000       0.9487000 
1 1 1 2  9  15 o 70.55000 0.5284000 70.41000 0.7944000 70.69000 0.6970000 -0.2773000     1.057000  
1 1 1 2  9  17 o 41.69000 0.3173000 42.32000 0.5037000 41.06000 0.3860000 1.264000       0.6346000 
1 1 1 2  9  19 o 93.16000 0.6940000 93.60000 1.054000  92.72000 0.9034000 0.8823000      1.388000  
1 1 1 2  9  21 o 64.19000 0.4536000 65.03000 0.6492000 63.36000 0.6338000 1.661000       0.9073000 
1 1 1 2  9  23 o 78.01000 0.6312000 77.97000 0.8921000 78.06000 0.8933000 -0.8295000E-01 1.262000  
1 1 1 2  9  25 o 33.86000 0.3390000 34.04000 0.4749000 33.68000 0.4840000 0.3545000      0.6781000 
1 1 1 2  9  27 o 50.62000 0.3796000 51.21000 0.5417000 50.03000 0.5319000 1.185000       0.7592000 
1 1 1 2  9  29 o 58.12000 0.4272000 57.94000 0.6018000 58.30000 0.6067000 -0.3559000     0.8545000 
1 1 1 2  9  31 o 51.56000 0.4823000 51.27000 0.5489000 51.84000 0.7932000 -0.5717000     0.9646000 
1 1 1 2  9  33 o 31.64000 0.3497000 30.54000 0.4990000 32.74000 0.4899000 -2.197000      0.6993000 
1 1 1 2  9  35 o 22.47000 0.3056000 22.66000 0.4397000 22.27000 0.4245000 0.3878000      0.6112000 
1 1 1 2  9  37 o 29.25000 0.3031000 29.55000 0.4295000 28.96000 0.4276000 0.5925000      0.6061000 
1 1 1 2  9  39 o 44.39000 0.3600000 44.54000 0.5090000 44.25000 0.5092000 0.2903000      0.7200000 
1 1 1 2  9  41 o 21.57000 0.4244000 21.36000 0.6520000 21.78000 0.5433000 -0.4259000     0.8487000 
1 1 1 2  9  43 o 48.28000 0.3863000 48.42000 0.5490000 48.14000 0.5438000 0.2840000      0.7727000 
1 1 1 2  9  45 o 17.29000 0.4273000 17.22000 0.5728000 17.36000 0.6343000 -0.1386000     0.8547000 
1 1 1 2  9  47 o 7.755000 0.8156000 8.618000 1.061000  6.892000 1.239000  1.725000       1.631000  
1 1 1 2  9  49 o 6.177000 0.9343000 7.308000 1.101000  5.045000 1.510000  2.263000       1.869000  
1 1 1 2  9  51 o 17.07000 0.3769000 17.44000 0.5482000 16.70000 0.5176000 0.7348000      0.7539000 
1 1 1 2  9  53 o 12.70000 0.5146000 13.43000 0.6301000 11.97000 0.8137000 1.464000       1.029000  
1 1 1 2  9  55 o 7.096000 0.8112000 7.140000 1.064000  7.052000 1.225000  0.8792000E-01  1.622000  
1 1 1 2  9  57 o 9.479000 0.5807000 9.382000 0.8119000 9.577000 0.8305000 -0.1958000     1.161000  
1 1 1 2  9  59 o 9.783000 0.6888000 10.25000 0.9282000 9.313000 1.018000  0.9396000      1.378000  
1 1 1 2  9  61 o 4.316000 1.031000  4.759000 1.489000  3.873000 1.427000  0.8853000      2.062000  
1 1 1 2  9  63 o 7.001000 0.9019000 6.120000 1.364000  7.882000 1.181000  -1.762000      1.804000  
1 1 1 2  9  65 o 8.635000 0.7889000 9.230000 0.9577000 8.040000 1.254000  1.190000       1.578000  
1 1 1 2  9  67 o 4.328000 1.123000  4.538000 1.547000  4.118000 1.628000  0.4201000      2.246000  
1 1 1 2  10 0  o 28.91000 0.3021000 28.91000 0.3021000 28.91000 0.3021000 0.000000       0.000000  
1 1 1 2  10 2  o 58.59000 0.4046000 58.46000 0.5707000 58.73000 0.5737000 -0.2709000     0.8092000 
1 1 1 2  10 4  o 34.69000 0.2593000 34.79000 0.3195000 34.59000 0.4085000 0.2014000      0.5186000 
1 1 1 2  10 6  o 19.11000 0.1891000 19.20000 0.2127000 19.02000 0.3127000 0.1817000      0.3781000 
1 1 1 2  10 8  o 86.10000 0.5904000 86.10000 0.8348000 86.10000 0.8350000 0.2594000E-02  1.181000  
1 1 1 2  10 10 o 11.62000 0.1994000 11.67000 0.3129000 11.57000 0.2473000 0.1006000      0.3988000 
1 1 1 2  10 12 o 55.59000 0.4774000 55.94000 0.7806000 55.25000 0.5499000 0.6870000      0.9548000 
1 1 1 2  10 14 f 51.95000 0.3812000 52.67000 0.6058000 51.24000 0.4630000 1.433000       0.7625000 
1 1 1 2  10 16 f 13.12000 0.2814000 13.54000 0.3981000 12.70000 0.3980000 0.8405000      0.5629000 
1 1 1 2  10 18 o 50.88000 0.4738000 51.91000 0.7403000 49.86000 0.5915000 2.047000       0.9476000 
1 1 1 2  10 20 o 12.62000 0.3158000 12.74000 0.5187000 12.50000 0.3603000 0.2470000      0.6316000 
1 1 1 2  10 22 o 71.55000 0.5445000 71.50000 0.7100000 71.60000 0.8256000 -0.9450000E-01 1.089000  
1 1 1 2  10 24 o 105.9000 0.8403000 105.4000 1.181000  106.4000 1.195000  -1.072000      1.681000  
1 1 1 2  10 26 o 21.79000 0.3002000 22.16000 0.4573000 21.42000 0.3891000 0.7303000      0.6005000 
1 1 1 2  10 28 o 20.14000 0.3438000 20.15000 0.4733000 20.13000 0.4989000 0.1981000E-01  0.6877000 
1 1 1 2  10 30 o 31.89000 0.3706000 32.35000 0.4329000 31.42000 0.6017000 0.9244000      0.7412000 
1 1 1 2  10 32 o 47.47000 0.4243000 47.08000 0.5970000 47.87000 0.6031000 -0.7854000     0.8486000 
1 1 1 2  10 34 o 16.83000 0.3537000 16.55000 0.5422000 17.10000 0.4543000 -0.5528000     0.7074000 
1 1 1 2  10 36 o 28.39000 0.3044000 28.73000 0.4324000 28.05000 0.4286000 0.6743000      0.6088000 
1 1 1 2  10 38 o 40.14000 0.3826000 40.21000 0.5420000 40.06000 0.5402000 0.1534000      0.7653000 
1 1 1 2  10 40 o 19.15000 0.3754000 18.94000 0.5772000 19.36000 0.4802000 -0.4201000     0.7509000 
1 1 1 2  10 42 o 42.70000 0.3857000 42.87000 0.5868000 42.53000 0.5007000 0.3379000      0.7714000 
1 1 1 2  10 44 o 17.51000 0.4155000 18.22000 0.5355000 16.81000 0.6355000 1.410000       0.8311000 
1 1 1 2  10 46 o 22.44000 0.3519000 21.73000 0.5136000 23.15000 0.4813000 -1.425000      0.7038000 
1 1 1 2  10 48 o 24.15000 0.3431000 24.50000 0.4933000 23.80000 0.4769000 0.7010000      0.6861000 
1 1 1 2  10 50 o 13.27000 0.4936000 13.56000 0.7253000 12.99000 0.6696000 0.5715000      0.9872000 
1 1 1 2  10 52 o 25.58000 0.3812000 25.44000 0.5356000 25.73000 0.5425000 -0.2820000     0.7623000 
1 1 1 2  10 54 o 6.842000 0.8740000 7.148000 1.309000  6.536000 1.159000  0.6122000      1.748000  
1 1 1 2  10 56 o 7.298000 0.7335000 7.174000 1.051000  7.422000 1.024000  -0.2485000     1.467000  
1 1 1 2  10 58 o 3.858000 0.9844000 4.271000 1.437000  3.444000 1.346000  0.8271000      1.969000  
1 1 1 2  10 60 o 6.981000 0.9880000 7.489000 1.001000  6.473000 1.704000  1.016000       1.976000  
1 1 1 2  10 62 o 4.248000 1.091000  5.036000 1.606000  3.461000 1.477000  1.575000       2.183000  
1 1 1 2  10 64 o 10.22000 0.6661000 10.66000 0.9548000 9.784000 0.9291000 0.8758000      1.332000  
1 1 1 2  10 66 f 4.698000 1.097000  4.559000 1.530000  4.837000 1.573000  -0.2779000     2.195000  
1 1 1 2  11 1  o 112.6000 0.7668000 111.2000 1.071000  114.1000 1.098000  -2.846000      1.534000  
1 1 1 2  11 3  o 108.7000 0.7988000 107.2000 1.194000  110.2000 1.061000  -2.988000      1.598000  
1 1 1 2  11 5  o 75.48000 0.6114000 75.73000 0.6586000 75.22000 1.030000  0.5020000      1.223000  
1 1 1 2  11 7  o 52.85000 0.3824000 52.70000 0.4681000 53.01000 0.6048000 -0.3103000     0.7648000 
1 1 1 2  11 9  o 28.33000 0.2203000 28.27000 0.3100000 28.38000 0.3130000 -0.1173000     0.4405000 
1 1 1 2  11 11 o 45.10000 0.3950000 45.35000 0.6458000 44.86000 0.4551000 0.4829000      0.7901000 
1 1 1 2  11 13 o 66.83000 0.4798000 66.87000 0.7567000 66.79000 0.5901000 0.8033000E-01  0.9596000 
1 1 1 2  11 15 o 90.26000 0.7180000 90.07000 1.009000  90.46000 1.022000  -0.3911000     1.436000  
1 1 1 2  11 17 o 59.94000 0.4370000 60.65000 0.6936000 59.23000 0.5318000 1.423000       0.8740000 
1 1 1 2  11 19 o 68.90000 0.5942000 69.83000 0.9750000 67.97000 0.6795000 1.866000       1.188000  
1 1 1 2  11 21 o 26.35000 0.2891000 26.00000 0.4806000 26.69000 0.3214000 -0.6922000     0.5781000 
1 1 1 2  11 23 o 17.27000 0.3668000 17.76000 0.4433000 16.78000 0.5844000 0.9807000      0.7335000 
1 1 1 2  11 25 o 13.35000 0.3552000 13.56000 0.4876000 13.14000 0.5167000 0.4162000      0.7105000 
1 1 1 2  11 27 o 22.22000 0.3421000 22.01000 0.4823000 22.43000 0.4854000 -0.4211000     0.6843000 
1 1 1 2  11 29 o 71.80000 0.5904000 71.72000 0.8354000 71.88000 0.8346000 -0.1586000     1.181000  
1 1 1 2  11 31 o 36.67000 0.3944000 36.89000 0.4519000 36.45000 0.6464000 0.4420000      0.7887000 
1 1 1 2  11 33 o 18.35000 0.3216000 18.04000 0.4560000 18.67000 0.4536000 -0.6319000     0.6432000 
1 1 1 2  11 35 o 46.57000 0.3662000 46.56000 0.5190000 46.58000 0.5169000 -0.1716000E-01 0.7325000 
1 1 1 2  11 37 o 15.85000 0.3956000 15.71000 0.5787000 16.00000 0.5394000 -0.2913000     0.7911000 
1 1 1 2  11 39 o 37.17000 0.3320000 37.56000 0.4735000 36.79000 0.4657000 0.7668000      0.6641000 
1 1 1 2  11 41 o 30.79000 0.3433000 31.09000 0.4482000 30.49000 0.5201000 0.5972000      0.6866000 
1 1 1 2  11 43 o 34.25000 0.3291000 34.87000 0.4686000 33.62000 0.4621000 1.248000       0.6581000 
1 1 1 2  11 45 o 23.61000 0.3714000 24.05000 0.4858000 23.17000 0.5620000 0.8759000      0.7429000 
1 1 1 2  11 47 o 15.50000 0.4550000 15.97000 0.6818000 15.04000 0.6026000 0.9235000      0.9099000 
1 1 1 2  11 49 o 9.684000 0.6598000 9.672000 0.8846000 9.695000 0.9792000 -0.2298000E-01 1.320000  
1 1 1 2  11 51 o 14.68000 0.4105000 14.08000 0.5834000 15.28000 0.5777000 -1.203000      0.8210000 
1 1 1 2  11 53 o 6.958000 0.7783000 6.509000 1.169000  7.408000 1.028000  -0.8986000     1.557000  
1 1 1 2  11 55 o 13.73000 0.4367000 13.13000 0.6448000 14.33000 0.5893000 -1.194000      0.8735000 
1 1 1 2  11 57 f 7.973000 0.6785000 7.492000 1.037000  8.454000 0.8751000 -0.9620000     1.357000  
1 1 1 2  11 59 f 8.131000 0.6921000 9.043000 0.8551000 7.219000 1.089000  1.824000       1.384000  
1 1 1 2  11 61 o 4.945000 0.9755000 4.259000 1.411000  5.632000 1.347000  -1.372000      1.951000  
1 1 1 2  11 63 o 12.02000 0.5717000 11.92000 0.8720000 12.12000 0.7395000 -0.2068000     1.143000  
1 1 1 2  11 65 o 3.285000 0.9911000 3.086000 1.342000  3.484000 1.459000  -0.3974000     1.982000  
1 1 1 2  11 67 o 5.795000 0.9615000 5.409000 1.410000  6.181000 1.307000  -0.7719000     1.923000  
1 1 1 2  12 0  o 76.03000 0.7374000 76.03000 0.7374000 76.03000 0.7374000 0.000000       0.000000  
1 1 1 2  12 2  o 107.9000 0.7352000 108.6000 1.047000  107.2000 1.033000  1.421000       1.470000  
1 1 1 2  12 4  o 50.23000 0.3802000 49.98000 0.4965000 50.48000 0.5758000 -0.5034000     0.7603000 
1 1 1 2  12 6  f 24.20000 0.2019000 24.58000 0.2526000 23.82000 0.3150000 0.7552000      0.4038000 
1 1 1 2  12 8  o 30.00000 0.2475000 29.85000 0.3235000 30.16000 0.3745000 -0.3164000     0.4949000 
1 1 1 2  12 10 o 27.15000 0.2492000 27.12000 0.3532000 27.18000 0.3517000 -0.6527000E-01 0.4984000 
1 1 1 2  12 12 o 64.55000 0.4862000 65.38000 0.7416000 63.71000 0.6289000 1.675000       0.9723000 
1 1 1 2  12 14 o 4.325000 0.4624000 4.253000 0.7157000 4.396000 0.5856000 -0.1430000     0.9248000 
1 1 1 2  12 16 o 47.56000 0.4489000 47.73000 0.6899000 47.39000 0.5744000 0.3450000      0.8977000 
1 1 1 2  12 18 f 29.45000 0.2542000 29.73000 0.3982000 29.17000 0.3162000 0.5598000      0.5084000 
1 1 1 2  12 20 f 70.31000 0.5819000 69.94000 0.9787000 70.68000 0.6298000 -0.7464000     1.164000  
1 1 1 2  12 22 o 49.41000 0.3936000 49.21000 0.5914000 49.61000 0.5196000 -0.3951000     0.7872000 
1 1 1 2  12 24 o 87.48000 0.6252000 86.61000 0.9791000 88.36000 0.7777000 -1.752000      1.250000  
1 1 1 2  12 26 o 47.32000 0.4636000 47.66000 0.5929000 46.98000 0.7127000 0.6836000      0.9271000 
1 1 1 2  12 28 o 33.27000 0.3526000 32.78000 0.4938000 33.76000 0.5034000 -0.9859000     0.7052000 
1 1 1 2  12 30 o 47.39000 0.3692000 47.91000 0.5255000 46.88000 0.5188000 1.030000       0.7384000 
1 1 1 2  12 32 o 28.04000 0.3149000 28.25000 0.4050000 27.83000 0.4822000 0.4283000      0.6297000 
1 1 1 2  12 34 o 50.48000 0.4185000 50.50000 0.6337000 50.45000 0.5468000 0.5116000E-01  0.8370000 
1 1 1 2  12 36 o 18.39000 0.3339000 18.39000 0.4701000 18.38000 0.4743000 0.3035000E-02  0.6678000 
1 1 1 2  12 38 o 31.69000 0.3120000 31.54000 0.4457000 31.83000 0.4366000 -0.2939000     0.6240000 
1 1 1 2  12 40 o 10.23000 0.6108000 10.20000 0.8869000 10.25000 0.8400000 -0.5316000E-01 1.222000  
1 1 1 2  12 42 o 22.19000 0.3589000 22.32000 0.5439000 22.06000 0.4683000 0.2554000      0.7177000 
1 1 1 2  12 44 o 20.66000 0.3861000 20.39000 0.4976000 20.94000 0.5906000 -0.5519000     0.7723000 
1 1 1 2  12 46 o 20.89000 0.3643000 21.18000 0.5079000 20.60000 0.5223000 0.5779000      0.7285000 
1 1 1 2  12 48 o 24.96000 0.3424000 24.79000 0.4838000 25.13000 0.4848000 -0.3399000     0.6849000 
1 1 1 2  12 50 o 18.84000 0.3699000 18.38000 0.5368000 19.30000 0.5089000 -0.9229000     0.7397000 
1 1 1 2  12 52 o 12.25000 0.5424000 12.44000 0.6853000 12.05000 0.8408000 0.3906000      1.085000  
1 1 1 2  12 54 o 7.208000 0.8182000 6.951000 1.311000  7.466000 0.9795000 -0.5152000     1.636000  
1 1 1 2  12 56 o 4.635000 1.090000  4.579000 1.406000  4.690000 1.666000  -0.1117000     2.180000  
1 1 1 2  12 58 o 9.603000 0.6122000 9.860000 0.8933000 9.346000 0.8373000 0.5145000      1.224000  
1 1 1 2  12 60 o 4.427000 1.046000  4.282000 1.546000  4.573000 1.410000  -0.2912000     2.092000  
1 1 1 2  12 62 o 4.108000 1.043000  4.691000 1.462000  3.525000 1.488000  1.167000       2.086000  
1 1 1 2  12 64 o 7.840000 0.9940000 8.749000 1.424000  6.932000 1.388000  1.817000       1.988000  
1 1 1 2  12 66 o 3.585000 1.073000  3.249000 1.378000  3.921000 1.644000  -0.6715000     2.145000  
1 1 1 2  13 1  o 59.46000 0.4464000 58.69000 0.5756000 60.23000 0.6824000 -1.548000      0.8927000 
1 1 1 2  13 3  o 46.09000 0.3523000 45.52000 0.4565000 46.66000 0.5368000 -1.135000      0.7047000 
1 1 1 2  13 5  o 66.90000 0.4627000 67.17000 0.6572000 66.64000 0.6517000 0.5257000      0.9255000 
1 1 1 2  13 7  o 58.67000 0.4730000 58.64000 0.6697000 58.70000 0.6682000 -0.5950000E-01 0.9460000 
1 1 1 2  13 9  o 61.35000 0.4940000 61.01000 0.6957000 61.69000 0.7014000 -0.6780000     0.9880000 
1 1 1 2  13 11 o 39.12000 0.3103000 39.17000 0.4083000 39.07000 0.4673000 0.1066000      0.6206000 
1 1 1 2  13 13 o 69.22000 0.4817000 69.00000 0.6788000 69.43000 0.6835000 -0.4286000     0.9633000 
1 1 1 2  13 15 o 46.52000 0.3942000 45.97000 0.5410000 47.06000 0.5735000 -1.097000      0.7884000 
1 1 1 2  13 17 o 35.20000 0.2828000 35.00000 0.4397000 35.41000 0.3558000 -0.4026000     0.5656000 
1 1 1 2  13 19 o 87.35000 0.7182000 88.25000 1.219000  86.46000 0.7597000 1.793000       1.436000  
1 1 1 2  13 21 o 74.23000 0.5357000 73.60000 0.8395000 74.85000 0.6656000 -1.251000      1.071000  
1 1 1 2  13 23 o 74.88000 0.5666000 74.45000 0.8503000 75.32000 0.7492000 -0.8696000     1.133000  
1 1 1 2  13 25 o 49.04000 0.4350000 49.20000 0.7299000 48.88000 0.4733000 0.3229000      0.8699000 
1 1 1 2  13 27 o 64.05000 0.5422000 63.79000 0.9105000 64.32000 0.5890000 -0.5308000     1.084000  
1 1 1 2  13 29 o 40.78000 0.3336000 40.37000 0.4686000 41.19000 0.4748000 -0.8198000     0.6671000 
1 1 1 2  13 31 o 16.28000 0.4408000 15.85000 0.5264000 16.71000 0.7073000 -0.8591000     0.8817000 
1 1 1 2  13 33 o 57.43000 0.4250000 57.60000 0.6013000 57.26000 0.6008000 0.3426000      0.8500000 
1 1 1 2  13 35 o 40.27000 0.3370000 40.31000 0.4762000 40.24000 0.4771000 0.7316000E-01  0.6741000 
1 1 1 2  13 37 o 22.48000 0.3249000 22.36000 0.4806000 22.60000 0.4372000 -0.2411000     0.6497000 
1 1 1 2  13 39 o 31.20000 0.3626000 30.91000 0.5089000 31.48000 0.5167000 -0.5695000     0.7252000 
1 1 1 2  13 41 o 12.57000 0.4478000 12.61000 0.6375000 12.54000 0.6291000 0.7128000E-01  0.8956000 
1 1 1 2  13 43 o 10.09000 0.5622000 10.16000 0.7893000 10.03000 0.8008000 0.1342000      1.124000  
1 1 1 2  13 45 o 16.63000 0.4320000 16.54000 0.5584000 16.72000 0.6594000 -0.1802000     0.8641000 
1 1 1 2  13 47 o 15.61000 0.4577000 15.93000 0.6778000 15.30000 0.6152000 0.6303000      0.9154000 
1 1 1 2  13 49 o 4.485000 1.084000  5.132000 1.608000  3.839000 1.453000  1.293000       2.167000  
1 1 1 2  13 51 o 5.175000 1.084000  5.340000 1.548000  5.009000 1.517000  0.3314000      2.167000  
1 1 1 2  13 53 o 8.183000 0.6798000 8.766000 0.9191000 7.599000 1.002000  1.167000       1.360000  
1 1 1 2  13 55 o 14.79000 0.4070000 14.51000 0.5767000 15.06000 0.5743000 -0.5524000     0.8139000 
1 1 1 2  13 57 o 4.434000 1.011000  4.117000 1.414000  4.751000 1.445000  -0.6331000     2.022000  
1 1 1 2  13 59 o 3.864000 1.069000  3.732000 1.497000  3.996000 1.527000  -0.2643000     2.139000  
1 1 1 2  13 61 o 7.809000 0.8655000 8.518000 1.223000  7.100000 1.225000  1.419000       1.731000  
1 1 1 2  13 63 f 8.055000 0.7960000 8.508000 1.048000  7.601000 1.198000  0.9066000      1.592000  
1 1 1 2  13 65 o 2.879000 0.9251000 2.701000 1.242000  3.056000 1.372000  -0.3546000     1.850000  
1 1 1 2  14 0  o 69.41000 0.7819000 69.41000 0.7819000 69.41000 0.7819000 0.000000       0.000000  
1 1 1 2  14 2  o 29.80000 0.2603000 30.08000 0.3711000 29.53000 0.3651000 0.5567000      0.5206000 
1 1 1 2  14 4  o 24.02000 0.2126000 23.64000 0.3186000 24.39000 0.2816000 -0.7558000     0.4252000 
1 1 1 2  14 6  o 42.44000 0.3733000 42.10000 0.6066000 42.79000 0.4353000 -0.6878000     0.7466000 
1 1 1 2  14 8  o 26.78000 0.2497000 27.16000 0.3590000 26.39000 0.3473000 0.7688000      0.4995000 
1 1 1 2  14 10 o 38.89000 0.3094000 39.12000 0.4089000 38.67000 0.4645000 0.4523000      0.6189000 
1 1 1 2  14 12 o 31.75000 0.3076000 32.60000 0.3657000 30.91000 0.4947000 1.694000       0.6152000 
1 1 1 2  14 14 o 27.63000 0.2737000 27.74000 0.3707000 27.52000 0.4029000 0.2181000      0.5474000 
1 1 1 2  14 16 o 17.25000 0.2812000 17.82000 0.4491000 16.67000 0.3386000 1.147000       0.5624000 
1 1 1 2  14 18 f 98.45000 0.6986000 97.87000 1.098000  99.04000 0.8644000 -1.166000      1.397000  
1 1 1 2  14 20 o 73.10000 0.6057000 72.50000 1.018000  73.70000 0.6563000 -1.199000      1.211000  
1 1 1 2  14 22 o 23.64000 0.3662000 23.96000 0.5152000 23.32000 0.5204000 0.6309000      0.7323000 
1 1 1 2  14 24 o 51.60000 0.3943000 51.20000 0.6160000 52.01000 0.4924000 -0.8098000     0.7886000 
1 1 1 2  14 26 o 49.60000 0.4571000 50.10000 0.7437000 49.10000 0.5316000 0.9954000      0.9142000 
1 1 1 2  14 28 o 44.60000 0.4134000 44.92000 0.6970000 44.27000 0.4447000 0.6481000      0.8268000 
1 1 1 2  14 30 f 73.85000 0.5408000 74.10000 0.8548000 73.60000 0.6628000 0.5031000      1.082000  
1 1 1 2  14 32 o 39.53000 0.3553000 39.70000 0.4662000 39.35000 0.5363000 0.3445000      0.7107000 
1 1 1 2  14 34 o 28.30000 0.3298000 28.31000 0.5019000 28.30000 0.4279000 0.1813000E-01  0.6595000 
1 1 1 2  14 36 o 40.84000 0.3844000 41.03000 0.5431000 40.65000 0.5442000 0.3749000      0.7689000 
1 1 1 2  14 38 o 10.93000 0.4778000 10.31000 0.6995000 11.56000 0.6512000 -1.245000      0.9557000 
1 1 1 2  14 40 o 21.70000 0.3291000 21.29000 0.4691000 22.11000 0.4616000 -0.8210000     0.6581000 
1 1 1 2  14 42 o 15.87000 0.4292000 15.96000 0.6465000 15.79000 0.5646000 0.1722000      0.8583000 
1 1 1 2  14 44 o 19.07000 0.3972000 19.22000 0.5390000 18.92000 0.5836000 0.3009000      0.7944000 
1 1 1 2  14 46 o 27.30000 0.3400000 27.01000 0.4861000 27.60000 0.4753000 -0.5857000     0.6799000 
1 1 1 2  14 48 o 12.39000 0.5807000 11.91000 0.8738000 12.87000 0.7651000 -0.9549000     1.161000  
1 1 1 2  14 50 o 18.33000 0.3696000 18.49000 0.5247000 18.17000 0.5207000 0.3160000      0.7392000 
1 1 1 2  14 52 o 6.509000 0.8160000 7.444000 0.9758000 5.573000 1.308000  1.871000       1.632000  
1 1 1 2  14 54 o 6.687000 0.8497000 6.816000 1.218000  6.557000 1.185000  0.2584000      1.699000  
1 1 1 2  14 56 o 4.798000 0.9559000 6.151000 1.168000  3.445000 1.514000  2.706000       1.912000  
1 1 1 2  14 58 o 5.291000 0.9207000 3.822000 1.509000  6.759000 1.055000  -2.937000      1.841000  
1 1 1 2  14 60 f 9.224000 0.6462000 8.171000 0.9925000 10.28000 0.8277000 -2.105000      1.292000  
1 1 1 2  14 62 o 6.134000 0.8907000 8.031000 1.029000  4.237000 1.454000  3.794000       1.781000  
1 1 1 2  14 64 o 3.637000 1.072000  4.745000 1.778000  2.528000 1.197000  2.217000       2.143000  
1 1 1 2  14 66 o 5.432000 1.063000  5.538000 1.592000  5.326000 1.408000  0.2122000      2.125000  
1 1 1 2  15 1  o 65.29000 0.4893000 65.99000 0.7457000 64.59000 0.6337000 1.400000       0.9786000 
1 1 1 2  15 3  o 31.96000 0.2608000 32.25000 0.3957000 31.68000 0.3397000 0.5766000      0.5215000 
1 1 1 2  15 5  o 51.25000 0.4428000 51.07000 0.7215000 51.43000 0.5136000 -0.3541000     0.8856000 
1 1 1 2  15 7  o 29.16000 0.2466000 29.31000 0.3250000 29.00000 0.3710000 0.3127000      0.4932000 
1 1 1 2  15 9  o 45.68000 0.3806000 45.50000 0.5396000 45.85000 0.5370000 -0.3450000     0.7613000 
1 1 1 2  15 11 o 71.20000 0.5128000 70.18000 0.6191000 72.21000 0.8176000 -2.032000      1.026000  
1 1 1 2  15 13 o 21.52000 0.2492000 21.21000 0.2677000 21.84000 0.4204000 -0.6288000     0.4984000 
1 1 1 2  15 15 o 33.07000 0.2895000 32.88000 0.3687000 33.25000 0.4463000 -0.3631000     0.5789000 
1 1 1 2  15 17 o 60.43000 0.4437000 60.74000 0.7005000 60.13000 0.5447000 0.6116000      0.8874000 
1 1 1 2  15 19 o 72.55000 0.6254000 72.83000 1.021000  72.28000 0.7224000 0.5516000      1.251000  
1 1 1 2  15 21 f 103.3000 0.9170000 103.1000 1.418000  103.5000 1.163000  -0.4081000     1.834000  
1 1 1 2  15 23 o 28.76000 0.3296000 28.62000 0.5556000 28.90000 0.3549000 -0.2781000     0.6593000 
1 1 1 2  15 25 o 81.45000 0.6976000 82.00000 1.140000  80.90000 0.8040000 1.098000       1.395000  
1 1 1 2  15 27 f 17.66000 0.3745000 17.62000 0.6323000 17.70000 0.4016000 -0.8660000E-01 0.7491000 
1 1 1 2  15 29 o 17.39000 0.3342000 17.33000 0.5155000 17.45000 0.4256000 -0.1264000     0.6685000 
1 1 1 2  15 31 o 72.13000 0.5955000 73.36000 0.8465000 70.90000 0.8377000 2.466000       1.191000  
1 1 1 2  15 33 f 38.51000 0.3337000 37.78000 0.5212000 39.24000 0.4169000 -1.453000      0.6674000 
1 1 1 2  15 35 o 59.09000 0.5576000 58.49000 0.8566000 59.69000 0.7140000 -1.199000      1.115000  
1 1 1 2  15 37 o 55.67000 0.4195000 55.95000 0.5949000 55.39000 0.5916000 0.5568000      0.8390000 
1 1 1 2  15 39 o 25.37000 0.3670000 25.32000 0.5070000 25.43000 0.5309000 -0.1125000     0.7341000 
1 1 1 2  15 41 o 14.82000 0.4183000 14.80000 0.5910000 14.84000 0.5920000 -0.4048000E-01 0.8366000 
1 1 1 2  15 43 o 32.84000 0.3594000 32.47000 0.5458000 33.22000 0.4677000 -0.7502000     0.7188000 
1 1 1 2  15 45 o 13.90000 0.4766000 14.28000 0.6618000 13.52000 0.6861000 0.7669000      0.9532000 
1 1 1 2  15 47 o 3.548000 1.040000  3.988000 1.577000  3.107000 1.357000  0.8816000      2.080000  
1 1 1 2  15 49 o 31.47000 0.3342000 31.98000 0.4730000 30.96000 0.4724000 1.021000       0.6685000 
1 1 1 2  15 51 o 12.83000 0.4580000 13.27000 0.6350000 12.38000 0.6602000 0.8871000      0.9160000 
1 1 1 2  15 53 o 10.35000 0.4933000 10.94000 0.6708000 9.763000 0.7236000 1.179000       0.9867000 
1 1 1 2  15 55 o 14.96000 0.3939000 15.57000 0.5180000 14.35000 0.5936000 1.225000       0.7878000 
1 1 1 2  15 57 o 10.43000 0.5436000 10.21000 0.7412000 10.65000 0.7955000 -0.4459000     1.087000  
1 1 1 2  15 59 o 3.320000 0.9696000 2.930000 1.336000  3.710000 1.406000  -0.7792000     1.939000  
1 1 1 2  15 61 o 3.667000 1.027000  3.718000 1.543000  3.616000 1.357000  0.1018000      2.055000  
1 1 1 2  15 63 o 5.533000 1.013000  5.791000 1.595000  5.275000 1.247000  0.5161000      2.025000  
1 1 1 2  15 65 o 6.574000 0.8903000 7.061000 1.362000  6.087000 1.147000  0.9741000      1.781000  
1 1 1 2  16 0  o 80.06000 0.7791000 80.06000 0.7791000 80.06000 0.7791000 0.000000       0.000000  
1 1 1 2  16 2  o 13.32000 0.1787000 13.19000 0.2497000 13.45000 0.2557000 -0.2587000     0.3574000 
1 1 1 2  16 4  o 123.7000 0.9110000 123.3000 1.374000  124.2000 1.197000  -0.9045000     1.822000  
1 1 1 2  16 6  o 127.2000 1.066000  128.3000 1.749000  126.2000 1.219000  2.090000       2.132000  
1 1 1 2  16 8  o 26.27000 0.2628000 26.42000 0.2813000 26.11000 0.4439000 0.3088000      0.5256000 
1 1 1 2  16 10 o 49.90000 0.3711000 49.13000 0.4485000 50.68000 0.5912000 -1.554000      0.7421000 
1 1 1 2  16 12 o 57.21000 0.4769000 58.01000 0.5214000 56.42000 0.7986000 1.587000       0.9537000 
1 1 1 2  16 14 o 69.62000 0.5770000 70.49000 0.6242000 68.75000 0.9706000 1.732000       1.154000  
1 1 1 2  16 16 o 25.58000 0.2580000 25.86000 0.3801000 25.30000 0.3489000 0.5589000      0.5160000 
1 1 1 2  16 18 o 95.55000 0.8079000 95.40000 1.315000  95.70000 0.9389000 -0.3003000     1.616000  
1 1 1 2  16 20 o 128.7000 0.9505000 128.4000 1.433000  128.9000 1.249000  -0.5088000     1.901000  
1 1 1 2  16 22 o 83.19000 0.5986000 83.00000 0.9422000 83.39000 0.7387000 -0.3863000     1.197000  
1 1 1 2  16 24 o 54.97000 0.4907000 54.88000 0.7943000 55.06000 0.5765000 -0.1780000     0.9814000 
1 1 1 2  16 26 o 59.07000 0.4443000 59.11000 0.6984000 59.03000 0.5492000 0.7812000E-01  0.8885000 
1 1 1 2  16 28 o 74.48000 0.6258000 75.19000 1.060000  73.77000 0.6650000 1.415000       1.252000  
1 1 1 2  16 30 o 63.68000 0.4961000 64.05000 0.7499000 63.31000 0.6496000 0.7452000      0.9921000 
1 1 1 2  16 32 o 53.29000 0.4322000 53.53000 0.6504000 53.05000 0.5694000 0.4873000      0.8644000 
1 1 1 2  16 34 o 36.35000 0.3730000 36.20000 0.6247000 36.49000 0.4076000 -0.2825000     0.7459000 
1 1 1 2  16 36 o 73.22000 0.5401000 73.51000 0.8525000 72.93000 0.6635000 0.5775000      1.080000  
1 1 1 2  16 38 o 13.27000 0.5007000 13.13000 0.8106000 13.41000 0.5881000 -0.2793000     1.001000  
1 1 1 2  16 40 o 39.62000 0.3969000 39.03000 0.6600000 40.21000 0.4412000 -1.183000      0.7939000 
1 1 1 2  16 42 o 19.21000 0.4365000 18.80000 0.7390000 19.62000 0.4648000 -0.8131000     0.8731000 
1 1 1 2  16 44 o 5.535000 1.102000  6.373000 1.481000  4.696000 1.631000  1.678000       2.203000  
1 1 1 2  16 46 o 24.03000 0.3469000 24.25000 0.4962000 23.81000 0.4848000 0.4414000      0.6937000 
1 1 1 2  16 48 o 36.19000 0.3707000 36.12000 0.5604000 36.25000 0.4853000 -0.1310000     0.7413000 
1 1 1 2  16 50 o 26.14000 0.4319000 26.51000 0.6597000 25.76000 0.5577000 0.7555000      0.8638000 
1 1 1 2  16 52 o 9.842000 0.5910000 10.90000 0.7871000 8.788000 0.8818000 2.107000       1.182000  
1 1 1 2  16 54 o 10.96000 0.5572000 11.09000 0.9349000 10.83000 0.6065000 0.2629000      1.114000  
1 1 1 2  16 56 o 13.70000 0.4622000 14.07000 0.6897000 13.33000 0.6154000 0.7429000      0.9243000 
1 1 1 2  16 58 o 8.889000 0.7468000 8.988000 1.041000  8.789000 1.071000  0.1990000      1.494000  
1 1 1 2  16 60 f 16.79000 0.5321000 16.66000 0.8777000 16.93000 0.6017000 -0.2692000     1.064000  
1 1 1 2  16 62 o 4.518000 1.096000  5.388000 1.675000  3.647000 1.413000  1.741000       2.192000  
1 1 1 2  16 64 o 5.010000 1.142000  5.245000 1.782000  4.775000 1.429000  0.4696000      2.284000  
1 1 1 2  16 66 o 6.235000 1.347000  5.962000 1.611000  6.509000 2.160000  -0.5475000     2.695000  
1 1 1 2  17 1  o 51.05000 0.3614000 51.09000 0.5113000 51.00000 0.5108000 0.9370000E-01  0.7227000 
1 1 1 2  17 3  o 62.09000 0.5302000 62.42000 0.8673000 61.75000 0.6099000 0.6634000      1.060000  
1 1 1 2  17 5  o 23.50000 0.2437000 23.37000 0.3432000 23.63000 0.3459000 -0.2552000     0.4873000 
1 1 1 2  17 7  o 46.87000 0.3378000 46.88000 0.4778000 46.87000 0.4778000 0.2121000E-02  0.6757000 
1 1 1 2  17 9  f 51.96000 0.3834000 52.13000 0.4726000 51.79000 0.6038000 0.3372000      0.7668000 
1 1 1 2  17 11 o 87.17000 0.7092000 88.06000 0.7693000 86.29000 1.192000  1.770000       1.418000  
1 1 1 2  17 13 o 46.70000 0.5436000 46.52000 0.4327000 46.88000 0.9973000 -0.3654000     1.087000  
1 1 1 2  17 15 o 67.51000 0.5796000 68.51000 0.6837000 66.51000 0.9361000 2.000000       1.159000  
1 1 1 2  17 17 o 76.86000 0.5373000 76.79000 0.7577000 76.94000 0.7620000 -0.1469000     1.075000  
1 1 1 2  17 19 o 87.15000 0.6993000 86.10000 0.9793000 88.19000 0.9985000 -2.091000      1.399000  
1 1 1 2  17 21 f 16.20000 0.3167000 16.32000 0.4725000 16.09000 0.4219000 0.2299000      0.6335000 
1 1 1 2  17 23 o 75.84000 0.5763000 76.13000 0.8705000 75.55000 0.7555000 0.5887000      1.153000  
1 1 1 2  17 25 o 57.22000 0.4323000 57.99000 0.6850000 56.45000 0.5275000 1.534000       0.8645000 
1 1 1 2  17 27 o 52.16000 0.4634000 52.89000 0.7831000 51.42000 0.4955000 1.475000       0.9267000 
1 1 1 2  17 29 o 50.14000 0.3917000 49.98000 0.6136000 50.29000 0.4871000 -0.3150000     0.7835000 
1 1 1 2  17 31 o 50.07000 0.4970000 50.77000 0.6215000 49.38000 0.7756000 1.388000       0.9939000 
1 1 1 2  17 33 o 26.29000 0.3029000 26.32000 0.4788000 26.26000 0.3711000 0.6111000E-01  0.6058000 
1 1 1 2  17 35 o 24.22000 0.3609000 25.22000 0.5803000 23.22000 0.4294000 2.002000       0.7219000 
1 1 1 2  17 37 o 23.28000 0.3247000 23.41000 0.4840000 23.14000 0.4330000 0.2766000      0.6494000 
1 1 1 2  17 39 o 25.92000 0.3192000 26.13000 0.4962000 25.71000 0.4015000 0.4206000      0.6383000 
1 1 1 2  17 41 o 26.11000 0.3352000 26.01000 0.5250000 26.21000 0.4169000 -0.1998000     0.6704000 
1 1 1 2  17 43 f 23.39000 0.3480000 23.34000 0.5348000 23.45000 0.4456000 -0.1086000     0.6961000 
1 1 1 2  17 45 o 4.818000 1.090000  5.726000 1.523000  3.910000 1.559000  1.815000       2.180000  
1 1 1 2  17 47 o 7.597000 0.8239000 7.635000 1.121000  7.559000 1.208000  0.7682000E-01  1.648000  
1 1 1 2  17 49 o 30.63000 0.4068000 30.93000 0.6598000 30.33000 0.4759000 0.6008000      0.8135000 
1 1 1 2  17 51 o 16.76000 0.3817000 17.30000 0.5835000 16.22000 0.4921000 1.081000       0.7633000 
1 1 1 2  17 53 o 11.20000 0.5139000 12.02000 0.7714000 10.37000 0.6790000 1.652000       1.028000  
1 1 1 2  17 55 o 6.144000 0.8788000 7.565000 1.143000  4.723000 1.336000  2.841000       1.758000  
1 1 1 2  17 57 o 4.875000 0.9907000 5.820000 1.478000  3.930000 1.320000  1.890000       1.981000  
1 1 1 2  17 59 o 5.965000 1.230000  5.749000 2.135000  6.181000 1.221000  -0.4313000     2.459000  
1 1 1 2  17 61 o 9.091000 0.7265000 9.076000 1.185000  9.106000 0.8412000 -0.2995000E-01 1.453000  
1 1 1 2  17 63 o 3.547000 1.012000  4.520000 1.649000  2.574000 1.172000  1.946000       2.023000  
1 1 1 2  17 65 o 4.839000 1.053000  5.639000 1.560000  4.039000 1.415000  1.600000       2.107000  
1 1 1 2  18 0  o 3.156000 0.7962000 3.156000 0.7962000 3.156000 0.7962000 0.000000       0.000000  
1 1 1 2  18 2  f 17.46000 0.3199000 17.25000 0.5554000 17.67000 0.3174000 -0.4175000     0.6397000 
1 1 1 2  18 4  o 155.6000 1.059000  156.9000 1.511000  154.4000 1.486000  2.497000       2.119000  
1 1 1 2  18 6  o 46.51000 0.3370000 45.79000 0.4710000 47.24000 0.4822000 -1.449000      0.6741000 
1 1 1 2  18 8  o 44.51000 0.3738000 44.20000 0.5271000 44.81000 0.5302000 -0.6096000     0.7476000 
1 1 1 2  18 10 o 136.2000 1.100000  136.0000 1.175000  136.4000 1.860000  -0.3345000     2.200000  
1 1 1 2  18 12 o 94.19000 1.002000  95.37000 0.8326000 93.01000 1.823000  2.355000       2.004000  
1 1 1 2  18 14 o 40.94000 0.3842000 41.70000 0.4516000 40.18000 0.6218000 1.521000       0.7685000 
1 1 1 2  18 16 o 64.98000 0.4610000 65.00000 0.6506000 64.96000 0.6532000 0.4073000E-01  0.9219000 
1 1 1 2  18 18 o 49.28000 0.4245000 49.94000 0.6110000 48.63000 0.5894000 1.309000       0.8490000 
1 1 1 2  18 20 o 86.17000 0.6469000 85.77000 0.9724000 86.57000 0.8535000 -0.7913000     1.294000  
1 1 1 2  18 22 o 27.08000 0.2942000 26.88000 0.3853000 27.29000 0.4446000 -0.4142000     0.5883000 
1 1 1 2  18 24 o 46.76000 0.4167000 46.78000 0.6958000 46.75000 0.4587000 0.2467000E-01  0.8334000 
1 1 1 2  18 26 o 86.71000 0.6245000 86.48000 0.9826000 86.94000 0.7710000 -0.4549000     1.249000  
1 1 1 2  18 28 o 38.55000 0.3759000 38.94000 0.6290000 38.17000 0.4119000 0.7673000      0.7518000 
1 1 1 2  18 30 f 12.83000 0.3984000 12.69000 0.6408000 12.97000 0.4735000 -0.2761000     0.7968000 
1 1 1 2  18 32 o 15.84000 0.3513000 15.52000 0.5372000 16.16000 0.4527000 -0.6363000     0.7025000 
1 1 1 2  18 34 o 15.76000 0.4396000 16.13000 0.6687000 15.40000 0.5707000 0.7372000      0.8791000 
1 1 1 2  18 36 o 27.92000 0.3138000 28.10000 0.4948000 27.73000 0.3859000 0.3675000      0.6275000 
1 1 1 2  18 38 o 25.24000 0.3226000 24.50000 0.5080000 25.98000 0.3976000 -1.477000      0.6451000 
1 1 1 2  18 40 o 35.92000 0.3542000 36.42000 0.5313000 35.42000 0.4687000 0.9972000      0.7085000 
1 1 1 2  18 42 o 35.19000 0.3915000 35.40000 0.6570000 34.98000 0.4261000 0.4240000      0.7831000 
1 1 1 2  18 44 o 37.00000 0.4212000 37.37000 0.6771000 36.63000 0.5013000 0.7359000      0.8424000 
1 1 1 2  18 46 o 45.02000 0.4279000 45.22000 0.6058000 44.82000 0.6046000 0.3990000      0.8559000 
1 1 1 2  18 48 o 33.51000 0.3847000 33.85000 0.6452000 33.18000 0.4192000 0.6732000      0.7695000 
1 1 1 2  18 50 o 11.09000 0.5014000 10.41000 0.8415000 11.77000 0.5452000 -1.368000      1.003000  
1 1 1 2  18 52 o 17.03000 0.3653000 17.41000 0.5745000 16.64000 0.4515000 0.7736000      0.7306000 
1 1 1 2  18 54 o 4.039000 0.9764000 3.368000 1.474000  4.710000 1.281000  -1.341000      1.953000  
1 1 1 2  18 56 o 8.555000 0.6806000 9.002000 0.9858000 8.107000 0.9386000 0.8953000      1.361000  
1 1 1 2  18 58 o 7.993000 0.7625000 7.421000 1.278000  8.565000 0.8328000 -1.144000      1.525000  
1 1 1 2  18 60 o 4.204000 1.067000  4.441000 1.608000  3.967000 1.404000  0.4745000      2.135000  
1 1 1 2  18 62 o 4.863000 1.102000  5.164000 1.667000  4.562000 1.441000  0.6015000      2.203000  
1 1 1 2  18 64 o 4.084000 0.9934000 4.666000 1.521000  3.501000 1.279000  1.164000       1.987000  
1 1 1 2  19 1  o 110.8000 1.303000  113.7000 1.554000  108.0000 2.092000  5.757000       2.606000  
1 1 1 2  19 3  o 27.59000 0.2472000 27.72000 0.3241000 27.47000 0.3734000 0.2542000      0.4944000 
1 1 1 2  19 5  o 49.91000 0.3877000 49.75000 0.5069000 50.08000 0.5868000 -0.3390000     0.7754000 
1 1 1 2  19 7  o 55.53000 0.4264000 55.34000 0.5571000 55.71000 0.6457000 -0.3702000     0.8528000 
1 1 1 2  19 9  o 80.81000 0.6616000 81.08000 0.7120000 80.55000 1.115000  0.5334000      1.323000  
1 1 1 2  19 11 o 25.66000 0.2912000 25.62000 0.3405000 25.70000 0.4724000 -0.8579000E-01 0.5823000 
1 1 1 2  19 13 o 47.52000 0.4165000 48.07000 0.4499000 46.96000 0.7011000 1.110000       0.8331000 
1 1 1 2  19 15 o 60.76000 0.4459000 61.72000 0.5575000 59.80000 0.6960000 1.928000       0.8917000 
1 1 1 2  19 17 o 138.9000 1.026000  137.9000 1.332000  139.8000 1.560000  -1.929000      2.051000  
1 1 1 2  19 19 o 50.66000 0.4064000 50.65000 0.6105000 50.67000 0.5366000 -0.2531000E-01 0.8128000 
1 1 1 2  19 21 o 72.10000 0.5106000 71.74000 0.7176000 72.47000 0.7267000 -0.7316000     1.021000  
1 1 1 2  19 23 o 36.14000 0.3294000 36.55000 0.4944000 35.73000 0.4353000 0.8158000      0.6588000 
1 1 1 2  19 25 o 42.36000 0.3628000 43.05000 0.4805000 41.68000 0.5437000 1.367000       0.7256000 
1 1 1 2  19 27 o 58.99000 0.5103000 59.04000 0.8590000 58.94000 0.5512000 0.1038000      1.021000  
1 1 1 2  19 29 o 12.08000 0.4216000 11.32000 0.6779000 12.85000 0.5014000 -1.529000      0.8432000 
1 1 1 2  19 31 o 31.60000 0.3544000 31.59000 0.4829000 31.61000 0.5187000 -0.2101000E-01 0.7087000 
1 1 1 2  19 33 o 35.48000 0.3555000 35.85000 0.5031000 35.12000 0.5024000 0.7250000      0.7110000 
1 1 1 2  19 35 o 13.12000 0.4706000 12.97000 0.7879000 13.27000 0.5146000 -0.3003000     0.9411000 
1 1 1 2  19 37 o 28.75000 0.3644000 29.07000 0.6162000 28.43000 0.3892000 0.6345000      0.7288000 
1 1 1 2  19 39 o 43.17000 0.3691000 43.07000 0.5764000 43.27000 0.4612000 -0.1954000     0.7382000 
1 1 1 2  19 41 o 34.14000 0.3580000 33.31000 0.5266000 34.97000 0.4850000 -1.658000      0.7159000 
1 1 1 2  19 43 o 25.39000 0.3355000 25.49000 0.5208000 25.29000 0.4230000 0.2031000      0.6709000 
1 1 1 2  19 45 o 25.38000 0.3979000 25.04000 0.5446000 25.72000 0.5804000 -0.6717000     0.7959000 
1 1 1 2  19 47 o 3.456000 0.9833000 3.457000 1.441000  3.456000 1.338000  0.5717000E-03  1.967000  
1 1 1 2  19 49 o 17.28000 0.3783000 18.01000 0.5915000 16.56000 0.4716000 1.451000       0.7565000 
1 1 1 2  19 51 o 6.009000 0.8279000 6.496000 1.259000  5.523000 1.075000  0.9737000      1.656000  
1 1 1 2  19 53 o 9.152000 0.5884000 8.867000 0.9609000 9.437000 0.6795000 -0.5694000     1.177000  
1 1 1 2  19 55 o 10.65000 0.5368000 10.78000 0.8533000 10.52000 0.6515000 0.2660000      1.074000  
1 1 1 2  19 57 o 12.99000 0.5229000 13.05000 0.7436000 12.92000 0.7353000 0.1321000      1.046000  
1 1 1 2  19 59 o 8.622000 0.7752000 7.894000 1.289000  9.351000 0.8614000 -1.456000      1.550000  
1 1 1 2  19 61 o 4.441000 1.006000  3.502000 1.526000  5.380000 1.310000  -1.877000      2.011000  
1 1 1 2  19 63 o 8.814000 0.7283000 9.543000 1.086000  8.085000 0.9702000 1.458000       1.457000  
1 1 1 2  19 65 o 3.764000 1.091000  3.442000 1.489000  4.087000 1.594000  -0.6450000     2.182000  
1 1 1 2  20 0  o 41.74000 0.4365000 41.74000 0.4365000 41.74000 0.4365000 0.000000       0.000000  
1 1 1 2  20 2  o 23.50000 0.2862000 23.06000 0.3532000 23.93000 0.4505000 -0.8706000     0.5725000 
1 1 1 2  20 4  o 67.65000 0.7482000 68.02000 0.6738000 67.28000 1.336000  0.7453000      1.496000  
1 1 1 2  20 6  f 55.88000 0.4910000 55.40000 0.5600000 56.36000 0.8068000 -0.9581000     0.9821000 
1 1 1 2  20 8  o 22.52000 0.2983000 22.36000 0.3678000 22.68000 0.4697000 -0.3219000     0.5966000 
1 1 1 2  20 10 o 26.88000 0.3046000 26.49000 0.3393000 27.27000 0.5059000 -0.7757000     0.6092000 
1 1 1 2  20 12 o 107.4000 0.8788000 106.2000 0.9247000 108.6000 1.495000  -2.415000      1.758000  
1 1 1 2  20 14 o 145.1000 1.025000  143.7000 1.242000  146.5000 1.632000  -2.761000      2.051000  
1 1 1 2  20 16 o 106.7000 0.8648000 107.1000 0.9340000 106.2000 1.456000  0.9071000      1.730000  
1 1 1 2  20 18 o 107.9000 0.9115000 108.4000 1.492000  107.4000 1.048000  1.026000       1.823000  
1 1 1 2  20 20 o 30.16000 0.2831000 30.17000 0.3956000 30.15000 0.4052000 0.2661000E-01  0.5663000 
1 1 1 2  20 22 o 18.58000 0.3126000 18.64000 0.4651000 18.52000 0.4180000 0.1275000      0.6253000 
1 1 1 2  20 24 o 38.30000 0.3192000 37.85000 0.4497000 38.75000 0.4533000 -0.9011000     0.6385000 
1 1 1 2  20 26 o 42.91000 0.3718000 43.32000 0.5662000 42.50000 0.4821000 0.8173000      0.7436000 
1 1 1 2  20 28 o 34.70000 0.3033000 34.83000 0.4283000 34.56000 0.4294000 0.2722000      0.6065000 
1 1 1 2  20 30 o 29.82000 0.3424000 29.64000 0.4709000 30.00000 0.4972000 -0.3643000     0.6848000 
1 1 1 2  20 32 o 49.84000 0.4121000 50.15000 0.6202000 49.52000 0.5427000 0.6376000      0.8241000 
1 1 1 2  20 34 o 24.13000 0.3487000 23.86000 0.5758000 24.41000 0.3935000 -0.5542000     0.6974000 
1 1 1 2  20 36 o 10.02000 0.6161000 10.45000 0.9863000 9.586000 0.7385000 0.8693000      1.232000  
1 1 1 2  20 38 o 16.90000 0.3787000 16.50000 0.5962000 17.30000 0.4670000 -0.8028000     0.7574000 
1 1 1 2  20 40 o 36.75000 0.3463000 36.49000 0.5403000 37.01000 0.4335000 -0.5212000     0.6927000 
1 1 1 2  20 42 o 18.01000 0.4321000 18.05000 0.7279000 17.96000 0.4660000 0.8428000E-01  0.8643000 
1 1 1 2  20 44 o 14.16000 0.4476000 13.97000 0.7047000 14.35000 0.5521000 -0.3853000     0.8952000 
1 1 1 2  20 46 o 22.07000 0.3536000 22.20000 0.5490000 21.94000 0.4457000 0.2646000      0.7072000 
1 1 1 2  20 48 o 22.45000 0.5059000 23.05000 0.8859000 21.84000 0.4889000 1.208000       1.012000  
1 1 1 2  20 50 o 10.91000 0.5271000 10.66000 0.8681000 11.15000 0.5981000 -0.4931000     1.054000  
1 1 1 2  20 52 o 6.653000 0.7599000 6.813000 1.199000  6.493000 0.9337000 0.3194000      1.520000  
1 1 1 2  20 54 o 3.856000 1.049000  4.152000 1.653000  3.559000 1.291000  0.5927000      2.097000  
1 1 1 2  20 56 o 8.171000 0.7700000 7.482000 1.242000  8.860000 0.9111000 -1.378000      1.540000  
1 1 1 2  20 58 o 11.15000 0.7189000 10.80000 1.225000  11.50000 0.7532000 -0.6960000     1.438000  
1 1 1 2  20 60 o 4.812000 1.069000  4.609000 1.627000  5.015000 1.387000  -0.4061000     2.138000  
1 1 1 2  20 62 o 4.076000 1.058000  4.208000 1.653000  3.943000 1.321000  0.2650000      2.116000  
1 1 1 2  20 64 o 3.115000 0.9285000 3.759000 1.482000  2.470000 1.119000  1.289000       1.857000  
1 1 1 2  21 1  o 37.82000 0.3506000 38.23000 0.4093000 37.42000 0.5693000 0.8051000      0.7012000 
1 1 1 2  21 3  o 147.8000 1.234000  148.2000 1.428000  147.4000 2.013000  0.7563000      2.468000  
1 1 1 2  21 5  o 83.90000 0.9537000 83.38000 0.9442000 84.43000 1.657000  -1.048000      1.907000  
1 1 1 2  21 7  o 134.8000 0.9963000 133.2000 1.287000  136.3000 1.521000  -3.161000      1.993000  
1 1 1 2  21 9  o 102.6000 0.7637000 102.3000 0.9951000 103.0000 1.159000  -0.6922000     1.527000  
1 1 1 2  21 11 o 142.5000 1.005000  142.3000 1.230000  142.7000 1.590000  -0.4569000     2.010000  
1 1 1 2  21 13 o 62.74000 0.4618000 62.78000 0.5682000 62.70000 0.7281000 0.7623000E-01  0.9235000 
1 1 1 2  21 15 o 50.04000 0.4317000 50.45000 0.4751000 49.63000 0.7209000 0.8166000      0.8634000 
1 1 1 2  21 17 f 71.12000 0.6144000 70.83000 0.9995000 71.41000 0.7147000 -0.5798000     1.229000  
1 1 1 2  21 19 f 72.62000 0.5140000 73.14000 0.7300000 72.09000 0.7238000 1.054000       1.028000  
1 1 1 2  21 21 f 72.73000 0.5563000 72.86000 0.8403000 72.60000 0.7293000 0.2578000      1.113000  
1 1 1 2  21 23 o 96.54000 0.6703000 96.77000 0.9493000 96.32000 0.9465000 0.4577000      1.341000  
1 1 1 2  21 25 o 22.77000 0.3074000 22.05000 0.4011000 23.49000 0.4659000 -1.439000      0.6147000 
1 1 1 2  21 27 o 35.56000 0.3358000 35.58000 0.5022000 35.55000 0.4459000 0.2510000E-01  0.6716000 
1 1 1 2  21 29 o 41.50000 0.3379000 41.81000 0.4778000 41.18000 0.4778000 0.6395000      0.6757000 
1 1 1 2  21 31 f 25.01000 0.3641000 24.79000 0.4077000 25.24000 0.6035000 -0.4428000     0.7283000 
1 1 1 2  21 33 o 39.84000 0.3581000 40.04000 0.5394000 39.65000 0.4711000 0.3885000      0.7162000 
1 1 1 2  21 35 o 32.84000 0.3740000 32.15000 0.5987000 33.53000 0.4484000 -1.386000      0.7480000 
1 1 1 2  21 37 o 40.37000 0.3530000 40.80000 0.5567000 39.94000 0.4343000 0.8640000      0.7061000 
1 1 1 2  21 39 o 7.443000 0.7819000 7.985000 1.168000  6.900000 1.039000  1.085000       1.564000  
1 1 1 2  21 41 o 13.93000 0.5027000 14.17000 0.8336000 13.68000 0.5620000 0.4855000      1.005000  
1 1 1 2  21 43 o 15.41000 0.4222000 15.03000 0.6592000 15.79000 0.5278000 -0.7608000     0.8445000 
1 1 1 2  21 45 f 11.40000 0.8122000 11.58000 0.7984000 11.22000 1.415000  0.3567000      1.624000  
1 1 1 2  21 47 o 4.304000 0.9652000 3.833000 1.443000  4.775000 1.282000  -0.9424000     1.930000  
1 1 1 2  21 49 o 26.32000 0.3313000 26.28000 0.5191000 26.36000 0.4120000 -0.7262000E-01 0.6627000 
1 1 1 2  21 51 o 13.87000 0.4183000 14.32000 0.6586000 13.42000 0.5159000 0.8988000      0.8366000 
1 1 1 2  21 53 o 14.61000 0.4162000 14.54000 0.6668000 14.68000 0.4984000 -0.1454000     0.8325000 
1 1 1 2  21 55 o 7.127000 0.7992000 7.202000 1.262000  7.051000 0.9804000 0.1506000      1.598000  
1 1 1 2  21 57 o 7.468000 0.7945000 7.068000 1.355000  7.867000 0.8295000 -0.7987000     1.589000  
1 1 1 2  21 59 o 3.584000 1.040000  4.214000 1.650000  2.954000 1.266000  1.259000       2.080000  
1 1 1 2  21 61 o 4.228000 1.102000  4.533000 1.624000  3.923000 1.489000  0.6103000      2.203000  
1 1 1 2  21 63 o 3.084000 0.9282000 3.785000 1.470000  2.383000 1.134000  1.402000       1.856000  
1 1 1 2  22 0  o 80.67000 0.7916000 80.67000 0.7916000 80.67000 0.7916000 0.000000       0.000000  
1 1 1 2  22 2  o 71.01000 0.6086000 70.66000 0.6993000 71.36000 0.9962000 -0.7008000     1.217000  
1 1 1 2  22 4  o 86.91000 0.6498000 87.37000 0.9862000 86.45000 0.8464000 0.9191000      1.300000  
1 1 1 2  22 6  o 35.09000 0.2795000 35.13000 0.3969000 35.05000 0.3937000 0.7959000E-01  0.5590000 
1 1 1 2  22 8  o 144.1000 1.135000  142.3000 1.585000  146.0000 1.626000  -3.719000      2.271000  
1 1 1 2  22 10 o 159.2000 1.172000  158.9000 1.532000  159.4000 1.774000  -0.4768000     2.344000  
1 1 1 2  22 12 o 26.51000 0.2741000 26.58000 0.3639000 26.44000 0.4099000 0.1334000      0.5481000 
1 1 1 2  22 14 o 60.60000 0.5122000 60.20000 0.5502000 61.01000 0.8641000 -0.8145000     1.024000  
1 1 1 2  22 16 o 18.38000 0.2952000 18.63000 0.3981000 18.13000 0.4360000 0.5008000      0.5905000 
1 1 1 2  22 18 o 42.87000 0.3864000 43.11000 0.5486000 42.64000 0.5443000 0.4701000      0.7728000 
1 1 1 2  22 20 o 47.28000 0.3899000 47.19000 0.5099000 47.37000 0.5899000 -0.1859000     0.7797000 
1 1 1 2  22 22 o 53.08000 0.3965000 53.09000 0.5594000 53.06000 0.5622000 0.2453000E-01  0.7931000 
1 1 1 2  22 24 o 44.59000 0.3489000 44.49000 0.4889000 44.69000 0.4980000 -0.2037000     0.6979000 
1 1 1 2  22 26 o 45.47000 0.3851000 45.81000 0.5854000 45.14000 0.5004000 0.6656000      0.7701000 
1 1 1 2  22 28 o 43.16000 0.3458000 42.87000 0.4852000 43.45000 0.4928000 -0.5769000     0.6916000 
1 1 1 2  22 30 o 5.250000 1.007000  5.252000 1.212000  5.248000 1.609000  0.4541000E-02  2.014000  
1 1 1 2  22 32 o 57.58000 0.4611000 57.95000 0.6953000 57.22000 0.6058000 0.7278000      0.9221000 
1 1 1 2  22 34 o 28.17000 0.3560000 28.32000 0.5097000 28.02000 0.4972000 0.3043000      0.7120000 
1 1 1 2  22 36 o 16.01000 0.3586000 15.79000 0.5124000 16.23000 0.5018000 -0.4478000     0.7172000 
1 1 1 2  22 38 o 12.81000 0.4312000 12.40000 0.6229000 13.23000 0.5966000 -0.8276000     0.8625000 
1 1 1 2  22 40 o 22.52000 0.3562000 22.86000 0.5320000 22.17000 0.4738000 0.6923000      0.7124000 
1 1 1 2  22 42 o 28.51000 0.3805000 27.97000 0.6363000 29.05000 0.4174000 -1.081000      0.7610000 
1 1 1 2  22 44 o 16.20000 0.4087000 16.44000 0.6358000 15.97000 0.5139000 0.4720000      0.8175000 
1 1 1 2  22 46 o 17.81000 0.3616000 17.54000 0.5708000 18.08000 0.4440000 -0.5365000     0.7231000 
1 1 1 2  22 48 o 21.27000 0.3921000 21.38000 0.6626000 21.17000 0.4195000 0.2056000      0.7842000 
1 1 1 2  22 50 o 6.091000 0.8302000 5.730000 1.403000  6.452000 0.8881000 -0.7221000     1.660000  
1 1 1 2  22 52 o 9.525000 0.5388000 9.479000 0.8708000 9.572000 0.6350000 -0.9250000E-01 1.078000  
1 1 1 2  22 54 f 3.572000 0.9715000 3.034000 1.379000  4.110000 1.369000  -1.076000      1.943000  
1 1 1 2  22 56 f 12.48000 0.4963000 11.90000 0.7184000 13.07000 0.6849000 -1.176000      0.9925000 
1 1 1 2  22 58 o 11.74000 0.4886000 12.15000 0.6708000 11.33000 0.7105000 0.8203000      0.9771000 
1 1 1 2  22 60 o 4.436000 1.006000  5.142000 1.418000  3.729000 1.427000  1.413000       2.012000  
1 1 1 2  22 62 f 4.712000 1.083000  4.836000 1.585000  4.588000 1.477000  0.2485000      2.166000  
1 1 1 2  22 64 o 4.705000 1.415000  4.865000 2.054000  4.544000 1.945000  0.3207000      2.829000  
1 1 1 2  23 1  o 99.59000 0.8845000 99.66000 1.120000  99.52000 1.369000  0.1370000      1.769000  
1 1 1 2  23 3  o 65.07000 0.4592000 64.53000 0.6436000 65.60000 0.6551000 -1.069000      0.9184000 
1 1 1 2  23 5  o 14.52000 0.2527000 14.55000 0.3577000 14.49000 0.3572000 0.6291000E-01  0.5055000 
1 1 1 2  23 7  o 52.66000 0.3829000 52.56000 0.5413000 52.76000 0.5416000 -0.1984000     0.7657000 
1 1 1 2  23 9  o 98.87000 0.6822000 98.95000 0.9660000 98.79000 0.9635000 0.1647000      1.364000  
1 1 1 2  23 11 o 139.1000 1.097000  138.6000 1.546000  139.6000 1.557000  -1.039000      2.194000  
1 1 1 2  23 13 o 47.70000 0.4148000 48.36000 0.4609000 47.04000 0.6898000 1.320000       0.8296000 
1 1 1 2  23 15 o 88.55000 0.6670000 87.79000 0.8671000 89.31000 1.014000  -1.525000      1.334000  
1 1 1 2  23 17 o 69.07000 0.5071000 69.03000 0.6231000 69.11000 0.8002000 -0.8502000E-01 1.014000  
1 1 1 2  23 19 f 46.00000 0.3800000 46.31000 0.5019000 45.68000 0.5706000 0.6278000      0.7600000 
1 1 1 2  23 21 o 54.88000 0.4057000 55.03000 0.5740000 54.73000 0.5735000 0.3015000      0.8114000 
1 1 1 2  23 23 o 25.98000 0.3047000 25.53000 0.3851000 26.43000 0.4723000 -0.8978000     0.6094000 
1 1 1 2  23 25 o 31.04000 0.3171000 30.29000 0.4724000 31.78000 0.4232000 -1.481000      0.6342000 
1 1 1 2  23 27 o 33.52000 0.3033000 33.77000 0.4276000 33.28000 0.4303000 0.4877000      0.6066000 
1 1 1 2  23 29 o 52.39000 0.4296000 52.41000 0.5587000 52.37000 0.6526000 0.3984000E-01  0.8591000 
1 1 1 2  23 31 o 15.55000 0.3952000 15.65000 0.5594000 15.45000 0.5584000 0.1962000      0.7904000 
1 1 1 2  23 33 o 30.57000 0.3070000 30.58000 0.4364000 30.57000 0.4320000 0.1032000E-01  0.6141000 
1 1 1 2  23 35 o 28.90000 0.3363000 29.21000 0.5099000 28.59000 0.4384000 0.6140000      0.6725000 
1 1 1 2  23 37 o 21.74000 0.3167000 21.78000 0.4418000 21.70000 0.4541000 0.7925000E-01  0.6335000 
1 1 1 2  23 39 o 14.77000 0.4053000 14.48000 0.5937000 15.06000 0.5520000 -0.5860000     0.8106000 
1 1 1 2  23 41 o 14.77000 0.4538000 15.00000 0.6876000 14.53000 0.5923000 0.4662000      0.9075000 
1 1 1 2  23 43 o 22.18000 0.3457000 22.14000 0.4906000 22.22000 0.4870000 -0.8111000E-01 0.6913000 
1 1 1 2  23 45 o 8.495000 0.7208000 8.735000 0.8432000 8.254000 1.169000  0.4809000      1.442000  
1 1 1 2  23 47 o 6.578000 0.8059000 6.149000 1.274000  7.006000 0.9869000 -0.8574000     1.612000  
1 1 1 2  23 49 o 8.997000 0.5340000 9.093000 0.7298000 8.901000 0.7797000 0.1915000      1.068000  
1 1 1 2  23 51 o 7.139000 0.6751000 6.674000 1.004000  7.605000 0.9026000 -0.9317000     1.350000  
1 1 1 2  23 53 o 9.315000 0.5612000 8.661000 0.8171000 9.968000 0.7694000 -1.307000      1.122000  
1 1 1 2  23 55 o 7.544000 0.8160000 7.690000 1.126000  7.398000 1.181000  0.2922000      1.632000  
1 1 1 2  23 57 o 2.910000 0.9670000 2.782000 1.301000  3.037000 1.431000  -0.2554000     1.934000  
1 1 1 2  23 59 o 8.513000 0.7554000 9.159000 1.064000  7.866000 1.073000  1.293000       1.511000  
1 1 1 2  23 61 o 3.308000 0.9903000 3.286000 1.371000  3.330000 1.430000  -0.4441000E-01 1.981000  
1 1 1 2  23 63 o 3.686000 0.9483000 4.507000 1.428000  2.865000 1.248000  1.643000       1.897000  
1 1 1 2  24 0  o 16.52000 0.4115000 16.52000 0.4115000 16.52000 0.4115000 0.000000       0.000000  
1 1 1 2  24 2  o 75.61000 0.6807000 75.04000 1.047000  76.19000 0.8696000 -1.151000      1.361000  
1 1 1 2  24 4  o 116.4000 0.7982000 117.3000 1.137000  115.5000 1.120000  1.766000       1.596000  
1 1 1 2  24 6  o 84.66000 0.5886000 85.34000 0.8386000 83.98000 0.8260000 1.354000       1.177000  
1 1 1 2  24 8  o 95.58000 0.6604000 95.15000 0.9298000 96.00000 0.9379000 -0.8435000     1.321000  
1 1 1 2  24 10 o 68.35000 0.4844000 68.47000 0.6873000 68.22000 0.6828000 0.2494000      0.9688000 
1 1 1 2  24 12 o 35.23000 0.3511000 36.00000 0.4344000 34.46000 0.5518000 1.549000       0.7022000 
1 1 1 2  24 14 o 52.01000 0.4980000 52.36000 0.7785000 51.67000 0.6214000 0.6898000      0.9960000 
1 1 1 2  24 16 f 60.96000 0.4750000 60.69000 0.6204000 61.23000 0.7196000 -0.5478000     0.9501000 
1 1 1 2  24 18 o 48.69000 0.3965000 48.47000 0.5173000 48.91000 0.6009000 -0.4414000     0.7929000 
1 1 1 2  24 20 f 43.67000 0.3674000 43.65000 0.5506000 43.68000 0.4867000 -0.2659000E-01 0.7349000 
1 1 1 2  24 22 f 45.05000 0.3509000 45.00000 0.4927000 45.11000 0.4997000 -0.1063000     0.7018000 
1 1 1 2  24 24 o 42.35000 0.3661000 41.35000 0.5468000 43.35000 0.4869000 -1.994000      0.7322000 
1 1 1 2  24 26 o 50.24000 0.3816000 49.28000 0.5297000 51.19000 0.5495000 -1.910000      0.7633000 
1 1 1 2  24 28 o 39.41000 0.3284000 39.48000 0.4658000 39.33000 0.4630000 0.1588000      0.6568000 
1 1 1 2  24 30 o 16.21000 0.5718000 16.54000 0.4633000 15.89000 1.046000  0.6490000      1.144000  
1 1 1 2  24 32 o 43.17000 0.3535000 43.17000 0.4938000 43.18000 0.5060000 -0.1674000E-01 0.7070000 
1 1 1 2  24 34 o 30.52000 0.3873000 30.64000 0.6362000 30.40000 0.4420000 0.2366000      0.7746000 
1 1 1 2  24 36 o 41.63000 0.3498000 41.99000 0.4948000 41.26000 0.4945000 0.7385000      0.6995000 
1 1 1 2  24 38 o 11.57000 0.4960000 10.86000 0.7451000 12.28000 0.6548000 -1.415000      0.9920000 
1 1 1 2  24 40 o 18.92000 0.3612000 18.54000 0.5218000 19.30000 0.4996000 -0.7573000     0.7224000 
1 1 1 2  24 42 o 13.58000 0.4430000 12.86000 0.6559000 14.29000 0.5957000 -1.430000      0.8860000 
1 1 1 2  24 44 o 9.335000 0.7031000 10.07000 0.7293000 8.595000 1.202000  1.480000       1.406000  
1 1 1 2  24 46 o 4.978000 1.054000  5.168000 1.484000  4.788000 1.498000  0.3798000      2.108000  
1 1 1 2  24 48 o 6.879000 0.7794000 7.879000 1.010000  5.880000 1.187000  1.999000       1.559000  
1 1 1 2  24 50 o 20.02000 0.3298000 20.17000 0.4621000 19.86000 0.4706000 0.3013000      0.6595000 
1 1 1 2  24 52 o 4.151000 0.9664000 4.131000 1.344000  4.170000 1.389000  -0.3886000E-01 1.933000  
1 1 1 2  24 54 o 6.894000 0.9585000 7.139000 1.396000  6.650000 1.314000  0.4883000      1.917000  
1 1 1 2  24 56 o 7.922000 0.8760000 8.089000 1.047000  7.755000 1.405000  0.3346000      1.752000  
1 1 1 2  24 58 o 5.482000 0.9718000 4.575000 1.483000  6.388000 1.257000  -1.813000      1.944000  
1 1 1 2  24 60 o 9.095000 0.6863000 8.934000 0.9001000 9.257000 1.036000  -0.3234000     1.373000  
1 1 1 2  24 62 o 4.496000 1.030000  4.149000 1.506000  4.844000 1.406000  -0.6951000     2.061000  
1 1 1 2  25 1  o 107.5000 0.7397000 108.1000 1.053000  106.9000 1.040000  1.205000       1.479000  
1 1 1 2  25 3  o 73.38000 0.5557000 72.71000 0.8335000 74.06000 0.7352000 -1.342000      1.111000  
1 1 1 2  25 5  o 32.69000 0.4455000 32.69000 0.7724000 32.70000 0.4442000 -0.1096000E-01 0.8910000 
1 1 1 2  25 7  o 73.14000 0.5147000 72.63000 0.7240000 73.66000 0.7317000 -1.037000      1.029000  
1 1 1 2  25 9  o 56.71000 0.4460000 56.27000 0.6730000 57.16000 0.5854000 -0.8935000     0.8920000 
1 1 1 2  25 11 o 51.67000 0.4644000 52.00000 0.5545000 51.35000 0.7451000 0.6537000      0.9288000 
1 1 1 2  25 13 o 26.83000 0.2931000 26.89000 0.4027000 26.77000 0.4260000 0.1197000      0.5862000 
1 1 1 2  25 15 o 51.32000 0.4121000 50.87000 0.5386000 51.77000 0.6238000 -0.9046000     0.8242000 
1 1 1 2  25 17 o 31.88000 0.3252000 31.40000 0.4535000 32.37000 0.4663000 -0.9718000     0.6505000 
1 1 1 2  25 19 o 45.22000 0.3765000 45.03000 0.5642000 45.41000 0.4988000 -0.3770000     0.7531000 
1 1 1 2  25 21 o 78.46000 0.5539000 77.56000 0.7745000 79.37000 0.7921000 -1.806000      1.108000  
1 1 1 2  25 23 o 19.12000 0.3142000 18.81000 0.4773000 19.43000 0.4088000 -0.6281000     0.6285000 
1 1 1 2  25 25 o 32.03000 0.3188000 31.98000 0.4727000 32.08000 0.4279000 -0.1078000     0.6376000 
1 1 1 2  25 27 o 4.619000 0.8551000 4.210000 1.217000  5.028000 1.202000  -0.8182000     1.710000  
1 1 1 2  25 29 o 27.93000 0.4946000 28.99000 0.4139000 26.86000 0.8986000 2.128000       0.9893000 
1 1 1 2  25 31 o 50.52000 0.3901000 51.06000 0.5557000 49.98000 0.5475000 1.076000       0.7801000 
1 1 1 2  25 33 o 38.20000 0.4317000 37.79000 0.6689000 38.60000 0.5460000 -0.8041000     0.8634000 
1 1 1 2  25 35 o 44.69000 0.3919000 44.37000 0.5130000 45.02000 0.5926000 -0.6451000     0.7838000 
1 1 1 2  25 37 o 17.96000 0.3673000 18.13000 0.5251000 17.79000 0.5138000 0.3485000      0.7347000 
1 1 1 2  25 39 o 5.345000 1.000000  5.208000 1.449000  5.482000 1.378000  -0.2745000     2.000000  
1 1 1 2  25 41 o 15.82000 0.4217000 16.18000 0.6332000 15.46000 0.5571000 0.7146000      0.8434000 
1 1 1 2  25 43 o 20.00000 0.3702000 19.94000 0.5742000 20.05000 0.4675000 -0.1128000     0.7404000 
1 1 1 2  25 45 o 4.246000 1.094000  3.737000 1.385000  4.754000 1.693000  -1.017000      2.187000  
1 1 1 2  25 47 o 12.80000 0.4191000 12.47000 0.5871000 13.14000 0.5982000 -0.6659000     0.8381000 
1 1 1 2  25 49 o 3.336000 0.9015000 4.022000 1.365000  2.651000 1.177000  1.372000       1.803000  
1 1 1 2  25 51 o 7.694000 0.6450000 8.431000 0.8498000 6.956000 0.9705000 1.475000       1.290000  
1 1 1 2  25 53 o 10.49000 0.5121000 10.54000 0.7420000 10.44000 0.7060000 0.9876000E-01  1.024000  
1 1 1 2  25 55 o 11.85000 0.4805000 12.18000 0.6697000 11.53000 0.6892000 0.6446000      0.9610000 
1 1 1 2  25 57 o 3.525000 0.9788000 3.238000 1.304000  3.813000 1.460000  -0.5752000     1.958000  
1 1 1 2  25 59 o 6.786000 0.8508000 5.974000 1.357000  7.599000 1.026000  -1.625000      1.702000  
1 1 1 2  25 61 o 3.043000 0.9178000 2.981000 1.292000  3.105000 1.304000  -0.1242000     1.836000  
1 1 1 2  26 0  o 76.95000 0.7613000 76.95000 0.7613000 76.95000 0.7613000 0.000000       0.000000  
1 1 1 2  26 2  o 102.2000 0.7045000 101.6000 0.9896000 102.9000 1.003000  -1.330000      1.409000  
1 1 1 2  26 4  o 54.75000 0.4309000 53.99000 0.6448000 55.52000 0.5718000 -1.530000      0.8618000 
1 1 1 2  26 6  o 37.86000 0.3991000 38.62000 0.6327000 37.09000 0.4867000 1.524000       0.7983000 
1 1 1 2  26 8  o 83.85000 0.7175000 84.34000 1.176000  83.36000 0.8218000 0.9740000      1.435000  
1 1 1 2  26 10 o 106.8000 0.8496000 106.7000 1.202000  106.8000 1.201000  -0.1785000     1.699000  
1 1 1 2  26 12 o 18.29000 0.2987000 17.98000 0.4179000 18.60000 0.4270000 -0.6193000     0.5974000 
1 1 1 2  26 14 o 68.33000 0.5246000 68.22000 0.6879000 68.45000 0.7923000 -0.2358000     1.049000  
1 1 1 2  26 16 o 39.46000 0.3439000 39.19000 0.4556000 39.73000 0.5154000 -0.5368000     0.6879000 
1 1 1 2  26 18 o 28.13000 0.3110000 28.32000 0.4403000 27.94000 0.4393000 0.3881000      0.6219000 
1 1 1 2  26 20 o 9.863000 0.4027000 10.22000 0.5121000 9.508000 0.6216000 0.7099000      0.8054000 
1 1 1 2  26 22 o 37.29000 0.3123000 37.14000 0.4361000 37.44000 0.4473000 -0.2993000     0.6247000 
1 1 1 2  26 24 o 45.14000 0.3858000 45.09000 0.5837000 45.18000 0.5048000 -0.8717000E-01 0.7717000 
1 1 1 2  26 26 o 31.01000 0.2978000 30.81000 0.4172000 31.22000 0.4251000 -0.4106000     0.5957000 
1 1 1 2  26 28 o 24.93000 0.3452000 24.77000 0.4038000 25.10000 0.5599000 -0.3357000     0.6903000 
1 1 1 2  26 30 o 8.494000 0.6077000 8.214000 0.8051000 8.775000 0.9104000 -0.5610000     1.215000  
1 1 1 2  26 32 o 21.98000 0.3336000 22.01000 0.4389000 21.96000 0.5024000 0.4684000E-01  0.6671000 
1 1 1 2  26 34 o 34.48000 0.3505000 34.51000 0.5348000 34.45000 0.4532000 0.6077000E-01  0.7010000 
1 1 1 2  26 36 o 44.66000 0.3661000 44.81000 0.5163000 44.50000 0.5193000 0.3052000      0.7323000 
1 1 1 2  26 38 o 5.556000 0.9630000 5.447000 1.429000  5.665000 1.291000  -0.2185000     1.926000  
1 1 1 2  26 40 o 14.62000 0.4108000 14.12000 0.5843000 15.13000 0.5777000 -1.011000      0.8216000 
1 1 1 2  26 42 o 12.63000 0.5149000 12.23000 0.7870000 13.03000 0.6641000 -0.7954000     1.030000  
1 1 1 2  26 44 o 8.741000 0.8269000 9.571000 0.8094000 7.911000 1.442000  1.660000       1.654000  
1 1 1 2  26 46 f 14.11000 0.4182000 14.22000 0.5952000 14.00000 0.5877000 0.2219000      0.8365000 
1 1 1 2  26 48 o 8.381000 0.6249000 7.887000 0.9985000 8.875000 0.7516000 -0.9872000     1.250000  
1 1 1 2  26 50 o 3.676000 0.9380000 3.758000 1.331000  3.595000 1.322000  0.1631000      1.876000  
1 1 1 2  26 52 o 6.091000 0.8298000 5.612000 1.247000  6.570000 1.095000  -0.9581000     1.660000  
1 1 1 2  26 54 o 14.78000 0.4554000 14.83000 0.6600000 14.73000 0.6277000 0.1001000      0.9108000 
1 1 1 2  26 56 o 14.80000 0.4822000 14.80000 0.6656000 14.80000 0.6978000 0.2612000E-02  0.9644000 
1 1 1 2  26 58 o 8.985000 0.6364000 8.973000 0.8864000 8.998000 0.9135000 -0.2431000E-01 1.273000  
1 1 1 2  26 60 o 3.397000 0.9514000 3.005000 1.290000  3.789000 1.399000  -0.7848000     1.903000  
1 1 1 2  26 62 o 4.242000 1.053000  5.065000 1.557000  3.418000 1.418000  1.646000       2.106000  
1 1 1 2  27 1  o 16.76000 0.2676000 16.70000 0.3759000 16.82000 0.3810000 -0.1236000     0.5352000 
1 1 1 2  27 3  o 34.11000 0.2875000 33.97000 0.4062000 34.26000 0.4069000 -0.2869000     0.5750000 
1 1 1 2  27 5  o 76.18000 0.5342000 76.02000 0.7535000 76.35000 0.7575000 -0.3252000     1.068000  
1 1 1 2  27 7  f 188.9000 1.286000  187.2000 1.803000  190.6000 1.835000  -3.412000      2.572000  
1 1 1 2  27 9  o 75.96000 0.5766000 75.96000 0.7564000 75.95000 0.8705000 0.7774000E-02  1.153000  
1 1 1 2  27 11 o 24.81000 0.2780000 24.67000 0.4149000 24.96000 0.3700000 -0.2969000     0.5559000 
1 1 1 2  27 13 o 38.19000 0.3346000 38.40000 0.4447000 37.98000 0.5002000 0.4162000      0.6693000 
1 1 1 2  27 15 o 42.29000 0.3584000 42.78000 0.4799000 41.79000 0.5324000 0.9877000      0.7167000 
1 1 1 2  27 17 o 47.49000 0.3910000 47.59000 0.5167000 47.38000 0.5869000 0.2162000      0.7820000 
1 1 1 2  27 19 o 19.76000 0.2902000 19.92000 0.4299000 19.60000 0.3900000 0.3247000      0.5804000 
1 1 1 2  27 21 o 3.389000 0.8623000 2.985000 1.208000  3.792000 1.231000  -0.8074000     1.725000  
1 1 1 2  27 23 o 43.50000 0.3751000 42.99000 0.5651000 44.00000 0.4935000 -1.015000      0.7503000 
1 1 1 2  27 25 o 44.31000 0.3530000 43.97000 0.4941000 44.65000 0.5043000 -0.6820000     0.7060000 
1 1 1 2  27 27 o 26.36000 0.3093000 26.50000 0.4056000 26.22000 0.4671000 0.2767000      0.6186000 
1 1 1 2  27 29 o 32.39000 0.3629000 32.94000 0.4996000 31.85000 0.5264000 1.088000       0.7258000 
1 1 1 2  27 31 o 36.30000 0.3503000 36.26000 0.4611000 36.35000 0.5275000 -0.9682000E-01 0.7006000 
1 1 1 2  27 33 o 17.82000 0.4372000 17.73000 0.7344000 17.90000 0.4747000 -0.1658000     0.8745000 
1 1 1 2  27 35 o 47.80000 0.4124000 48.26000 0.6258000 47.33000 0.5372000 0.9346000      0.8247000 
1 1 1 2  27 37 o 5.606000 0.9339000 5.147000 1.414000  6.065000 1.221000  -0.9180000     1.868000  
1 1 1 2  27 39 o 25.87000 0.3301000 26.14000 0.4575000 25.60000 0.4759000 0.5359000      0.6601000 
1 1 1 2  27 41 o 17.56000 0.3704000 17.10000 0.5108000 18.02000 0.5365000 -0.9186000     0.7408000 
1 1 1 2  27 43 o 23.87000 0.3238000 24.55000 0.4542000 23.20000 0.4617000 1.351000       0.6477000 
1 1 1 2  27 45 o 3.343000 0.9393000 2.892000 1.243000  3.795000 1.409000  -0.9028000     1.879000  
1 1 1 2  27 47 o 6.968000 0.6540000 7.178000 0.9154000 6.758000 0.9342000 0.4207000      1.308000  
1 1 1 2  27 49 o 3.774000 0.8309000 2.185000 1.040000  5.363000 1.296000  -3.178000      1.662000  
1 1 1 2  27 51 o 19.03000 0.3473000 19.15000 0.4640000 18.90000 0.5168000 0.2513000      0.6945000 
1 1 1 2  27 53 o 11.04000 0.6289000 11.20000 0.8581000 10.88000 0.9197000 0.3145000      1.258000  
1 1 1 2  27 55 o 9.823000 0.8165000 9.986000 0.9896000 9.659000 1.299000  0.3271000      1.633000  
1 1 1 2  27 57 o 6.598000 0.7949000 7.364000 1.058000  5.832000 1.187000  1.532000       1.590000  
1 1 1 2  27 59 o 4.064000 0.9897000 4.931000 1.477000  3.197000 1.317000  1.734000       1.979000  
1 1 1 2  27 61 o 4.491000 1.000000  5.376000 1.466000  3.606000 1.361000  1.770000       2.001000  
1 1 1 2  28 0  f 38.22000 0.4332000 38.22000 0.4332000 38.22000 0.4332000 0.000000       0.000000  
1 1 1 2  28 2  o 41.65000 0.3242000 40.98000 0.4518000 42.32000 0.4651000 -1.340000      0.6484000 
1 1 1 2  28 4  o 10.80000 0.3614000 10.82000 0.5177000 10.78000 0.5044000 0.4973000E-01  0.7228000 
1 1 1 2  28 6  o 73.11000 0.5165000 72.41000 0.7232000 73.81000 0.7377000 -1.398000      1.033000  
1 1 1 2  28 8  f 10.57000 0.4622000 11.33000 0.5048000 9.816000 0.7743000 1.516000       0.9243000 
1 1 1 2  28 10 o 53.64000 0.3953000 53.24000 0.5562000 54.04000 0.5618000 -0.8042000     0.7906000 
1 1 1 2  28 12 o 50.07000 0.4561000 49.77000 0.5311000 50.38000 0.7416000 -0.6037000     0.9122000 
1 1 1 2  28 14 o 104.4000 0.7803000 103.6000 1.013000  105.3000 1.187000  -1.696000      1.561000  
1 1 1 2  28 16 o 72.09000 0.5518000 72.36000 0.7271000 71.83000 0.8303000 0.5286000      1.104000  
1 1 1 2  28 18 o 36.98000 0.3196000 36.97000 0.3989000 37.00000 0.4994000 -0.3188000E-01 0.6392000 
1 1 1 2  28 20 o 49.19000 0.3749000 49.17000 0.5293000 49.20000 0.5310000 -0.3130000E-01 0.7498000 
1 1 1 2  28 22 o 6.576000 0.6559000 7.196000 0.8887000 5.956000 0.9649000 1.240000       1.312000  
1 1 1 2  28 24 f 6.792000 0.6186000 6.762000 0.8665000 6.822000 0.8833000 -0.5989000E-01 1.237000  
1 1 1 2  28 26 o 14.48000 0.3684000 14.48000 0.4808000 14.49000 0.5584000 -0.1559000E-01 0.7369000 
1 1 1 2  28 28 o 36.84000 0.4303000 36.13000 0.5071000 37.54000 0.6954000 -1.413000      0.8606000 
1 1 1 2  28 30 o 31.71000 0.3342000 31.97000 0.4436000 31.45000 0.5000000 0.5267000      0.6684000 
1 1 1 2  28 32 f 12.03000 0.4738000 12.08000 0.7129000 11.97000 0.6244000 0.1149000      0.9477000 
1 1 1 2  28 34 o 19.90000 0.3371000 19.77000 0.4819000 20.03000 0.4715000 -0.2602000     0.6742000 
1 1 1 2  28 36 o 24.66000 0.3165000 24.49000 0.4473000 24.83000 0.4478000 -0.3404000     0.6329000 
1 1 1 2  28 38 o 21.98000 0.3344000 21.76000 0.4760000 22.20000 0.4697000 -0.4386000     0.6688000 
1 1 1 2  28 40 o 5.072000 0.9238000 6.120000 1.323000  4.025000 1.290000  2.095000       1.848000  
1 1 1 2  28 42 o 5.429000 0.8755000 4.062000 1.414000  6.797000 1.033000  -2.735000      1.751000  
1 1 1 2  28 44 o 11.03000 0.6419000 11.35000 0.7988000 10.71000 1.005000  0.6407000      1.284000  
1 1 1 2  28 46 o 4.326000 0.9186000 4.896000 1.309000  3.755000 1.289000  1.141000       1.837000  
1 1 1 2  28 48 o 7.347000 0.6421000 6.986000 0.8808000 7.708000 0.9345000 -0.7223000     1.284000  
1 1 1 2  28 50 o 9.143000 0.5610000 9.232000 0.7111000 9.055000 0.8680000 0.1775000      1.122000  
1 1 1 2  28 52 o 15.64000 0.4622000 15.83000 0.6266000 15.46000 0.6797000 0.3673000      0.9245000 
1 1 1 2  28 54 o 8.022000 0.8316000 7.102000 1.149000  8.943000 1.202000  -1.841000      1.663000  
1 1 1 2  28 56 o 8.679000 0.6424000 10.12000 0.7807000 7.234000 1.020000  2.890000       1.285000  
1 1 1 2  28 58 o 5.878000 0.8339000 5.403000 1.286000  6.354000 1.062000  -0.9511000     1.668000  
1 1 1 2  28 60 o 3.360000 0.9334000 3.137000 1.308000  3.583000 1.332000  -0.4461000     1.867000  
1 1 1 2  29 1  o 52.22000 0.3848000 52.48000 0.5459000 51.95000 0.5424000 0.5258000      0.7696000 
1 1 1 2  29 3  o 37.45000 0.3298000 36.99000 0.4264000 37.91000 0.5033000 -0.9234000     0.6596000 
1 1 1 2  29 5  o 60.94000 0.4740000 60.22000 0.6138000 61.66000 0.7224000 -1.441000      0.9479000 
1 1 1 2  29 7  o 35.31000 0.3216000 35.05000 0.4191000 35.56000 0.4880000 -0.5119000     0.6433000 
1 1 1 2  29 9  o 79.52000 0.5584000 80.11000 0.7960000 78.93000 0.7833000 1.185000       1.117000  
1 1 1 2  29 11 o 44.91000 0.3747000 45.16000 0.5689000 44.65000 0.4877000 0.5132000      0.7494000 
1 1 1 2  29 13 o 37.16000 0.3303000 37.16000 0.4365000 37.16000 0.4958000 -0.4185000E-02 0.6605000 
1 1 1 2  29 15 o 22.82000 0.3641000 23.53000 0.5372000 22.10000 0.4918000 1.427000       0.7283000 
1 1 1 2  29 17 o 11.06000 0.3733000 11.39000 0.4756000 10.74000 0.5754000 0.6494000      0.7465000 
1 1 1 2  29 19 o 14.99000 0.3040000 14.36000 0.4440000 15.62000 0.4154000 -1.253000      0.6080000 
1 1 1 2  29 21 o 13.49000 0.3731000 13.03000 0.5731000 13.95000 0.4778000 -0.9279000     0.7462000 
1 1 1 2  29 23 o 18.65000 0.2910000 18.44000 0.4050000 18.85000 0.4179000 -0.4077000     0.5819000 
1 1 1 2  29 25 o 17.62000 0.3122000 17.63000 0.4342000 17.62000 0.4486000 0.8265000E-02  0.6243000 
1 1 1 2  29 27 o 49.69000 0.4435000 49.73000 0.6190000 49.65000 0.6353000 0.8195000E-01  0.8870000 
1 1 1 2  29 29 o 43.07000 0.4635000 42.70000 0.5757000 43.43000 0.7266000 -0.7312000     0.9270000 
1 1 1 2  29 31 o 25.16000 0.3360000 24.76000 0.5061000 25.56000 0.4421000 -0.7966000     0.6720000 
1 1 1 2  29 33 f 24.69000 0.4089000 24.53000 0.6813000 24.86000 0.4523000 -0.3290000     0.8178000 
1 1 1 2  29 35 o 19.06000 0.3524000 18.76000 0.5073000 19.37000 0.4892000 -0.6128000     0.7048000 
1 1 1 2  29 37 f 26.21000 0.3233000 26.42000 0.4575000 25.99000 0.4570000 0.4263000      0.6466000 
1 1 1 2  29 39 o 12.22000 0.4626000 11.30000 0.7011000 13.13000 0.6038000 -1.828000      0.9252000 
1 1 1 2  29 41 o 19.41000 0.3670000 19.27000 0.5521000 19.55000 0.4836000 -0.2810000     0.7339000 
1 1 1 2  29 43 o 8.623000 0.7957000 9.366000 0.9534000 7.880000 1.274000  1.486000       1.591000  
1 1 1 2  29 45 o 25.38000 0.3107000 25.53000 0.4446000 25.23000 0.4341000 0.2974000      0.6213000 
1 1 1 2  29 47 o 13.46000 0.4357000 13.53000 0.6228000 13.39000 0.6094000 0.1447000      0.8714000 
1 1 1 2  29 49 o 8.068000 0.6407000 8.075000 0.9139000 8.062000 0.8981000 0.1339000E-01  1.281000  
1 1 1 2  29 51 o 4.561000 0.9878000 4.198000 1.509000  4.923000 1.275000  -0.7251000     1.976000  
1 1 1 2  29 53 o 5.258000 1.001000  4.809000 1.560000  5.708000 1.257000  -0.8990000     2.003000  
1 1 1 2  29 55 f 3.112000 0.9216000 3.637000 1.419000  2.586000 1.177000  1.051000       1.843000  
1 1 1 2  29 57 o 4.281000 1.057000  4.577000 1.493000  3.985000 1.497000  0.5914000      2.114000  
1 1 1 2  29 59 o 8.781000 0.6690000 8.279000 1.026000  9.283000 0.8584000 -1.003000      1.338000  
1 1 1 2  30 0  o 16.94000 0.4027000 16.94000 0.4027000 16.94000 0.4027000 0.000000       0.000000  
1 1 1 2  30 2  o 47.84000 0.3629000 47.76000 0.5128000 47.92000 0.5138000 -0.1575000     0.7259000 
1 1 1 2  30 4  o 58.18000 0.4569000 57.76000 0.5956000 58.59000 0.6930000 -0.8239000     0.9138000 
1 1 1 2  30 6  o 7.599000 0.4932000 7.812000 0.6834000 7.387000 0.7112000 0.4252000      0.9864000 
1 1 1 2  30 8  o 38.95000 0.3154000 38.90000 0.4478000 39.00000 0.4442000 -0.9833000E-01 0.6308000 
1 1 1 2  30 10 o 22.21000 0.3179000 22.36000 0.5168000 22.06000 0.3702000 0.3017000      0.6357000 
1 1 1 2  30 12 o 59.32000 0.4658000 59.15000 0.6100000 59.49000 0.7042000 -0.3442000     0.9317000 
1 1 1 2  30 14 o 73.94000 0.5662000 73.48000 0.7375000 74.39000 0.8592000 -0.9115000     1.132000  
1 1 1 2  30 16 o 36.74000 0.3189000 36.73000 0.3961000 36.76000 0.5000000 -0.2597000E-01 0.6379000 
1 1 1 2  30 18 o 53.27000 0.5103000 53.09000 0.6534000 53.44000 0.7839000 -0.3431000     1.021000  
1 1 1 2  30 20 o 58.26000 0.4656000 58.38000 0.7049000 58.13000 0.6084000 0.2460000      0.9312000 
1 1 1 2  30 22 o 43.88000 0.3497000 43.18000 0.4854000 44.58000 0.5035000 -1.400000      0.6994000 
1 1 1 2  30 24 o 16.46000 0.3165000 15.90000 0.4471000 17.02000 0.4481000 -1.117000      0.6330000 
1 1 1 2  30 26 o 15.95000 0.3954000 15.83000 0.5257000 16.06000 0.5908000 -0.2313000     0.7909000 
1 1 1 2  30 28 o 24.68000 0.3359000 24.66000 0.4210000 24.69000 0.5236000 -0.3057000E-01 0.6718000 
1 1 1 2  30 30 o 20.39000 0.3779000 20.64000 0.5931000 20.14000 0.4686000 0.4991000      0.7559000 
1 1 1 2  30 32 o 17.21000 0.3901000 16.71000 0.6054000 17.70000 0.4921000 -0.9919000     0.7802000 
1 1 1 2  30 34 o 35.28000 0.3346000 35.22000 0.4751000 35.34000 0.4713000 -0.1153000     0.6692000 
1 1 1 2  30 36 o 27.95000 0.3174000 27.94000 0.4507000 27.95000 0.4471000 -0.2436000E-02 0.6348000 
1 1 1 2  30 38 o 14.83000 0.4081000 14.55000 0.5917000 15.10000 0.5623000 -0.5459000     0.8162000 
1 1 1 2  30 40 o 19.54000 0.4128000 19.67000 0.6715000 19.42000 0.4803000 0.2438000      0.8256000 
1 1 1 2  30 42 o 5.106000 0.9378000 5.878000 1.193000  4.334000 1.447000  1.545000       1.876000  
1 1 1 2  30 44 o 17.63000 0.3606000 17.56000 0.4787000 17.70000 0.5394000 -0.1351000     0.7212000 
1 1 1 2  30 46 o 4.515000 0.9397000 4.464000 1.298000  4.565000 1.360000  -0.1007000     1.879000  
1 1 1 2  30 48 o 4.676000 0.9302000 5.120000 1.325000  4.231000 1.306000  0.8897000      1.860000  
1 1 1 2  30 50 o 7.908000 0.7548000 7.216000 1.225000  8.601000 0.8817000 -1.385000      1.510000  
1 1 1 2  30 52 o 6.915000 0.7924000 6.263000 1.253000  7.567000 0.9708000 -1.304000      1.585000  
1 1 1 2  30 54 o 6.726000 0.8423000 6.154000 1.312000  7.298000 1.056000  -1.144000      1.685000  
1 1 1 2  30 56 o 11.20000 0.6592000 10.72000 0.8180000 11.67000 1.034000  -0.9489000     1.318000  
1 1 1 2  30 58 o 4.393000 1.037000  4.832000 1.469000  3.953000 1.464000  0.8790000      2.074000  
1 1 1 2  30 60 o 7.644000 1.035000  7.277000 1.583000  8.011000 1.335000  -0.7339000     2.070000  
1 1 1 2  31 1  o 17.09000 0.3142000 17.48000 0.4071000 16.71000 0.4788000 0.7719000      0.6285000 
1 1 1 2  31 3  o 6.324000 0.6769000 5.897000 0.9317000 6.752000 0.9823000 -0.8554000     1.354000  
1 1 1 2  31 5  o 24.93000 0.2659000 25.00000 0.3771000 24.85000 0.3751000 0.1485000      0.5319000 
1 1 1 2  31 7  o 36.58000 0.3038000 36.59000 0.4305000 36.56000 0.4289000 0.2881000E-01  0.6077000 
1 1 1 2  31 9  o 57.23000 0.5080000 56.85000 0.8231000 57.62000 0.5955000 -0.7636000     1.016000  
1 1 1 2  31 11 o 32.07000 0.2894000 32.22000 0.4116000 31.92000 0.4069000 0.3060000      0.5788000 
1 1 1 2  31 13 o 54.31000 0.4344000 54.17000 0.5694000 54.45000 0.6562000 -0.2784000     0.8688000 
1 1 1 2  31 15 o 22.73000 0.2811000 22.42000 0.3506000 23.03000 0.4396000 -0.6117000     0.5623000 
1 1 1 2  31 17 o 38.40000 0.3447000 38.20000 0.4555000 38.60000 0.5174000 -0.4070000     0.6893000 
1 1 1 2  31 19 o 17.04000 0.3160000 17.24000 0.4304000 16.85000 0.4627000 0.3932000      0.6320000 
1 1 1 2  31 21 o 50.93000 0.4673000 50.91000 0.5467000 50.95000 0.7581000 -0.3481000E-01 0.9347000 
1 1 1 2  31 23 o 15.80000 0.3267000 16.05000 0.4342000 15.55000 0.4884000 0.4933000      0.6535000 
1 1 1 2  31 25 o 28.72000 0.3279000 28.47000 0.4203000 28.96000 0.5035000 -0.4914000     0.6559000 
1 1 1 2  31 27 o 40.70000 0.3807000 40.57000 0.4827000 40.82000 0.5887000 -0.2457000     0.7613000 
1 1 1 2  31 29 o 13.29000 0.4358000 13.17000 0.6497000 13.42000 0.5810000 -0.2514000     0.8716000 
1 1 1 2  31 31 o 17.63000 0.3488000 17.54000 0.5008000 17.73000 0.4856000 -0.1899000     0.6976000 
1 1 1 2  31 33 f 23.96000 0.4057000 24.01000 0.6649000 23.92000 0.4650000 0.9429000E-01  0.8114000 
1 1 1 2  31 35 o 37.85000 0.3691000 37.99000 0.5607000 37.72000 0.4803000 0.2694000      0.7382000 
1 1 1 2  31 37 o 20.58000 0.3428000 20.13000 0.4860000 21.03000 0.4835000 -0.9038000     0.6855000 
1 1 1 2  31 39 o 6.515000 0.9368000 5.168000 1.587000  7.861000 0.9960000 -2.693000      1.874000  
1 1 1 2  31 41 o 13.97000 0.4298000 13.69000 0.5716000 14.24000 0.6420000 -0.5561000     0.8596000 
1 1 1 2  31 43 o 4.300000 0.9305000 4.744000 1.270000  3.856000 1.361000  0.8882000      1.861000  
1 1 1 2  31 45 o 7.227000 0.6888000 7.412000 0.9393000 7.041000 1.008000  0.3712000      1.378000  
1 1 1 2  31 47 o 5.689000 0.9040000 5.901000 1.400000  5.478000 1.144000  0.4223000      1.808000  
1 1 1 2  31 49 o 3.861000 0.9874000 3.222000 1.340000  4.501000 1.450000  -1.280000      1.975000  
1 1 1 2  31 51 f 4.203000 1.019000  4.660000 1.526000  3.745000 1.353000  0.9142000      2.039000  
1 1 1 2  31 53 o 3.342000 0.9902000 3.055000 1.384000  3.629000 1.416000  -0.5739000     1.980000  
1 1 1 2  31 55 o 4.326000 0.9751000 5.466000 1.451000  3.186000 1.304000  2.280000       1.950000  
1 1 1 2  31 57 o 5.758000 0.9139000 6.113000 1.240000  5.403000 1.342000  0.7107000      1.828000  
1 1 1 2  31 59 o 8.848000 0.6411000 10.09000 0.8124000 7.609000 0.9920000 2.479000       1.282000  
1 1 1 2  32 0  o 62.54000 0.7367000 62.54000 0.7367000 62.54000 0.7367000 0.000000       0.000000  
1 1 1 2  32 2  o 48.96000 0.4007000 49.35000 0.6103000 48.57000 0.5193000 0.7850000      0.8013000 
1 1 1 2  32 4  o 25.03000 0.2696000 25.00000 0.3789000 25.07000 0.3836000 -0.7500000E-01 0.5392000 
1 1 1 2  32 6  o 51.00000 0.3818000 50.73000 0.5377000 51.26000 0.5421000 -0.5282000     0.7635000 
1 1 1 2  32 8  o 34.91000 0.3633000 35.09000 0.5908000 34.72000 0.4229000 0.3712000      0.7266000 
1 1 1 2  32 10 o 67.16000 0.4812000 67.30000 0.6819000 67.03000 0.6791000 0.2685000      0.9624000 
1 1 1 2  32 12 o 70.32000 0.5409000 70.10000 0.7082000 70.54000 0.8179000 -0.4407000     1.082000  
1 1 1 2  32 14 o 59.52000 0.4709000 58.94000 0.6161000 60.10000 0.7123000 -1.158000      0.9417000 
1 1 1 2  32 16 o 49.84000 0.4099000 50.39000 0.5479000 49.29000 0.6097000 1.096000       0.8197000 
1 1 1 2  32 18 o 62.50000 0.4920000 62.66000 0.6486000 62.33000 0.7400000 0.3267000      0.9840000 
1 1 1 2  32 20 o 22.27000 0.2895000 22.23000 0.4081000 22.31000 0.4107000 -0.8237000E-01 0.5789000 
1 1 1 2  32 22 o 43.04000 0.3483000 42.51000 0.4857000 43.58000 0.4993000 -1.072000      0.6965000 
1 1 1 2  32 24 o 38.45000 0.5058000 38.33000 0.5246000 38.56000 0.8648000 -0.2335000     1.012000  
1 1 1 2  32 26 o 24.78000 0.3425000 24.88000 0.4184000 24.69000 0.5424000 0.1890000      0.6850000 
1 1 1 2  32 28 o 25.66000 0.3230000 25.39000 0.4704000 25.93000 0.4428000 -0.5411000     0.6460000 
1 1 1 2  32 30 o 13.50000 0.3997000 13.77000 0.5449000 13.23000 0.5849000 0.5380000      0.7993000 
1 1 1 2  32 32 o 4.670000 1.024000  3.855000 1.539000  5.485000 1.352000  -1.629000      2.049000  
1 1 1 2  32 34 o 19.39000 0.3440000 19.77000 0.4810000 19.00000 0.4919000 0.7719000      0.6880000 
1 1 1 2  32 36 o 14.78000 0.4338000 13.89000 0.6647000 15.68000 0.5575000 -1.788000      0.8675000 
1 1 1 2  32 38 o 26.07000 0.4125000 26.55000 0.6585000 25.60000 0.4972000 0.9489000      0.8251000 
1 1 1 2  32 40 o 14.06000 0.3952000 14.20000 0.5567000 13.93000 0.5610000 0.2746000      0.7903000 
1 1 1 2  32 42 o 3.651000 0.8980000 3.446000 1.286000  3.857000 1.253000  -0.4110000     1.796000  
1 1 1 2  32 44 o 9.494000 0.5772000 8.496000 0.8117000 10.49000 0.8207000 -1.997000      1.154000  
1 1 1 2  32 46 o 4.092000 0.9813000 3.976000 1.465000  4.207000 1.306000  -0.2312000     1.963000  
1 1 1 2  32 48 o 4.915000 0.9142000 5.612000 1.251000  4.218000 1.333000  1.394000       1.828000  
1 1 1 2  32 50 o 5.197000 1.034000  5.884000 1.475000  4.510000 1.450000  1.374000       2.068000  
1 1 1 2  32 52 o 5.447000 1.015000  5.592000 1.436000  5.302000 1.434000  0.2902000      2.029000  
1 1 1 2  32 54 o 4.618000 0.9429000 5.565000 1.282000  3.670000 1.383000  1.895000       1.886000  
1 1 1 2  32 56 o 12.89000 0.4941000 13.16000 0.6304000 12.62000 0.7611000 0.5333000      0.9883000 
1 1 1 2  32 58 o 3.900000 0.9910000 3.248000 1.305000  4.552000 1.492000  -1.304000      1.982000  
1 1 1 2  33 1  o 38.25000 0.3630000 37.61000 0.5046000 38.88000 0.5221000 -1.272000      0.7261000 
1 1 1 2  33 3  o 23.73000 0.2950000 23.58000 0.4525000 23.88000 0.3785000 -0.2961000     0.5899000 
1 1 1 2  33 5  o 17.82000 0.3047000 17.38000 0.4602000 18.26000 0.3996000 -0.8794000     0.6095000 
1 1 1 2  33 7  o 6.334000 0.9305000 6.826000 1.632000  5.843000 0.8940000 0.9822000      1.861000  
1 1 1 2  33 9  o 39.50000 0.3486000 39.14000 0.5253000 39.87000 0.4583000 -0.7357000     0.6971000 
1 1 1 2  33 11 o 25.45000 0.3132000 25.59000 0.4443000 25.32000 0.4416000 0.2723000      0.6265000 
1 1 1 2  33 13 o 42.79000 0.3662000 42.39000 0.4834000 43.19000 0.5503000 -0.7919000     0.7325000 
1 1 1 2  33 15 o 18.99000 0.3054000 18.66000 0.4166000 19.31000 0.4468000 -0.6464000     0.6108000 
1 1 1 2  33 17 o 46.29000 0.3720000 46.68000 0.4624000 45.90000 0.5830000 0.7874000      0.7441000 
1 1 1 2  33 19 o 47.32000 0.3794000 47.30000 0.4679000 47.33000 0.5973000 -0.3764000E-01 0.7588000 
1 1 1 2  33 21 o 6.851000 0.6318000 6.715000 0.9178000 6.986000 0.8685000 -0.2711000     1.264000  
1 1 1 2  33 23 o 20.43000 0.3304000 20.94000 0.4171000 19.92000 0.5125000 1.017000       0.6608000 
1 1 1 2  33 25 o 5.760000 0.7894000 6.585000 0.9853000 4.935000 1.234000  1.650000       1.579000  
1 1 1 2  33 27 o 20.93000 0.5012000 21.08000 0.4617000 20.78000 0.8897000 0.2980000      1.002000  
1 1 1 2  33 29 o 3.509000 0.9598000 3.312000 1.311000  3.706000 1.403000  -0.3948000     1.920000  
1 1 1 2  33 31 o 28.88000 0.3463000 28.85000 0.5220000 28.90000 0.4552000 -0.5113000E-01 0.6926000 
1 1 1 2  33 33 o 28.02000 0.3199000 28.41000 0.4562000 27.63000 0.4484000 0.7760000      0.6397000 
1 1 1 2  33 35 o 18.64000 0.3566000 18.65000 0.5041000 18.62000 0.5046000 0.3493000E-01  0.7133000 
1 1 1 2  33 37 o 17.37000 0.3811000 17.47000 0.5246000 17.27000 0.5529000 0.2000000      0.7622000 
1 1 1 2  33 39 o 20.31000 0.4040000 20.37000 0.6645000 20.25000 0.4596000 0.1187000      0.8079000 
1 1 1 2  33 41 o 8.181000 0.6582000 8.067000 1.055000  8.295000 0.7868000 -0.2286000     1.316000  
1 1 1 2  33 43 o 14.23000 0.4501000 14.47000 0.5594000 13.99000 0.7052000 0.4725000      0.9001000 
1 1 1 2  33 45 o 8.379000 0.6754000 8.425000 0.9899000 8.333000 0.9191000 0.9220000E-01  1.351000  
1 1 1 2  33 47 f 5.979000 0.8387000 6.244000 1.217000  5.714000 1.154000  0.5304000      1.677000  
1 1 1 2  33 49 o 4.141000 0.9697000 3.152000 1.236000  5.130000 1.495000  -1.978000      1.939000  
1 1 1 2  33 51 o 3.294000 0.9709000 3.251000 1.307000  3.336000 1.436000  -0.8535000E-01 1.942000  
1 1 1 2  33 53 o 4.735000 0.9905000 4.777000 1.353000  4.693000 1.447000  0.8452000E-01  1.981000  
1 1 1 2  33 55 o 6.306000 0.8958000 5.819000 1.255000  6.793000 1.278000  -0.9744000     1.792000  
1 1 1 2  33 57 o 5.744000 0.8986000 5.906000 1.182000  5.581000 1.354000  0.3249000      1.797000  
1 1 1 2  34 0  o 60.79000 0.6253000 60.79000 0.6253000 60.79000 0.6253000 0.000000       0.000000  
1 1 1 2  34 2  o 21.76000 0.3650000 21.74000 0.4715000 21.79000 0.5573000 -0.5093000E-01 0.7300000 
1 1 1 2  34 4  o 27.46000 0.3381000 27.07000 0.5499000 27.85000 0.3936000 -0.7831000     0.6762000 
1 1 1 2  34 6  o 24.69000 0.3298000 24.54000 0.5324000 24.84000 0.3894000 -0.3023000     0.6596000 
1 1 1 2  34 8  o 36.48000 0.3332000 36.12000 0.5027000 36.84000 0.4376000 -0.7192000     0.6665000 
1 1 1 2  34 10 o 15.63000 0.3501000 15.00000 0.5108000 16.27000 0.4789000 -1.271000      0.7002000 
1 1 1 2  34 12 o 44.78000 0.3812000 45.09000 0.5827000 44.46000 0.4918000 0.6351000      0.7625000 
1 1 1 2  34 14 o 49.28000 0.3875000 49.30000 0.4781000 49.26000 0.6098000 0.3751000E-01  0.7749000 
1 1 1 2  34 16 o 50.74000 0.3970000 50.58000 0.4868000 50.89000 0.6274000 -0.3117000     0.7941000 
1 1 1 2  34 18 o 33.06000 0.3095000 32.72000 0.3821000 33.40000 0.4869000 -0.6829000     0.6190000 
1 1 1 2  34 20 o 24.85000 0.2891000 24.97000 0.4091000 24.72000 0.4086000 0.2545000      0.5782000 
1 1 1 2  34 22 o 13.82000 0.3852000 13.99000 0.5139000 13.65000 0.5739000 0.3385000      0.7703000 
1 1 1 2  34 24 f 12.15000 0.4347000 12.61000 0.6131000 11.69000 0.6165000 0.9144000      0.8694000 
1 1 1 2  34 26 o 16.99000 0.3807000 16.51000 0.4883000 17.48000 0.5841000 -0.9788000     0.7614000 
1 1 1 2  34 28 o 23.71000 0.3162000 23.90000 0.4340000 23.52000 0.4599000 0.3845000      0.6324000 
1 1 1 2  34 30 o 23.15000 0.3996000 22.72000 0.5122000 23.57000 0.6135000 -0.8475000     0.7992000 
1 1 1 2  34 32 o 6.990000 0.7398000 7.256000 0.9452000 6.724000 1.138000  0.5324000      1.480000  
1 1 1 2  34 34 o 21.71000 0.3350000 21.97000 0.4775000 21.44000 0.4699000 0.5261000      0.6699000 
1 1 1 2  34 36 o 15.97000 0.4054000 15.59000 0.5561000 16.35000 0.5901000 -0.7535000     0.8108000 
1 1 1 2  34 38 o 30.60000 0.3500000 31.05000 0.5317000 30.15000 0.4553000 0.9008000      0.7000000 
1 1 1 2  34 40 o 6.141000 0.8752000 4.785000 1.521000  7.497000 0.8667000 -2.712000      1.750000  
1 1 1 2  34 42 o 19.85000 0.3735000 19.29000 0.4889000 20.42000 0.5647000 -1.132000      0.7469000 
1 1 1 2  34 44 f 12.38000 0.5822000 12.28000 0.9524000 12.47000 0.6699000 -0.1919000     1.164000  
1 1 1 2  34 46 o 6.490000 0.7178000 6.486000 0.9909000 6.493000 1.039000  -0.6621000E-02 1.436000  
1 1 1 2  34 48 o 3.956000 0.9700000 3.139000 1.228000  4.772000 1.502000  -1.633000      1.940000  
1 1 1 2  34 50 o 4.237000 1.019000  4.334000 1.482000  4.139000 1.398000  0.1951000      2.038000  
1 1 1 2  34 52 o 8.898000 0.6637000 8.568000 1.003000  9.228000 0.8699000 -0.6598000     1.327000  
1 1 1 2  34 54 o 3.657000 0.9376000 4.541000 1.441000  2.774000 1.200000  1.767000       1.875000  
1 1 1 2  34 56 o 3.405000 0.9613000 3.569000 1.390000  3.242000 1.329000  0.3265000      1.923000  
1 1 1 2  35 1  o 53.95000 0.4035000 53.32000 0.5652000 54.59000 0.5760000 -1.272000      0.8070000 
1 1 1 2  35 3  o 67.11000 0.5915000 67.48000 0.9690000 66.73000 0.6786000 0.7533000      1.183000  
1 1 1 2  35 5  o 50.00000 0.3799000 50.32000 0.5401000 49.68000 0.5344000 0.6449000      0.7598000 
1 1 1 2  35 7  o 22.47000 0.2767000 22.77000 0.3859000 22.17000 0.3967000 0.5907000      0.5534000 
1 1 1 2  35 9  o 29.01000 0.3032000 29.23000 0.4009000 28.78000 0.4551000 0.4547000      0.6065000 
1 1 1 2  35 11 o 48.78000 0.3736000 48.14000 0.5222000 49.41000 0.5345000 -1.268000      0.7473000 
1 1 1 2  35 13 o 19.08000 0.3096000 19.40000 0.4166000 18.75000 0.4580000 0.6492000      0.6191000 
1 1 1 2  35 15 o 31.49000 0.3000000 31.60000 0.3765000 31.38000 0.4671000 0.2250000      0.5999000 
1 1 1 2  35 17 o 18.33000 0.2998000 18.56000 0.3769000 18.10000 0.4662000 0.4508000      0.5995000 
1 1 1 2  35 19 o 36.06000 0.3255000 35.81000 0.4002000 36.31000 0.5136000 -0.4965000     0.6511000 
1 1 1 2  35 21 o 14.40000 0.3814000 14.43000 0.5019000 14.37000 0.5743000 0.6338000E-01  0.7627000 
1 1 1 2  35 23 o 13.40000 0.4122000 13.75000 0.6165000 13.04000 0.5473000 0.7153000      0.8244000 
1 1 1 2  35 25 o 15.61000 0.4116000 16.11000 0.5023000 15.11000 0.6523000 1.004000       0.8233000 
1 1 1 2  35 27 f 28.55000 0.3119000 28.53000 0.4404000 28.58000 0.4417000 -0.5196000E-01 0.6237000 
1 1 1 2  35 29 o 8.812000 0.5916000 8.685000 0.8278000 8.939000 0.8454000 -0.2547000     1.183000  
1 1 1 2  35 31 o 11.96000 0.4886000 11.91000 0.7568000 12.01000 0.6182000 -0.1052000     0.9772000 
1 1 1 2  35 33 o 24.03000 0.3781000 23.93000 0.4610000 24.13000 0.5994000 -0.2089000     0.7561000 
1 1 1 2  35 35 o 23.02000 0.3433000 23.32000 0.4565000 22.72000 0.5128000 0.6048000      0.6866000 
1 1 1 2  35 37 o 28.80000 0.3823000 28.90000 0.6183000 28.71000 0.4496000 0.1874000      0.7645000 
1 1 1 2  35 39 o 5.321000 0.8767000 5.638000 1.178000  5.003000 1.299000  0.6354000      1.753000  
1 1 1 2  35 41 o 17.50000 0.4268000 17.75000 0.5823000 17.25000 0.6241000 0.5035000      0.8536000 
1 1 1 2  35 43 o 3.656000 0.9467000 4.157000 1.393000  3.155000 1.283000  1.002000       1.893000  
1 1 1 2  35 45 o 3.605000 0.9246000 3.823000 1.307000  3.388000 1.308000  0.4345000      1.849000  
1 1 1 2  35 47 o 4.654000 1.230000  5.115000 2.015000  4.193000 1.410000  0.9226000      2.459000  
1 1 1 2  35 49 o 4.740000 0.9823000 5.111000 1.351000  4.369000 1.426000  0.7419000      1.965000  
1 1 1 2  35 51 o 4.926000 0.9828000 4.553000 1.441000  5.298000 1.336000  -0.7450000     1.966000  
1 1 1 2  35 53 o 3.966000 0.9647000 4.010000 1.386000  3.923000 1.342000  0.8739000E-01  1.929000  
1 1 1 2  35 55 o 4.349000 1.045000  4.280000 1.450000  4.418000 1.504000  -0.1380000     2.090000  
1 1 1 2  36 0  o 13.85000 0.5293000 13.85000 0.5293000 13.85000 0.5293000 0.000000       0.000000  
1 1 1 2  36 2  o 49.07000 0.4609000 49.23000 0.7525000 48.91000 0.5325000 0.3232000      0.9218000 
1 1 1 2  36 4  o 47.24000 0.3667000 47.19000 0.5187000 47.28000 0.5186000 -0.8913000E-01 0.7335000 
1 1 1 2  36 6  o 13.92000 0.3273000 14.00000 0.4585000 13.84000 0.4672000 0.1537000      0.6545000 
1 1 1 2  36 8  o 23.01000 0.2975000 23.30000 0.4004000 22.71000 0.4402000 0.5921000      0.5951000 
1 1 1 2  36 10 o 23.64000 0.2785000 23.73000 0.3981000 23.55000 0.3897000 0.1837000      0.5571000 
1 1 1 2  36 12 f 53.75000 0.4029000 53.93000 0.5713000 53.57000 0.5684000 0.3655000      0.8059000 
1 1 1 2  36 14 o 44.36000 0.3641000 44.40000 0.4516000 44.31000 0.5714000 0.8727000E-01  0.7283000 
1 1 1 2  36 16 o 31.75000 0.3076000 31.87000 0.3850000 31.63000 0.4799000 0.2349000      0.6153000 
1 1 1 2  36 18 o 31.01000 0.3497000 31.60000 0.3849000 30.41000 0.5841000 1.193000       0.6995000 
1 1 1 2  36 20 o 16.29000 0.3658000 16.26000 0.4764000 16.32000 0.5553000 -0.5763000E-01 0.7317000 
1 1 1 2  36 22 o 51.12000 0.4639000 50.73000 0.6434000 51.51000 0.6684000 -0.7786000     0.9277000 
1 1 1 2  36 24 o 24.40000 0.3826000 24.65000 0.4392000 24.16000 0.6266000 0.4877000      0.7652000 
1 1 1 2  36 26 o 23.14000 0.3339000 23.18000 0.4966000 23.10000 0.4464000 0.8250000E-01  0.6678000 
1 1 1 2  36 28 o 26.02000 0.3179000 26.01000 0.4537000 26.02000 0.4455000 -0.2266000E-02 0.6358000 
1 1 1 2  36 30 o 20.47000 0.3542000 20.54000 0.5407000 20.40000 0.4577000 0.1371000      0.7083000 
1 1 1 2  36 32 o 29.05000 0.3186000 29.17000 0.4476000 28.94000 0.4536000 0.2322000      0.6372000 
1 1 1 2  36 34 o 13.51000 0.4011000 13.58000 0.5481000 13.44000 0.5858000 0.1371000      0.8022000 
1 1 1 2  36 36 o 12.89000 0.4972000 12.45000 0.6786000 13.33000 0.7268000 -0.8783000     0.9943000 
1 1 1 2  36 38 o 7.154000 0.7644000 6.810000 1.045000  7.498000 1.116000  -0.6887000     1.529000  
1 1 1 2  36 40 o 20.63000 0.3695000 20.23000 0.4701000 21.03000 0.5701000 -0.8026000     0.7390000 
1 1 1 2  36 42 o 15.19000 0.3595000 15.41000 0.5192000 14.97000 0.4973000 0.4450000      0.7190000 
1 1 1 2  36 44 o 15.08000 0.3875000 14.95000 0.5327000 15.21000 0.5629000 -0.2658000     0.7750000 
1 1 1 2  36 46 o 10.08000 0.5846000 9.721000 0.8629000 10.44000 0.7890000 -0.7176000     1.169000  
1 1 1 2  36 48 o 3.689000 0.9991000 4.358000 1.555000  3.021000 1.255000  1.337000       1.998000  
1 1 1 2  36 50 o 5.758000 1.060000  6.901000 1.630000  4.614000 1.357000  2.287000       2.121000  
1 1 1 2  36 52 o 4.003000 1.051000  3.932000 1.514000  4.074000 1.458000  -0.1421000     2.102000  
1 1 1 2  36 54 o 11.86000 0.5090000 11.34000 0.7332000 12.38000 0.7063000 -1.033000      1.018000  
1 1 1 2  36 56 o 6.588000 1.322000  5.376000 1.709000  7.800000 2.019000  -2.425000      2.645000  
1 1 1 2  37 1  o 33.34000 0.4331000 33.61000 0.6211000 33.07000 0.6039000 0.5368000      0.8663000 
1 1 1 2  37 3  o 12.29000 0.3908000 12.07000 0.5118000 12.51000 0.5907000 -0.4379000     0.7816000 
1 1 1 2  37 5  o 19.16000 0.3665000 18.84000 0.4254000 19.48000 0.5970000 -0.6356000     0.7331000 
1 1 1 2  37 7  o 17.72000 0.3282000 17.71000 0.4376000 17.74000 0.4893000 -0.2337000E-01 0.6564000 
1 1 1 2  37 9  o 20.64000 0.2870000 20.98000 0.4054000 20.30000 0.4065000 0.6801000      0.5741000 
1 1 1 2  37 11 o 35.13000 0.3115000 35.04000 0.4375000 35.23000 0.4435000 -0.1857000     0.6230000 
1 1 1 2  37 13 o 3.337000 0.9010000 3.015000 1.213000  3.659000 1.333000  -0.6443000     1.802000  
1 1 1 2  37 15 o 17.51000 0.3682000 18.16000 0.4381000 16.87000 0.5919000 1.294000       0.7364000 
1 1 1 2  37 17 o 14.98000 0.3914000 15.42000 0.4388000 14.54000 0.6483000 0.8809000      0.7829000 
1 1 1 2  37 19 o 42.87000 0.4145000 42.56000 0.4455000 43.18000 0.6991000 -0.6254000     0.8290000 
1 1 1 2  37 21 o 32.99000 0.3764000 32.46000 0.5178000 33.52000 0.5466000 -1.066000      0.7529000 
1 1 1 2  37 23 o 16.12000 0.4190000 16.22000 0.5270000 16.02000 0.6515000 0.1956000      0.8380000 
1 1 1 2  37 25 o 4.977000 0.9645000 4.702000 1.444000  5.253000 1.279000  -0.5513000     1.929000  
1 1 1 2  37 27 o 11.26000 0.4639000 11.23000 0.6589000 11.28000 0.6532000 -0.4540000E-01 0.9278000 
1 1 1 2  37 29 o 38.79000 0.3686000 38.70000 0.5547000 38.88000 0.4858000 -0.1765000     0.7373000 
1 1 1 2  37 31 o 7.307000 0.7224000 8.145000 0.8770000 6.469000 1.148000  1.676000       1.445000  
1 1 1 2  37 33 o 8.027000 0.6476000 9.005000 0.7587000 7.049000 1.050000  1.957000       1.295000  
1 1 1 2  37 35 f 8.307000 0.6523000 7.689000 1.027000  8.926000 0.8048000 -1.237000      1.305000  
1 1 1 2  37 37 o 5.938000 0.9552000 4.552000 1.525000  7.325000 1.150000  -2.773000      1.910000  
1 1 1 2  37 39 o 11.61000 0.4645000 11.88000 0.6163000 11.34000 0.6952000 0.5385000      0.9290000 
1 1 1 2  37 41 o 17.37000 0.4364000 16.85000 0.5046000 17.90000 0.7121000 -1.049000      0.8727000 
1 1 1 2  37 43 o 13.10000 0.4205000 13.86000 0.5688000 12.34000 0.6194000 1.525000       0.8409000 
1 1 1 2  37 45 o 4.156000 0.9727000 3.877000 1.465000  4.435000 1.280000  -0.5576000     1.945000  
1 1 1 2  37 47 o 3.928000 1.015000  3.787000 1.504000  4.069000 1.365000  -0.2821000     2.031000  
1 1 1 2  37 49 f 5.095000 0.9746000 4.322000 1.498000  5.867000 1.247000  -1.546000      1.949000  
1 1 1 2  37 51 o 7.364000 0.8248000 6.251000 1.357000  8.477000 0.9374000 -2.227000      1.650000  
1 1 1 2  37 53 o 5.668000 1.017000  6.150000 1.390000  5.187000 1.485000  0.9630000      2.034000  
1 1 1 2  37 55 o 2.897000 0.9250000 2.993000 1.370000  2.800000 1.243000  0.1933000      1.850000  
1 1 1 2  38 0  o 3.583000 1.289000  3.583000 1.289000  3.583000 1.289000  0.000000       0.000000  
1 1 1 2  38 2  o 76.12000 0.5868000 75.99000 0.7662000 76.24000 0.8890000 -0.2442000     1.174000  
1 1 1 2  38 4  o 50.39000 0.6073000 50.72000 0.5509000 50.05000 1.083000  0.6766000      1.215000  
1 1 1 2  38 6  f 26.43000 0.3472000 26.20000 0.4127000 26.66000 0.5585000 -0.4543000     0.6945000 
1 1 1 2  38 8  o 31.52000 0.3237000 31.21000 0.4223000 31.83000 0.4907000 -0.6132000     0.6474000 
1 1 1 2  38 10 o 12.24000 0.4086000 12.20000 0.5476000 12.28000 0.6066000 -0.7410000E-01 0.8172000 
1 1 1 2  38 12 o 15.49000 0.3456000 15.32000 0.4579000 15.65000 0.5177000 -0.3231000     0.6911000 
1 1 1 2  38 14 o 13.94000 0.4233000 13.39000 0.4686000 14.50000 0.7050000 -1.114000      0.8466000 
1 1 1 2  38 16 f 12.81000 0.5400000 13.12000 0.4980000 12.50000 0.9583000 0.6271000      1.080000  
1 1 1 2  38 18 o 40.01000 0.3509000 39.56000 0.4324000 40.46000 0.5529000 -0.9006000     0.7019000 
1 1 1 2  38 20 o 17.14000 0.4050000 17.23000 0.5550000 17.06000 0.5900000 0.1664000      0.8100000 
1 1 1 2  38 22 o 10.86000 0.5581000 10.73000 0.6913000 10.98000 0.8764000 -0.2543000     1.116000  
1 1 1 2  38 24 o 38.32000 0.3680000 38.70000 0.5555000 37.93000 0.4827000 0.7678000      0.7359000 
1 1 1 2  38 26 o 33.03000 0.3208000 33.32000 0.4604000 32.73000 0.4469000 0.5848000      0.6416000 
1 1 1 2  38 28 o 12.01000 0.4769000 11.97000 0.7246000 12.06000 0.6202000 -0.9403000E-01 0.9538000 
1 1 1 2  38 30 o 9.125000 0.5495000 9.127000 0.7861000 9.122000 0.7681000 0.4803000E-02  1.099000  
1 1 1 2  38 32 o 22.18000 0.3204000 22.18000 0.4458000 22.19000 0.4604000 -0.1260000E-01 0.6409000 
1 1 1 2  38 34 o 7.099000 0.7402000 7.331000 1.121000  6.868000 0.9664000 0.4639000      1.480000  
1 1 1 2  38 36 f 5.891000 0.9897000 5.287000 1.419000  6.496000 1.380000  -1.209000      1.979000  
1 1 1 2  38 38 o 4.707000 0.9048000 5.230000 1.215000  4.183000 1.341000  1.047000       1.810000  
1 1 1 2  38 40 o 5.968000 0.8905000 7.126000 0.9081000 4.809000 1.532000  2.317000       1.781000  
1 1 1 2  38 42 o 8.698000 0.9473000 8.180000 0.8947000 9.216000 1.670000  -1.036000      1.895000  
1 1 1 2  38 44 o 5.508000 0.9233000 4.917000 1.336000  6.099000 1.275000  -1.183000      1.847000  
1 1 1 2  38 46 o 5.875000 0.9966000 5.474000 1.655000  6.276000 1.111000  -0.8016000     1.993000  
1 1 1 2  38 48 o 5.342000 0.9342000 4.968000 1.247000  5.717000 1.391000  -0.7496000     1.868000  
1 1 1 2  38 50 o 6.650000 0.7886000 6.368000 1.088000  6.932000 1.142000  -0.5646000     1.577000  
1 1 1 2  38 52 o 5.381000 0.9269000 5.484000 1.267000  5.278000 1.353000  0.2058000      1.854000  
1 1 1 2  38 54 o 5.362000 0.9467000 5.801000 1.352000  4.923000 1.326000  0.8782000      1.893000  
1 1 1 2  39 1  o 54.33000 0.4102000 54.32000 0.5803000 54.33000 0.5800000 -0.9472000E-02 0.8205000 
1 1 1 2  39 3  o 27.04000 0.3343000 27.03000 0.4734000 27.05000 0.4721000 -0.1840000E-01 0.6686000 
1 1 1 2  39 5  o 22.04000 0.3278000 21.69000 0.4229000 22.39000 0.5010000 -0.6942000     0.6556000 
1 1 1 2  39 7  o 35.48000 0.3456000 35.66000 0.4478000 35.31000 0.5265000 0.3534000      0.6911000 
1 1 1 2  39 9  o 24.72000 0.3181000 24.52000 0.4178000 24.93000 0.4798000 -0.4087000     0.6363000 
1 1 1 2  39 11 o 11.71000 0.4114000 11.48000 0.5976000 11.93000 0.5655000 -0.4519000     0.8228000 
1 1 1 2  39 13 o 21.11000 0.3298000 20.82000 0.4261000 21.39000 0.5036000 -0.5688000     0.6597000 
1 1 1 2  39 15 o 34.07000 0.3670000 33.91000 0.4078000 34.23000 0.6102000 -0.3142000     0.7339000 
1 1 1 2  39 17 o 10.56000 0.5861000 10.58000 0.6132000 10.54000 0.9990000 0.3858000E-01  1.172000  
1 1 1 2  39 19 o 32.41000 0.3925000 32.82000 0.4521000 32.01000 0.6418000 0.8164000      0.7851000 
1 1 1 2  39 21 o 31.09000 0.3145000 31.42000 0.4411000 30.76000 0.4485000 0.6507000      0.6291000 
1 1 1 2  39 23 f 17.70000 0.3733000 17.66000 0.5593000 17.75000 0.4944000 -0.8953000E-01 0.7465000 
1 1 1 2  39 25 o 21.18000 0.3266000 21.14000 0.4568000 21.21000 0.4669000 -0.7317000E-01 0.6532000 
1 1 1 2  39 27 o 13.57000 0.4133000 13.45000 0.6232000 13.70000 0.5430000 -0.2464000     0.8266000 
1 1 1 2  39 29 o 11.66000 0.4383000 11.75000 0.6436000 11.57000 0.5952000 0.1777000      0.8766000 
1 1 1 2  39 31 o 22.80000 0.3145000 22.58000 0.4395000 23.03000 0.4499000 -0.4496000     0.6290000 
1 1 1 2  39 33 o 17.25000 0.3706000 17.08000 0.5769000 17.41000 0.4654000 -0.3301000     0.7413000 
1 1 1 2  39 35 o 8.548000 0.6470000 8.416000 0.9227000 8.681000 0.9071000 -0.2650000     1.294000  
1 1 1 2  39 37 o 4.083000 0.9754000 3.964000 1.436000  4.202000 1.320000  -0.2381000     1.951000  
1 1 1 2  39 39 o 16.69000 0.3615000 16.80000 0.5046000 16.58000 0.5179000 0.2134000      0.7231000 
1 1 1 2  39 41 o 10.13000 0.5461000 10.99000 0.8036000 9.277000 0.7397000 1.709000       1.092000  
1 1 1 2  39 43 o 9.952000 0.4901000 10.35000 0.6948000 9.549000 0.6914000 0.8051000      0.9802000 
1 1 1 2  39 45 o 6.584000 0.8978000 7.527000 1.030000  5.642000 1.471000  1.885000       1.796000  
1 1 1 2  39 47 o 2.583000 0.8289000 2.790000 1.209000  2.375000 1.134000  0.4148000      1.658000  
1 1 1 2  39 49 o 3.192000 0.9297000 3.227000 1.335000  3.157000 1.294000  0.6998000E-01  1.859000  
1 1 1 2  39 51 o 3.807000 1.004000  3.635000 1.465000  3.980000 1.374000  -0.3444000     2.008000  
1 1 1 2  39 53 o 4.329000 0.9675000 3.840000 1.423000  4.817000 1.311000  -0.9771000     1.935000  
1 1 1 2  40 0  o 35.37000 0.4566000 35.37000 0.4566000 35.37000 0.4566000 0.000000       0.000000  
1 1 1 2  40 2  o 16.68000 0.3536000 16.58000 0.4551000 16.78000 0.5413000 -0.1983000     0.7072000 
1 1 1 2  40 4  o 20.07000 0.3104000 19.38000 0.4442000 20.77000 0.4336000 -1.392000      0.6207000 
1 1 1 2  40 6  f 36.82000 0.3778000 36.51000 0.5290000 37.14000 0.5394000 -0.6324000     0.7556000 
1 1 1 2  40 8  o 37.51000 0.3577000 37.16000 0.4638000 37.85000 0.5446000 -0.6925000     0.7153000 
1 1 1 2  40 10 o 36.04000 0.3512000 36.33000 0.4571000 35.76000 0.5335000 0.5718000      0.7025000 
1 1 1 2  40 12 f 42.97000 0.3830000 43.66000 0.5012000 42.28000 0.5793000 1.375000       0.7660000 
1 1 1 2  40 14 o 16.60000 0.5815000 16.01000 0.4531000 17.20000 1.071000  -1.195000      1.163000  
1 1 1 2  40 16 o 29.43000 0.3726000 29.08000 0.4021000 29.79000 0.6273000 -0.7069000     0.7451000 
1 1 1 2  40 18 o 14.78000 0.4706000 14.35000 0.5497000 15.20000 0.7640000 -0.8455000     0.9412000 
1 1 1 2  40 20 o 37.20000 0.3349000 36.78000 0.4658000 37.61000 0.4813000 -0.8271000     0.6698000 
1 1 1 2  40 22 o 16.31000 0.3713000 16.18000 0.5514000 16.43000 0.4972000 -0.2502000     0.7425000 
1 1 1 2  40 24 o 22.14000 0.3163000 22.41000 0.4403000 21.88000 0.4541000 0.5331000      0.6325000 
1 1 1 2  40 26 o 6.483000 0.7978000 7.618000 0.9659000 5.348000 1.270000  2.269000       1.596000  
1 1 1 2  40 28 o 11.90000 0.4407000 12.56000 0.6043000 11.24000 0.6417000 1.314000       0.8815000 
1 1 1 2  40 30 o 19.79000 0.3238000 19.47000 0.4617000 20.11000 0.4541000 -0.6412000     0.6475000 
1 1 1 2  40 32 o 12.15000 0.4383000 11.98000 0.6182000 12.33000 0.6214000 -0.3449000     0.8766000 
1 1 1 2  40 34 o 11.74000 0.4826000 11.59000 0.6829000 11.88000 0.6822000 -0.2814000     0.9653000 
1 1 1 2  40 36 o 16.15000 0.3802000 15.93000 0.5861000 16.36000 0.4845000 -0.4340000     0.7605000 
1 1 1 2  40 38 o 10.22000 0.5373000 10.35000 0.6942000 10.09000 0.8204000 0.2679000      1.075000  
1 1 1 2  40 40 o 13.29000 0.4051000 13.53000 0.5805000 13.05000 0.5651000 0.4830000      0.8102000 
1 1 1 2  40 42 o 4.326000 0.8858000 3.919000 1.297000  4.733000 1.206000  -0.8142000     1.772000  
1 1 1 2  40 44 o 4.342000 1.016000  4.341000 1.383000  4.343000 1.489000  -0.2882000E-02 2.032000  
1 1 1 2  40 46 o 7.980000 0.7278000 8.319000 0.8815000 7.641000 1.158000  0.6778000      1.456000  
1 1 1 2  40 48 o 11.80000 0.4875000 11.41000 0.7274000 12.20000 0.6493000 -0.7953000     0.9750000 
1 1 1 2  40 50 o 4.561000 1.152000  4.390000 1.514000  4.733000 1.737000  -0.3431000     2.305000  
1 1 1 2  40 52 o 6.658000 0.7895000 6.939000 1.052000  6.378000 1.177000  0.5603000      1.579000  
1 1 1 2  41 1  o 51.53000 0.4593000 51.80000 0.6531000 51.26000 0.6459000 0.5343000      0.9185000 
1 1 1 2  41 3  o 16.96000 0.3343000 16.56000 0.4717000 17.37000 0.4740000 -0.8125000     0.6687000 
1 1 1 2  41 5  o 44.96000 0.3630000 44.93000 0.5146000 44.99000 0.5121000 -0.5500000E-01 0.7259000 
1 1 1 2  41 7  o 50.05000 0.3909000 49.87000 0.5536000 50.24000 0.5521000 -0.3682000     0.7819000 
1 1 1 2  41 9  o 17.79000 0.3408000 17.71000 0.4743000 17.88000 0.4896000 -0.1727000     0.6817000 
1 1 1 2  41 11 o 41.56000 0.3471000 41.94000 0.4950000 41.18000 0.4868000 0.7618000      0.6943000 
1 1 1 2  41 13 o 37.81000 0.3988000 38.73000 0.4765000 36.90000 0.6396000 1.823000       0.7976000 
1 1 1 2  41 15 o 34.75000 0.3312000 34.40000 0.4093000 35.11000 0.5208000 -0.7111000     0.6624000 
1 1 1 2  41 17 o 14.09000 0.4504000 14.46000 0.6477000 13.73000 0.6261000 0.7302000      0.9008000 
1 1 1 2  41 19 o 12.53000 0.4326000 12.85000 0.5398000 12.21000 0.6761000 0.6410000      0.8651000 
1 1 1 2  41 21 o 35.18000 0.3483000 35.42000 0.5213000 34.94000 0.4620000 0.4825000      0.6965000 
1 1 1 2  41 23 o 39.95000 0.3436000 40.04000 0.4849000 39.87000 0.4870000 0.1718000      0.6872000 
1 1 1 2  41 25 o 16.00000 0.3750000 15.67000 0.5757000 16.33000 0.4808000 -0.6681000     0.7501000 
1 1 1 2  41 27 o 18.69000 0.3274000 18.66000 0.4594000 18.73000 0.4667000 -0.7375000E-01 0.6549000 
1 1 1 2  41 29 o 16.37000 0.3796000 16.56000 0.5563000 16.19000 0.5166000 0.3735000      0.7591000 
1 1 1 2  41 31 o 15.92000 0.3587000 15.61000 0.5163000 16.23000 0.4980000 -0.6180000     0.7173000 
1 1 1 2  41 33 o 22.20000 0.3685000 22.76000 0.5221000 21.63000 0.5203000 1.122000       0.7371000 
1 1 1 2  41 35 o 23.02000 0.3475000 22.83000 0.5219000 23.22000 0.4591000 -0.3906000     0.6951000 
1 1 1 2  41 37 o 14.47000 0.4196000 14.54000 0.6241000 14.40000 0.5610000 0.1358000      0.8391000 
1 1 1 2  41 39 o 9.804000 0.5135000 9.417000 0.6807000 10.19000 0.7690000 -0.7746000     1.027000  
1 1 1 2  41 41 o 8.198000 0.6482000 8.662000 0.7771000 7.734000 1.038000  0.9277000      1.296000  
1 1 1 2  41 43 o 6.973000 0.7828000 6.362000 1.132000  7.584000 1.081000  -1.222000      1.566000  
1 1 1 2  41 45 o 10.25000 0.6107000 10.14000 0.8623000 10.35000 0.8650000 -0.2133000     1.221000  
1 1 1 2  41 47 o 11.05000 0.5113000 11.00000 0.7113000 11.10000 0.7347000 -0.1066000     1.023000  
1 1 1 2  41 49 o 5.513000 0.9017000 6.030000 1.182000  4.995000 1.362000  1.035000       1.803000  
1 1 1 2  41 51 o 3.891000 0.9703000 3.728000 1.351000  4.054000 1.393000  -0.3262000     1.941000  
1 1 1 2  42 0  o 26.79000 0.4427000 26.79000 0.4427000 26.79000 0.4427000 0.000000       0.000000  
1 1 1 2  42 2  o 24.96000 0.3637000 24.87000 0.5846000 25.04000 0.4327000 -0.1768000     0.7273000 
1 1 1 2  42 4  o 23.54000 0.3105000 23.11000 0.4413000 23.97000 0.4370000 -0.8592000     0.6211000 
1 1 1 2  42 6  o 21.27000 0.3139000 21.20000 0.4427000 21.35000 0.4451000 -0.1562000     0.6278000 
1 1 1 2  42 8  o 4.710000 0.9404000 4.268000 1.367000  5.152000 1.292000  -0.8847000     1.881000  
1 1 1 2  42 10 o 10.47000 0.4983000 10.14000 0.7288000 10.81000 0.6797000 -0.6708000     0.9966000 
1 1 1 2  42 12 o 40.85000 0.4177000 41.38000 0.4919000 40.31000 0.6753000 1.065000       0.8355000 
1 1 1 2  42 14 o 14.96000 0.3753000 15.72000 0.4718000 14.21000 0.5838000 1.511000       0.7506000 
1 1 1 2  42 16 o 21.10000 0.3572000 21.13000 0.5194000 21.07000 0.4904000 0.5583000E-01  0.7143000 
1 1 1 2  42 18 o 31.40000 0.3374000 31.46000 0.4537000 31.33000 0.4994000 0.1290000      0.6747000 
1 1 1 2  42 20 o 14.32000 0.3969000 14.23000 0.5947000 14.40000 0.5258000 -0.1695000     0.7938000 
1 1 1 2  42 22 o 10.03000 0.4815000 10.23000 0.6831000 9.831000 0.6788000 0.4032000      0.9631000 
1 1 1 2  42 24 o 10.58000 0.4807000 9.677000 0.7724000 11.47000 0.5724000 -1.796000      0.9614000 
1 1 1 2  42 26 o 21.01000 0.3107000 20.90000 0.4409000 21.12000 0.4379000 -0.2168000     0.6214000 
1 1 1 2  42 28 o 10.60000 0.5119000 10.78000 0.6221000 10.43000 0.8132000 0.3478000      1.024000  
1 1 1 2  42 30 o 3.379000 0.9227000 3.753000 1.341000  3.005000 1.267000  0.7486000      1.845000  
1 1 1 2  42 32 o 6.674000 0.7334000 6.810000 0.9658000 6.537000 1.104000  0.2735000      1.467000  
1 1 1 2  42 34 o 11.46000 0.5614000 12.67000 0.7692000 10.25000 0.8179000 2.420000       1.123000  
1 1 1 2  42 36 o 8.233000 0.5775000 8.167000 0.7994000 8.299000 0.8337000 -0.1314000     1.155000  
1 1 1 2  42 38 o 4.552000 0.8438000 6.174000 1.077000  2.930000 1.299000  3.245000       1.688000  
1 1 1 2  42 40 o 5.084000 0.9487000 5.316000 1.282000  4.851000 1.399000  0.4648000      1.897000  
1 1 1 2  42 42 o 6.785000 0.7649000 6.094000 1.172000  7.477000 0.9837000 -1.383000      1.530000  
1 1 1 2  42 44 o 4.250000 0.8118000 2.533000 1.124000  5.968000 1.172000  -3.436000      1.624000  
1 1 1 2  42 46 o 3.662000 0.9964000 3.511000 1.417000  3.814000 1.401000  -0.3030000     1.993000  
1 1 1 2  42 48 f 6.118000 0.7622000 6.280000 1.019000  5.957000 1.134000  0.3230000      1.524000  
1 1 1 2  42 50 o 7.384000 0.6827000 7.128000 1.054000  7.641000 0.8674000 -0.5130000     1.365000  
1 1 1 2  43 1  o 48.92000 0.4207000 50.07000 0.6454000 47.78000 0.5398000 2.293000       0.8413000 
1 1 1 2  43 3  o 19.00000 0.3536000 18.75000 0.5247000 19.25000 0.4741000 -0.4928000     0.7072000 
1 1 1 2  43 5  o 30.94000 0.3371000 31.36000 0.5116000 30.52000 0.4392000 0.8366000      0.6743000 
1 1 1 2  43 7  o 10.84000 0.4675000 9.797000 0.7132000 11.88000 0.6047000 -2.079000      0.9350000 
1 1 1 2  43 9  o 34.13000 0.3472000 34.18000 0.4596000 34.09000 0.5205000 0.8798000E-01  0.6944000 
1 1 1 2  43 11 o 22.01000 0.3197000 22.31000 0.4524000 21.72000 0.4520000 0.5825000      0.6395000 
1 1 1 2  43 13 o 7.864000 0.6672000 8.261000 0.8652000 7.466000 1.016000  0.7949000      1.334000  
1 1 1 2  43 15 o 8.988000 0.6107000 9.071000 0.8491000 8.906000 0.8779000 0.1647000      1.221000  
1 1 1 2  43 17 o 13.06000 0.4157000 13.77000 0.5013000 12.35000 0.6632000 1.421000       0.8313000 
1 1 1 2  43 19 o 18.03000 0.3429000 18.36000 0.4684000 17.69000 0.5009000 0.6763000      0.6858000 
1 1 1 2  43 21 o 15.03000 0.3743000 14.84000 0.5642000 15.22000 0.4920000 -0.3735000     0.7486000 
1 1 1 2  43 23 f 6.757000 0.7072000 7.592000 0.9439000 5.923000 1.053000  1.669000       1.414000  
1 1 1 2  43 25 o 22.58000 0.3321000 22.57000 0.4309000 22.60000 0.5055000 -0.2164000E-01 0.6642000 
1 1 1 2  43 27 o 21.42000 0.3121000 21.29000 0.4338000 21.55000 0.4489000 -0.2578000     0.6243000 
1 1 1 2  43 29 o 11.69000 0.4285000 12.36000 0.5394000 11.02000 0.6661000 1.340000       0.8571000 
1 1 1 2  43 31 o 5.301000 0.8878000 4.006000 1.340000  6.597000 1.165000  -2.592000      1.776000  
1 1 1 2  43 33 o 10.99000 0.5765000 10.48000 0.9873000 11.49000 0.5956000 -1.009000      1.153000  
1 1 1 2  43 35 o 7.142000 0.6508000 6.005000 1.054000  8.279000 0.7632000 -2.274000      1.302000  
1 1 1 2  43 37 o 8.041000 0.6617000 7.826000 0.8787000 8.255000 0.9897000 -0.4291000     1.323000  
1 1 1 2  43 39 o 10.82000 0.4803000 10.84000 0.6549000 10.81000 0.7029000 0.2797000E-01  0.9607000 
1 1 1 2  43 41 o 15.76000 0.3974000 15.96000 0.5120000 15.55000 0.6079000 0.4093000      0.7948000 
1 1 1 2  43 43 o 15.85000 0.4136000 16.16000 0.6123000 15.55000 0.5561000 0.6167000      0.8272000 
1 1 1 2  43 45 o 10.49000 0.5430000 10.16000 0.8507000 10.82000 0.6750000 -0.6575000     1.086000  
1 1 1 2  43 47 o 5.759000 0.8410000 5.442000 1.295000  6.076000 1.074000  -0.6349000     1.682000  
1 1 1 2  43 49 o 5.341000 0.9096000 5.623000 1.347000  5.059000 1.223000  0.5635000      1.819000  
1 1 1 2  44 0  o 27.35000 0.4571000 27.35000 0.4571000 27.35000 0.4571000 0.000000       0.000000  
1 1 1 2  44 2  o 20.58000 0.3363000 20.25000 0.4789000 20.90000 0.4724000 -0.6508000     0.6726000 
1 1 1 2  44 4  o 42.03000 0.3814000 41.67000 0.5721000 42.39000 0.5044000 -0.7104000     0.7628000 
1 1 1 2  44 6  o 14.94000 0.4052000 14.57000 0.6322000 15.31000 0.5071000 -0.7400000     0.8105000 
1 1 1 2  44 8  o 21.37000 0.3690000 21.50000 0.5228000 21.23000 0.5210000 0.2653000      0.7380000 
1 1 1 2  44 10 o 16.24000 0.3830000 16.04000 0.5862000 16.44000 0.4930000 -0.3998000     0.7659000 
1 1 1 2  44 12 o 40.72000 0.3778000 40.81000 0.5695000 40.63000 0.4968000 0.1792000      0.7557000 
1 1 1 2  44 14 o 8.582000 0.6107000 8.796000 0.9058000 8.367000 0.8195000 0.4291000      1.221000  
1 1 1 2  44 16 o 19.51000 0.3721000 18.95000 0.5422000 20.07000 0.5096000 -1.116000      0.7441000 
1 1 1 2  44 18 o 27.08000 0.3403000 27.10000 0.4866000 27.07000 0.4758000 0.2456000E-01  0.6806000 
1 1 1 2  44 20 o 10.73000 0.4435000 10.31000 0.6895000 11.15000 0.5578000 -0.8381000     0.8869000 
1 1 1 2  44 22 o 10.49000 0.4684000 10.34000 0.7153000 10.63000 0.6048000 -0.2963000     0.9367000 
1 1 1 2  44 24 o 8.054000 0.5381000 8.208000 0.7594000 7.901000 0.7625000 0.3067000      1.076000  
1 1 1 2  44 26 o 7.407000 0.5896000 7.645000 0.7891000 7.169000 0.8763000 0.4754000      1.179000  
1 1 1 2  44 28 o 6.082000 0.7396000 6.336000 0.9632000 5.828000 1.123000  0.5089000      1.479000  
1 1 1 2  44 30 o 22.53000 0.3957000 22.78000 0.5151000 22.27000 0.6008000 0.5129000      0.7914000 
1 1 1 2  44 32 o 15.23000 0.4631000 15.89000 0.7380000 14.56000 0.5598000 1.325000       0.9263000 
1 1 1 2  44 34 o 4.784000 0.8659000 3.931000 1.341000  5.636000 1.095000  -1.705000      1.732000  
1 1 1 2  44 36 o 12.52000 0.4798000 12.75000 0.5813000 12.30000 0.7635000 0.4509000      0.9596000 
1 1 1 2  44 38 f 6.435000 0.7024000 6.689000 0.9323000 6.182000 1.051000  0.5071000      1.405000  
1 1 1 2  44 40 o 3.039000 0.8905000 2.865000 1.205000  3.213000 1.311000  -0.3478000     1.781000  
1 1 1 2  44 42 o 5.933000 0.8681000 5.810000 1.330000  6.056000 1.116000  -0.2460000     1.736000  
1 1 1 2  44 44 o 2.970000 0.9461000 3.091000 1.417000  2.848000 1.254000  0.2429000      1.892000  
1 1 1 2  44 46 o 8.334000 0.6088000 8.168000 0.8935000 8.499000 0.8272000 -0.3311000     1.218000  
1 1 1 2  44 48 o 3.321000 0.9247000 2.923000 1.259000  3.719000 1.354000  -0.7960000     1.849000  
1 1 1 2  45 1  o 33.21000 0.3829000 33.33000 0.5397000 33.09000 0.5435000 0.2376000      0.7659000 
1 1 1 2  45 3  o 25.15000 0.3452000 24.59000 0.5350000 25.71000 0.4365000 -1.121000      0.6905000 
1 1 1 2  45 5  o 16.08000 0.3516000 15.89000 0.5016000 16.28000 0.4928000 -0.3891000     0.7032000 
1 1 1 2  45 7  o 5.039000 0.9300000 4.137000 1.386000  5.941000 1.240000  -1.804000      1.860000  
1 1 1 2  45 9  o 13.88000 0.4152000 14.54000 0.6209000 13.22000 0.5513000 1.316000       0.8303000 
1 1 1 2  45 11 o 29.77000 0.3388000 30.18000 0.5209000 29.36000 0.4334000 0.8241000      0.6776000 
1 1 1 2  45 13 o 17.34000 0.4184000 18.15000 0.6319000 16.52000 0.5485000 1.625000       0.8367000 
1 1 1 2  45 15 o 18.54000 0.3432000 18.93000 0.4610000 18.16000 0.5085000 0.7740000      0.6864000 
1 1 1 2  45 17 o 15.04000 0.4052000 15.01000 0.5651000 15.07000 0.5808000 -0.5218000E-01 0.8104000 
1 1 1 2  45 19 o 14.40000 0.3625000 14.27000 0.4931000 14.53000 0.5316000 -0.2549000     0.7251000 
1 1 1 2  45 21 o 10.45000 0.4791000 10.35000 0.6098000 10.56000 0.7390000 -0.2132000     0.9581000 
1 1 1 2  45 23 o 9.563000 0.4631000 10.06000 0.6422000 9.069000 0.6674000 0.9868000      0.9261000 
1 1 1 2  45 25 f 18.50000 0.3088000 18.74000 0.4293000 18.26000 0.4441000 0.4788000      0.6177000 
1 1 1 2  45 27 o 12.62000 0.3876000 12.24000 0.5443000 12.99000 0.5520000 -0.7464000     0.7752000 
1 1 1 2  45 29 o 4.435000 1.025000  4.917000 1.520000  3.954000 1.377000  0.9624000      2.051000  
1 1 1 2  45 31 o 3.635000 0.9411000 4.078000 1.393000  3.191000 1.265000  0.8866000      1.882000  
1 1 1 2  45 33 o 9.492000 0.5481000 9.038000 0.8145000 9.946000 0.7335000 -0.9072000     1.096000  
1 1 1 2  45 35 o 4.331000 0.9689000 3.772000 1.363000  4.891000 1.377000  -1.119000      1.938000  
1 1 1 2  45 37 o 8.486000 0.5643000 8.733000 0.7906000 8.240000 0.8056000 0.4929000      1.129000  
1 1 1 2  45 39 o 6.882000 0.7645000 7.482000 0.9271000 6.282000 1.216000  1.199000       1.529000  
1 1 1 2  45 41 o 12.65000 0.4630000 12.52000 0.7371000 12.78000 0.5605000 -0.2661000     0.9260000 
1 1 1 2  45 43 o 5.030000 0.8915000 5.082000 1.224000  4.977000 1.296000  0.1046000      1.783000  
1 1 1 2  45 45 o 11.27000 0.4776000 11.40000 0.6486000 11.15000 0.7011000 0.2494000      0.9551000 
1 1 1 2  45 47 o 3.255000 0.8952000 3.478000 1.289000  3.032000 1.243000  0.4463000      1.790000  
1 1 1 2  46 0  o 42.02000 0.5791000 42.02000 0.5791000 42.02000 0.5791000 0.000000       0.000000  
1 1 1 2  46 2  o 18.86000 0.3466000 19.30000 0.5049000 18.42000 0.4750000 0.8714000      0.6932000 
1 1 1 2  46 4  o 25.83000 0.3377000 26.39000 0.4520000 25.27000 0.5018000 1.126000       0.6754000 
1 1 1 2  46 6  o 14.94000 0.3724000 15.31000 0.5224000 14.57000 0.5310000 0.7366000      0.7449000 
1 1 1 2  46 8  o 19.55000 0.3312000 19.38000 0.4805000 19.73000 0.4560000 -0.3559000     0.6624000 
1 1 1 2  46 10 o 21.23000 0.3388000 21.23000 0.5187000 21.24000 0.4359000 -0.1739000E-01 0.6776000 
1 1 1 2  46 12 o 3.676000 0.9315000 3.347000 1.316000  4.005000 1.318000  -0.6574000     1.863000  
1 1 1 2  46 14 o 24.97000 0.3468000 25.57000 0.3888000 24.38000 0.5744000 1.194000       0.6936000 
1 1 1 2  46 16 o 13.01000 0.4160000 13.80000 0.5392000 12.21000 0.6336000 1.590000       0.8320000 
1 1 1 2  46 18 o 25.13000 0.3818000 24.03000 0.3851000 26.23000 0.6595000 -2.204000      0.7637000 
1 1 1 2  46 20 f 11.22000 0.4147000 11.04000 0.6197000 11.41000 0.5513000 -0.3677000     0.8295000 
1 1 1 2  46 22 o 3.210000 0.8703000 3.172000 1.233000  3.248000 1.229000  -0.7682000E-01 1.741000  
1 1 1 2  46 24 o 3.574000 0.8956000 4.068000 1.296000  3.079000 1.237000  0.9893000      1.791000  
1 1 1 2  46 26 o 5.331000 0.8428000 5.612000 1.203000  5.051000 1.181000  0.5613000      1.686000  
1 1 1 2  46 28 o 6.311000 0.8902000 5.945000 1.405000  6.678000 1.093000  -0.7334000     1.780000  
1 1 1 2  46 30 o 10.27000 0.4451000 9.361000 0.6404000 11.17000 0.6184000 -1.813000      0.8902000 
1 1 1 2  46 32 o 8.385000 0.5709000 8.426000 0.7489000 8.344000 0.8618000 0.8192000E-01  1.142000  
1 1 1 2  46 34 o 6.336000 0.7499000 6.774000 0.9451000 5.899000 1.164000  0.8750000      1.500000  
1 1 1 2  46 36 o 9.690000 0.5407000 9.256000 0.7878000 10.12000 0.7410000 -0.8685000     1.081000  
1 1 1 2  46 38 o 11.71000 0.4516000 10.88000 0.6268000 12.55000 0.6502000 -1.679000      0.9031000 
1 1 1 2  46 40 o 14.58000 0.4156000 14.37000 0.6182000 14.80000 0.5555000 -0.4296000     0.8312000 
1 1 1 2  46 42 o 3.696000 0.9316000 3.084000 1.238000  4.307000 1.392000  -1.223000      1.863000  
1 1 1 2  46 44 o 3.903000 0.9736000 3.817000 1.401000  3.990000 1.352000  -0.1735000     1.947000  
1 1 1 2  46 46 o 3.252000 0.8981000 3.023000 1.267000  3.482000 1.273000  -0.4588000     1.796000  
1 1 1 2  47 1  o 10.97000 0.4477000 11.30000 0.6507000 10.63000 0.6150000 0.6708000      0.8953000 
1 1 1 2  47 3  o 6.253000 0.8175000 5.837000 1.178000  6.669000 1.134000  -0.8315000     1.635000  
1 1 1 2  47 5  o 16.99000 0.3463000 17.19000 0.5012000 16.79000 0.4781000 0.3918000      0.6927000 
1 1 1 2  47 7  o 15.77000 0.3582000 15.65000 0.5165000 15.88000 0.4965000 -0.2314000     0.7164000 
1 1 1 2  47 9  o 12.34000 0.5032000 11.73000 0.8386000 12.94000 0.5562000 -1.214000      1.006000  
1 1 1 2  47 11 o 2.555000 0.7939000 2.187000 1.033000  2.923000 1.206000  -0.7362000     1.588000  
1 1 1 2  47 13 o 16.92000 0.3398000 16.74000 0.4288000 17.09000 0.5273000 -0.3529000     0.6797000 
1 1 1 2  47 15 o 14.15000 0.4586000 14.47000 0.5592000 13.82000 0.7270000 0.6514000      0.9172000 
1 1 1 2  47 17 o 6.962000 0.6619000 8.026000 0.7165000 5.899000 1.113000  2.128000       1.324000  
1 1 1 2  47 19 o 6.672000 0.6972000 7.134000 0.7412000 6.210000 1.181000  0.9232000      1.394000  
1 1 1 2  47 21 o 5.423000 0.7650000 5.535000 1.080000  5.310000 1.084000  0.2258000      1.530000  
1 1 1 2  47 23 o 9.176000 0.5142000 9.235000 0.6828000 9.117000 0.7690000 0.1182000      1.028000  
1 1 1 2  47 25 o 11.07000 0.4265000 11.28000 0.5991000 10.86000 0.6072000 0.4207000      0.8530000 
1 1 1 2  47 27 o 3.198000 0.9431000 3.280000 1.403000  3.115000 1.261000  0.1657000      1.886000  
1 1 1 2  47 29 f 8.696000 0.5134000 8.578000 0.7279000 8.814000 0.7242000 -0.2360000     1.027000  
1 1 1 2  47 31 o 11.29000 0.4449000 11.20000 0.6132000 11.37000 0.6447000 -0.1659000     0.8897000 
1 1 1 2  47 33 o 8.953000 0.5684000 9.240000 0.7172000 8.667000 0.8819000 0.5730000      1.137000  
1 1 1 2  47 35 o 5.872000 0.8288000 5.672000 1.218000  6.072000 1.124000  -0.4001000     1.658000  
1 1 1 2  47 37 o 5.177000 0.8817000 5.461000 1.238000  4.892000 1.256000  0.5688000      1.763000  
1 1 1 2  47 39 o 10.52000 0.5411000 11.45000 0.7589000 9.592000 0.7714000 1.858000       1.082000  
1 1 1 2  47 41 o 7.830000 0.6138000 7.541000 0.8960000 8.120000 0.8391000 -0.5799000     1.228000  
1 1 1 2  47 43 o 6.463000 0.8801000 5.484000 1.541000  7.443000 0.8514000 -1.959000      1.760000  
1 1 1 2  47 45 o 4.781000 0.9119000 4.133000 1.358000  5.430000 1.217000  -1.297000      1.824000  
1 1 1 2  48 0  o 4.166000 1.428000  4.166000 1.428000  4.166000 1.428000  0.000000       0.000000  
1 1 1 2  48 2  o 10.62000 0.4541000 10.19000 0.6679000 11.04000 0.6153000 -0.8505000     0.9081000 
1 1 1 2  48 4  o 6.962000 0.6681000 7.329000 0.9082000 6.595000 0.9800000 0.7338000      1.336000  
1 1 1 2  48 6  o 19.68000 0.3167000 19.65000 0.4497000 19.71000 0.4460000 -0.5328000E-01 0.6333000 
1 1 1 2  48 8  o 10.27000 0.5492000 10.15000 0.9064000 10.38000 0.6203000 -0.2308000     1.098000  
1 1 1 2  48 10 o 3.653000 0.8263000 2.790000 1.174000  4.515000 1.163000  -1.725000      1.653000  
1 1 1 2  48 12 f 15.55000 0.3574000 15.79000 0.5555000 15.31000 0.4498000 0.4848000      0.7148000 
1 1 1 2  48 14 f 21.01000 0.3137000 21.23000 0.3915000 20.79000 0.4902000 0.4337000      0.6274000 
1 1 1 2  48 16 o 8.014000 0.5559000 8.324000 0.6960000 7.704000 0.8670000 0.6200000      1.112000  
1 1 1 2  48 18 o 16.06000 0.3404000 16.39000 0.4306000 15.72000 0.5274000 0.6684000      0.6808000 
1 1 1 2  48 20 o 15.05000 0.3617000 15.19000 0.4804000 14.90000 0.5409000 0.2865000      0.7235000 
1 1 1 2  48 22 o 5.928000 0.8165000 5.248000 1.385000  6.608000 0.8659000 -1.360000      1.633000  
1 1 1 2  48 24 o 12.87000 0.3631000 12.32000 0.5035000 13.42000 0.5234000 -1.103000      0.7263000 
1 1 1 2  48 26 o 6.037000 0.9198000 5.858000 1.485000  6.216000 1.086000  -0.3578000     1.840000  
1 1 1 2  48 28 o 8.400000 0.5235000 8.481000 0.7330000 8.320000 0.7477000 0.1604000      1.047000  
1 1 1 2  48 30 o 10.31000 0.4731000 10.28000 0.6594000 10.33000 0.6785000 -0.4647000E-01 0.9461000 
1 1 1 2  48 32 o 8.754000 0.5478000 9.116000 0.7403000 8.393000 0.8075000 0.7228000      1.096000  
1 1 1 2  48 34 o 5.119000 0.9095000 4.430000 1.261000  5.807000 1.311000  -1.377000      1.819000  
1 1 1 2  48 36 o 11.61000 0.4605000 12.16000 0.6147000 11.05000 0.6859000 1.110000       0.9210000 
1 1 1 2  48 38 o 9.395000 0.5450000 8.684000 0.8166000 10.11000 0.7219000 -1.422000      1.090000  
1 1 1 2  48 40 o 3.456000 0.8684000 2.724000 1.178000  4.187000 1.277000  -1.462000      1.737000  
1 1 1 2  48 42 o 3.863000 0.9516000 3.966000 1.373000  3.761000 1.318000  0.2042000      1.903000  
1 1 1 2  48 44 o 3.959000 0.9100000 4.803000 1.220000  3.115000 1.350000  1.688000       1.820000  
1 1 1 2  49 1  o 32.07000 0.5241000 32.29000 0.5231000 31.85000 0.9083000 0.4393000      1.048000  
1 1 1 2  49 3  o 21.11000 0.3517000 21.76000 0.5397000 20.46000 0.4513000 1.299000       0.7035000 
1 1 1 2  49 5  o 18.64000 0.3911000 18.79000 0.6338000 18.49000 0.4583000 0.3024000      0.7822000 
1 1 1 2  49 7  o 8.008000 0.5714000 7.951000 0.8719000 8.064000 0.7389000 -0.1135000     1.143000  
1 1 1 2  49 9  o 2.706000 0.8196000 3.007000 1.249000  2.405000 1.062000  0.6020000      1.639000  
1 1 1 2  49 11 o 4.104000 0.8687000 4.603000 1.237000  3.605000 1.220000  0.9978000      1.737000  
1 1 1 2  49 13 o 3.883000 0.8880000 3.809000 1.202000  3.956000 1.307000  -0.1475000     1.776000  
1 1 1 2  49 15 o 5.434000 0.7863000 5.712000 0.9044000 5.156000 1.287000  0.5566000      1.573000  
1 1 1 2  49 17 o 13.17000 0.3816000 13.62000 0.4617000 12.73000 0.6076000 0.8979000      0.7631000 
1 1 1 2  49 19 o 14.97000 0.4070000 14.95000 0.5817000 14.99000 0.5694000 -0.4324000E-01 0.8140000 
1 1 1 2  49 21 o 10.75000 0.4588000 9.975000 0.6114000 11.52000 0.6841000 -1.546000      0.9175000 
1 1 1 2  49 23 o 9.443000 0.5084000 9.776000 0.7826000 9.110000 0.6493000 0.6663000      1.017000  
1 1 1 2  49 25 o 3.477000 0.9622000 4.151000 1.504000  2.803000 1.201000  1.348000       1.924000  
1 1 1 2  49 27 o 6.394000 0.6849000 6.190000 0.9584000 6.599000 0.9787000 -0.4087000     1.370000  
1 1 1 2  49 29 o 8.522000 0.5595000 8.607000 0.7681000 8.436000 0.8137000 0.1703000      1.119000  
1 1 1 2  49 31 o 3.884000 0.9428000 3.912000 1.276000  3.856000 1.388000  0.5640000E-01  1.886000  
1 1 1 2  49 33 o 9.898000 0.5553000 10.27000 0.6615000 9.525000 0.8922000 0.7450000      1.111000  
1 1 1 2  49 35 o 4.345000 0.9119000 4.402000 1.232000  4.288000 1.345000  0.1142000      1.824000  
1 1 1 2  49 37 o 5.722000 0.8757000 6.512000 0.9547000 4.931000 1.468000  1.581000       1.751000  
1 1 1 2  49 39 o 6.571000 0.7811000 5.584000 1.151000  7.557000 1.056000  -1.974000      1.562000  
1 1 1 2  49 41 o 5.275000 0.9470000 5.949000 1.331000  4.601000 1.348000  1.348000       1.894000  
1 1 1 2  49 43 o 6.030000 1.336000  5.553000 1.569000  6.506000 2.162000  -0.9526000     2.671000  
1 1 1 2  50 0  o 23.96000 0.4543000 23.96000 0.4543000 23.96000 0.4543000 0.000000       0.000000  
1 1 1 2  50 2  o 5.674000 0.7700000 5.743000 1.115000  5.605000 1.063000  0.1374000      1.540000  
1 1 1 2  50 4  o 6.514000 0.7986000 5.850000 1.364000  7.178000 0.8306000 -1.328000      1.597000  
1 1 1 2  50 6  o 5.641000 1.146000  6.735000 1.916000  4.547000 1.259000  2.188000       2.293000  
1 1 1 2  50 8  o 3.252000 0.8941000 3.681000 1.354000  2.822000 1.168000  0.8590000      1.788000  
1 1 1 2  50 10 o 14.17000 0.4097000 13.81000 0.6184000 14.52000 0.5375000 -0.7059000     0.8193000 
1 1 1 2  50 12 o 14.22000 0.3726000 13.84000 0.5086000 14.59000 0.5446000 -0.7446000     0.7451000 
1 1 1 2  50 14 o 18.33000 0.3238000 18.33000 0.4122000 18.32000 0.4994000 0.7181000E-02  0.6475000 
1 1 1 2  50 16 o 13.49000 0.3948000 13.85000 0.5170000 13.12000 0.5967000 0.7377000      0.7895000 
1 1 1 2  50 18 o 16.07000 0.3600000 16.05000 0.4715000 16.08000 0.5442000 -0.3162000E-01 0.7200000 
1 1 1 2  50 20 o 6.136000 0.7705000 6.331000 1.080000  5.941000 1.100000  0.3902000      1.541000  
1 1 1 2  50 22 o 9.498000 0.5332000 9.456000 0.8448000 9.540000 0.6508000 -0.8425000E-01 1.066000  
1 1 1 2  50 24 o 14.32000 0.4269000 13.79000 0.6329000 14.84000 0.5732000 -1.051000      0.8538000 
1 1 1 2  50 26 o 7.344000 0.6102000 7.159000 0.8727000 7.528000 0.8530000 -0.3687000     1.220000  
1 1 1 2  50 28 o 13.40000 0.3941000 13.44000 0.5366000 13.35000 0.5773000 0.9347000E-01  0.7882000 
1 1 1 2  50 30 o 19.58000 0.3632000 20.06000 0.4733000 19.09000 0.5511000 0.9663000      0.7264000 
1 1 1 2  50 32 o 4.982000 0.8893000 5.590000 1.187000  4.375000 1.325000  1.215000       1.779000  
1 1 1 2  50 34 o 4.786000 0.8570000 3.905000 1.259000  5.667000 1.163000  -1.762000      1.714000  
1 1 1 2  50 36 o 10.28000 0.5160000 9.513000 0.6739000 11.04000 0.7816000 -1.530000      1.032000  
1 1 1 2  50 38 o 5.584000 0.9345000 5.503000 1.247000  5.664000 1.392000  -0.1608000     1.869000  
1 1 1 2  50 40 o 3.330000 0.9207000 3.305000 1.298000  3.354000 1.306000  -0.4842000E-01 1.841000  
1 1 1 2  51 1  o 10.35000 0.5275000 10.63000 0.7791000 10.07000 0.7112000 0.5580000      1.055000  
1 1 1 2  51 3  o 10.82000 0.5130000 11.68000 0.8056000 9.947000 0.6354000 1.737000       1.026000  
1 1 1 2  51 5  o 5.611000 0.7668000 5.810000 1.030000  5.412000 1.136000  0.3989000      1.534000  
1 1 1 2  51 7  o 3.481000 0.8289000 2.710000 1.134000  4.252000 1.209000  -1.542000      1.658000  
1 1 1 2  51 9  o 10.18000 0.5015000 10.52000 0.7180000 9.837000 0.7004000 0.6824000      1.003000  
1 1 1 2  51 11 o 4.158000 0.9143000 4.760000 1.347000  3.555000 1.237000  1.205000       1.829000  
1 1 1 2  51 13 f 5.717000 0.8458000 5.525000 1.202000  5.909000 1.191000  -0.3837000     1.692000  
1 1 1 2  51 15 o 4.974000 0.8685000 5.141000 1.171000  4.808000 1.283000  0.3327000      1.737000  
1 1 1 2  51 17 o 7.334000 0.6032000 7.117000 0.8632000 7.552000 0.8426000 -0.4345000     1.206000  
1 1 1 2  51 19 o 7.145000 0.6631000 8.374000 0.8598000 5.917000 1.010000  2.457000       1.326000  
1 1 1 2  51 21 o 13.22000 0.3708000 13.39000 0.5088000 13.06000 0.5395000 0.3311000      0.7416000 
1 1 1 2  51 23 o 7.309000 0.7280000 6.872000 1.081000  7.746000 0.9758000 -0.8739000     1.456000  
1 1 1 2  51 25 o 10.79000 0.4417000 11.15000 0.5877000 10.42000 0.6596000 0.7307000      0.8834000 
1 1 1 2  51 27 o 16.89000 0.3452000 17.00000 0.4906000 16.77000 0.4859000 0.2340000      0.6905000 
1 1 1 2  51 29 o 4.044000 0.9704000 3.590000 1.304000  4.498000 1.438000  -0.9084000     1.941000  
1 1 1 2  51 31 o 6.976000 0.6461000 6.552000 0.9810000 7.400000 0.8412000 -0.8478000     1.292000  
1 1 1 2  51 33 o 7.446000 0.6618000 8.082000 0.8546000 6.810000 1.011000  1.272000       1.324000  
1 1 1 2  51 35 o 3.033000 0.9070000 2.904000 1.240000  3.162000 1.324000  -0.2588000     1.814000  
1 1 1 2  51 37 o 4.704000 1.006000  4.011000 1.386000  5.398000 1.459000  -1.387000      2.012000  
1 1 1 2  51 39 o 4.504000 0.8539000 5.831000 1.061000  3.177000 1.338000  2.655000       1.708000  
1 1 1 2  52 0  o 12.01000 1.192000  12.01000 1.192000  12.01000 1.192000  0.000000       0.000000  
1 1 1 2  52 2  f 7.274000 0.7673000 7.842000 1.035000  6.707000 1.133000  1.135000       1.535000  
1 1 1 2  52 4  o 4.444000 0.8924000 4.990000 1.233000  3.899000 1.290000  1.091000       1.785000  
1 1 1 2  52 6  o 11.84000 0.4065000 11.76000 0.5800000 11.93000 0.5697000 -0.1719000     0.8130000 
1 1 1 2  52 8  o 3.919000 0.8995000 4.104000 1.213000  3.733000 1.328000  0.3713000      1.799000  
1 1 1 2  52 10 o 6.982000 0.6010000 6.521000 0.8308000 7.443000 0.8686000 -0.9226000     1.202000  
1 1 1 2  52 12 o 6.025000 0.6808000 5.410000 0.9567000 6.639000 0.9687000 -1.228000      1.362000  
1 1 1 2  52 14 o 10.79000 0.4310000 11.09000 0.5529000 10.49000 0.6612000 0.6015000      0.8619000 
1 1 1 2  52 16 o 12.32000 0.4092000 12.35000 0.5054000 12.28000 0.6437000 0.6885000E-01  0.8184000 
1 1 1 2  52 18 o 2.909000 0.8497000 2.278000 1.011000  3.539000 1.366000  -1.261000      1.699000  
1 1 1 2  52 20 f 3.026000 0.8497000 3.332000 1.249000  2.720000 1.152000  0.6121000      1.699000  
1 1 1 2  52 22 o 3.625000 0.8940000 4.348000 1.270000  2.901000 1.258000  1.447000       1.788000  
1 1 1 2  52 24 o 5.494000 0.8108000 5.204000 1.195000  5.785000 1.096000  -0.5815000     1.622000  
1 1 1 2  52 26 o 10.36000 0.5112000 10.81000 0.6232000 9.907000 0.8105000 0.9045000      1.022000  
1 1 1 2  52 28 o 3.482000 0.8848000 4.100000 1.261000  2.864000 1.241000  1.236000       1.770000  
1 1 1 2  52 30 o 3.927000 0.9234000 4.421000 1.317000  3.434000 1.295000  0.9870000      1.847000  
1 1 1 2  52 32 o 3.870000 0.9454000 3.964000 1.356000  3.775000 1.318000  0.1896000      1.891000  
1 1 1 2  52 34 o 2.964000 0.8799000 3.209000 1.256000  2.719000 1.233000  0.4901000      1.760000  
1 1 1 2  52 36 o 6.464000 0.8305000 6.211000 0.9869000 6.716000 1.336000  -0.5049000     1.661000  
1 1 1 2  52 38 o 4.515000 1.018000  4.519000 1.477000  4.511000 1.400000  0.8756000E-02  2.035000  
1 1 1 2  53 1  o 18.98000 0.4130000 18.84000 0.5699000 19.11000 0.5979000 -0.2627000     0.8260000 
1 1 1 2  53 3  o 16.41000 0.4183000 16.72000 0.5750000 16.10000 0.6076000 0.6225000      0.8365000 
1 1 1 2  53 5  o 7.194000 0.6572000 6.988000 0.9123000 7.400000 0.9461000 -0.4125000     1.314000  
1 1 1 2  53 7  o 7.955000 0.6107000 7.850000 0.7637000 8.059000 0.9532000 -0.2087000     1.221000  
1 1 1 2  53 9  o 8.907000 0.4701000 8.811000 0.6600000 9.003000 0.6696000 -0.1922000     0.9402000 
1 1 1 2  53 11 o 7.281000 0.5749000 7.048000 0.8400000 7.514000 0.7850000 -0.4663000     1.150000  
1 1 1 2  53 13 o 11.23000 0.4040000 10.82000 0.5233000 11.63000 0.6156000 -0.8087000     0.8080000 
1 1 1 2  53 15 o 12.51000 0.3935000 12.71000 0.4853000 12.31000 0.6196000 0.3993000      0.7870000 
1 1 1 2  53 17 f 11.29000 0.5069000 11.62000 0.5230000 10.97000 0.8686000 0.6429000      1.014000  
1 1 1 2  53 19 o 4.944000 0.8366000 4.691000 1.223000  5.198000 1.142000  -0.5063000     1.673000  
1 1 1 2  53 21 o 4.668000 0.9248000 4.089000 1.288000  5.247000 1.327000  -1.158000      1.850000  
1 1 1 2  53 23 o 4.057000 0.9459000 4.059000 1.271000  4.056000 1.402000  0.2959000E-02  1.892000  
1 1 1 2  53 25 o 11.82000 0.4703000 12.21000 0.6082000 11.42000 0.7175000 0.7865000      0.9406000 
1 1 1 2  53 27 o 3.215000 0.9227000 2.843000 1.214000  3.587000 1.390000  -0.7441000     1.845000  
1 1 1 2  53 29 o 5.355000 0.8429000 4.854000 1.235000  5.857000 1.148000  -1.003000      1.686000  
1 1 1 2  53 31 o 4.060000 0.9209000 4.614000 1.310000  3.506000 1.294000  1.107000       1.842000  
1 1 1 2  53 33 o 3.765000 0.9530000 4.519000 1.367000  3.010000 1.328000  1.509000       1.906000  
1 1 1 2  53 35 o 5.002000 1.026000  4.780000 1.373000  5.223000 1.524000  -0.4427000     2.052000  
1 1 1 2  53 37 f 4.294000 1.178000  4.643000 1.709000  3.945000 1.621000  0.6974000      2.356000  
1 1 1 2  54 0  o 2.655000 1.188000  2.655000 1.188000  2.655000 1.188000  0.000000       0.000000  
1 1 1 2  54 2  o 6.594000 0.8025000 6.707000 0.9942000 6.481000 1.260000  0.2263000      1.605000  
1 1 1 2  54 4  o 10.76000 0.4945000 10.27000 0.6209000 11.26000 0.7698000 -0.9969000     0.9890000 
1 1 1 2  54 6  o 11.28000 0.4789000 11.06000 0.7378000 11.50000 0.6107000 -0.4464000     0.9578000 
1 1 1 2  54 8  o 5.877000 0.8322000 6.062000 0.9383000 5.692000 1.375000  0.3694000      1.664000  
1 1 1 2  54 10 o 7.481000 0.5864000 7.442000 0.7882000 7.520000 0.8684000 -0.7874000E-01 1.173000  
1 1 1 2  54 12 o 9.857000 0.4639000 9.854000 0.6226000 9.861000 0.6880000 -0.6968000E-02 0.9279000 
1 1 1 2  54 14 f 3.948000 0.7773000 5.224000 1.041000  2.672000 1.154000  2.552000       1.555000  
1 1 1 2  54 16 o 7.479000 0.6024000 7.166000 0.7654000 7.791000 0.9305000 -0.6250000     1.205000  
1 1 1 2  54 18 o 14.83000 0.3770000 15.11000 0.4906000 14.56000 0.5726000 0.5438000      0.7540000 
1 1 1 2  54 20 o 3.916000 0.9358000 3.775000 1.267000  4.058000 1.377000  -0.2829000     1.872000  
1 1 1 2  54 22 o 5.903000 0.8023000 5.119000 1.157000  6.686000 1.112000  -1.567000      1.605000  
1 1 1 2  54 24 o 3.449000 0.9195000 3.629000 1.277000  3.270000 1.323000  0.3591000      1.839000  
1 1 1 2  54 26 o 3.750000 0.9036000 4.374000 1.266000  3.125000 1.290000  1.250000       1.807000  
1 1 1 2  54 28 o 2.846000 0.8581000 2.973000 1.233000  2.718000 1.194000  0.2551000      1.716000  
1 1 1 2  54 30 o 3.198000 0.8834000 2.722000 1.202000  3.673000 1.295000  -0.9514000     1.767000  
1 1 1 2  54 32 o 4.879000 0.9659000 4.260000 1.338000  5.498000 1.393000  -1.239000      1.932000  
1 1 1 2  54 34 o 4.963000 0.9712000 4.823000 1.249000  5.104000 1.487000  -0.2809000     1.942000  
1 1 1 2  55 1  o 6.697000 0.8372000 6.006000 1.349000  7.389000 0.9916000 -1.382000      1.674000  
1 1 1 2  55 3  o 5.267000 0.9699000 5.941000 1.073000  4.593000 1.616000  1.348000       1.940000  
1 1 1 2  55 5  f 4.372000 0.9144000 4.232000 1.258000  4.511000 1.328000  -0.2784000     1.829000  
1 1 1 2  55 7  o 7.983000 0.5345000 7.564000 0.7687000 8.402000 0.7428000 -0.8374000     1.069000  
1 1 1 2  55 9  o 4.423000 0.8456000 3.836000 1.241000  5.011000 1.149000  -1.174000      1.691000  
1 1 1 2  55 11 o 3.227000 0.8776000 3.684000 1.258000  2.769000 1.224000  0.9152000      1.755000  
1 1 1 2  55 13 o 7.932000 0.8357000 8.759000 0.7021000 7.106000 1.517000  1.653000       1.671000  
1 1 1 2  55 15 o 10.36000 0.5085000 10.10000 0.6090000 10.63000 0.8146000 -0.5324000     1.017000  
1 1 1 2  55 17 o 9.763000 0.5542000 9.832000 0.6896000 9.694000 0.8677000 0.1383000      1.108000  
1 1 1 2  55 19 o 3.535000 0.9015000 2.844000 1.183000  4.225000 1.361000  -1.381000      1.803000  
1 1 1 2  55 21 o 6.354000 0.6800000 5.560000 1.029000  7.148000 0.8895000 -1.588000      1.360000  
1 1 1 2  55 23 o 4.974000 0.8775000 5.485000 1.199000  4.464000 1.281000  1.021000       1.755000  
1 1 1 2  55 25 o 6.638000 0.7089000 6.132000 1.033000  7.143000 0.9707000 -1.011000      1.418000  
1 1 1 2  55 27 o 7.085000 0.7331000 7.970000 0.8715000 6.199000 1.179000  1.771000       1.466000  
1 1 1 2  55 29 o 4.173000 0.9433000 3.404000 1.323000  4.941000 1.344000  -1.537000      1.887000  
1 1 1 2  55 31 o 10.62000 0.5356000 10.26000 0.7504000 10.99000 0.7644000 -0.7247000     1.071000  
1 1 1 2  55 33 o 7.385000 0.6958000 7.836000 0.9033000 6.934000 1.059000  0.9015000      1.392000  
1 1 1 2  56 0  o 4.323000 1.300000  4.323000 1.300000  4.323000 1.300000  0.000000       0.000000  
1 1 1 2  56 2  o 4.309000 1.020000  4.349000 1.342000  4.269000 1.536000  0.8011000E-01  2.039000  
1 1 1 2  56 4  o 11.33000 0.4700000 10.42000 0.6167000 12.25000 0.7094000 -1.822000      0.9400000 
1 1 1 2  56 6  o 11.15000 0.4898000 11.71000 0.5775000 10.59000 0.7913000 1.116000       0.9796000 
1 1 1 2  56 8  o 4.057000 0.9939000 3.469000 1.261000  4.645000 1.537000  -1.176000      1.988000  
1 1 1 2  56 10 o 2.472000 0.7680000 2.102000 0.9840000 2.841000 1.180000  -0.7384000     1.536000  
1 1 1 2  56 12 o 4.191000 0.8691000 5.076000 1.064000  3.306000 1.375000  1.771000       1.738000  
1 1 1 2  56 14 o 5.379000 0.8642000 5.543000 1.143000  5.215000 1.297000  0.3280000      1.728000  
1 1 1 2  56 16 o 3.903000 0.8870000 3.074000 1.254000  4.733000 1.255000  -1.659000      1.774000  
1 1 1 2  56 18 o 3.646000 0.8556000 2.821000 1.190000  4.470000 1.230000  -1.649000      1.711000  
1 1 1 2  56 20 o 3.572000 0.9062000 4.085000 1.325000  3.059000 1.236000  1.026000       1.812000  
1 1 1 2  56 22 o 5.756000 0.8027000 5.446000 1.198000  6.067000 1.069000  -0.6207000     1.605000  
1 1 1 2  56 24 o 4.045000 0.9359000 3.442000 1.302000  4.648000 1.345000  -1.206000      1.872000  
1 1 1 2  56 26 o 2.491000 0.7769000 2.455000 1.106000  2.526000 1.091000  -0.7095000E-01 1.554000  
1 1 1 2  56 28 o 4.830000 1.103000  4.497000 1.343000  5.163000 1.750000  -0.6664000     2.206000  
1 1 1 2  56 30 o 6.659000 0.7428000 6.448000 1.103000  6.870000 0.9949000 -0.4226000     1.486000  
1 1 1 2  57 1  o 2.939000 0.8767000 3.303000 1.331000  2.576000 1.142000  0.7265000      1.753000  
1 1 1 2  57 3  o 1.932000 0.6636000 2.077000 0.9902000 1.787000 0.8838000 0.2903000      1.327000  
1 1 1 2  57 5  o 5.385000 0.8584000 6.008000 0.9585000 4.763000 1.424000  1.244000       1.717000  
1 1 1 2  57 7  o 7.015000 0.7175000 6.177000 1.147000  7.852000 0.8618000 -1.676000      1.435000  
1 1 1 2  57 9  o 10.44000 0.4956000 10.41000 0.6216000 10.47000 0.7721000 -0.5448000E-01 0.9912000 
1 1 1 2  57 11 o 9.146000 0.6128000 9.748000 0.5790000 8.544000 1.080000  1.204000       1.226000  
1 1 1 2  57 13 o 7.490000 0.7032000 6.798000 0.8236000 8.181000 1.140000  -1.383000      1.406000  
1 1 1 2  57 15 o 3.876000 0.9665000 4.112000 1.432000  3.640000 1.299000  0.4721000      1.933000  
1 1 1 2  57 17 o 7.977000 0.6021000 7.768000 0.8434000 8.187000 0.8595000 -0.4192000     1.204000  
1 1 1 2  57 19 o 3.322000 0.8850000 2.652000 1.223000  3.992000 1.279000  -1.340000      1.770000  
1 1 1 2  57 21 o 5.880000 0.8153000 5.351000 1.299000  6.409000 0.9857000 -1.058000      1.631000  
1 1 1 2  57 23 o 4.057000 0.9736000 3.101000 1.326000  5.012000 1.426000  -1.911000      1.947000  
1 1 1 2  57 25 o 7.799000 0.7534000 8.931000 0.8065000 6.667000 1.273000  2.264000       1.507000  
1 1 1 2  57 27 o 8.164000 0.7634000 8.584000 0.7951000 7.745000 1.304000  0.8393000      1.527000  
1 1 1 2  57 29 o 4.154000 1.188000  3.748000 1.553000  4.561000 1.798000  -0.8124000     2.376000  
1 1 1 2  58 0  o 3.871000 1.292000  3.871000 1.292000  3.871000 1.292000  0.000000       0.000000  
1 1 1 2  58 2  o 3.924000 0.9085000 3.070000 1.285000  4.778000 1.285000  -1.708000      1.817000  
1 1 1 2  58 4  o 3.913000 0.9234000 3.482000 1.293000  4.344000 1.318000  -0.8621000     1.847000  
1 1 1 2  58 6  o 3.793000 0.8624000 2.872000 1.206000  4.714000 1.233000  -1.842000      1.725000  
1 1 1 2  58 8  o 3.907000 0.9315000 3.189000 1.247000  4.625000 1.384000  -1.436000      1.863000  
1 1 1 2  58 10 o 4.927000 0.8938000 5.177000 0.9915000 4.677000 1.487000  0.5002000      1.788000  
1 1 1 2  58 12 o 7.287000 0.6126000 7.886000 0.7668000 6.687000 0.9555000 1.198000       1.225000  
1 1 1 2  58 14 o 7.128000 0.8529000 7.891000 0.9680000 6.365000 1.405000  1.526000       1.706000  
1 1 1 2  58 16 o 7.900000 0.8017000 8.964000 0.6858000 6.836000 1.449000  2.129000       1.603000  
1 1 1 2  58 18 o 3.123000 0.9300000 2.972000 1.270000  3.273000 1.359000  -0.3014000     1.860000  
1 1 1 2  58 20 o 7.073000 0.7265000 6.510000 1.031000  7.636000 1.024000  -1.126000      1.453000  
1 1 1 2  58 22 o 3.019000 0.9161000 2.601000 1.148000  3.437000 1.428000  -0.8364000     1.832000  
1 1 1 2  58 24 o 7.559000 0.7045000 7.548000 0.9475000 7.570000 1.043000  -0.2226000E-01 1.409000  
1 1 1 2  58 26 o 3.625000 0.9875000 3.571000 1.379000  3.679000 1.414000  -0.1089000     1.975000  
1 1 1 2  59 1  o 12.07000 0.4633000 12.65000 0.6772000 11.50000 0.6323000 1.156000       0.9265000 
1 1 1 2  59 3  o 3.384000 0.8822000 3.602000 1.261000  3.165000 1.234000  0.4366000      1.764000  
1 1 1 2  59 5  o 5.428000 0.8466000 6.597000 1.082000  4.260000 1.302000  2.337000       1.693000  
1 1 1 2  59 7  o 3.336000 0.9063000 3.440000 1.260000  3.232000 1.303000  0.2077000      1.813000  
1 1 1 2  59 9  o 3.433000 0.9024000 3.466000 1.291000  3.400000 1.261000  0.6594000E-01  1.805000  
1 1 1 2  59 11 f 3.712000 0.8716000 2.480000 1.113000  4.943000 1.341000  -2.463000      1.743000  
1 1 1 2  59 13 o 5.948000 0.8258000 5.759000 1.084000  6.136000 1.246000  -0.3766000     1.652000  
1 1 1 2  59 15 o 8.162000 0.6239000 8.570000 0.8045000 7.754000 0.9538000 0.8154000      1.248000  
1 1 1 2  59 17 o 4.454000 0.9003000 4.119000 1.374000  4.788000 1.164000  -0.6694000     1.801000  
1 1 1 2  59 19 o 3.232000 0.8952000 3.595000 1.301000  2.869000 1.230000  0.7261000      1.790000  
1 1 1 2  59 21 o 5.813000 0.7896000 5.887000 1.073000  5.739000 1.158000  0.1485000      1.579000  
1 1 1 2  59 23 o 3.444000 0.9288000 3.370000 1.288000  3.518000 1.338000  -0.1485000     1.858000  
1 1 1 2  60 0  o 5.829000 1.106000  5.829000 1.106000  5.829000 1.106000  0.000000       0.000000  
1 1 1 2  60 2  o 4.490000 0.8964000 4.677000 1.233000  4.303000 1.302000  0.3741000      1.793000  
1 1 1 2  60 4  o 6.483000 0.7378000 6.233000 1.006000  6.733000 1.080000  -0.4996000     1.476000  
1 1 1 2  60 6  o 3.848000 0.9174000 3.724000 1.313000  3.972000 1.281000  -0.2476000     1.835000  
1 1 1 2  60 8  o 7.936000 0.6042000 8.583000 0.8475000 7.289000 0.8614000 1.294000       1.208000  
1 1 1 2  60 10 o 5.274000 0.8325000 4.706000 1.090000  5.842000 1.258000  -1.136000      1.665000  
1 1 1 2  60 12 o 5.271000 0.8510000 3.943000 1.294000  6.600000 1.106000  -2.657000      1.702000  
1 1 1 2  60 14 o 4.190000 0.9149000 4.011000 1.183000  4.369000 1.396000  -0.3579000     1.830000  
1 1 1 2  60 16 o 3.646000 0.9939000 3.282000 1.343000  4.010000 1.466000  -0.7278000     1.988000  
1 1 1 2  60 18 o 3.359000 0.9047000 2.792000 1.192000  3.926000 1.361000  -1.135000      1.809000  
1 1 1 2  60 20 o 3.667000 0.9577000 3.337000 1.290000  3.996000 1.416000  -0.6590000     1.915000  
1 1 1 2  61 1  o 3.464000 0.9354000 2.920000 1.219000  4.008000 1.419000  -1.088000      1.871000  
1 1 1 2  61 3  o 3.184000 0.8990000 3.497000 1.284000  2.871000 1.258000  0.6264000      1.798000  
1 1 1 2  61 5  o 3.679000 0.8954000 4.360000 1.307000  2.997000 1.225000  1.362000       1.791000  
1 1 1 2  61 7  o 4.355000 0.8851000 3.922000 1.271000  4.787000 1.232000  -0.8649000     1.770000  
1 1 1 2  61 9  o 4.207000 0.9075000 4.034000 1.181000  4.381000 1.378000  -0.3469000     1.815000  
1 1 1 2  61 11 o 4.952000 0.9435000 4.702000 1.250000  5.203000 1.414000  -0.5008000     1.887000  
1 1 1 2  61 13 o 4.104000 0.9453000 3.677000 1.312000  4.530000 1.361000  -0.8533000     1.891000  
1 1 1 2  61 15 o 4.805000 0.8588000 4.756000 1.032000  4.854000 1.373000  -0.9835000E-01 1.718000  
1 1 1 2  61 17 o 3.865000 1.064000  2.891000 1.342000  4.839000 1.650000  -1.948000      2.127000  
1 1 1 2  62 0  o 3.127000 1.304000  3.127000 1.304000  3.127000 1.304000  0.000000       0.000000  
1 1 1 2  62 2  o 5.209000 0.8151000 5.363000 1.062000  5.056000 1.237000  0.3074000      1.630000  
1 1 1 2  62 4  o 5.454000 0.7960000 4.382000 1.287000  6.527000 0.9365000 -2.145000      1.592000  
1 1 1 2  62 6  o 8.672000 0.5910000 9.728000 0.8081000 7.616000 0.8625000 2.112000       1.182000  
1 1 1 2  62 8  o 5.713000 0.8721000 4.206000 1.386000  7.219000 1.058000  -3.012000      1.744000  
1 1 1 2  62 10 o 7.707000 0.6150000 7.274000 0.7988000 8.140000 0.9354000 -0.8663000     1.230000  
1 1 1 2  62 12 o 2.909000 0.9215000 2.571000 1.174000  3.246000 1.421000  -0.6750000     1.843000  
1 1 1 2  63 1  o 2.903000 0.9292000 2.758000 1.269000  3.048000 1.358000  -0.2902000     1.858000  
1 1 1 2  63 3  o 4.788000 1.179000  5.385000 1.795000  4.192000 1.528000  1.193000       2.357000  
1 1 1 2  63 5  o 7.394000 1.726000  ?        ?         7.394000 1.726000  ?              ?         
1 1 1 3  0  1  o 14.14000 0.1615000 14.14000 0.1615000 14.14000 0.1615000 0.000000       0.000000  
1 1 1 3  0  3  o 99.22000 0.9528000 99.22000 0.9528000 99.22000 0.9528000 0.000000       0.000000  
1 1 1 3  0  5  f 21.22000 0.2638000 21.22000 0.2638000 21.22000 0.2638000 0.000000       0.000000  
1 1 1 3  0  7  o 25.23000 0.2674000 25.23000 0.2674000 25.23000 0.2674000 0.000000       0.000000  
1 1 1 3  0  9  o 71.86000 0.6968000 71.86000 0.6968000 71.86000 0.6968000 0.000000       0.000000  
1 1 1 3  0  11 o 42.64000 0.4283000 42.64000 0.4283000 42.64000 0.4283000 0.000000       0.000000  
1 1 1 3  0  13 o 63.80000 0.6253000 63.80000 0.6253000 63.80000 0.6253000 0.000000       0.000000  
1 1 1 3  0  15 o 93.46000 0.9052000 93.46000 0.9052000 93.46000 0.9052000 0.000000       0.000000  
1 1 1 3  0  17 o 35.89000 0.4397000 35.89000 0.4397000 35.89000 0.4397000 0.000000       0.000000  
1 1 1 3  0  19 o 24.20000 0.3068000 24.20000 0.3068000 24.20000 0.3068000 0.000000       0.000000  
1 1 1 3  0  21 o 127.6000 1.233000  127.6000 1.233000  127.6000 1.233000  0.000000       0.000000  
1 1 1 3  0  23 o 64.87000 0.6477000 64.87000 0.6477000 64.87000 0.6477000 0.000000       0.000000  
1 1 1 3  0  25 o 12.78000 0.4531000 12.78000 0.4531000 12.78000 0.4531000 0.000000       0.000000  
1 1 1 3  0  27 o 64.47000 0.7522000 64.47000 0.7522000 64.47000 0.7522000 0.000000       0.000000  
1 1 1 3  0  29 o 49.13000 0.6030000 49.13000 0.6030000 49.13000 0.6030000 0.000000       0.000000  
1 1 1 3  0  31 o 52.21000 0.5534000 52.21000 0.5534000 52.21000 0.5534000 0.000000       0.000000  
1 1 1 3  0  33 o 29.73000 0.4177000 29.73000 0.4177000 29.73000 0.4177000 0.000000       0.000000  
1 1 1 3  0  35 o 21.39000 0.4265000 21.39000 0.4265000 21.39000 0.4265000 0.000000       0.000000  
1 1 1 3  0  37 o 59.10000 0.6166000 59.10000 0.6166000 59.10000 0.6166000 0.000000       0.000000  
1 1 1 3  0  39 o 22.25000 0.5438000 22.25000 0.5438000 22.25000 0.5438000 0.000000       0.000000  
1 1 1 3  0  41 o 8.356000 0.9027000 8.356000 0.9027000 8.356000 0.9027000 0.000000       0.000000  
1 1 1 3  0  43 o 44.92000 0.6064000 44.92000 0.6064000 44.92000 0.6064000 0.000000       0.000000  
1 1 1 3  0  45 o 10.30000 0.9329000 10.30000 0.9329000 10.30000 0.9329000 0.000000       0.000000  
1 1 1 3  0  47 o 29.79000 0.4646000 29.79000 0.4646000 29.79000 0.4646000 0.000000       0.000000  
1 1 1 3  0  49 o 8.042000 1.066000  8.042000 1.066000  8.042000 1.066000  0.000000       0.000000  
1 1 1 3  0  51 o 22.03000 0.4920000 22.03000 0.4920000 22.03000 0.4920000 0.000000       0.000000  
1 1 1 3  0  53 o 4.290000 1.698000  4.290000 1.698000  4.290000 1.698000  0.000000       0.000000  
1 1 1 3  0  55 o 2.381000 1.126000  2.381000 1.126000  2.381000 1.126000  0.000000       0.000000  
1 1 1 3  0  57 o 21.07000 0.5050000 21.07000 0.5050000 21.07000 0.5050000 0.000000       0.000000  
1 1 1 3  0  59 o 9.412000 0.8384000 9.412000 0.8384000 9.412000 0.8384000 0.000000       0.000000  
1 1 1 3  0  61 o 3.660000 1.462000  3.660000 1.462000  3.660000 1.462000  0.000000       0.000000  
1 1 1 3  0  63 o 6.270000 1.320000  6.270000 1.320000  6.270000 1.320000  0.000000       0.000000  
1 1 1 3  0  65 o 3.125000 1.345000  3.125000 1.345000  3.125000 1.345000  0.000000       0.000000  
1 1 1 3  0  67 o 5.138000 1.489000  5.138000 1.489000  5.138000 1.489000  0.000000       0.000000  
1 1 1 3  1  0  o 96.63000 1.072000  96.63000 1.072000  96.63000 1.072000  0.000000       0.000000  
1 1 1 3  1  2  o 31.84000 0.2225000 32.24000 0.3182000 31.45000 0.3111000 0.7900000      0.4450000 
1 1 1 3  1  4  o 5.085000 0.1619000 4.904000 0.2302000 5.266000 0.2276000 -0.3611000     0.3237000 
1 1 1 3  1  6  o 78.62000 0.5541000 78.52000 0.6776000 78.72000 0.8769000 -0.1943000     1.108000  
1 1 1 3  1  8  o 83.27000 0.5870000 83.15000 0.9267000 83.39000 0.7207000 -0.2357000     1.174000  
1 1 1 3  1  10 o 33.50000 0.2443000 33.46000 0.3452000 33.54000 0.3459000 -0.8066000E-01 0.4886000 
1 1 1 3  1  12 o 22.16000 0.2171000 21.77000 0.3050000 22.56000 0.3090000 -0.7845000     0.4341000 
1 1 1 3  1  14 o 43.42000 0.3584000 43.46000 0.5065000 43.37000 0.5072000 0.9241000E-01  0.7167000 
1 1 1 3  1  16 o 78.39000 0.6241000 77.88000 0.8764000 78.91000 0.8887000 -1.039000      1.248000  
1 1 1 3  1  18 o 77.97000 0.5824000 77.19000 0.8750000 78.76000 0.7689000 -1.574000      1.165000  
1 1 1 3  1  20 o 41.75000 0.3096000 41.92000 0.4390000 41.59000 0.4367000 0.3293000      0.6192000 
1 1 1 3  1  22 f 86.53000 0.5978000 86.82000 0.8484000 86.24000 0.8424000 0.5750000      1.196000  
1 1 1 3  1  24 f 54.93000 0.3969000 55.07000 0.5622000 54.80000 0.5605000 0.2689000      0.7939000 
1 1 1 3  1  26 o 90.59000 0.6784000 90.37000 0.8862000 90.82000 1.027000  -0.4484000     1.357000  
1 1 1 3  1  28 o 54.80000 0.4343000 55.01000 0.6581000 54.58000 0.5668000 0.4294000      0.8686000 
1 1 1 3  1  30 o 35.19000 0.4282000 35.26000 0.6132000 35.13000 0.5980000 0.1290000      0.8565000 
1 1 1 3  1  32 o 84.97000 0.6877000 85.22000 0.9762000 84.72000 0.9689000 0.4972000      1.375000  
1 1 1 3  1  34 o 57.34000 0.4244000 56.55000 0.5912000 58.12000 0.6091000 -1.564000      0.8488000 
1 1 1 3  1  36 o 31.54000 0.3014000 30.98000 0.4208000 32.09000 0.4316000 -1.103000      0.6028000 
1 1 1 3  1  38 o 15.25000 0.4228000 15.89000 0.5909000 14.60000 0.6050000 1.289000       0.8457000 
1 1 1 3  1  40 o 34.57000 0.4089000 35.06000 0.5262000 34.08000 0.6261000 0.9802000      0.8178000 
1 1 1 3  1  42 o 11.79000 0.6238000 12.02000 0.7701000 11.55000 0.9815000 0.4679000      1.248000  
1 1 1 3  1  44 o 32.18000 0.3626000 32.58000 0.4683000 31.78000 0.5537000 0.8020000      0.7252000 
1 1 1 3  1  46 o 12.49000 0.4892000 12.63000 0.7061000 12.35000 0.6773000 0.2743000      0.9784000 
1 1 1 3  1  48 o 14.56000 0.4485000 14.09000 0.6328000 15.03000 0.6358000 -0.9399000     0.8970000 
1 1 1 3  1  50 o 13.26000 0.4704000 13.03000 0.6940000 13.49000 0.6351000 -0.4552000     0.9408000 
1 1 1 3  1  52 o 12.45000 0.5469000 13.08000 0.7169000 11.83000 0.8261000 1.242000       1.094000  
1 1 1 3  1  54 o 24.79000 0.4386000 25.00000 0.5601000 24.59000 0.6750000 0.4108000      0.8771000 
1 1 1 3  1  56 o 19.85000 0.4242000 19.98000 0.5791000 19.72000 0.6201000 0.2602000      0.8485000 
1 1 1 3  1  58 o 8.581000 0.6777000 8.362000 0.9971000 8.800000 0.9181000 -0.4373000     1.355000  
1 1 1 3  1  60 o 3.495000 0.9730000 3.029000 1.278000  3.960000 1.467000  -0.9309000     1.946000  
1 1 1 3  1  62 o 7.703000 0.9354000 8.510000 1.146000  6.895000 1.479000  1.615000       1.871000  
1 1 1 3  1  64 o 13.40000 0.5629000 13.55000 0.7475000 13.25000 0.8419000 0.3063000      1.126000  
1 1 1 3  1  66 o 4.947000 1.117000  6.029000 1.648000  3.865000 1.509000  2.164000       2.235000  
1 1 1 3  1  68 o 4.852000 0.9887000 5.712000 1.317000  3.993000 1.475000  1.719000       1.977000  
1 1 1 3  2  1  o 125.4000 0.9202000 123.8000 1.187000  126.9000 1.406000  -3.161000      1.840000  
1 1 1 3  2  3  o 18.56000 0.1542000 18.35000 0.1982000 18.76000 0.2363000 -0.4084000     0.3084000 
1 1 1 3  2  5  o 141.7000 0.9936000 141.5000 1.216000  141.8000 1.572000  -0.2896000     1.987000  
1 1 1 3  2  7  o 118.1000 0.8026000 118.1000 1.135000  118.1000 1.135000  0.7278000E-02  1.605000  
1 1 1 3  2  9  f 62.85000 0.4461000 62.47000 0.7014000 63.23000 0.5515000 -0.7631000     0.8922000 
1 1 1 3  2  11 o 64.93000 0.4843000 64.88000 0.6333000 64.98000 0.7328000 -0.9721000E-01 0.9686000 
1 1 1 3  2  13 o 52.53000 0.3968000 52.22000 0.5963000 52.84000 0.5237000 -0.6153000     0.7936000 
1 1 1 3  2  15 o 19.21000 0.2164000 19.19000 0.3033000 19.24000 0.3088000 -0.5142000E-01 0.4328000 
1 1 1 3  2  17 o 70.13000 0.5248000 70.11000 0.6872000 70.16000 0.7935000 -0.4955000E-01 1.050000  
1 1 1 3  2  19 o 41.35000 0.3308000 42.01000 0.5054000 40.70000 0.4269000 1.314000       0.6615000 
1 1 1 3  2  21 o 102.9000 0.7061000 102.7000 0.9958000 103.1000 1.001000  -0.4818000     1.412000  
1 1 1 3  2  23 o 48.60000 0.3559000 48.25000 0.5009000 48.96000 0.5058000 -0.7037000     0.7118000 
1 1 1 3  2  25 o 110.4000 0.7579000 110.6000 1.074000  110.2000 1.070000  0.3924000      1.516000  
1 1 1 3  2  27 o 99.82000 0.7430000 98.46000 1.111000  101.2000 0.9873000 -2.713000      1.486000  
1 1 1 3  2  29 o 62.95000 0.5217000 63.30000 0.7421000 62.59000 0.7334000 0.7147000      1.043000  
1 1 1 3  2  31 o 39.91000 0.3537000 40.00000 0.4620000 39.83000 0.5356000 0.1635000      0.7073000 
1 1 1 3  2  33 o 24.53000 0.3844000 24.34000 0.6002000 24.72000 0.4805000 -0.3795000     0.7688000 
1 1 1 3  2  35 o 23.39000 0.3674000 23.91000 0.5923000 22.88000 0.4350000 1.029000       0.7349000 
1 1 1 3  2  37 o 24.68000 0.2981000 24.93000 0.4190000 24.43000 0.4241000 0.4939000      0.5962000 
1 1 1 3  2  39 o 18.20000 0.3293000 18.06000 0.4711000 18.33000 0.4602000 -0.2666000     0.6586000 
1 1 1 3  2  41 o 17.00000 0.3858000 16.22000 0.5869000 17.77000 0.5009000 -1.558000      0.7716000 
1 1 1 3  2  43 o 23.29000 0.4213000 23.95000 0.5132000 22.63000 0.6683000 1.317000       0.8426000 
1 1 1 3  2  45 o 12.53000 0.5451000 12.00000 0.8679000 13.06000 0.6597000 -1.053000      1.090000  
1 1 1 3  2  47 f 10.29000 0.6188000 10.07000 0.8889000 10.52000 0.8609000 -0.4480000     1.238000  
1 1 1 3  2  49 o 38.03000 0.3746000 37.28000 0.4870000 38.78000 0.5694000 -1.495000      0.7492000 
1 1 1 3  2  51 o 44.60000 0.4377000 43.95000 0.6199000 45.25000 0.6181000 -1.295000      0.8754000 
1 1 1 3  2  53 f 13.44000 0.4853000 13.03000 0.7632000 13.85000 0.5997000 -0.8134000     0.9706000 
1 1 1 3  2  55 o 16.53000 0.4982000 16.03000 0.5893000 17.04000 0.8035000 -1.010000      0.9965000 
1 1 1 3  2  57 o 24.60000 0.3990000 24.41000 0.5706000 24.80000 0.5580000 -0.3826000     0.7981000 
1 1 1 3  2  59 o 12.27000 0.4839000 12.62000 0.6936000 11.92000 0.6751000 0.6911000      0.9679000 
1 1 1 3  2  61 f 5.121000 0.9757000 5.533000 1.311000  4.709000 1.446000  0.8233000      1.951000  
1 1 1 3  2  63 o 8.516000 0.7000000 8.699000 0.9703000 8.332000 1.009000  0.3670000      1.400000  
1 1 1 3  2  65 o 5.691000 1.018000  4.228000 1.528000  7.154000 1.344000  -2.926000      2.035000  
1 1 1 3  2  67 o 2.837000 0.9003000 2.376000 1.143000  3.299000 1.392000  -0.9231000     1.801000  
1 1 1 3  3  0  o 59.64000 0.8142000 59.64000 0.8142000 59.64000 0.8142000 0.000000       0.000000  
1 1 1 3  3  2  f 49.65000 0.3681000 49.90000 0.4839000 49.39000 0.5549000 0.5155000      0.7363000 
1 1 1 3  3  4  o 66.34000 0.4900000 66.27000 0.6403000 66.42000 0.7419000 -0.1472000     0.9800000 
1 1 1 3  3  6  o 79.35000 0.5419000 78.26000 0.7554000 80.45000 0.7771000 -2.194000      1.084000  
1 1 1 3  3  8  o 127.8000 0.8690000 127.5000 1.225000  128.2000 1.233000  -0.7581000     1.738000  
1 1 1 3  3  10 o 53.69000 0.3849000 53.54000 0.6057000 53.83000 0.4751000 -0.2859000     0.7698000 
1 1 1 3  3  12 o 87.07000 0.7705000 87.73000 1.200000  86.41000 0.9671000 1.318000       1.541000  
1 1 1 3  3  14 f 35.37000 0.2620000 35.37000 0.3701000 35.38000 0.3710000 -0.1150000E-01 0.5241000 
1 1 1 3  3  16 o 32.08000 0.3186000 31.98000 0.4035000 32.19000 0.4933000 -0.2082000     0.6373000 
1 1 1 3  3  18 o 76.61000 0.5301000 76.48000 0.7485000 76.73000 0.7509000 -0.2459000     1.060000  
1 1 1 3  3  20 o 96.41000 0.6624000 96.29000 0.9355000 96.53000 0.9381000 -0.2435000     1.325000  
1 1 1 3  3  22 o 74.46000 0.5190000 73.84000 0.7282000 75.09000 0.7397000 -1.246000      1.038000  
1 1 1 3  3  24 o 99.03000 0.6824000 98.62000 0.9615000 99.44000 0.9685000 -0.8154000     1.365000  
1 1 1 3  3  26 o 79.97000 0.6034000 79.72000 0.7880000 80.23000 0.9141000 -0.5168000     1.207000  
1 1 1 3  3  28 o 77.24000 0.5430000 76.59000 0.7617000 77.89000 0.7739000 -1.310000      1.086000  
1 1 1 3  3  30 o 86.47000 0.7835000 85.50000 0.9765000 87.45000 1.226000  -1.944000      1.567000  
1 1 1 3  3  32 o 54.29000 0.4037000 53.95000 0.5686000 54.62000 0.5731000 -0.6737000     0.8073000 
1 1 1 3  3  34 o 20.69000 0.3545000 20.84000 0.5013000 20.54000 0.5014000 0.3059000      0.7090000 
1 1 1 3  3  36 o 30.86000 0.3261000 31.24000 0.4982000 30.48000 0.4208000 0.7605000      0.6521000 
1 1 1 3  3  38 o 19.73000 0.3130000 19.88000 0.4396000 19.58000 0.4457000 0.3056000      0.6260000 
1 1 1 3  3  40 o 47.04000 0.4036000 47.12000 0.6147000 46.96000 0.5231000 0.1621000      0.8072000 
1 1 1 3  3  42 o 29.53000 0.3439000 29.48000 0.5174000 29.58000 0.4531000 -0.1053000     0.6878000 
1 1 1 3  3  44 o 18.89000 0.4532000 18.28000 0.5286000 19.50000 0.7363000 -1.217000      0.9064000 
1 1 1 3  3  46 f 32.27000 0.4339000 32.56000 0.6623000 31.97000 0.5607000 0.5950000      0.8677000 
1 1 1 3  3  48 o 41.87000 0.3951000 41.81000 0.5976000 41.93000 0.5169000 -0.1149000     0.7901000 
1 1 1 3  3  50 o 12.60000 0.4971000 12.90000 0.6782000 12.30000 0.7269000 0.6048000      0.9942000 
1 1 1 3  3  52 o 15.53000 0.4463000 15.64000 0.6754000 15.41000 0.5836000 0.2311000      0.8926000 
1 1 1 3  3  54 o 14.69000 0.4902000 14.72000 0.6894000 14.67000 0.6970000 0.5555000E-01  0.9803000 
1 1 1 3  3  56 f 10.84000 0.5642000 10.68000 0.8044000 11.00000 0.7914000 -0.3163000     1.128000  
1 1 1 3  3  58 o 10.16000 0.5992000 10.35000 0.9217000 9.974000 0.7658000 0.3753000      1.198000  
1 1 1 3  3  60 o 3.810000 0.9842000 3.405000 1.359000  4.216000 1.424000  -0.8115000     1.968000  
1 1 1 3  3  62 f 11.03000 0.5459000 11.17000 0.7669000 10.88000 0.7769000 0.2885000      1.092000  
1 1 1 3  3  64 o 10.99000 0.5700000 11.93000 0.7355000 10.05000 0.8710000 1.884000       1.140000  
1 1 1 3  3  66 o 7.265000 0.9179000 7.237000 1.423000  7.293000 1.160000  -0.5563000E-01 1.836000  
1 1 1 3  3  68 o 4.200000 1.036000  4.070000 1.496000  4.330000 1.433000  -0.2595000     2.072000  
1 1 1 3  4  1  o 38.70000 0.2901000 38.96000 0.3815000 38.44000 0.4371000 0.5214000      0.5801000 
1 1 1 3  4  3  o 57.95000 0.4107000 57.76000 0.5003000 58.15000 0.6515000 -0.3896000     0.8214000 
1 1 1 3  4  5  o 10.79000 0.1242000 10.75000 0.1846000 10.83000 0.1662000 -0.8693000E-01 0.2484000 
1 1 1 3  4  7  o 65.43000 0.4491000 64.83000 0.6292000 66.04000 0.6409000 -1.213000      0.8982000 
1 1 1 3  4  9  o 58.03000 0.4012000 58.87000 0.5748000 57.19000 0.5600000 1.677000       0.8024000 
1 1 1 3  4  11 o 64.86000 0.5764000 64.46000 0.8870000 65.25000 0.7362000 -0.7873000     1.153000  
1 1 1 3  4  13 o 46.31000 0.3536000 46.06000 0.5310000 46.56000 0.4672000 -0.4966000     0.7073000 
1 1 1 3  4  15 f 37.71000 0.3581000 37.90000 0.4554000 37.52000 0.5529000 0.3786000      0.7163000 
1 1 1 3  4  17 o 33.60000 0.2567000 33.78000 0.3643000 33.42000 0.3618000 0.3605000      0.5135000 
1 1 1 3  4  19 o 72.49000 0.5455000 72.98000 0.8304000 72.00000 0.7075000 0.9860000      1.091000  
1 1 1 3  4  21 o 90.41000 0.6718000 90.07000 1.012000  90.74000 0.8840000 -0.6647000     1.344000  
1 1 1 3  4  23 o 21.70000 0.3176000 21.60000 0.4051000 21.80000 0.4892000 -0.2012000     0.6352000 
1 1 1 3  4  25 o 34.63000 0.2897000 34.68000 0.4085000 34.59000 0.4109000 0.9282000E-01  0.5794000 
1 1 1 3  4  27 o 58.41000 0.5170000 58.96000 0.8469000 57.86000 0.5935000 1.103000       1.034000  
1 1 1 3  4  29 o 37.03000 0.4078000 37.17000 0.6334000 36.88000 0.5138000 0.2915000      0.8156000 
1 1 1 3  4  31 o 51.70000 0.5044000 51.41000 0.6360000 52.00000 0.7832000 -0.5881000     1.009000  
1 1 1 3  4  33 o 17.83000 0.3538000 17.61000 0.5514000 18.06000 0.4435000 -0.4507000     0.7076000 
1 1 1 3  4  35 o 76.69000 0.5432000 77.23000 0.7718000 76.15000 0.7644000 1.080000       1.086000  
1 1 1 3  4  37 o 55.03000 0.4118000 54.56000 0.5796000 55.49000 0.5850000 -0.9278000     0.8235000 
1 1 1 3  4  39 o 30.72000 0.3329000 30.94000 0.4337000 30.50000 0.5051000 0.4466000      0.6657000 
1 1 1 3  4  41 o 40.66000 0.4207000 40.72000 0.6806000 40.59000 0.4947000 0.1293000      0.8414000 
1 1 1 3  4  43 f 46.45000 0.5943000 46.19000 0.5303000 46.71000 1.064000  -0.5201000     1.189000  
1 1 1 3  4  45 o 28.26000 0.4067000 28.25000 0.4545000 28.26000 0.6744000 -0.7206000E-02 0.8133000 
1 1 1 3  4  47 o 7.919000 0.8699000 7.040000 1.289000  8.798000 1.169000  -1.758000      1.740000  
1 1 1 3  4  49 o 10.80000 0.5851000 10.61000 0.8624000 10.99000 0.7909000 -0.3800000     1.170000  
1 1 1 3  4  51 o 6.096000 0.9730000 6.011000 1.271000  6.181000 1.474000  -0.1709000     1.946000  
1 1 1 3  4  53 o 21.64000 0.4341000 21.63000 0.7204000 21.65000 0.4844000 -0.1537000E-01 0.8681000 
1 1 1 3  4  55 o 19.92000 0.5307000 20.95000 0.4954000 18.89000 0.9386000 2.055000       1.061000  
1 1 1 3  4  57 o 7.245000 0.7920000 7.409000 1.208000  7.081000 1.024000  0.3279000      1.584000  
1 1 1 3  4  59 o 22.33000 0.3544000 22.47000 0.5020000 22.20000 0.5003000 0.2657000      0.7087000 
1 1 1 3  4  61 o 5.527000 0.9857000 6.363000 1.132000  4.691000 1.614000  1.672000       1.971000  
1 1 1 3  4  63 o 3.647000 1.130000  3.723000 1.742000  3.571000 1.439000  0.1526000      2.259000  
1 1 1 3  4  65 o 6.317000 0.9405000 7.625000 1.062000  5.009000 1.552000  2.615000       1.881000  
1 1 1 3  4  67 o 4.012000 1.013000  4.602000 1.504000  3.422000 1.358000  1.180000       2.026000  
1 1 1 3  5  0  o 104.6000 1.162000  104.6000 1.162000  104.6000 1.162000  0.000000       0.000000  
1 1 1 3  5  2  o 47.34000 0.3785000 47.36000 0.5359000 47.33000 0.5347000 0.3533000E-01  0.7570000 
1 1 1 3  5  4  o 90.42000 0.7117000 90.86000 1.012000  89.97000 1.001000  0.8936000      1.423000  
1 1 1 3  5  6  o 68.96000 0.4722000 68.59000 0.6643000 69.33000 0.6714000 -0.7403000     0.9444000 
1 1 1 3  5  8  f 62.12000 0.4280000 62.29000 0.6067000 61.95000 0.6040000 0.3431000      0.8561000 
1 1 1 3  5  10 o 29.36000 0.2362000 29.67000 0.3133000 29.05000 0.3537000 0.6167000      0.4725000 
1 1 1 3  5  12 o 59.40000 0.4884000 59.70000 0.8262000 59.10000 0.5209000 0.6023000      0.9767000 
1 1 1 3  5  14 o 48.07000 0.3518000 48.33000 0.5565000 47.82000 0.4304000 0.5145000      0.7035000 
1 1 1 3  5  16 o 76.87000 0.6531000 76.24000 0.7445000 77.50000 1.073000  -1.256000      1.306000  
1 1 1 3  5  18 o 46.48000 0.3354000 46.43000 0.4735000 46.53000 0.4752000 -0.1002000     0.6708000 
1 1 1 3  5  20 o 35.42000 0.2756000 35.31000 0.3893000 35.53000 0.3901000 -0.2160000     0.5511000 
1 1 1 3  5  22 o 67.54000 0.4744000 67.43000 0.6702000 67.65000 0.6717000 -0.2270000     0.9489000 
1 1 1 3  5  24 o 39.32000 0.3083000 38.81000 0.4301000 39.82000 0.4417000 -1.005000      0.6165000 
1 1 1 3  5  26 o 52.85000 0.4461000 53.76000 0.6375000 51.94000 0.6242000 1.822000       0.8922000 
1 1 1 3  5  28 o 76.40000 0.5373000 76.46000 0.7606000 76.34000 0.7590000 0.1264000      1.075000  
1 1 1 3  5  30 o 41.39000 0.4374000 41.68000 0.5557000 41.10000 0.6755000 0.5848000      0.8747000 
1 1 1 3  5  32 o 34.82000 0.4059000 34.19000 0.5097000 35.45000 0.6319000 -1.253000      0.8118000 
1 1 1 3  5  34 o 13.24000 0.3921000 12.62000 0.5500000 13.85000 0.5590000 -1.233000      0.7842000 
1 1 1 3  5  36 o 35.99000 0.3165000 35.82000 0.4460000 36.16000 0.4492000 -0.3480000     0.6330000 
1 1 1 3  5  38 o 22.74000 0.3583000 22.62000 0.5147000 22.85000 0.4987000 -0.2236000     0.7167000 
1 1 1 3  5  40 o 51.49000 0.4256000 50.97000 0.6362000 52.02000 0.5656000 -1.054000      0.8512000 
1 1 1 3  5  42 o 20.67000 0.3693000 20.44000 0.5593000 20.89000 0.4822000 -0.4514000     0.7385000 
1 1 1 3  5  44 o 19.47000 0.4128000 19.50000 0.5936000 19.43000 0.5738000 0.7122000E-01  0.8256000 
1 1 1 3  5  46 o 15.13000 0.4352000 15.29000 0.6605000 14.97000 0.5670000 0.3232000      0.8704000 
1 1 1 3  5  48 o 21.81000 0.3643000 21.85000 0.5064000 21.77000 0.5239000 0.8212000E-01  0.7286000 
1 1 1 3  5  50 o 9.977000 0.6291000 10.38000 0.9409000 9.576000 0.8355000 0.8019000      1.258000  
1 1 1 3  5  52 o 10.72000 0.5727000 10.28000 0.8886000 11.15000 0.7228000 -0.8708000     1.145000  
1 1 1 3  5  54 o 6.288000 0.8544000 6.173000 1.253000  6.404000 1.162000  -0.2307000     1.709000  
1 1 1 3  5  56 o 12.18000 0.4710000 12.50000 0.6690000 11.87000 0.6633000 0.6300000      0.9420000 
1 1 1 3  5  58 o 4.259000 0.9722000 4.851000 1.322000  3.667000 1.426000  1.184000       1.944000  
1 1 1 3  5  60 o 2.833000 0.9038000 3.125000 1.358000  2.540000 1.193000  0.5855000      1.808000  
1 1 1 3  5  62 o 4.427000 1.165000  4.947000 1.775000  3.907000 1.510000  1.040000       2.331000  
1 1 1 3  5  64 o 6.804000 1.035000  6.018000 1.457000  7.590000 1.470000  -1.571000      2.070000  
1 1 1 3  5  66 o 4.376000 1.003000  3.154000 1.386000  5.599000 1.451000  -2.445000      2.007000  
1 1 1 3  6  1  o 121.2000 0.9510000 122.2000 1.355000  120.3000 1.335000  1.892000       1.902000  
1 1 1 3  6  3  o 90.22000 0.6644000 90.50000 0.8733000 89.93000 1.001000  0.5686000      1.329000  
1 1 1 3  6  5  o 113.7000 0.8933000 112.3000 1.249000  115.1000 1.278000  -2.735000      1.787000  
1 1 1 3  6  7  o 66.68000 0.4580000 66.72000 0.6479000 66.65000 0.6476000 0.6953000E-01  0.9161000 
1 1 1 3  6  9  o 50.20000 0.3507000 50.43000 0.4977000 49.97000 0.4941000 0.4581000      0.7013000 
1 1 1 3  6  11 o 28.38000 0.2623000 27.89000 0.4195000 28.87000 0.3150000 -0.9767000     0.5246000 
1 1 1 3  6  13 o 28.97000 0.2315000 29.03000 0.3612000 28.91000 0.2898000 0.1182000      0.4631000 
1 1 1 3  6  15 o 68.89000 0.5508000 68.31000 0.7711000 69.47000 0.7866000 -1.167000      1.102000  
1 1 1 3  6  17 o 37.55000 0.2810000 37.60000 0.3973000 37.50000 0.3975000 0.1003000      0.5620000 
1 1 1 3  6  19 o 91.69000 0.6825000 91.99000 1.035000  91.39000 0.8901000 0.6003000      1.365000  
1 1 1 3  6  21 o 58.64000 0.4168000 58.48000 0.5884000 58.80000 0.5903000 -0.3156000     0.8335000 
1 1 1 3  6  23 f 33.05000 0.2753000 33.19000 0.3922000 32.91000 0.3864000 0.2729000      0.5506000 
1 1 1 3  6  25 o 46.20000 0.3765000 46.49000 0.4972000 45.92000 0.5656000 0.5719000      0.7530000 
1 1 1 3  6  27 o 63.29000 0.5900000 63.45000 0.9189000 63.14000 0.7401000 0.3074000      1.180000  
1 1 1 3  6  29 o 24.50000 0.3842000 24.86000 0.4577000 24.14000 0.6172000 0.7213000      0.7684000 
1 1 1 3  6  31 f 96.37000 0.7234000 95.58000 0.9382000 97.15000 1.101000  -1.572000      1.447000  
1 1 1 3  6  33 o 67.81000 0.5274000 68.46000 0.8042000 67.15000 0.6825000 1.311000       1.055000  
1 1 1 3  6  35 o 39.10000 0.3293000 39.20000 0.4660000 39.00000 0.4655000 0.1925000      0.6587000 
1 1 1 3  6  37 o 37.58000 0.3246000 37.37000 0.4577000 37.78000 0.4606000 -0.4082000     0.6493000 
1 1 1 3  6  39 o 19.45000 0.3455000 18.96000 0.4417000 19.94000 0.5313000 -0.9855000     0.6909000 
1 1 1 3  6  41 o 51.93000 0.5219000 51.85000 0.8088000 52.01000 0.6597000 -0.1556000     1.044000  
1 1 1 3  6  43 o 21.40000 0.4141000 20.45000 0.5008000 22.35000 0.6597000 -1.897000      0.8282000 
1 1 1 3  6  45 o 12.98000 0.4961000 13.49000 0.6860000 12.46000 0.7167000 1.035000       0.9921000 
1 1 1 3  6  47 o 34.49000 0.3681000 34.81000 0.5555000 34.17000 0.4831000 0.6341000      0.7362000 
1 1 1 3  6  49 o 31.49000 0.3377000 31.37000 0.4777000 31.60000 0.4775000 -0.2318000     0.6754000 
1 1 1 3  6  51 o 6.579000 0.9953000 6.198000 1.409000  6.961000 1.406000  -0.7633000     1.991000  
1 1 1 3  6  53 o 10.47000 0.6790000 10.81000 1.103000  10.13000 0.7915000 0.6836000      1.358000  
1 1 1 3  6  55 o 15.53000 0.5122000 16.01000 0.5384000 15.04000 0.8714000 0.9704000      1.024000  
1 1 1 3  6  57 o 13.99000 0.4239000 13.18000 0.6124000 14.80000 0.5863000 -1.617000      0.8478000 
1 1 1 3  6  59 o 18.50000 0.3844000 18.47000 0.5365000 18.53000 0.5507000 -0.6418000E-01 0.7689000 
1 1 1 3  6  61 o 7.522000 0.8131000 7.673000 1.044000  7.371000 1.246000  0.3017000      1.626000  
1 1 1 3  6  63 o 7.739000 0.9533000 9.920000 1.390000  5.558000 1.304000  4.362000       1.907000  
1 1 1 3  6  65 o 6.822000 1.051000  6.251000 1.284000  7.392000 1.664000  -1.141000      2.102000  
1 1 1 3  6  67 o 4.420000 1.063000  4.277000 1.538000  4.563000 1.466000  -0.2864000     2.125000  
1 1 1 3  7  0  o 95.52000 0.9198000 95.52000 0.9198000 95.52000 0.9198000 0.000000       0.000000  
1 1 1 3  7  2  o 69.73000 0.5519000 70.41000 0.7877000 69.06000 0.7732000 1.351000       1.104000  
1 1 1 3  7  4  o 68.71000 0.5449000 68.70000 0.7701000 68.72000 0.7712000 -0.2036000E-01 1.090000  
1 1 1 3  7  6  o 50.53000 0.3510000 50.69000 0.4975000 50.37000 0.4953000 0.3245000      0.7020000 
1 1 1 3  7  8  o 13.82000 0.1468000 13.99000 0.2096000 13.65000 0.2057000 0.3465000      0.2936000 
1 1 1 3  7  10 o 25.35000 0.2305000 25.61000 0.3285000 25.10000 0.3235000 0.5105000      0.4611000 
1 1 1 3  7  12 f 33.06000 0.2544000 33.07000 0.3984000 33.06000 0.3166000 0.8846000E-02  0.5089000 
1 1 1 3  7  14 o 68.72000 0.5801000 68.48000 0.9430000 68.96000 0.6758000 -0.4873000     1.160000  
1 1 1 3  7  16 o 86.10000 0.6852000 86.77000 0.9713000 85.43000 0.9668000 1.335000       1.370000  
1 1 1 3  7  18 o 66.57000 0.5012000 66.52000 0.7550000 66.63000 0.6593000 -0.1101000     1.002000  
1 1 1 3  7  20 o 60.79000 0.4653000 60.34000 0.7002000 61.25000 0.6128000 -0.9089000     0.9306000 
1 1 1 3  7  22 o 36.19000 0.2878000 36.18000 0.4074000 36.20000 0.4065000 -0.2570000E-01 0.5755000 
1 1 1 3  7  24 f 57.42000 0.4501000 57.25000 0.6810000 57.59000 0.5886000 -0.3472000     0.9001000 
1 1 1 3  7  26 o 56.81000 0.4753000 56.09000 0.6602000 57.54000 0.6839000 -1.450000      0.9506000 
1 1 1 3  7  28 o 42.22000 0.4133000 41.63000 0.6716000 42.81000 0.4819000 -1.180000      0.8266000 
1 1 1 3  7  30 o 7.547000 0.7153000 8.271000 0.7838000 6.822000 1.197000  1.448000       1.431000  
1 1 1 3  7  32 o 22.39000 0.2979000 22.55000 0.4209000 22.23000 0.4216000 0.3255000      0.5957000 
1 1 1 3  7  34 o 7.796000 0.6731000 7.837000 1.034000  7.755000 0.8621000 0.8155000E-01  1.346000  
1 1 1 3  7  36 o 79.89000 0.5645000 79.75000 0.7969000 80.03000 0.7997000 -0.2840000     1.129000  
1 1 1 3  7  38 o 27.79000 0.3274000 27.60000 0.4263000 27.98000 0.4971000 -0.3802000     0.6548000 
1 1 1 3  7  40 o 3.653000 1.028000  4.029000 1.524000  3.277000 1.380000  0.7521000      2.056000  
1 1 1 3  7  42 o 50.86000 0.4309000 50.76000 0.5616000 50.96000 0.6537000 -0.1981000     0.8618000 
1 1 1 3  7  44 o 36.37000 0.4065000 36.33000 0.4828000 36.41000 0.6542000 -0.8522000E-01 0.8131000 
1 1 1 3  7  46 o 11.59000 0.5357000 11.48000 0.7359000 11.71000 0.7788000 -0.2350000     1.071000  
1 1 1 3  7  48 o 37.48000 0.3492000 37.40000 0.4940000 37.55000 0.4936000 -0.1534000     0.6983000 
1 1 1 3  7  50 o 9.921000 0.6438000 9.550000 0.8592000 10.29000 0.9590000 -0.7434000     1.288000  
1 1 1 3  7  52 o 10.74000 0.5509000 10.04000 0.8354000 11.45000 0.7184000 -1.411000      1.102000  
1 1 1 3  7  54 o 9.222000 0.6256000 9.731000 0.7629000 8.713000 0.9917000 1.018000       1.251000  
1 1 1 3  7  56 o 3.724000 0.9655000 4.447000 1.426000  3.001000 1.302000  1.445000       1.931000  
1 1 1 3  7  58 o 5.941000 0.9704000 5.681000 1.535000  6.200000 1.188000  -0.5193000     1.941000  
1 1 1 3  7  60 o 10.46000 0.5570000 11.00000 0.7479000 9.915000 0.8255000 1.087000       1.114000  
1 1 1 3  7  62 o 6.465000 1.051000  7.327000 1.607000  5.604000 1.355000  1.723000       2.102000  
1 1 1 3  7  64 o 4.775000 1.059000  3.922000 1.543000  5.628000 1.451000  -1.706000      2.118000  
1 1 1 3  7  66 o 3.202000 1.005000  2.688000 1.259000  3.715000 1.566000  -1.027000      2.009000  
1 1 1 3  8  1  o 107.0000 0.7529000 106.5000 0.9162000 107.5000 1.195000  -0.9995000     1.506000  
1 1 1 3  8  3  o 146.9000 1.154000  147.1000 1.632000  146.7000 1.631000  0.3974000      2.307000  
1 1 1 3  8  5  o 96.86000 0.6605000 96.72000 0.9329000 97.01000 0.9353000 -0.2895000     1.321000  
1 1 1 3  8  7  o 54.62000 0.3796000 54.74000 0.5375000 54.51000 0.5363000 0.2221000      0.7593000 
1 1 1 3  8  9  o 20.60000 0.1879000 20.57000 0.2484000 20.64000 0.2820000 -0.6712000E-01 0.3758000 
1 1 1 3  8  11 o 47.29000 0.3613000 47.25000 0.5453000 47.33000 0.4740000 -0.8432000E-01 0.7225000 
1 1 1 3  8  13 o 52.01000 0.4481000 52.77000 0.7350000 51.24000 0.5127000 1.529000       0.8961000 
1 1 1 3  8  15 o 81.12000 0.6034000 81.11000 0.9102000 81.13000 0.7926000 -0.1445000E-01 1.207000  
1 1 1 3  8  17 o 68.77000 0.4935000 68.61000 0.7768000 68.92000 0.6088000 -0.3172000     0.9869000 
1 1 1 3  8  19 o 38.42000 0.3136000 38.48000 0.4707000 38.36000 0.4144000 0.1157000      0.6271000 
1 1 1 3  8  21 o 55.52000 0.5119000 56.22000 0.6532000 54.82000 0.7884000 1.402000       1.024000  
1 1 1 3  8  23 o 123.4000 0.9773000 122.8000 1.376000  123.9000 1.388000  -1.083000      1.955000  
1 1 1 3  8  25 f 41.37000 0.3716000 41.79000 0.5275000 40.94000 0.5234000 0.8573000      0.7432000 
1 1 1 3  8  27 o 54.68000 0.4339000 54.44000 0.6551000 54.91000 0.5691000 -0.4705000     0.8677000 
1 1 1 3  8  29 o 95.17000 0.7140000 94.83000 0.9322000 95.51000 1.082000  -0.6828000     1.428000  
1 1 1 3  8  31 o 24.92000 0.4549000 24.63000 0.4067000 25.21000 0.8138000 -0.5750000     0.9097000 
1 1 1 3  8  33 f 30.64000 0.2992000 30.57000 0.4226000 30.72000 0.4236000 -0.1536000     0.5984000 
1 1 1 3  8  35 o 20.91000 0.3079000 20.80000 0.4468000 21.03000 0.4238000 -0.2284000     0.6158000 
1 1 1 3  8  37 o 24.10000 0.3209000 24.11000 0.4214000 24.10000 0.4840000 0.6355000E-02  0.6418000 
1 1 1 3  8  39 o 29.86000 0.3286000 30.04000 0.4980000 29.67000 0.4288000 0.3699000      0.6571000 
1 1 1 3  8  41 o 36.40000 0.4090000 36.61000 0.6683000 36.20000 0.4718000 0.4105000      0.8181000 
1 1 1 3  8  43 o 40.54000 0.3514000 40.58000 0.4966000 40.50000 0.4972000 0.8733000E-01  0.7028000 
1 1 1 3  8  45 o 27.40000 0.3335000 27.65000 0.4738000 27.15000 0.4693000 0.4974000      0.6669000 
1 1 1 3  8  47 o 47.83000 0.4224000 47.30000 0.6374000 48.37000 0.5544000 -1.077000      0.8448000 
1 1 1 3  8  49 o 40.15000 0.3881000 40.23000 0.5887000 40.07000 0.5058000 0.1590000      0.7761000 
1 1 1 3  8  51 o 19.32000 0.3928000 18.93000 0.6111000 19.70000 0.4936000 -0.7731000     0.7855000 
1 1 1 3  8  53 o 15.89000 0.4547000 15.82000 0.6420000 15.96000 0.6441000 -0.1456000     0.9094000 
1 1 1 3  8  55 o 14.76000 0.5178000 15.99000 0.7807000 13.54000 0.6805000 2.449000       1.036000  
1 1 1 3  8  57 f 9.570000 0.6097000 9.543000 0.8674000 9.597000 0.8570000 -0.5377000E-01 1.219000  
1 1 1 3  8  59 o 8.407000 0.6633000 7.524000 1.045000  9.290000 0.8175000 -1.766000      1.327000  
1 1 1 3  8  61 o 6.190000 0.9975000 5.660000 1.581000  6.719000 1.217000  -1.059000      1.995000  
1 1 1 3  8  63 o 5.618000 1.114000  4.960000 1.623000  6.276000 1.527000  -1.316000      2.229000  
1 1 1 3  8  65 o 8.390000 0.8028000 8.666000 1.009000  8.114000 1.249000  0.5517000      1.606000  
1 1 1 3  8  67 f 3.720000 1.083000  4.242000 1.672000  3.198000 1.378000  1.044000       2.167000  
1 1 1 3  9  0  o 12.39000 0.1860000 12.39000 0.1860000 12.39000 0.1860000 0.000000       0.000000  
1 1 1 3  9  2  f 73.87000 0.5239000 73.43000 0.6361000 74.31000 0.8326000 -0.8738000     1.048000  
1 1 1 3  9  4  o 49.99000 0.3481000 50.38000 0.4958000 49.59000 0.4888000 0.7907000      0.6962000 
1 1 1 3  9  6  o 54.49000 0.4087000 54.30000 0.5338000 54.68000 0.6190000 -0.3802000     0.8174000 
1 1 1 3  9  8  o 60.24000 0.4496000 60.96000 0.5973000 59.51000 0.6722000 1.442000       0.8992000 
1 1 1 3  9  10 o 51.03000 0.4136000 51.13000 0.5864000 50.93000 0.5835000 0.1919000      0.8272000 
1 1 1 3  9  12 f 22.35000 0.2069000 22.44000 0.3085000 22.26000 0.2758000 0.1869000      0.4139000 
1 1 1 3  9  14 o 17.89000 0.1908000 17.98000 0.2955000 17.79000 0.2416000 0.1871000      0.3816000 
1 1 1 3  9  16 o 62.42000 0.4723000 62.80000 0.7139000 62.04000 0.6187000 0.7565000      0.9447000 
1 1 1 3  9  18 o 78.49000 0.5605000 78.26000 0.8821000 78.72000 0.6918000 -0.4522000     1.121000  
1 1 1 3  9  20 o 15.77000 0.2890000 15.97000 0.4892000 15.57000 0.3079000 0.3958000      0.5780000 
1 1 1 3  9  22 o 93.50000 0.6954000 92.80000 1.043000  94.20000 0.9201000 -1.400000      1.391000  
1 1 1 3  9  24 o 17.31000 0.3187000 17.31000 0.4520000 17.32000 0.4494000 -0.6199000E-02 0.6374000 
1 1 1 3  9  26 o 45.58000 0.3511000 45.77000 0.4995000 45.40000 0.4935000 0.3745000      0.7022000 
1 1 1 3  9  28 o 66.61000 0.5504000 66.44000 0.7780000 66.79000 0.7788000 -0.3410000     1.101000  
1 1 1 3  9  30 o 32.93000 0.3057000 33.21000 0.4389000 32.66000 0.4257000 0.5503000      0.6114000 
1 1 1 3  9  32 o 23.19000 0.3005000 23.67000 0.4195000 22.71000 0.4305000 0.9595000      0.6011000 
1 1 1 3  9  34 o 27.36000 0.3196000 27.74000 0.4923000 26.99000 0.4078000 0.7464000      0.6393000 
1 1 1 3  9  36 o 36.47000 0.3726000 36.61000 0.5266000 36.34000 0.5274000 0.2724000      0.7453000 
1 1 1 3  9  38 f 25.79000 0.3406000 25.99000 0.4860000 25.58000 0.4774000 0.4109000      0.6812000 
1 1 1 3  9  40 o 27.02000 0.3092000 26.74000 0.4374000 27.31000 0.4370000 -0.5695000     0.6183000 
1 1 1 3  9  42 o 31.91000 0.3196000 32.45000 0.4548000 31.37000 0.4491000 1.073000       0.6391000 
1 1 1 3  9  44 o 29.64000 0.3902000 30.22000 0.4570000 29.06000 0.6326000 1.156000       0.7804000 
1 1 1 3  9  46 o 8.111000 0.7760000 7.735000 1.152000  8.488000 1.040000  -0.7535000     1.552000  
1 1 1 3  9  48 o 11.46000 0.5409000 11.69000 0.7681000 11.23000 0.7617000 0.4554000      1.082000  
1 1 1 3  9  50 o 20.79000 0.4000000 20.99000 0.5688000 20.59000 0.5625000 0.3992000      0.8000000 
1 1 1 3  9  52 o 19.00000 0.3828000 18.80000 0.5891000 19.20000 0.4889000 -0.4020000     0.7655000 
1 1 1 3  9  54 o 8.210000 0.6672000 7.863000 0.9777000 8.557000 0.9082000 -0.6940000     1.334000  
1 1 1 3  9  56 o 4.483000 1.002000  5.482000 1.376000  3.483000 1.458000  1.999000       2.005000  
1 1 1 3  9  58 o 7.162000 0.8041000 7.079000 1.197000  7.245000 1.074000  -0.1664000     1.608000  
1 1 1 3  9  60 o 3.493000 0.9308000 4.541000 1.450000  2.444000 1.168000  2.097000       1.862000  
1 1 1 3  9  62 o 3.481000 1.038000  3.461000 1.497000  3.500000 1.438000  -0.3940000E-01 2.076000  
1 1 1 3  9  64 o 10.81000 0.5952000 11.04000 0.8104000 10.58000 0.8720000 0.4522000      1.190000  
1 1 1 3  9  66 o 4.395000 1.100000  4.289000 1.442000  4.501000 1.662000  -0.2112000     2.201000  
1 1 1 3  10 1  o 63.35000 0.4362000 63.38000 0.6171000 63.32000 0.6167000 0.5253000E-01  0.8724000 
1 1 1 3  10 3  o 57.57000 0.4115000 57.60000 0.5040000 57.54000 0.6506000 0.5210000E-01  0.8229000 
1 1 1 3  10 5  o 58.74000 0.4393000 59.12000 0.5795000 58.36000 0.6604000 0.7574000      0.8786000 
1 1 1 3  10 7  o 15.29000 0.1560000 15.49000 0.2208000 15.09000 0.2204000 0.4057000      0.3120000 
1 1 1 3  10 9  o 33.00000 0.2828000 33.47000 0.4053000 32.52000 0.3946000 0.9545000      0.5657000 
1 1 1 3  10 11 o 55.21000 0.4166000 54.97000 0.6257000 55.45000 0.5501000 -0.4721000     0.8332000 
1 1 1 3  10 13 o 78.84000 0.5868000 78.81000 0.8859000 78.87000 0.7696000 -0.5135000E-01 1.174000  
1 1 1 3  10 15 o 87.64000 0.6516000 88.10000 0.9870000 87.17000 0.8509000 0.9302000      1.303000  
1 1 1 3  10 17 f 158.8000 1.165000  156.9000 1.743000  160.7000 1.547000  -3.764000      2.330000  
1 1 1 3  10 19 o 183.7000 1.527000  182.8000 2.484000  184.7000 1.777000  -1.848000      3.054000  
1 1 1 3  10 21 o 48.45000 0.3680000 48.81000 0.5804000 48.08000 0.4526000 0.7375000      0.7360000 
1 1 1 3  10 23 o 73.17000 0.5320000 74.06000 0.8451000 72.28000 0.6463000 1.778000       1.064000  
1 1 1 3  10 25 o 79.74000 0.5578000 79.77000 0.7892000 79.71000 0.7884000 0.6414000E-01  1.116000  
1 1 1 3  10 27 o 67.73000 0.6265000 67.94000 0.9760000 67.51000 0.7858000 0.4275000      1.253000  
1 1 1 3  10 29 o 119.9000 0.8238000 119.5000 1.162000  120.3000 1.169000  -0.7814000     1.648000  
1 1 1 3  10 31 o 89.27000 0.7674000 88.64000 0.8758000 89.90000 1.260000  -1.263000      1.535000  
1 1 1 3  10 33 o 27.95000 0.3451000 27.56000 0.4938000 28.33000 0.4822000 -0.7692000     0.6901000 
1 1 1 3  10 35 o 7.017000 0.6925000 6.843000 0.9745000 7.191000 0.9842000 -0.3485000     1.385000  
1 1 1 3  10 37 o 35.94000 0.3423000 35.27000 0.4475000 36.62000 0.5181000 -1.345000      0.6846000 
1 1 1 3  10 39 o 28.08000 0.3066000 28.56000 0.4338000 27.60000 0.4332000 0.9609000      0.6131000 
1 1 1 3  10 41 o 29.47000 0.3662000 30.15000 0.5124000 28.79000 0.5234000 1.357000       0.7324000 
1 1 1 3  10 43 o 3.696000 0.9998000 3.200000 1.359000  4.192000 1.467000  -0.9923000     2.000000  
1 1 1 3  10 45 o 27.65000 0.3313000 27.84000 0.4675000 27.46000 0.4696000 0.3748000      0.6627000 
1 1 1 3  10 47 o 19.73000 0.3982000 19.57000 0.6002000 19.90000 0.5235000 -0.3297000     0.7965000 
1 1 1 3  10 49 o 13.34000 0.5030000 12.74000 0.6889000 13.93000 0.7330000 -1.193000      1.006000  
1 1 1 3  10 51 o 9.275000 0.6129000 8.750000 0.9205000 9.800000 0.8093000 -1.050000      1.226000  
1 1 1 3  10 53 o 16.68000 0.4409000 17.28000 0.6348000 16.08000 0.6121000 1.201000       0.8818000 
1 1 1 3  10 55 o 7.587000 0.7137000 7.577000 1.000000  7.597000 1.018000  -0.2017000E-01 1.427000  
1 1 1 3  10 57 o 7.325000 0.6851000 7.501000 0.9482000 7.148000 0.9890000 0.3532000      1.370000  
1 1 1 3  10 59 o 4.133000 1.061000  3.840000 1.537000  4.427000 1.463000  -0.5869000     2.122000  
1 1 1 3  10 61 o 8.235000 0.8015000 7.209000 1.368000  9.260000 0.8354000 -2.051000      1.603000  
1 1 1 3  10 63 o 8.422000 0.7900000 10.04000 0.8146000 6.801000 1.354000  3.241000       1.580000  
1 1 1 3  10 65 o 4.681000 1.068000  3.899000 1.471000  5.463000 1.550000  -1.564000      2.137000  
1 1 1 3  10 67 o 5.156000 1.048000  4.648000 1.544000  5.664000 1.417000  -1.016000      2.096000  
1 1 1 3  11 0  o 114.8000 1.105000  114.8000 1.105000  114.8000 1.105000  0.000000       0.000000  
1 1 1 3  11 2  o 107.9000 0.7354000 107.4000 1.035000  108.5000 1.046000  -1.063000      1.471000  
1 1 1 3  11 4  o 65.26000 0.5315000 65.27000 0.5700000 65.25000 0.8972000 0.1772000E-01  1.063000  
1 1 1 3  11 6  o 45.46000 0.3475000 45.37000 0.4546000 45.56000 0.5257000 -0.1898000     0.6950000 
1 1 1 3  11 8  o 9.264000 0.1931000 9.236000 0.2779000 9.292000 0.2682000 -0.5540000E-01 0.3862000 
1 1 1 3  11 10 o 48.49000 0.3705000 48.95000 0.5621000 48.03000 0.4829000 0.9262000      0.7410000 
1 1 1 3  11 12 o 22.15000 0.2406000 22.64000 0.3929000 21.65000 0.2780000 0.9981000      0.4813000 
1 1 1 3  11 14 o 10.02000 0.2756000 10.51000 0.4015000 9.529000 0.3778000 0.9773000      0.5513000 
1 1 1 3  11 16 o 87.61000 0.7424000 88.37000 1.217000  86.85000 0.8508000 1.517000       1.485000  
1 1 1 3  11 18 o 64.36000 0.4656000 63.70000 0.7275000 65.03000 0.5814000 -1.324000      0.9313000 
1 1 1 3  11 20 o 101.5000 0.8231000 100.9000 1.385000  102.1000 0.8892000 -1.189000      1.646000  
1 1 1 3  11 22 o 53.37000 0.4010000 53.40000 0.6296000 53.35000 0.4967000 0.4164000E-01  0.8019000 
1 1 1 3  11 24 o 62.74000 0.4622000 62.54000 0.7258000 62.95000 0.5724000 -0.4063000     0.9244000 
1 1 1 3  11 26 o 54.21000 0.4109000 54.50000 0.6487000 53.92000 0.5045000 0.5758000      0.8218000 
1 1 1 3  11 28 o 46.43000 0.3603000 46.18000 0.5069000 46.68000 0.5123000 -0.4918000     0.7207000 
1 1 1 3  11 30 o 34.02000 0.3122000 33.68000 0.4405000 34.36000 0.4425000 -0.6754000     0.6244000 
1 1 1 3  11 32 o 27.30000 0.3438000 27.36000 0.4861000 27.24000 0.4863000 0.1267000      0.6876000 
1 1 1 3  11 34 o 48.51000 0.4083000 48.82000 0.6224000 48.21000 0.5287000 0.6139000      0.8166000 
1 1 1 3  11 36 o 15.35000 0.3610000 15.17000 0.5139000 15.53000 0.5071000 -0.3635000     0.7219000 
1 1 1 3  11 38 o 53.74000 0.4346000 52.80000 0.6466000 54.67000 0.5809000 -1.867000      0.8692000 
1 1 1 3  11 40 o 24.52000 0.3684000 24.54000 0.5226000 24.50000 0.5194000 0.4025000E-01  0.7368000 
1 1 1 3  11 42 o 15.32000 0.4100000 15.16000 0.5836000 15.47000 0.5761000 -0.3155000     0.8201000 
1 1 1 3  11 44 o 16.69000 0.4629000 16.12000 0.5746000 17.26000 0.7258000 -1.141000      0.9257000 
1 1 1 3  11 46 o 17.13000 0.3973000 17.52000 0.5536000 16.75000 0.5701000 0.7648000      0.7947000 
1 1 1 3  11 48 o 28.32000 0.3333000 28.51000 0.4669000 28.13000 0.4759000 0.3889000      0.6667000 
1 1 1 3  11 50 o 20.48000 0.3781000 19.83000 0.5738000 21.13000 0.4925000 -1.299000      0.7561000 
1 1 1 3  11 52 o 18.15000 0.4109000 17.96000 0.5249000 18.33000 0.6323000 -0.3655000     0.8218000 
1 1 1 3  11 54 o 12.34000 0.4646000 12.51000 0.6766000 12.17000 0.6369000 0.3400000      0.9292000 
1 1 1 3  11 56 o 12.47000 0.5587000 12.70000 0.6264000 12.24000 0.9254000 0.4569000      1.117000  
1 1 1 3  11 58 o 14.94000 0.4340000 14.90000 0.6483000 14.97000 0.5772000 -0.6598000E-01 0.8680000 
1 1 1 3  11 60 o 8.396000 0.8222000 8.290000 1.148000  8.502000 1.178000  -0.2117000     1.644000  
1 1 1 3  11 62 o 3.920000 1.067000  3.354000 1.424000  4.485000 1.589000  -1.131000      2.133000  
1 1 1 3  11 64 o 9.215000 0.7132000 9.645000 1.011000  8.786000 1.007000  0.8593000      1.426000  
1 1 1 3  11 66 o 6.069000 0.9568000 6.057000 1.282000  6.081000 1.421000  -0.2455000E-01 1.914000  
1 1 1 3  12 1  o 59.22000 0.4427000 59.26000 0.5811000 59.17000 0.6680000 0.9110000E-01  0.8854000 
1 1 1 3  12 3  f 81.08000 0.6590000 80.54000 0.6995000 81.63000 1.117000  -1.088000      1.318000  
1 1 1 3  12 5  o 70.40000 0.5237000 70.78000 0.6900000 70.02000 0.7880000 0.7606000      1.047000  
1 1 1 3  12 7  o 54.22000 0.4383000 54.20000 0.6205000 54.24000 0.6191000 -0.4091000E-01 0.8765000 
1 1 1 3  12 9  o 33.30000 0.2692000 33.40000 0.4058000 33.20000 0.3538000 0.2045000      0.5384000 
1 1 1 3  12 11 o 56.47000 0.3969000 56.67000 0.5627000 56.27000 0.5599000 0.4007000      0.7938000 
1 1 1 3  12 13 o 39.90000 0.3434000 40.59000 0.4922000 39.21000 0.4790000 1.376000       0.6868000 
1 1 1 3  12 15 o 105.4000 0.7797000 105.0000 1.172000  105.8000 1.029000  -0.8453000     1.559000  
1 1 1 3  12 17 o 75.95000 0.5700000 74.94000 0.8489000 76.96000 0.7609000 -2.021000      1.140000  
1 1 1 3  12 19 o 62.97000 0.4586000 62.79000 0.7208000 63.15000 0.5671000 -0.3693000     0.9172000 
1 1 1 3  12 21 o 21.25000 0.2535000 21.13000 0.3825000 21.37000 0.3328000 -0.2366000     0.5070000 
1 1 1 3  12 23 o 36.32000 0.3736000 36.32000 0.4788000 36.32000 0.5736000 0.2651000E-02  0.7472000 
1 1 1 3  12 25 o 53.94000 0.4092000 54.42000 0.6466000 53.47000 0.5016000 0.9487000      0.8183000 
1 1 1 3  12 27 o 94.07000 1.005000  93.85000 1.830000  94.29000 0.8299000 -0.4360000     2.010000  
1 1 1 3  12 29 o 54.61000 0.5710000 54.42000 0.8021000 54.80000 0.8128000 -0.3828000     1.142000  
1 1 1 3  12 31 o 69.19000 0.6077000 70.34000 0.7118000 68.03000 0.9852000 2.305000       1.215000  
1 1 1 3  12 33 o 24.60000 0.2962000 24.21000 0.4186000 24.99000 0.4191000 -0.7768000     0.5923000 
1 1 1 3  12 35 o 29.81000 0.3305000 29.57000 0.5031000 30.06000 0.4287000 -0.4868000     0.6610000 
1 1 1 3  12 37 o 25.02000 0.3431000 25.19000 0.4882000 24.84000 0.4822000 0.3445000      0.6862000 
1 1 1 3  12 39 o 29.36000 0.3329000 28.89000 0.5047000 29.82000 0.4343000 -0.9330000     0.6659000 
1 1 1 3  12 41 f 31.54000 0.3473000 32.06000 0.5270000 31.03000 0.4525000 1.036000       0.6946000 
1 1 1 3  12 43 f 35.55000 0.3358000 35.67000 0.4731000 35.42000 0.4767000 0.2533000      0.6716000 
1 1 1 3  12 45 o 17.00000 0.4196000 17.08000 0.5719000 16.92000 0.6141000 0.1515000      0.8391000 
1 1 1 3  12 47 o 17.13000 0.4380000 17.40000 0.6606000 16.85000 0.5752000 0.5519000      0.8759000 
1 1 1 3  12 49 o 5.757000 1.081000  5.230000 1.598000  6.284000 1.456000  -1.054000      2.162000  
1 1 1 3  12 51 o 3.764000 1.018000  4.012000 1.522000  3.516000 1.352000  0.4958000      2.036000  
1 1 1 3  12 53 o 18.86000 0.3947000 18.95000 0.5925000 18.78000 0.5216000 0.1736000      0.7894000 
1 1 1 3  12 55 o 14.27000 0.4045000 13.89000 0.5756000 14.64000 0.5684000 -0.7491000     0.8089000 
1 1 1 3  12 57 o 9.696000 0.5827000 9.929000 0.8097000 9.462000 0.8383000 0.4678000      1.165000  
1 1 1 3  12 59 o 3.143000 0.9543000 2.503000 1.177000  3.783000 1.502000  -1.280000      1.909000  
1 1 1 3  12 61 o 11.83000 0.5544000 12.29000 0.8125000 11.37000 0.7546000 0.9204000      1.109000  
1 1 1 3  12 63 o 7.021000 0.8199000 6.700000 1.151000  7.342000 1.168000  -0.6421000     1.640000  
1 1 1 3  12 65 o 3.800000 1.060000  4.042000 1.618000  3.558000 1.369000  0.4841000      2.119000  
1 1 1 3  13 0  o 63.97000 0.7215000 63.97000 0.7215000 63.97000 0.7215000 0.000000       0.000000  
1 1 1 3  13 2  o 43.74000 0.3345000 43.23000 0.5004000 44.24000 0.4438000 -1.005000      0.6689000 
1 1 1 3  13 4  o 51.47000 0.3907000 51.44000 0.5107000 51.50000 0.5914000 -0.5749000E-01 0.7814000 
1 1 1 3  13 6  o 6.489000 0.2275000 6.647000 0.2940000 6.330000 0.3473000 0.3171000      0.4550000 
1 1 1 3  13 8  o 68.16000 0.5089000 68.65000 0.6717000 67.67000 0.7646000 0.9748000      1.018000  
1 1 1 3  13 10 f 58.38000 0.4096000 59.03000 0.5853000 57.72000 0.5731000 1.313000       0.8191000 
1 1 1 3  13 12 o 68.71000 0.5543000 68.43000 0.7794000 68.99000 0.7885000 -0.5614000     1.109000  
1 1 1 3  13 14 o 23.89000 0.2323000 24.19000 0.3030000 23.60000 0.3523000 0.5834000      0.4647000 
1 1 1 3  13 16 o 118.3000 0.8755000 119.3000 1.330000  117.2000 1.139000  2.130000       1.751000  
1 1 1 3  13 18 o 72.88000 0.5247000 72.68000 0.8243000 73.09000 0.6494000 -0.4089000     1.049000  
1 1 1 3  13 20 o 65.69000 0.5469000 64.82000 0.9158000 66.56000 0.5982000 -1.735000      1.094000  
1 1 1 3  13 22 o 118.6000 0.9385000 119.2000 1.331000  118.1000 1.324000  1.015000       1.877000  
1 1 1 3  13 24 o 42.06000 0.3392000 42.03000 0.5297000 42.09000 0.4237000 -0.6068000E-01 0.6783000 
1 1 1 3  13 26 o 20.43000 0.5462000 18.99000 0.5552000 21.87000 0.9409000 -2.872000      1.092000  
1 1 1 3  13 28 o 33.96000 0.3558000 33.91000 0.5982000 34.01000 0.3853000 -0.9383000E-01 0.7115000 
1 1 1 3  13 30 o 56.67000 0.4505000 56.10000 0.6719000 57.23000 0.6003000 -1.138000      0.9010000 
1 1 1 3  13 32 o 12.00000 0.4386000 12.10000 0.6477000 11.90000 0.5917000 0.1983000      0.8773000 
1 1 1 3  13 34 o 20.31000 0.3275000 19.64000 0.4947000 20.97000 0.4292000 -1.336000      0.6549000 
1 1 1 3  13 36 o 30.65000 0.3423000 30.52000 0.4799000 30.79000 0.4884000 -0.2704000     0.6847000 
1 1 1 3  13 38 o 11.27000 0.4600000 11.34000 0.6606000 11.19000 0.6402000 0.1473000      0.9199000 
1 1 1 3  13 40 o 4.539000 1.050000  4.819000 1.431000  4.259000 1.538000  0.5600000      2.101000  
1 1 1 3  13 42 o 7.337000 0.7986000 7.697000 1.087000  6.977000 1.170000  0.7201000      1.597000  
1 1 1 3  13 44 o 18.20000 0.4067000 18.34000 0.5322000 18.05000 0.6152000 0.2925000      0.8135000 
1 1 1 3  13 46 o 11.36000 0.5560000 10.34000 0.8784000 12.37000 0.6819000 -2.033000      1.112000  
1 1 1 3  13 48 o 30.35000 0.3871000 29.95000 0.5583000 30.75000 0.5365000 -0.8010000     0.7742000 
1 1 1 3  13 50 o 29.09000 0.3335000 28.58000 0.4787000 29.61000 0.4645000 -1.029000      0.6671000 
1 1 1 3  13 52 o 25.03000 0.3311000 24.99000 0.4715000 25.07000 0.4649000 -0.7909000E-01 0.6621000 
1 1 1 3  13 54 o 16.37000 0.3761000 16.04000 0.5414000 16.71000 0.5223000 -0.6720000     0.7522000 
1 1 1 3  13 56 o 19.47000 0.4155000 19.38000 0.4981000 19.56000 0.6652000 -0.1814000     0.8311000 
1 1 1 3  13 58 o 9.218000 0.5825000 8.654000 0.9064000 9.782000 0.7317000 -1.128000      1.165000  
1 1 1 3  13 60 f 10.43000 0.6144000 10.90000 0.9449000 9.965000 0.7855000 0.9329000      1.229000  
1 1 1 3  13 62 o 6.879000 0.8591000 7.576000 1.261000  6.182000 1.167000  1.394000       1.718000  
1 1 1 3  13 64 o 10.19000 0.7569000 9.284000 1.303000  11.09000 0.7703000 -1.809000      1.514000  
1 1 1 3  13 66 o 9.096000 0.7182000 10.53000 1.071000  7.661000 0.9572000 2.870000       1.436000  
1 1 1 3  14 1  o 79.99000 0.5495000 79.62000 0.7739000 80.36000 0.7803000 -0.7381000     1.099000  
1 1 1 3  14 3  o 7.733000 0.1942000 7.966000 0.2715000 7.499000 0.2779000 0.4669000      0.3885000 
1 1 1 3  14 5  o 72.24000 0.5146000 72.39000 0.6327000 72.08000 0.8117000 0.3032000      1.029000  
1 1 1 3  14 7  o 27.99000 0.2533000 27.69000 0.3548000 28.28000 0.3616000 -0.5930000     0.5066000 
1 1 1 3  14 9  o 32.24000 0.3094000 32.05000 0.3547000 32.43000 0.5071000 -0.3814000     0.6188000 
1 1 1 3  14 11 o 75.63000 0.5657000 75.76000 0.8555000 75.51000 0.7404000 0.2521000      1.131000  
1 1 1 3  14 13 o 47.59000 0.3716000 47.38000 0.4830000 47.80000 0.5650000 -0.4207000     0.7433000 
1 1 1 3  14 15 o 91.44000 0.6301000 91.09000 0.8870000 91.80000 0.8953000 -0.7191000     1.260000  
1 1 1 3  14 17 o 30.27000 0.2604000 30.19000 0.4036000 30.34000 0.3290000 -0.1534000     0.5207000 
1 1 1 3  14 19 o 157.1000 1.105000  156.1000 1.737000  158.1000 1.365000  -1.951000      2.209000  
1 1 1 3  14 21 o 90.81000 0.7693000 90.54000 1.252000  91.07000 0.8946000 -0.5324000     1.539000  
1 1 1 3  14 23 o 56.14000 0.4208000 55.61000 0.6579000 56.68000 0.5249000 -1.070000      0.8417000 
1 1 1 3  14 25 o 134.3000 1.494000  133.6000 2.578000  135.0000 1.510000  -1.407000      2.988000  
1 1 1 3  14 27 o 90.77000 0.7461000 90.86000 1.259000  90.68000 0.8006000 0.1768000      1.492000  
1 1 1 3  14 29 o 48.75000 0.3841000 48.89000 0.6047000 48.60000 0.4738000 0.2898000      0.7682000 
1 1 1 3  14 31 o 58.56000 0.4989000 58.70000 0.6985000 58.41000 0.7126000 0.2940000      0.9978000 
1 1 1 3  14 33 o 21.27000 0.3057000 21.29000 0.4817000 21.24000 0.3767000 0.5636000E-01  0.6115000 
1 1 1 3  14 35 o 40.50000 0.3921000 40.14000 0.6549000 40.86000 0.4313000 -0.7241000     0.7841000 
1 1 1 3  14 37 o 32.53000 0.3671000 32.44000 0.6203000 32.62000 0.3929000 -0.1766000     0.7343000 
1 1 1 3  14 39 o 39.51000 0.4111000 39.67000 0.6663000 39.35000 0.4818000 0.3139000      0.8222000 
1 1 1 3  14 41 o 31.23000 0.3816000 30.69000 0.6135000 31.78000 0.4538000 -1.086000      0.7631000 
1 1 1 3  14 43 o 12.55000 0.4864000 12.50000 0.6764000 12.59000 0.6991000 -0.9741000E-01 0.9728000 
1 1 1 3  14 45 o 16.83000 0.4325000 17.59000 0.5387000 16.08000 0.6768000 1.505000       0.8650000 
1 1 1 3  14 47 o 15.82000 0.4207000 16.18000 0.5769000 15.46000 0.6125000 0.7168000      0.8414000 
1 1 1 3  14 49 o 43.86000 0.3711000 44.43000 0.5285000 43.30000 0.5212000 1.133000       0.7423000 
1 1 1 3  14 51 o 14.58000 0.4493000 15.13000 0.5594000 14.03000 0.7032000 1.102000       0.8985000 
1 1 1 3  14 53 o 12.90000 0.4188000 11.97000 0.6179000 13.82000 0.5656000 -1.852000      0.8377000 
1 1 1 3  14 55 o 5.103000 1.001000  4.923000 1.512000  5.282000 1.311000  -0.3584000     2.001000  
1 1 1 3  14 57 o 15.50000 0.4112000 16.13000 0.6540000 14.87000 0.4986000 1.262000       0.8224000 
1 1 1 3  14 59 o 12.96000 0.5417000 13.02000 0.8947000 12.89000 0.6111000 0.1321000      1.083000  
1 1 1 3  14 61 o 3.582000 1.035000  3.564000 1.484000  3.599000 1.443000  -0.3471000E-01 2.070000  
1 1 1 3  14 63 o 6.477000 0.9034000 8.073000 1.201000  4.881000 1.349000  3.192000       1.807000  
1 1 1 3  14 65 o 5.506000 1.159000  5.904000 1.626000  5.109000 1.652000  0.7948000      2.318000  
1 1 1 3  15 0  o 18.28000 0.2481000 18.28000 0.2481000 18.28000 0.2481000 0.000000       0.000000  
1 1 1 3  15 2  o 102.8000 0.7030000 102.8000 0.9947000 102.8000 0.9937000 -0.1673000E-01 1.406000  
1 1 1 3  15 4  o 123.1000 0.9069000 123.2000 1.372000  123.0000 1.186000  0.1791000      1.814000  
1 1 1 3  15 6  o 57.46000 0.5208000 57.49000 0.8090000 57.42000 0.6562000 0.7301000E-01  1.042000  
1 1 1 3  15 8  o 58.55000 0.4239000 58.83000 0.5236000 58.28000 0.6668000 0.5534000      0.8478000 
1 1 1 3  15 10 o 68.18000 0.5124000 67.98000 0.6699000 68.37000 0.7756000 -0.3883000     1.025000  
1 1 1 3  15 12 o 98.94000 0.8042000 98.82000 0.8593000 99.06000 1.360000  -0.2354000     1.608000  
1 1 1 3  15 14 o 88.79000 0.6126000 88.11000 0.8591000 89.47000 0.8736000 -1.362000      1.225000  
1 1 1 3  15 16 o 54.88000 0.4564000 54.89000 0.6376000 54.86000 0.6532000 0.3172000E-01  0.9128000 
1 1 1 3  15 18 o 78.19000 0.5639000 79.00000 0.8951000 77.37000 0.6860000 1.633000       1.128000  
1 1 1 3  15 20 o 105.8000 0.8939000 106.8000 1.467000  104.8000 1.022000  2.023000       1.788000  
1 1 1 3  15 22 o 23.14000 0.3620000 23.00000 0.5160000 23.27000 0.5078000 -0.2730000     0.7240000 
1 1 1 3  15 24 o 30.53000 0.3229000 31.17000 0.4541000 29.90000 0.4590000 1.269000       0.6457000 
1 1 1 3  15 26 o 66.00000 0.7298000 66.84000 1.332000  65.16000 0.5964000 1.684000       1.460000  
1 1 1 3  15 28 o 46.05000 0.3677000 46.07000 0.5736000 46.04000 0.4601000 0.2600000E-01  0.7353000 
1 1 1 3  15 30 o 8.034000 0.7015000 6.836000 1.182000  9.231000 0.7559000 -2.395000      1.403000  
1 1 1 3  15 32 o 29.35000 0.3229000 29.29000 0.4804000 29.40000 0.4314000 -0.1093000     0.6457000 
1 1 1 3  15 34 o 30.21000 0.3259000 30.87000 0.4839000 29.56000 0.4368000 1.307000       0.6519000 
1 1 1 3  15 36 o 14.40000 0.3985000 14.23000 0.6274000 14.57000 0.4913000 -0.3376000     0.7969000 
1 1 1 3  15 38 o 28.36000 0.3735000 28.85000 0.6000000 27.87000 0.4451000 0.9798000      0.7471000 
1 1 1 3  15 40 f 36.92000 0.3402000 36.18000 0.5254000 37.66000 0.4324000 -1.475000      0.6805000 
1 1 1 3  15 42 o 15.74000 0.4347000 15.40000 0.6960000 16.09000 0.5212000 -0.6871000     0.8695000 
1 1 1 3  15 44 o 17.39000 0.4202000 17.75000 0.6384000 17.04000 0.5464000 0.7124000      0.8403000 
1 1 1 3  15 46 o 26.50000 0.3482000 27.26000 0.5464000 25.73000 0.4318000 1.537000       0.6964000 
1 1 1 3  15 48 o 26.25000 0.3947000 26.69000 0.6369000 25.81000 0.4664000 0.8745000      0.7894000 
1 1 1 3  15 50 o 19.49000 0.4449000 19.34000 0.7249000 19.65000 0.5161000 -0.3065000     0.8898000 
1 1 1 3  15 52 f 14.34000 0.4275000 14.31000 0.6807000 14.37000 0.5173000 -0.5492000E-01 0.8550000 
1 1 1 3  15 54 o 11.81000 0.4665000 11.70000 0.7347000 11.92000 0.5750000 -0.2169000     0.9329000 
1 1 1 3  15 56 o 9.178000 0.6404000 9.426000 0.9694000 8.930000 0.8371000 0.4957000      1.281000  
1 1 1 3  15 58 o 16.01000 0.4316000 16.92000 0.6480000 15.11000 0.5703000 1.808000       0.8632000 
1 1 1 3  15 60 o 7.288000 0.9505000 7.115000 1.696000  7.460000 0.8597000 -0.3452000     1.901000  
1 1 1 3  15 62 o 7.821000 0.7675000 7.908000 1.230000  7.734000 0.9177000 0.1736000      1.535000  
1 1 1 3  15 64 f 5.697000 1.076000  6.156000 1.752000  5.238000 1.252000  0.9184000      2.153000  
1 1 1 3  15 66 o 3.005000 0.9553000 3.984000 1.632000  2.025000 0.9928000 1.958000       1.911000  
1 1 1 3  16 1  o 36.01000 0.2678000 35.88000 0.3770000 36.15000 0.3805000 -0.2714000     0.5356000 
1 1 1 3  16 3  o 47.16000 0.3624000 46.98000 0.5456000 47.34000 0.4772000 -0.3564000     0.7248000 
1 1 1 3  16 5  o 70.54000 0.6344000 71.06000 0.9889000 70.03000 0.7948000 1.039000       1.269000  
1 1 1 3  16 7  o 26.58000 0.2264000 26.43000 0.2790000 26.73000 0.3568000 -0.2962000     0.4529000 
1 1 1 3  16 9  o 35.42000 0.3265000 35.39000 0.3809000 35.45000 0.5304000 -0.6464000E-01 0.6530000 
1 1 1 3  16 11 o 90.09000 0.7333000 90.21000 0.7866000 89.97000 1.238000  0.2360000      1.467000  
1 1 1 3  16 13 o 22.33000 0.2786000 22.73000 0.3043000 21.93000 0.4668000 0.8090000      0.5572000 
1 1 1 3  16 15 o 124.6000 0.9230000 123.7000 1.196000  125.5000 1.406000  -1.767000      1.846000  
1 1 1 3  16 17 f 47.85000 0.3854000 48.51000 0.5786000 47.19000 0.5091000 1.315000       0.7708000 
1 1 1 3  16 19 o 97.45000 0.7265000 98.18000 1.103000  96.72000 0.9461000 1.462000       1.453000  
1 1 1 3  16 21 o 59.38000 0.5202000 58.96000 0.8420000 59.80000 0.6111000 -0.8431000     1.040000  
1 1 1 3  16 23 o 41.46000 0.3755000 41.25000 0.5279000 41.67000 0.5340000 -0.4212000     0.7509000 
1 1 1 3  16 25 o 75.37000 0.6229000 74.28000 1.041000  76.45000 0.6850000 -2.169000      1.246000  
1 1 1 3  16 27 o 47.27000 0.4262000 46.81000 0.7125000 47.72000 0.4678000 -0.9110000     0.8523000 
1 1 1 3  16 29 o 10.14000 0.4710000 10.19000 0.7222000 10.09000 0.6049000 0.9600000E-01  0.9421000 
1 1 1 3  16 31 o 99.56000 0.8913000 101.5000 1.145000  97.60000 1.366000  3.917000       1.783000  
1 1 1 3  16 33 o 23.95000 0.3051000 23.85000 0.4768000 24.04000 0.3809000 -0.1991000     0.6103000 
1 1 1 3  16 35 o 26.56000 0.3715000 26.80000 0.5773000 26.32000 0.4676000 0.4864000      0.7429000 
1 1 1 3  16 37 o 23.80000 0.3162000 23.98000 0.4922000 23.62000 0.3970000 0.3574000      0.6324000 
1 1 1 3  16 39 o 21.61000 0.3370000 21.78000 0.5293000 21.44000 0.4174000 0.3442000      0.6741000 
1 1 1 3  16 41 o 42.10000 0.4204000 42.12000 0.7060000 42.08000 0.4566000 0.4128000E-01  0.8408000 
1 1 1 3  16 43 o 31.25000 0.3353000 30.82000 0.5256000 31.67000 0.4166000 -0.8543000     0.6707000 
1 1 1 3  16 45 o 23.72000 0.3647000 24.42000 0.5411000 23.02000 0.4892000 1.402000       0.7295000 
1 1 1 3  16 47 o 22.19000 0.4014000 22.51000 0.5458000 21.88000 0.5887000 0.6356000      0.8028000 
1 1 1 3  16 49 o 27.47000 0.3359000 27.40000 0.5217000 27.55000 0.4234000 -0.1494000     0.6718000 
1 1 1 3  16 51 o 14.62000 0.4122000 15.13000 0.6344000 14.11000 0.5266000 1.014000       0.8245000 
1 1 1 3  16 53 o 21.93000 0.3940000 22.26000 0.6601000 21.60000 0.4304000 0.6627000      0.7881000 
1 1 1 3  16 55 o 11.43000 0.4981000 11.15000 0.8149000 11.71000 0.5732000 -0.5677000     0.9963000 
1 1 1 3  16 57 o 5.977000 0.9719000 6.286000 1.420000  5.668000 1.327000  0.6181000      1.944000  
1 1 1 3  16 59 o 3.404000 0.9179000 2.561000 1.252000  4.247000 1.343000  -1.685000      1.836000  
1 1 1 3  16 61 o 3.063000 0.8993000 2.545000 1.210000  3.581000 1.331000  -1.036000      1.799000  
1 1 1 3  16 63 o 3.259000 0.9626000 3.101000 1.391000  3.416000 1.331000  -0.3153000     1.925000  
1 1 1 3  16 65 o 3.957000 1.031000  4.162000 1.613000  3.752000 1.285000  0.4103000      2.062000  
1 1 1 3  17 0  o 3.364000 0.7337000 3.364000 0.7337000 3.364000 0.7337000 0.000000       0.000000  
1 1 1 3  17 2  o 73.93000 0.6619000 74.40000 1.030000  73.47000 0.8318000 0.9286000      1.324000  
1 1 1 3  17 4  o 106.5000 0.7877000 107.2000 1.197000  105.7000 1.024000  1.509000       1.575000  
1 1 1 3  17 6  o 30.73000 0.2802000 31.01000 0.3100000 30.45000 0.4668000 0.5671000      0.5604000 
1 1 1 3  17 8  o 73.69000 0.6276000 73.05000 0.7172000 74.32000 1.030000  -1.267000      1.255000  
1 1 1 3  17 10 o 101.8000 0.8257000 101.7000 0.8835000 101.8000 1.395000  -0.4795000E-01 1.651000  
1 1 1 3  17 12 o 77.17000 0.5537000 77.07000 0.6783000 77.28000 0.8754000 -0.2083000     1.107000  
1 1 1 3  17 14 o 96.48000 0.7909000 95.91000 0.8361000 97.06000 1.343000  -1.150000      1.582000  
1 1 1 3  17 16 o 158.4000 1.275000  159.4000 1.375000  157.4000 2.148000  2.021000       2.550000  
1 1 1 3  17 18 o 22.73000 0.3268000 22.57000 0.4830000 22.88000 0.4404000 -0.3034000     0.6536000 
1 1 1 3  17 20 o 84.85000 0.7230000 84.62000 1.177000  85.09000 0.8405000 -0.4699000     1.446000  
1 1 1 3  17 22 o 56.37000 0.4245000 56.69000 0.6687000 56.04000 0.5231000 0.6499000      0.8490000 
1 1 1 3  17 24 o 34.52000 0.4396000 33.46000 0.7848000 35.58000 0.3963000 -2.120000      0.8792000 
1 1 1 3  17 26 o 97.77000 0.8026000 98.01000 1.356000  97.53000 0.8592000 0.4824000      1.605000  
1 1 1 3  17 28 o 9.807000 0.4985000 9.294000 0.8154000 10.32000 0.5738000 -1.027000      0.9971000 
1 1 1 3  17 30 o 78.80000 0.6017000 79.81000 0.9151000 77.79000 0.7816000 2.020000       1.203000  
1 1 1 3  17 32 o 10.65000 0.5021000 10.52000 0.7631000 10.78000 0.6529000 -0.2651000     1.004000  
1 1 1 3  17 34 o 38.09000 0.3720000 37.69000 0.5201000 38.48000 0.5319000 -0.7939000     0.7439000 
1 1 1 3  17 36 o 33.47000 0.3199000 33.47000 0.5009000 33.46000 0.3982000 0.2747000E-02  0.6399000 
1 1 1 3  17 38 o 25.44000 0.3671000 25.99000 0.6172000 24.88000 0.3976000 1.110000       0.7342000 
1 1 1 3  17 40 o 47.25000 0.3878000 47.10000 0.6077000 47.40000 0.4820000 -0.3052000     0.7757000 
1 1 1 3  17 42 o 21.05000 0.3525000 20.85000 0.5528000 21.26000 0.4375000 -0.4087000     0.7050000 
1 1 1 3  17 44 o 19.96000 0.3958000 19.85000 0.5989000 20.08000 0.5175000 -0.2390000     0.7915000 
1 1 1 3  17 46 o 18.40000 0.3958000 18.09000 0.6232000 18.72000 0.4881000 -0.6268000     0.7915000 
1 1 1 3  17 48 f 10.56000 0.6288000 10.73000 1.032000  10.40000 0.7183000 0.3395000      1.258000  
1 1 1 3  17 50 o 13.25000 0.4590000 14.28000 0.7154000 12.22000 0.5753000 2.057000       0.9180000 
1 1 1 3  17 52 o 14.62000 0.4213000 14.61000 0.6651000 14.63000 0.5171000 -0.1737000E-01 0.8425000 
1 1 1 3  17 54 o 7.772000 0.7118000 8.090000 1.105000  7.454000 0.8973000 0.6358000      1.424000  
1 1 1 3  17 56 o 4.071000 1.030000  3.934000 1.501000  4.208000 1.411000  -0.2738000     2.060000  
1 1 1 3  17 58 o 4.866000 1.014000  4.214000 1.546000  5.517000 1.311000  -1.303000      2.028000  
1 1 1 3  17 60 o 4.623000 1.062000  4.987000 1.555000  4.259000 1.446000  0.7277000      2.124000  
1 1 1 3  17 62 o 13.53000 0.4944000 13.37000 0.8135000 13.68000 0.5620000 -0.3045000     0.9888000 
1 1 1 3  17 64 o 9.718000 0.7321000 10.18000 1.217000  9.255000 0.8140000 0.9270000      1.464000  
1 1 1 3  18 1  o 64.80000 0.7421000 64.80000 0.7407000 64.79000 1.286000  0.5363000E-02  1.484000  
1 1 1 3  18 3  o 73.26000 0.5869000 72.81000 0.8254000 73.71000 0.8345000 -0.9044000     1.174000  
1 1 1 3  18 5  o 59.79000 0.4547000 59.08000 0.5877000 60.51000 0.6940000 -1.437000      0.9094000 
1 1 1 3  18 7  o 37.23000 0.3418000 37.36000 0.3987000 37.10000 0.5553000 0.2602000      0.6836000 
1 1 1 3  18 9  o 52.28000 0.3864000 52.34000 0.4762000 52.23000 0.6086000 0.1178000      0.7727000 
1 1 1 3  18 11 o 52.79000 0.3911000 52.83000 0.4809000 52.75000 0.6168000 0.7189000E-01  0.7821000 
1 1 1 3  18 13 o 53.07000 0.3950000 53.12000 0.4861000 53.02000 0.6227000 0.9740000E-01  0.7900000 
1 1 1 3  18 15 o 38.04000 0.4840000 37.64000 0.3757000 38.45000 0.8922000 -0.8071000     0.9681000 
1 1 1 3  18 17 o 42.12000 0.3351000 41.85000 0.4074000 42.40000 0.5321000 -0.5479000     0.6702000 
1 1 1 3  18 19 o 23.85000 0.3163000 24.17000 0.5297000 23.54000 0.3459000 0.6327000      0.6326000 
1 1 1 3  18 21 f 78.04000 0.5657000 78.25000 0.8926000 77.82000 0.6952000 0.4337000      1.131000  
1 1 1 3  18 23 o 44.47000 0.4020000 44.66000 0.6724000 44.28000 0.4409000 0.3711000      0.8041000 
1 1 1 3  18 25 o 20.99000 0.3410000 20.78000 0.5599000 21.19000 0.3893000 -0.4092000     0.6819000 
1 1 1 3  18 27 o 73.43000 0.5376000 73.64000 0.8475000 73.23000 0.6617000 0.4067000      1.075000  
1 1 1 3  18 29 o 66.15000 0.4906000 66.24000 0.7704000 66.07000 0.6078000 0.1661000      0.9812000 
1 1 1 3  18 31 o 22.01000 0.3185000 22.35000 0.4642000 21.67000 0.4362000 0.6751000      0.6370000 
1 1 1 3  18 33 o 27.83000 0.3196000 27.50000 0.4751000 28.16000 0.4277000 -0.6557000     0.6393000 
1 1 1 3  18 35 o 24.82000 0.3546000 24.54000 0.5914000 25.10000 0.3914000 -0.5545000     0.7092000 
1 1 1 3  18 37 o 24.81000 0.3830000 25.20000 0.6247000 24.41000 0.4432000 0.7893000      0.7660000 
1 1 1 3  18 39 o 19.66000 0.3455000 19.66000 0.5416000 19.67000 0.4289000 -0.9333000E-02 0.6909000 
1 1 1 3  18 41 o 24.48000 0.3815000 24.10000 0.6447000 24.86000 0.4080000 -0.7645000     0.7630000 
1 1 1 3  18 43 o 29.16000 0.3364000 29.42000 0.5224000 28.90000 0.4242000 0.5286000      0.6729000 
1 1 1 3  18 45 o 10.15000 0.6407000 10.04000 0.9649000 10.26000 0.8430000 -0.2216000     1.281000  
1 1 1 3  18 47 o 20.48000 0.3606000 21.14000 0.5596000 19.83000 0.4549000 1.311000       0.7212000 
1 1 1 3  18 49 o 8.898000 0.7910000 8.630000 1.335000  9.166000 0.8483000 -0.5364000     1.582000  
1 1 1 3  18 51 o 8.508000 0.6514000 7.723000 1.096000  9.292000 0.7037000 -1.568000      1.303000  
1 1 1 3  18 53 f 8.523000 0.7220000 8.128000 1.253000  8.917000 0.7173000 -0.7890000     1.444000  
1 1 1 3  18 55 o 9.844000 0.5822000 9.753000 0.9385000 9.936000 0.6891000 -0.1828000     1.164000  
1 1 1 3  18 57 o 6.227000 1.067000  6.433000 1.381000  6.021000 1.627000  0.4125000      2.135000  
1 1 1 3  18 59 o 4.346000 1.179000  4.187000 1.865000  4.506000 1.444000  -0.3189000     2.358000  
1 1 1 3  18 61 o 11.51000 0.5500000 12.18000 0.8220000 10.83000 0.7309000 1.355000       1.100000  
1 1 1 3  18 63 o 4.808000 1.031000  5.637000 1.579000  3.980000 1.327000  1.657000       2.063000  
1 1 1 3  18 65 o 4.599000 1.005000  6.008000 1.591000  3.191000 1.228000  2.818000       2.009000  
1 1 1 3  19 0  f 87.08000 0.8482000 87.08000 0.8482000 87.08000 0.8482000 0.000000       0.000000  
1 1 1 3  19 2  o 86.53000 0.6439000 86.09000 0.9690000 86.97000 0.8481000 -0.8807000     1.288000  
1 1 1 3  19 4  o 50.38000 0.3891000 50.75000 0.5147000 50.00000 0.5836000 0.7521000      0.7781000 
1 1 1 3  19 6  o 47.77000 0.3767000 48.36000 0.5789000 47.18000 0.4823000 1.180000       0.7535000 
1 1 1 3  19 8  o 97.55000 0.6937000 96.95000 0.8445000 98.15000 1.101000  -1.196000      1.387000  
1 1 1 3  19 10 o 58.40000 0.4306000 57.55000 0.5210000 59.24000 0.6858000 -1.691000      0.8612000 
1 1 1 3  19 12 f 69.72000 0.5987000 69.68000 0.6927000 69.76000 0.9767000 -0.7418000E-01 1.197000  
1 1 1 3  19 14 o 136.9000 1.145000  138.1000 1.335000  135.8000 1.860000  2.373000       2.289000  
1 1 1 3  19 16 o 52.32000 0.3969000 51.80000 0.4821000 52.84000 0.6306000 -1.038000      0.7937000 
1 1 1 3  19 18 o 63.12000 0.5208000 63.23000 0.7360000 63.01000 0.7370000 0.2212000      1.042000  
1 1 1 3  19 20 o 81.84000 0.6188000 81.35000 0.9307000 82.32000 0.8158000 -0.9696000     1.238000  
1 1 1 3  19 22 o 45.20000 0.4180000 44.52000 0.6704000 45.88000 0.4996000 -1.355000      0.8360000 
1 1 1 3  19 24 o 7.210000 0.6506000 6.998000 1.050000  7.421000 0.7692000 -0.4228000     1.301000  
1 1 1 3  19 26 o 23.28000 0.3321000 23.19000 0.5450000 23.38000 0.3796000 -0.1889000     0.6641000 
1 1 1 3  19 28 o 34.68000 0.3143000 34.76000 0.4904000 34.60000 0.3932000 0.1544000      0.6286000 
1 1 1 3  19 30 o 29.41000 0.3157000 29.01000 0.4642000 29.82000 0.4279000 -0.8166000     0.6313000 
1 1 1 3  19 32 o 27.69000 0.3185000 26.81000 0.4639000 28.58000 0.4367000 -1.766000      0.6371000 
1 1 1 3  19 34 o 51.11000 0.4198000 51.54000 0.6339000 50.69000 0.5505000 0.8450000      0.8395000 
1 1 1 3  19 36 o 48.27000 0.4624000 48.81000 0.7521000 47.73000 0.5382000 1.076000       0.9249000 
1 1 1 3  19 38 o 9.431000 0.6075000 9.574000 0.9659000 9.288000 0.7371000 0.2855000      1.215000  
1 1 1 3  19 40 o 21.35000 0.3516000 20.83000 0.5614000 21.87000 0.4234000 -1.036000      0.7032000 
1 1 1 3  19 42 f 6.573000 0.9162000 6.798000 1.392000  6.347000 1.192000  0.4510000      1.832000  
1 1 1 3  19 44 o 18.42000 0.4174000 18.64000 0.6144000 18.21000 0.5652000 0.4351000      0.8348000 
1 1 1 3  19 46 o 8.913000 0.7218000 9.931000 0.9715000 7.895000 1.068000  2.035000       1.444000  
1 1 1 3  19 48 o 16.96000 0.5842000 17.07000 1.078000  16.85000 0.4516000 0.2209000      1.168000  
1 1 1 3  19 50 o 4.275000 0.9921000 3.949000 1.511000  4.602000 1.286000  -0.6525000     1.984000  
1 1 1 3  19 52 o 6.603000 0.7815000 6.835000 1.227000  6.370000 0.9687000 0.4656000      1.563000  
1 1 1 3  19 54 o 4.449000 0.9869000 5.245000 1.538000  3.652000 1.238000  1.593000       1.974000  
1 1 1 3  19 56 o 8.729000 0.6681000 9.109000 1.021000  8.350000 0.8620000 0.7592000      1.336000  
1 1 1 3  19 58 o 7.790000 0.6814000 8.097000 1.033000  7.483000 0.8886000 0.6142000      1.363000  
1 1 1 3  19 60 f 7.953000 0.7080000 8.177000 1.099000  7.729000 0.8925000 0.4480000      1.416000  
1 1 1 3  19 62 o 6.849000 0.8269000 6.657000 1.356000  7.040000 0.9468000 -0.3839000     1.654000  
1 1 1 3  19 64 o 3.872000 1.106000  4.628000 1.821000  3.117000 1.257000  1.511000       2.213000  
1 1 1 3  20 1  o 22.28000 0.2507000 22.39000 0.3544000 22.17000 0.3547000 0.2183000      0.5014000 
1 1 1 3  20 3  o 87.87000 0.6062000 87.85000 0.8574000 87.90000 0.8572000 -0.5457000E-01 1.212000  
1 1 1 3  20 5  o 79.98000 0.6400000 79.60000 0.9013000 80.35000 0.9088000 -0.7477000     1.280000  
1 1 1 3  20 7  o 63.58000 0.4486000 63.54000 0.6341000 63.61000 0.6346000 -0.6837000E-01 0.8971000 
1 1 1 3  20 9  o 74.29000 0.5349000 74.60000 0.6596000 73.98000 0.8422000 0.6106000      1.070000  
1 1 1 3  20 11 o 94.60000 0.7983000 94.81000 0.9273000 94.39000 1.300000  0.4134000      1.597000  
1 1 1 3  20 13 o 17.85000 0.3089000 18.15000 0.3149000 17.54000 0.5314000 0.6047000      0.6178000 
1 1 1 3  20 15 o 30.74000 0.2787000 31.03000 0.3456000 30.45000 0.4374000 0.5851000      0.5574000 
1 1 1 3  20 17 o 73.42000 0.5345000 73.14000 0.6528000 73.70000 0.8464000 -0.5575000     1.069000  
1 1 1 3  20 19 o 74.91000 0.6450000 74.57000 1.049000  75.25000 0.7504000 -0.6845000     1.290000  
1 1 1 3  20 21 o 41.46000 0.3540000 41.36000 0.4608000 41.56000 0.5374000 -0.1986000     0.7079000 
1 1 1 3  20 23 o 39.27000 0.3427000 38.61000 0.5062000 39.93000 0.4621000 -1.320000      0.6854000 
1 1 1 3  20 25 o 73.00000 0.6109000 72.45000 1.026000  73.56000 0.6635000 -1.110000      1.222000  
1 1 1 3  20 27 o 13.11000 0.3870000 13.09000 0.5916000 13.13000 0.4991000 -0.3902000E-01 0.7739000 
1 1 1 3  20 29 o 48.29000 0.4020000 48.58000 0.6016000 47.99000 0.5334000 0.5881000      0.8040000 
1 1 1 3  20 31 f 16.72000 0.3500000 16.79000 0.5132000 16.66000 0.4762000 0.1292000      0.7001000 
1 1 1 3  20 33 o 10.62000 0.4910000 11.27000 0.7013000 9.964000 0.6874000 1.308000       0.9820000 
1 1 1 3  20 35 o 10.79000 0.5637000 10.64000 0.9676000 10.95000 0.5787000 -0.3154000     1.127000  
1 1 1 3  20 37 f 24.20000 0.3222000 24.55000 0.5024000 23.85000 0.4035000 0.7020000      0.6444000 
1 1 1 3  20 39 o 14.17000 0.4337000 14.25000 0.6830000 14.10000 0.5347000 0.1476000      0.8674000 
1 1 1 3  20 41 o 24.83000 0.3801000 24.60000 0.6322000 25.05000 0.4223000 -0.4494000     0.7602000 
1 1 1 3  20 43 o 22.92000 0.3544000 22.90000 0.5500000 22.93000 0.4470000 -0.2616000E-01 0.7088000 
1 1 1 3  20 45 o 15.16000 0.5352000 15.42000 0.6723000 14.90000 0.8329000 0.5255000      1.070000  
1 1 1 3  20 47 o 7.743000 0.6930000 8.557000 1.030000  6.928000 0.9276000 1.629000       1.386000  
1 1 1 3  20 49 o 2.800000 0.8848000 2.627000 1.250000  2.973000 1.252000  -0.3456000     1.770000  
1 1 1 3  20 51 o 12.12000 0.4796000 11.97000 0.7607000 12.27000 0.5843000 -0.3010000     0.9592000 
1 1 1 3  20 53 o 9.705000 0.6585000 10.41000 1.086000  9.002000 0.7446000 1.406000       1.317000  
1 1 1 3  20 55 o 7.414000 0.7433000 7.642000 1.207000  7.186000 0.8676000 0.4557000      1.487000  
1 1 1 3  20 57 o 4.498000 1.053000  4.715000 1.578000  4.282000 1.394000  0.4333000      2.105000  
1 1 1 3  20 59 o 2.732000 0.8832000 3.414000 1.462000  2.051000 0.9910000 1.363000       1.766000  
1 1 1 3  20 61 o 11.27000 0.5341000 11.57000 0.8390000 10.97000 0.6613000 0.5968000      1.068000  
1 1 1 3  20 63 o 9.165000 0.6772000 9.569000 1.133000  8.761000 0.7415000 0.8082000      1.354000  
1 1 1 3  21 0  o 68.83000 0.6802000 68.83000 0.6802000 68.83000 0.6802000 0.000000       0.000000  
1 1 1 3  21 2  o 22.77000 0.2421000 23.11000 0.3158000 22.44000 0.3671000 0.6636000      0.4842000 
1 1 1 3  21 4  o 19.02000 0.2312000 19.10000 0.3092000 18.94000 0.3438000 0.1614000      0.4623000 
1 1 1 3  21 6  o 105.6000 0.7249000 105.9000 1.029000  105.3000 1.021000  0.6279000      1.450000  
1 1 1 3  21 8  o 63.63000 0.6346000 63.68000 0.8994000 63.58000 0.8955000 0.9600000E-01  1.269000  
1 1 1 3  21 10 o 53.14000 0.4620000 52.69000 0.4866000 53.59000 0.7854000 -0.8986000     0.9240000 
1 1 1 3  21 12 o 49.71000 0.4365000 49.98000 0.4687000 49.44000 0.7364000 0.5473000      0.8729000 
1 1 1 3  21 14 o 63.96000 0.4704000 64.16000 0.5793000 63.75000 0.7413000 0.4051000      0.9408000 
1 1 1 3  21 16 f 70.88000 0.5169000 71.13000 0.6373000 70.62000 0.8140000 0.5060000      1.034000  
1 1 1 3  21 18 o 54.79000 0.4645000 54.65000 0.6582000 54.92000 0.6555000 -0.2701000     0.9290000 
1 1 1 3  21 20 o 42.07000 0.3586000 41.58000 0.4626000 42.56000 0.5480000 -0.9745000     0.7171000 
1 1 1 3  21 22 o 78.07000 0.5925000 77.54000 0.8885000 78.60000 0.7841000 -1.059000      1.185000  
1 1 1 3  21 24 o 23.12000 0.3080000 22.88000 0.4546000 23.37000 0.4156000 -0.4892000     0.6159000 
1 1 1 3  21 26 o 40.84000 0.3315000 40.92000 0.4645000 40.77000 0.4731000 0.1509000      0.6630000 
1 1 1 3  21 28 o 28.73000 0.2976000 28.59000 0.4627000 28.87000 0.3743000 -0.2762000     0.5951000 
1 1 1 3  21 30 o 28.34000 0.3028000 28.82000 0.4721000 27.86000 0.3794000 0.9617000      0.6056000 
1 1 1 3  21 32 o 25.35000 0.3860000 25.23000 0.4709000 25.48000 0.6118000 -0.2488000     0.7720000 
1 1 1 3  21 34 o 33.65000 0.3406000 33.31000 0.4991000 33.99000 0.4636000 -0.6768000     0.6812000 
1 1 1 3  21 36 o 29.56000 0.3620000 30.48000 0.6014000 28.65000 0.4031000 1.833000       0.7240000 
1 1 1 3  21 38 o 15.34000 0.4011000 15.25000 0.6350000 15.44000 0.4902000 -0.1887000     0.8022000 
1 1 1 3  21 40 o 13.26000 0.4407000 12.43000 0.6850000 14.09000 0.5548000 -1.665000      0.8815000 
1 1 1 3  21 42 o 16.80000 0.3956000 16.56000 0.6162000 17.04000 0.4963000 -0.4801000     0.7912000 
1 1 1 3  21 44 f 31.86000 0.3580000 32.46000 0.5329000 31.25000 0.4783000 1.211000       0.7161000 
1 1 1 3  21 46 o 6.170000 0.8840000 5.845000 1.461000  6.496000 0.9953000 -0.6515000     1.768000  
1 1 1 3  21 48 o 13.04000 0.4803000 13.55000 0.7760000 12.53000 0.5662000 1.022000       0.9606000 
1 1 1 3  21 50 o 13.67000 0.4462000 13.77000 0.7123000 13.58000 0.5374000 0.1872000      0.8923000 
1 1 1 3  21 52 f 17.71000 0.3737000 17.80000 0.5826000 17.61000 0.4683000 0.1985000      0.7475000 
1 1 1 3  21 54 o 6.524000 0.8586000 8.093000 1.134000  4.956000 1.289000  3.137000       1.717000  
1 1 1 3  21 56 o 9.992000 0.6871000 9.964000 0.9418000 10.02000 1.001000  -0.5505000E-01 1.374000  
1 1 1 3  21 58 o 4.198000 1.141000  4.774000 1.808000  3.622000 1.393000  1.153000       2.282000  
1 1 1 3  21 60 o 15.82000 0.4242000 16.00000 0.6578000 15.64000 0.5359000 0.3602000      0.8485000 
1 1 1 3  21 62 o 11.36000 0.5551000 11.67000 0.8939000 11.06000 0.6585000 0.6129000      1.110000  
1 1 1 3  21 64 o 8.863000 0.7959000 9.979000 1.294000  7.748000 0.9267000 2.231000       1.592000  
1 1 1 3  22 1  o 46.00000 0.3387000 45.89000 0.4785000 46.10000 0.4795000 -0.2095000     0.6774000 
1 1 1 3  22 3  o 63.78000 0.5586000 62.56000 0.6250000 65.00000 0.9260000 -2.441000      1.117000  
1 1 1 3  22 5  o 56.67000 0.4982000 56.44000 0.5711000 56.89000 0.8165000 -0.4483000     0.9963000 
1 1 1 3  22 7  o 71.51000 0.6510000 71.49000 1.010000  71.52000 0.8213000 -0.3647000E-01 1.302000  
1 1 1 3  22 9  o 26.24000 0.3021000 25.94000 0.3185000 26.53000 0.5134000 -0.5902000     0.6042000 
1 1 1 3  22 11 f 14.39000 0.3561000 14.26000 0.4226000 14.52000 0.5732000 -0.2633000     0.7121000 
1 1 1 3  22 13 o 26.24000 0.2627000 26.48000 0.3316000 26.01000 0.4075000 0.4748000      0.5254000 
1 1 1 3  22 15 o 18.06000 0.2758000 18.26000 0.3475000 17.86000 0.4284000 0.4027000      0.5517000 
1 1 1 3  22 17 o 19.31000 0.2871000 20.02000 0.3807000 18.60000 0.4297000 1.417000       0.5741000 
1 1 1 3  22 19 o 35.55000 0.3486000 36.02000 0.4989000 35.08000 0.4871000 0.9323000      0.6973000 
1 1 1 3  22 21 o 77.14000 0.5869000 76.74000 0.8802000 77.53000 0.7765000 -0.7926000     1.174000  
1 1 1 3  22 23 o 24.92000 0.2778000 24.49000 0.3865000 25.35000 0.3992000 -0.8660000     0.5556000 
1 1 1 3  22 25 o 13.79000 0.3731000 14.72000 0.5442000 12.85000 0.5106000 1.876000       0.7462000 
1 1 1 3  22 27 o 18.39000 0.3006000 18.09000 0.4236000 18.69000 0.4267000 -0.6054000     0.6012000 
1 1 1 3  22 29 o 41.22000 0.3640000 41.13000 0.4700000 41.32000 0.5559000 -0.1972000     0.7279000 
1 1 1 3  22 31 o 56.36000 0.5401000 56.66000 0.6825000 56.07000 0.8373000 0.5955000      1.080000  
1 1 1 3  22 33 o 29.90000 0.3114000 29.62000 0.4829000 30.19000 0.3931000 -0.5768000     0.6227000 
1 1 1 3  22 35 o 30.57000 0.4628000 30.00000 0.8330000 31.14000 0.4034000 -1.137000      0.9255000 
1 1 1 3  22 37 o 21.43000 0.3295000 20.98000 0.5126000 21.88000 0.4142000 -0.8914000     0.6590000 
1 1 1 3  22 39 o 22.16000 0.3447000 22.84000 0.5313000 21.48000 0.4393000 1.354000       0.6894000 
1 1 1 3  22 41 f 10.93000 0.5470000 9.745000 0.9163000 12.11000 0.5979000 -2.360000      1.094000  
1 1 1 3  22 43 o 14.44000 0.4359000 13.63000 0.6999000 15.25000 0.5197000 -1.618000      0.8717000 
1 1 1 3  22 45 o 4.082000 1.031000  4.263000 1.490000  3.902000 1.425000  0.3611000      2.062000  
1 1 1 3  22 47 o 9.893000 0.6698000 10.16000 1.099000  9.624000 0.7659000 0.5383000      1.340000  
1 1 1 3  22 49 o 20.33000 0.3427000 20.21000 0.5405000 20.44000 0.4215000 -0.2254000     0.6854000 
1 1 1 3  22 51 o 11.89000 0.4796000 11.27000 0.7939000 12.51000 0.5384000 -1.233000      0.9592000 
1 1 1 3  22 53 o 9.093000 0.6665000 9.258000 1.128000  8.929000 0.7110000 0.3290000      1.333000  
1 1 1 3  22 55 o 3.850000 1.021000  4.623000 1.537000  3.077000 1.343000  1.546000       2.042000  
1 1 1 3  22 57 o 4.942000 1.161000  5.279000 1.739000  4.605000 1.540000  0.6730000      2.323000  
1 1 1 3  22 59 o 2.805000 0.8805000 3.012000 1.342000  2.598000 1.141000  0.4141000      1.761000  
1 1 1 3  22 61 o 7.310000 0.7480000 7.756000 1.122000  6.864000 0.9893000 0.8925000      1.496000  
1 1 1 3  22 63 o 4.530000 0.9722000 4.009000 1.521000  5.051000 1.211000  -1.043000      1.944000  
1 1 1 3  23 0  o 17.28000 0.3420000 17.28000 0.3420000 17.28000 0.3420000 0.000000       0.000000  
1 1 1 3  23 2  f 90.05000 0.6721000 90.90000 0.8878000 89.20000 1.009000  1.700000       1.344000  
1 1 1 3  23 4  o 96.53000 0.7175000 95.44000 1.074000  97.61000 0.9517000 -2.167000      1.435000  
1 1 1 3  23 6  o 103.5000 0.7686000 105.0000 1.022000  102.0000 1.149000  2.986000       1.537000  
1 1 1 3  23 8  o 58.25000 0.4527000 58.84000 0.5976000 57.67000 0.6801000 1.164000       0.9054000 
1 1 1 3  23 10 o 34.37000 0.3427000 34.73000 0.3675000 34.02000 0.5786000 0.7182000      0.6855000 
1 1 1 3  23 12 o 40.96000 0.3713000 41.10000 0.4094000 40.82000 0.6196000 0.2809000      0.7426000 
1 1 1 3  23 14 o 70.40000 0.5738000 70.17000 0.8101000 70.63000 0.8128000 -0.4621000     1.148000  
1 1 1 3  23 16 o 30.88000 0.2994000 30.90000 0.3969000 30.85000 0.4483000 0.4850000E-01  0.5988000 
1 1 1 3  23 18 o 40.73000 0.3752000 40.61000 0.5371000 40.85000 0.5240000 -0.2333000     0.7504000 
1 1 1 3  23 20 o 12.11000 0.3740000 11.87000 0.5449000 12.34000 0.5125000 -0.4745000     0.7481000 
1 1 1 3  23 22 o 27.29000 0.2806000 26.97000 0.3885000 27.60000 0.4050000 -0.6311000     0.5612000 
1 1 1 3  23 24 o 23.82000 0.3039000 23.78000 0.4507000 23.86000 0.4078000 -0.8139000E-01 0.6078000 
1 1 1 3  23 26 o 16.73000 0.3127000 16.67000 0.4373000 16.79000 0.4471000 -0.1162000     0.6254000 
1 1 1 3  23 28 o 10.18000 0.4892000 10.32000 0.6232000 10.04000 0.7541000 0.2855000      0.9783000 
1 1 1 3  23 30 o 29.32000 0.3200000 29.61000 0.4165000 29.03000 0.4861000 0.5859000      0.6401000 
1 1 1 3  23 32 o 15.67000 0.3644000 15.26000 0.5322000 16.08000 0.4980000 -0.8269000     0.7289000 
1 1 1 3  23 34 o 31.40000 0.3531000 31.02000 0.4947000 31.78000 0.5040000 -0.7535000     0.7062000 
1 1 1 3  23 36 o 25.30000 0.3386000 25.31000 0.5117000 25.30000 0.4435000 0.1045000E-01  0.6772000 
1 1 1 3  23 38 o 22.70000 0.3425000 22.32000 0.5408000 23.08000 0.4205000 -0.7583000     0.6850000 
1 1 1 3  23 40 o 20.95000 0.4064000 21.49000 0.6812000 20.41000 0.4436000 1.079000       0.8129000 
1 1 1 3  23 42 f 7.105000 0.8123000 8.606000 1.113000  5.604000 1.183000  3.002000       1.625000  
1 1 1 3  23 44 o 19.93000 0.4350000 19.22000 0.5543000 20.65000 0.6706000 -1.432000      0.8700000 
1 1 1 3  23 46 o 3.617000 0.9832000 3.226000 1.368000  4.007000 1.412000  -0.7803000     1.966000  
1 1 1 3  23 48 o 14.88000 0.4623000 14.18000 0.8038000 15.59000 0.4569000 -1.402000      0.9246000 
1 1 1 3  23 50 o 25.79000 0.3255000 25.95000 0.5106000 25.62000 0.4039000 0.3254000      0.6510000 
1 1 1 3  23 52 o 15.65000 0.3971000 16.18000 0.6327000 15.13000 0.4799000 1.047000       0.7941000 
1 1 1 3  23 54 o 4.398000 1.017000  4.803000 1.537000  3.993000 1.334000  0.8101000      2.035000  
1 1 1 3  23 56 o 9.824000 0.6053000 10.03000 0.9281000 9.614000 0.7774000 0.4190000      1.211000  
1 1 1 3  23 58 o 10.18000 0.6236000 9.355000 1.032000  11.01000 0.6996000 -1.658000      1.247000  
1 1 1 3  23 60 o 7.074000 0.7300000 6.557000 1.093000  7.591000 0.9683000 -1.034000      1.460000  
1 1 1 3  23 62 o 4.620000 0.9412000 4.738000 1.323000  4.503000 1.339000  0.2351000      1.882000  
1 1 1 3  24 1  o 36.62000 0.3730000 36.45000 0.4698000 36.78000 0.5795000 -0.3332000     0.7460000 
1 1 1 3  24 3  o 72.55000 0.5087000 72.76000 0.7212000 72.33000 0.7175000 0.4306000      1.017000  
1 1 1 3  24 5  o 50.88000 0.3729000 51.24000 0.5311000 50.52000 0.5236000 0.7232000      0.7458000 
1 1 1 3  24 7  o 22.11000 0.2860000 21.44000 0.4114000 22.79000 0.3973000 -1.350000      0.5719000 
1 1 1 3  24 9  o 77.49000 0.5599000 77.28000 0.6850000 77.69000 0.8859000 -0.4137000     1.120000  
1 1 1 3  24 11 o 108.5000 0.8885000 106.4000 0.9281000 110.5000 1.515000  -4.080000      1.777000  
1 1 1 3  24 13 f 15.90000 0.2819000 16.28000 0.3636000 15.51000 0.4310000 0.7616000      0.5639000 
1 1 1 3  24 15 o 10.36000 0.3751000 10.08000 0.5095000 10.65000 0.5506000 -0.5667000     0.7502000 
1 1 1 3  24 17 o 19.34000 0.3463000 19.73000 0.5433000 18.95000 0.4295000 0.7748000      0.6926000 
1 1 1 3  24 19 o 8.351000 0.4867000 8.870000 0.5485000 7.833000 0.8041000 1.037000       0.9734000 
1 1 1 3  24 21 f 35.08000 0.3249000 34.73000 0.4837000 35.44000 0.4339000 -0.7060000     0.6498000 
1 1 1 3  24 23 o 24.85000 0.2959000 24.77000 0.4409000 24.93000 0.3947000 -0.1617000     0.5917000 
1 1 1 3  24 25 o 12.84000 0.3547000 12.74000 0.4907000 12.95000 0.5122000 -0.2124000     0.7093000 
1 1 1 3  24 27 o 29.18000 0.2919000 29.13000 0.4070000 29.24000 0.4185000 -0.1037000     0.5838000 
1 1 1 3  24 29 o 32.46000 0.3222000 32.58000 0.4259000 32.33000 0.4836000 0.2443000      0.6444000 
1 1 1 3  24 31 o 71.61000 0.5940000 71.58000 0.8319000 71.64000 0.8480000 -0.5471000E-01 1.188000  
1 1 1 3  24 33 o 61.35000 0.4885000 61.69000 0.6440000 61.01000 0.7348000 0.6830000      0.9770000 
1 1 1 3  24 35 o 16.50000 0.3966000 16.57000 0.6035000 16.44000 0.5147000 0.1316000      0.7932000 
1 1 1 3  24 37 o 33.07000 0.3194000 33.34000 0.4583000 32.79000 0.4450000 0.5521000      0.6388000 
1 1 1 3  24 39 o 17.27000 0.3797000 16.96000 0.5391000 17.59000 0.5348000 -0.6353000     0.7594000 
1 1 1 3  24 41 f 14.85000 0.3866000 15.48000 0.5519000 14.23000 0.5416000 1.248000       0.7733000 
1 1 1 3  24 43 o 28.57000 0.4143000 28.43000 0.5259000 28.72000 0.6402000 -0.2948000     0.8285000 
1 1 1 3  24 45 o 14.25000 0.4360000 14.26000 0.5652000 14.24000 0.6640000 0.1368000E-01  0.8720000 
1 1 1 3  24 47 o 3.993000 0.9327000 4.736000 1.353000  3.250000 1.284000  1.485000       1.865000  
1 1 1 3  24 49 o 4.287000 0.9652000 4.356000 1.313000  4.218000 1.415000  0.1382000      1.930000  
1 1 1 3  24 51 o 6.162000 0.8201000 7.125000 0.9407000 5.198000 1.344000  1.926000       1.640000  
1 1 1 3  24 53 o 8.418000 0.6489000 8.280000 0.9683000 8.557000 0.8642000 -0.2768000     1.298000  
1 1 1 3  24 55 f 6.700000 0.8075000 7.453000 0.9678000 5.946000 1.293000  1.507000       1.615000  
1 1 1 3  24 57 o 5.942000 0.9199000 6.091000 1.176000  5.792000 1.415000  0.2992000      1.840000  
1 1 1 3  24 59 o 4.672000 1.027000  4.712000 1.467000  4.631000 1.437000  0.8087000E-01  2.054000  
1 1 1 3  24 61 o 4.599000 1.001000  5.423000 1.376000  3.775000 1.455000  1.648000       2.003000  
1 1 1 3  24 63 o 6.140000 1.047000  5.354000 1.510000  6.927000 1.452000  -1.573000      2.095000  
1 1 1 3  25 0  o 93.28000 1.054000  93.28000 1.054000  93.28000 1.054000  0.000000       0.000000  
1 1 1 3  25 2  o 68.85000 0.6285000 69.63000 0.9819000 68.07000 0.7846000 1.555000       1.257000  
1 1 1 3  25 4  o 55.42000 0.4020000 55.05000 0.5643000 55.80000 0.5727000 -0.7461000     0.8040000 
1 1 1 3  25 6  o 53.46000 0.3900000 53.53000 0.5527000 53.38000 0.5502000 0.1528000      0.7799000 
1 1 1 3  25 8  f 53.00000 0.3887000 53.16000 0.5516000 52.84000 0.5477000 0.3174000      0.7774000 
1 1 1 3  25 10 o 25.74000 0.4039000 25.41000 0.3345000 26.07000 0.7353000 -0.6651000     0.8078000 
1 1 1 3  25 12 o 41.42000 0.3336000 41.80000 0.4169000 41.05000 0.5209000 0.7510000      0.6672000 
1 1 1 3  25 14 o 21.62000 0.2713000 21.47000 0.3486000 21.76000 0.4157000 -0.2928000     0.5425000 
1 1 1 3  25 16 f 34.18000 0.3417000 34.68000 0.4956000 33.69000 0.4706000 0.9867000      0.6834000 
1 1 1 3  25 18 o 65.04000 0.5039000 64.65000 0.6570000 65.42000 0.7641000 -0.7707000     1.008000  
1 1 1 3  25 20 o 47.52000 0.3918000 47.22000 0.5871000 47.82000 0.5189000 -0.6081000     0.7836000 
1 1 1 3  25 22 o 46.59000 0.3904000 46.28000 0.5856000 46.90000 0.5164000 -0.6274000     0.7808000 
1 1 1 3  25 24 o 21.31000 0.2767000 20.93000 0.3839000 21.69000 0.3985000 -0.7617000     0.5534000 
1 1 1 3  25 26 o 16.84000 0.3489000 17.10000 0.4250000 16.58000 0.5535000 0.5154000      0.6979000 
1 1 1 3  25 28 o 41.75000 0.4118000 41.87000 0.4779000 41.64000 0.6708000 0.2242000      0.8237000 
1 1 1 3  25 30 o 41.85000 0.3983000 42.02000 0.5515000 41.68000 0.5748000 0.3354000      0.7966000 
1 1 1 3  25 32 o 9.513000 0.5865000 9.337000 0.8023000 9.688000 0.8556000 -0.3505000     1.173000  
1 1 1 3  25 34 o 13.58000 0.3942000 13.14000 0.5612000 14.02000 0.5538000 -0.8804000     0.7884000 
1 1 1 3  25 36 o 22.84000 0.3233000 23.03000 0.4636000 22.65000 0.4508000 0.3797000      0.6466000 
1 1 1 3  25 38 o 15.66000 0.3962000 15.08000 0.5717000 16.25000 0.5486000 -1.170000      0.7923000 
1 1 1 3  25 40 f 13.92000 0.4410000 14.14000 0.6598000 13.69000 0.5854000 0.4525000      0.8820000 
1 1 1 3  25 42 o 25.45000 0.3517000 25.88000 0.4655000 25.02000 0.5273000 0.8595000      0.7033000 
1 1 1 3  25 44 o 26.33000 0.3204000 26.35000 0.4572000 26.30000 0.4491000 0.5448000E-01  0.6409000 
1 1 1 3  25 46 o 14.74000 0.4293000 14.72000 0.6606000 14.76000 0.5484000 -0.4125000E-01 0.8586000 
1 1 1 3  25 48 o 3.309000 0.9661000 3.355000 1.396000  3.263000 1.336000  0.9221000E-01  1.932000  
1 1 1 3  25 50 o 3.325000 0.9077000 4.056000 1.371000  2.594000 1.190000  1.463000       1.815000  
1 1 1 3  25 52 o 3.750000 0.9684000 3.624000 1.387000  3.876000 1.351000  -0.2521000     1.937000  
1 1 1 3  25 54 o 3.411000 0.9965000 3.339000 1.419000  3.482000 1.399000  -0.1430000     1.993000  
1 1 1 3  25 56 o 5.969000 1.110000  6.172000 1.686000  5.767000 1.444000  0.4050000      2.220000  
1 1 1 3  25 58 o 3.848000 0.9973000 4.084000 1.431000  3.612000 1.390000  0.4713000      1.995000  
1 1 1 3  25 60 o 3.943000 1.012000  3.448000 1.415000  4.439000 1.446000  -0.9913000     2.023000  
1 1 1 3  25 62 o 3.840000 0.9853000 3.357000 1.395000  4.324000 1.392000  -0.9671000     1.971000  
1 1 1 3  26 1  o 35.46000 0.3151000 35.43000 0.4768000 35.48000 0.4120000 -0.4854000E-01 0.6301000 
1 1 1 3  26 3  o 22.36000 0.3367000 22.18000 0.5197000 22.54000 0.4282000 -0.3607000     0.6733000 
1 1 1 3  26 5  o 126.2000 0.9330000 126.3000 1.411000  126.0000 1.221000  0.2775000      1.866000  
1 1 1 3  26 7  f 103.5000 0.7141000 104.1000 1.017000  102.8000 1.003000  1.342000       1.428000  
1 1 1 3  26 9  o 80.34000 0.6068000 80.81000 0.8017000 79.88000 0.9111000 0.9330000      1.214000  
1 1 1 3  26 11 f 37.66000 0.3152000 37.09000 0.3869000 38.22000 0.4977000 -1.127000      0.6304000 
1 1 1 3  26 13 o 54.22000 0.4321000 54.65000 0.5764000 53.78000 0.6438000 0.8727000      0.8642000 
1 1 1 3  26 15 o 74.13000 0.6058000 73.57000 0.8547000 74.68000 0.8587000 -1.106000      1.212000  
1 1 1 3  26 17 o 52.19000 0.4001000 52.68000 0.4987000 51.70000 0.6257000 0.9804000      0.8002000 
1 1 1 3  26 19 o 47.90000 0.3936000 48.25000 0.5220000 47.56000 0.5892000 0.6877000      0.7872000 
1 1 1 3  26 21 o 6.408000 0.7052000 7.029000 1.013000  5.786000 0.9813000 1.243000       1.410000  
1 1 1 3  26 23 o 49.69000 0.4069000 49.56000 0.6094000 49.82000 0.5392000 -0.2586000     0.8137000 
1 1 1 3  26 25 o 21.65000 0.2888000 21.79000 0.3959000 21.50000 0.4205000 0.2832000      0.5776000 
1 1 1 3  26 27 o 31.47000 0.3274000 32.31000 0.4219000 30.64000 0.5009000 1.669000       0.6549000 
1 1 1 3  26 29 o 48.07000 0.4007000 47.31000 0.5923000 48.83000 0.5397000 -1.518000      0.8014000 
1 1 1 3  26 31 o 46.95000 0.4577000 47.18000 0.5258000 46.72000 0.7494000 0.4566000      0.9155000 
1 1 1 3  26 33 o 30.78000 0.3375000 30.81000 0.5112000 30.75000 0.4407000 0.6544000E-01  0.6749000 
1 1 1 3  26 35 o 4.175000 1.052000  4.028000 1.539000  4.322000 1.436000  -0.2939000     2.104000  
1 1 1 3  26 37 o 19.64000 0.3471000 20.03000 0.4863000 19.26000 0.4953000 0.7700000      0.6942000 
1 1 1 3  26 39 o 21.78000 0.3547000 21.78000 0.5390000 21.78000 0.4613000 -0.1192000E-02 0.7095000 
1 1 1 3  26 41 o 28.07000 0.3231000 28.21000 0.4588000 27.93000 0.4550000 0.2834000      0.6461000 
1 1 1 3  26 43 o 36.32000 0.3663000 36.55000 0.4851000 36.09000 0.5490000 0.4603000      0.7326000 
1 1 1 3  26 45 o 16.82000 0.4221000 17.52000 0.6059000 16.12000 0.5878000 1.401000       0.8442000 
1 1 1 3  26 47 o 6.516000 0.8042000 5.835000 1.187000  7.198000 1.086000  -1.363000      1.608000  
1 1 1 3  26 49 o 6.759000 0.7355000 6.446000 1.107000  7.073000 0.9693000 -0.6262000     1.471000  
1 1 1 3  26 51 o 11.43000 0.4657000 11.23000 0.6719000 11.63000 0.6451000 -0.3984000     0.9314000 
1 1 1 3  26 53 o 10.50000 0.6525000 10.36000 1.037000  10.64000 0.7925000 -0.2869000     1.305000  
1 1 1 3  26 55 o 10.96000 0.9128000 11.07000 1.129000  10.85000 1.434000  0.2155000      1.826000  
1 1 1 3  26 57 o 9.218000 0.7077000 9.131000 0.9444000 9.306000 1.054000  -0.1753000     1.415000  
1 1 1 3  26 59 o 3.541000 0.9778000 4.128000 1.458000  2.955000 1.303000  1.173000       1.956000  
1 1 1 3  26 61 o 2.846000 0.8770000 3.299000 1.351000  2.393000 1.118000  0.9062000      1.754000  
1 1 1 3  27 0  o 54.13000 0.5587000 54.13000 0.5587000 54.13000 0.5587000 0.000000       0.000000  
1 1 1 3  27 2  o 104.1000 0.7172000 104.0000 1.014000  104.1000 1.015000  -0.2478000E-01 1.434000  
1 1 1 3  27 4  o 58.61000 0.4577000 58.36000 0.6901000 58.85000 0.6014000 -0.4889000     0.9154000 
1 1 1 3  27 6  o 14.93000 0.3885000 14.76000 0.5029000 15.10000 0.5923000 -0.3391000     0.7770000 
1 1 1 3  27 8  o 80.06000 0.7220000 79.29000 1.112000  80.84000 0.9210000 -1.545000      1.444000  
1 1 1 3  27 10 o 70.26000 0.5389000 70.28000 0.7090000 70.24000 0.8117000 0.4126000E-01  1.078000  
1 1 1 3  27 12 o 69.89000 0.5361000 70.43000 0.7115000 69.35000 0.8022000 1.083000       1.072000  
1 1 1 3  27 14 o 53.85000 0.5127000 53.45000 0.7933000 54.24000 0.6498000 -0.7946000     1.025000  
1 1 1 3  27 16 o 76.55000 0.5575000 76.54000 0.6849000 76.56000 0.8797000 -0.2337000E-01 1.115000  
1 1 1 3  27 18 o 23.29000 0.2855000 23.56000 0.3832000 23.01000 0.4234000 0.5484000      0.5710000 
1 1 1 3  27 20 o 24.75000 0.3129000 24.73000 0.4517000 24.77000 0.4330000 -0.4334000E-01 0.6257000 
1 1 1 3  27 22 o 23.81000 0.2764000 23.83000 0.3887000 23.78000 0.3929000 0.5036000E-01  0.5527000 
1 1 1 3  27 24 o 32.93000 0.3196000 32.86000 0.4743000 32.99000 0.4285000 -0.1295000     0.6392000 
1 1 1 3  27 26 o 30.97000 0.3425000 30.66000 0.4718000 31.27000 0.4965000 -0.6130000     0.6849000 
1 1 1 3  27 28 o 11.83000 0.4067000 12.02000 0.5707000 11.63000 0.5795000 0.3891000      0.8134000 
1 1 1 3  27 30 o 25.53000 0.3276000 25.71000 0.4183000 25.35000 0.5043000 0.3586000      0.6552000 
1 1 1 3  27 32 o 32.86000 0.3400000 33.08000 0.5115000 32.64000 0.4481000 0.4350000      0.6800000 
1 1 1 3  27 34 o 37.36000 0.3632000 37.54000 0.5504000 37.18000 0.4740000 0.3616000      0.7264000 
1 1 1 3  27 36 o 42.09000 0.3549000 41.95000 0.5025000 42.23000 0.5014000 -0.2840000     0.7098000 
1 1 1 3  27 38 o 25.35000 0.3204000 25.45000 0.4572000 25.25000 0.4489000 0.2006000      0.6407000 
1 1 1 3  27 40 o 13.06000 0.4438000 13.74000 0.6161000 12.37000 0.6390000 1.372000       0.8877000 
1 1 1 3  27 42 o 24.63000 0.3464000 24.66000 0.5245000 24.61000 0.4526000 0.5067000E-01  0.6927000 
1 1 1 3  27 44 o 26.68000 0.3736000 26.45000 0.5237000 26.90000 0.5330000 -0.4449000     0.7472000 
1 1 1 3  27 46 o 8.314000 0.6249000 8.492000 0.8640000 8.137000 0.9031000 0.3554000      1.250000  
1 1 1 3  27 48 o 17.35000 0.3791000 17.15000 0.5660000 17.54000 0.5043000 -0.3915000     0.7581000 
1 1 1 3  27 50 o 4.840000 0.9250000 4.474000 1.329000  5.207000 1.287000  -0.7325000     1.850000  
1 1 1 3  27 52 o 3.366000 0.9426000 3.218000 1.319000  3.515000 1.347000  -0.2966000     1.885000  
1 1 1 3  27 54 o 3.349000 0.9761000 2.695000 1.218000  4.003000 1.526000  -1.308000      1.952000  
1 1 1 3  27 56 o 8.117000 0.7466000 8.720000 0.9442000 7.514000 1.157000  1.206000       1.493000  
1 1 1 3  27 58 o 13.13000 0.4880000 12.17000 0.7240000 14.09000 0.6545000 -1.922000      0.9759000 
1 1 1 3  27 60 o 3.582000 1.018000  3.607000 1.490000  3.557000 1.388000  0.4929000E-01  2.036000  
1 1 1 3  28 1  o 26.61000 0.2622000 26.60000 0.3724000 26.61000 0.3691000 -0.1745000E-02 0.5243000 
1 1 1 3  28 3  o 59.64000 0.4303000 58.98000 0.6023000 60.29000 0.6148000 -1.308000      0.8606000 
1 1 1 3  28 5  o 15.85000 0.2975000 15.81000 0.3954000 15.89000 0.4447000 -0.7265000E-01 0.5951000 
1 1 1 3  28 7  o 33.61000 0.3338000 33.80000 0.4812000 33.42000 0.4627000 0.3843000      0.6675000 
1 1 1 3  28 9  o 33.38000 0.3344000 33.38000 0.4772000 33.39000 0.4686000 -0.1504000E-01 0.6688000 
1 1 1 3  28 11 o 25.15000 0.3446000 25.11000 0.3964000 25.18000 0.5638000 -0.6260000E-01 0.6892000 
1 1 1 3  28 13 o 5.383000 0.7515000 4.836000 1.148000  5.930000 0.9707000 -1.094000      1.503000  
1 1 1 3  28 15 o 52.35000 0.4025000 52.36000 0.4960000 52.34000 0.6341000 0.1981000E-01  0.8050000 
1 1 1 3  28 17 o 51.84000 0.4186000 51.79000 0.5509000 51.88000 0.6304000 -0.9068000E-01 0.8372000 
1 1 1 3  28 19 o 29.79000 0.3037000 30.18000 0.4100000 29.40000 0.4481000 0.7823000      0.6074000 
1 1 1 3  28 21 o 44.28000 0.3484000 44.54000 0.4935000 44.02000 0.4921000 0.5264000      0.6969000 
1 1 1 3  28 23 o 26.66000 0.2803000 26.76000 0.3940000 26.56000 0.3988000 0.2055000      0.5606000 
1 1 1 3  28 25 o 23.10000 0.3097000 23.29000 0.3960000 22.90000 0.4763000 0.3943000      0.6194000 
1 1 1 3  28 27 o 16.36000 0.3479000 15.94000 0.4948000 16.77000 0.4893000 -0.8268000     0.6958000 
1 1 1 3  28 29 f 33.44000 0.3635000 33.19000 0.5076000 33.68000 0.5204000 -0.4874000     0.7270000 
1 1 1 3  28 31 o 27.98000 0.3311000 27.85000 0.4908000 28.12000 0.4445000 -0.2765000     0.6622000 
1 1 1 3  28 33 o 21.35000 0.3241000 21.44000 0.4584000 21.26000 0.4583000 0.1803000      0.6483000 
1 1 1 3  28 35 f 23.11000 0.3514000 23.73000 0.5361000 22.49000 0.4545000 1.245000       0.7028000 
1 1 1 3  28 37 o 22.77000 0.3321000 23.34000 0.4719000 22.20000 0.4673000 1.131000       0.6641000 
1 1 1 3  28 39 f 21.47000 0.3564000 21.07000 0.5393000 21.88000 0.4660000 -0.8066000     0.7128000 
1 1 1 3  28 41 o 19.59000 0.3688000 19.72000 0.5540000 19.47000 0.4870000 0.2497000      0.7376000 
1 1 1 3  28 43 o 6.724000 0.9829000 5.832000 1.261000  7.615000 1.508000  -1.783000      1.966000  
1 1 1 3  28 45 o 2.868000 0.8791000 2.994000 1.272000  2.742000 1.214000  0.2523000      1.758000  
1 1 1 3  28 47 o 5.909000 0.7868000 5.432000 1.213000  6.386000 1.002000  -0.9544000     1.574000  
1 1 1 3  28 49 o 3.103000 0.9040000 2.664000 1.178000  3.542000 1.371000  -0.8782000     1.808000  
1 1 1 3  28 51 o 13.07000 0.4527000 13.43000 0.6639000 12.72000 0.6156000 0.7102000      0.9053000 
1 1 1 3  28 53 o 9.284000 0.5710000 9.129000 0.7845000 9.439000 0.8298000 -0.3106000     1.142000  
1 1 1 3  28 55 o 10.13000 0.5885000 10.14000 0.7685000 10.13000 0.8914000 0.1213000E-01  1.177000  
1 1 1 3  28 57 o 4.862000 0.9589000 6.011000 1.234000  3.713000 1.468000  2.298000       1.918000  
1 1 1 3  28 59 o 4.404000 1.015000  4.859000 1.422000  3.950000 1.448000  0.9098000      2.030000  
1 1 1 3  28 61 o 5.106000 1.197000  6.171000 1.865000  4.041000 1.501000  2.130000       2.394000  
1 1 1 3  29 0  o 47.05000 0.5032000 47.05000 0.5032000 47.05000 0.5032000 0.000000       0.000000  
1 1 1 3  29 2  o 67.28000 0.4792000 67.81000 0.6826000 66.74000 0.6726000 1.075000       0.9583000 
1 1 1 3  29 4  o 108.6000 0.8084000 108.4000 1.057000  108.7000 1.223000  -0.3524000     1.617000  
1 1 1 3  29 6  o 29.22000 0.3138000 28.87000 0.4401000 29.57000 0.4475000 -0.6937000     0.6277000 
1 1 1 3  29 8  o 64.89000 0.4654000 64.90000 0.6596000 64.89000 0.6566000 0.1162000E-01  0.9307000 
1 1 1 3  29 10 o 23.99000 0.3044000 24.16000 0.4323000 23.83000 0.4285000 0.3306000      0.6087000 
1 1 1 3  29 12 o 11.81000 0.4333000 11.97000 0.5689000 11.65000 0.6537000 0.3222000      0.8666000 
1 1 1 3  29 14 o 43.84000 0.3684000 43.37000 0.4809000 44.31000 0.5582000 -0.9391000     0.7368000 
1 1 1 3  29 16 o 25.83000 0.2930000 25.83000 0.3899000 25.82000 0.4375000 0.1598000E-01  0.5860000 
1 1 1 3  29 18 o 42.59000 0.3648000 42.79000 0.4854000 42.39000 0.5448000 0.3935000      0.7296000 
1 1 1 3  29 20 o 23.61000 0.2772000 23.65000 0.3441000 23.57000 0.4347000 0.8393000E-01  0.5544000 
1 1 1 3  29 22 o 25.34000 0.2775000 25.31000 0.3875000 25.36000 0.3972000 -0.5340000E-01 0.5549000 
1 1 1 3  29 24 o 23.89000 0.3125000 24.04000 0.3948000 23.74000 0.4846000 0.2998000      0.6251000 
1 1 1 3  29 26 o 9.340000 0.4753000 9.681000 0.6397000 8.999000 0.7032000 0.6820000      0.9506000 
1 1 1 3  29 28 o 58.30000 0.4691000 57.97000 0.7016000 58.64000 0.6230000 -0.6699000     0.9383000 
1 1 1 3  29 30 o 29.98000 0.3554000 30.03000 0.4835000 29.92000 0.5211000 0.1173000      0.7109000 
1 1 1 3  29 32 o 33.41000 0.3436000 33.84000 0.5246000 32.97000 0.4439000 0.8618000      0.6872000 
1 1 1 3  29 34 f 23.18000 0.3594000 23.20000 0.5390000 23.16000 0.4755000 0.3103000E-01  0.7187000 
1 1 1 3  29 36 o 17.38000 0.3777000 17.75000 0.5239000 17.00000 0.5442000 0.7535000      0.7554000 
1 1 1 3  29 38 o 20.42000 0.3627000 21.13000 0.5434000 19.72000 0.4805000 1.407000       0.7254000 
1 1 1 3  29 40 f 11.32000 0.5289000 10.78000 0.7485000 11.87000 0.7476000 -1.081000      1.058000  
1 1 1 3  29 42 o 26.65000 0.3903000 26.53000 0.4457000 26.77000 0.6409000 -0.2396000     0.7807000 
1 1 1 3  29 44 o 20.98000 0.3307000 21.01000 0.4678000 20.96000 0.4675000 0.5670000E-01  0.6613000 
1 1 1 3  29 46 o 5.730000 0.8290000 6.380000 1.068000  5.079000 1.268000  1.301000       1.658000  
1 1 1 3  29 48 o 7.492000 0.7174000 6.957000 1.133000  8.028000 0.8797000 -1.071000      1.435000  
1 1 1 3  29 50 o 10.64000 0.5338000 10.50000 0.7632000 10.78000 0.7466000 -0.2801000     1.068000  
1 1 1 3  29 52 f 11.06000 0.5685000 12.00000 0.8601000 10.11000 0.7437000 1.888000       1.137000  
1 1 1 3  29 54 o 4.545000 1.036000  4.115000 1.561000  4.975000 1.361000  -0.8595000     2.071000  
1 1 1 3  29 56 o 10.57000 0.5580000 10.59000 0.7939000 10.55000 0.7845000 0.4072000E-01  1.116000  
1 1 1 3  29 58 o 2.939000 0.9094000 3.226000 1.348000  2.652000 1.221000  0.5735000      1.819000  
1 1 1 3  29 60 o 4.455000 0.9805000 3.590000 1.413000  5.320000 1.360000  -1.730000      1.961000  
1 1 1 3  30 1  o 30.94000 0.3042000 30.55000 0.3970000 31.33000 0.4610000 -0.7796000     0.6083000 
1 1 1 3  30 3  o 26.84000 0.2912000 26.69000 0.3853000 27.00000 0.4367000 -0.3138000     0.5824000 
1 1 1 3  30 5  o 51.84000 0.3856000 52.03000 0.5486000 51.65000 0.5420000 0.3816000      0.7712000 
1 1 1 3  30 7  o 17.13000 0.2826000 16.53000 0.4088000 17.73000 0.3903000 -1.202000      0.5652000 
1 1 1 3  30 9  o 22.72000 0.2808000 22.43000 0.4207000 23.00000 0.3721000 -0.5720000     0.5617000 
1 1 1 3  30 11 o 21.96000 0.2907000 22.15000 0.3956000 21.78000 0.4261000 0.3761000      0.5814000 
1 1 1 3  30 13 o 32.43000 0.2965000 32.97000 0.3752000 31.89000 0.4592000 1.081000       0.5930000 
1 1 1 3  30 15 o 97.68000 0.9567000 96.85000 1.344000  98.51000 1.361000  -1.659000      1.913000  
1 1 1 3  30 17 o 39.45000 0.3512000 38.98000 0.4672000 39.92000 0.5245000 -0.9430000     0.7024000 
1 1 1 3  30 19 o 14.20000 0.3252000 14.30000 0.4246000 14.10000 0.4927000 0.1971000      0.6504000 
1 1 1 3  30 21 o 50.26000 0.3831000 50.45000 0.5408000 50.08000 0.5429000 0.3677000      0.7663000 
1 1 1 3  30 23 o 20.44000 0.2867000 20.63000 0.4001000 20.25000 0.4107000 0.3856000      0.5734000 
1 1 1 3  30 25 o 29.19000 0.3573000 29.60000 0.4093000 28.77000 0.5859000 0.8365000      0.7147000 
1 1 1 3  30 27 o 28.34000 0.3220000 27.97000 0.4727000 28.71000 0.4372000 -0.7368000     0.6439000 
1 1 1 3  30 29 o 20.20000 0.3853000 20.83000 0.5312000 19.57000 0.5582000 1.263000       0.7706000 
1 1 1 3  30 31 o 31.54000 0.3158000 31.78000 0.4474000 31.31000 0.4459000 0.4676000      0.6317000 
1 1 1 3  30 33 o 7.054000 0.8041000 6.876000 1.209000  7.232000 1.060000  -0.3565000     1.608000  
1 1 1 3  30 35 f 14.32000 0.4403000 15.03000 0.6580000 13.60000 0.5851000 1.433000       0.8805000 
1 1 1 3  30 37 o 23.36000 0.3258000 23.30000 0.4667000 23.43000 0.4548000 -0.1327000     0.6516000 
1 1 1 3  30 39 o 23.55000 0.3673000 23.73000 0.5341000 23.36000 0.5045000 0.3665000      0.7347000 
1 1 1 3  30 41 o 50.88000 0.4018000 51.12000 0.5700000 50.64000 0.5664000 0.4744000      0.8035000 
1 1 1 3  30 43 o 7.201000 0.7077000 7.265000 1.086000  7.136000 0.9082000 0.1290000      1.415000  
1 1 1 3  30 45 o 18.01000 0.3776000 17.95000 0.4942000 18.08000 0.5709000 -0.1281000     0.7551000 
1 1 1 3  30 47 o 5.111000 0.9167000 5.326000 1.294000  4.896000 1.299000  0.4292000      1.833000  
1 1 1 3  30 49 o 4.304000 0.9570000 3.859000 1.373000  4.749000 1.333000  -0.8899000     1.914000  
1 1 1 3  30 51 o 6.669000 0.9136000 5.770000 1.353000  7.569000 1.228000  -1.799000      1.827000  
1 1 1 3  30 53 o 5.892000 1.055000  5.491000 1.545000  6.292000 1.436000  -0.8008000     2.109000  
1 1 1 3  30 55 o 5.476000 1.020000  5.637000 1.304000  5.314000 1.568000  0.3235000      2.039000  
1 1 1 3  30 57 o 8.651000 0.7096000 8.552000 0.8874000 8.750000 1.108000  -0.1980000     1.419000  
1 1 1 3  30 59 o 8.551000 0.6404000 8.426000 0.9108000 8.676000 0.9006000 -0.2501000     1.281000  
1 1 1 3  31 0  o 13.36000 0.5137000 13.36000 0.5137000 13.36000 0.5137000 0.000000       0.000000  
1 1 1 3  31 2  o 10.67000 0.3948000 10.48000 0.5942000 10.87000 0.5200000 -0.3859000     0.7896000 
1 1 1 3  31 4  o 15.31000 0.3247000 15.37000 0.4851000 15.26000 0.4317000 0.1103000      0.6494000 
1 1 1 3  31 6  o 36.12000 0.3015000 35.87000 0.4239000 36.38000 0.4288000 -0.5117000     0.6029000 
1 1 1 3  31 8  o 15.80000 0.3085000 15.47000 0.4666000 16.14000 0.4037000 -0.6640000     0.6170000 
1 1 1 3  31 10 o 50.52000 0.4097000 50.53000 0.6207000 50.52000 0.5348000 0.6958000E-02  0.8194000 
1 1 1 3  31 12 o 28.56000 0.2983000 28.86000 0.3994000 28.27000 0.4432000 0.5890000      0.5966000 
1 1 1 3  31 14 o 39.51000 0.3744000 38.90000 0.5315000 40.13000 0.5274000 -1.232000      0.7488000 
1 1 1 3  31 16 o 19.12000 0.3021000 19.28000 0.4181000 18.96000 0.4361000 0.3137000      0.6041000 
1 1 1 3  31 18 o 10.99000 0.4333000 11.57000 0.5232000 10.41000 0.6908000 1.159000       0.8665000 
1 1 1 3  31 20 o 45.98000 0.3692000 46.40000 0.4604000 45.55000 0.5772000 0.8509000      0.7384000 
1 1 1 3  31 22 o 46.82000 0.3663000 46.98000 0.5153000 46.66000 0.5209000 0.3216000      0.7327000 
1 1 1 3  31 24 o 28.65000 0.3549000 28.59000 0.4090000 28.72000 0.5801000 -0.1361000     0.7098000 
1 1 1 3  31 26 o 55.46000 0.4494000 55.58000 0.6740000 55.34000 0.5947000 0.2409000      0.8989000 
1 1 1 3  31 28 o 3.301000 0.9064000 3.699000 1.329000  2.903000 1.233000  0.7956000      1.813000  
1 1 1 3  31 30 o 25.31000 0.3370000 25.37000 0.5021000 25.26000 0.4496000 0.1049000      0.6740000 
1 1 1 3  31 32 o 25.65000 0.3213000 26.07000 0.4527000 25.24000 0.4560000 0.8241000      0.6425000 
1 1 1 3  31 34 o 2.847000 0.8963000 3.432000 1.430000  2.261000 1.081000  1.171000       1.793000  
1 1 1 3  31 36 o 29.21000 0.3474000 29.70000 0.5203000 28.72000 0.4603000 0.9733000      0.6947000 
1 1 1 3  31 38 o 4.421000 1.068000  4.375000 1.518000  4.467000 1.504000  -0.9273000E-01 2.136000  
1 1 1 3  31 40 o 26.84000 0.3150000 26.38000 0.4472000 27.30000 0.4437000 -0.9207000     0.6300000 
1 1 1 3  31 42 o 3.597000 0.9674000 3.264000 1.356000  3.930000 1.380000  -0.6661000     1.935000  
1 1 1 3  31 44 o 5.085000 0.9242000 4.823000 1.301000  5.348000 1.313000  -0.5253000     1.848000  
1 1 1 3  31 46 o 7.708000 0.6633000 8.008000 0.9692000 7.409000 0.9057000 0.5986000      1.327000  
1 1 1 3  31 48 o 3.675000 0.9706000 3.795000 1.463000  3.556000 1.276000  0.2392000      1.941000  
1 1 1 3  31 50 o 9.283000 0.6299000 9.265000 0.8221000 9.301000 0.9545000 -0.3609000E-01 1.260000  
1 1 1 3  31 52 o 3.409000 1.010000  3.120000 1.341000  3.699000 1.511000  -0.5790000     2.020000  
1 1 1 3  31 54 o 10.76000 0.5190000 10.71000 0.7431000 10.82000 0.7248000 -0.1071000     1.038000  
1 1 1 3  31 56 o 7.735000 0.6785000 7.842000 1.038000  7.629000 0.8743000 0.2134000      1.357000  
1 1 1 3  31 58 o 2.933000 0.8855000 2.925000 1.248000  2.941000 1.256000  -0.1667000E-01 1.771000  
1 1 1 3  32 1  o 24.31000 0.2723000 24.01000 0.3852000 24.61000 0.3850000 -0.6069000     0.5446000 
1 1 1 3  32 3  o 31.27000 0.3072000 31.25000 0.4664000 31.29000 0.3999000 -0.3855000E-01 0.6144000 
1 1 1 3  32 5  o 21.41000 0.3209000 21.52000 0.5230000 21.30000 0.3718000 0.2221000      0.6417000 
1 1 1 3  32 7  o 20.05000 0.3237000 20.34000 0.5250000 19.77000 0.3789000 0.5711000      0.6475000 
1 1 1 3  32 9  o 54.77000 0.4987000 54.59000 0.8157000 54.94000 0.5739000 -0.3538000     0.9974000 
1 1 1 3  32 11 o 7.682000 0.5500000 7.567000 0.7372000 7.797000 0.8165000 -0.2299000     1.100000  
1 1 1 3  32 13 o 24.71000 0.3146000 24.50000 0.4480000 24.92000 0.4419000 -0.4208000     0.6292000 
1 1 1 3  32 15 f 10.47000 0.3932000 10.35000 0.5238000 10.58000 0.5866000 -0.2343000     0.7864000 
1 1 1 3  32 17 o 15.02000 0.3148000 15.41000 0.3935000 14.63000 0.4914000 0.7823000      0.6295000 
1 1 1 3  32 19 o 12.80000 0.3603000 13.01000 0.4526000 12.60000 0.5606000 0.4145000      0.7205000 
1 1 1 3  32 21 o 7.236000 0.8166000 7.482000 0.7772000 6.990000 1.436000  0.4920000      1.633000  
1 1 1 3  32 23 o 32.49000 0.3693000 32.60000 0.4309000 32.37000 0.5998000 0.2356000      0.7386000 
1 1 1 3  32 25 o 22.60000 0.3150000 22.39000 0.4546000 22.80000 0.4363000 -0.4089000     0.6301000 
1 1 1 3  32 27 o 13.49000 0.4184000 13.94000 0.5297000 13.04000 0.6477000 0.8935000      0.8368000 
1 1 1 3  32 29 o 19.21000 0.3795000 19.25000 0.5078000 19.18000 0.5639000 0.7500000E-01  0.7589000 
1 1 1 3  32 31 o 11.63000 0.4612000 11.25000 0.6548000 12.02000 0.6497000 -0.7683000     0.9225000 
1 1 1 3  32 33 o 21.80000 0.3597000 22.53000 0.5476000 21.07000 0.4664000 1.465000       0.7193000 
1 1 1 3  32 35 o 34.43000 0.3359000 34.70000 0.4809000 34.16000 0.4691000 0.5375000      0.6718000 
1 1 1 3  32 37 o 8.471000 0.7048000 9.054000 0.9720000 7.887000 1.021000  1.166000       1.410000  
1 1 1 3  32 39 o 27.06000 0.3415000 27.25000 0.5241000 26.87000 0.4378000 0.3790000      0.6829000 
1 1 1 3  32 41 o 33.18000 0.4175000 34.03000 0.6453000 32.32000 0.5298000 1.712000       0.8349000 
1 1 1 3  32 43 o 9.336000 0.5433000 9.050000 0.7528000 9.622000 0.7836000 -0.5715000     1.087000  
1 1 1 3  32 45 o 21.81000 0.3787000 21.93000 0.5488000 21.70000 0.5219000 0.2248000      0.7574000 
1 1 1 3  32 47 o 11.60000 0.4653000 11.49000 0.7172000 11.71000 0.5929000 -0.2172000     0.9305000 
1 1 1 3  32 49 o 10.55000 0.5354000 10.53000 0.7124000 10.57000 0.7994000 -0.3502000E-01 1.071000  
1 1 1 3  32 51 o 6.685000 0.7493000 6.631000 1.035000  6.739000 1.084000  -0.1078000     1.499000  
1 1 1 3  32 53 o 3.130000 0.9106000 3.029000 1.283000  3.230000 1.292000  -0.2007000     1.821000  
1 1 1 3  32 55 o 4.303000 0.9902000 4.947000 1.491000  3.660000 1.303000  1.287000       1.980000  
1 1 1 3  32 57 f 4.035000 1.046000  4.126000 1.439000  3.945000 1.519000  0.1814000      2.092000  
1 1 1 3  33 0  o 70.55000 0.7122000 70.55000 0.7122000 70.55000 0.7122000 0.000000       0.000000  
1 1 1 3  33 2  o 29.18000 0.3018000 28.71000 0.4560000 29.65000 0.3955000 -0.9358000     0.6036000 
1 1 1 3  33 4  o 33.68000 0.3152000 33.10000 0.4698000 34.26000 0.4204000 -1.156000      0.6304000 
1 1 1 3  33 6  o 47.85000 0.3655000 47.58000 0.5155000 48.13000 0.5182000 -0.5491000     0.7309000 
1 1 1 3  33 8  o 20.23000 0.3071000 19.93000 0.4701000 20.52000 0.3952000 -0.5940000     0.6141000 
1 1 1 3  33 10 o 24.43000 0.2697000 24.32000 0.3812000 24.53000 0.3816000 -0.2112000     0.5393000 
1 1 1 3  33 12 o 41.03000 0.3537000 41.26000 0.4686000 40.79000 0.5300000 0.4691000      0.7075000 
1 1 1 3  33 14 o 39.57000 0.3332000 39.34000 0.4136000 39.79000 0.5224000 -0.4502000     0.6663000 
1 1 1 3  33 16 o 21.06000 0.2834000 21.54000 0.3542000 20.58000 0.4425000 0.9552000      0.5668000 
1 1 1 3  33 18 o 18.34000 0.3050000 18.64000 0.3806000 18.04000 0.4768000 0.5971000      0.6101000 
1 1 1 3  33 20 o 40.70000 0.3932000 40.92000 0.4296000 40.47000 0.6587000 0.4538000      0.7864000 
1 1 1 3  33 22 o 29.22000 0.3618000 29.26000 0.4181000 29.17000 0.5905000 0.9315000E-01  0.7235000 
1 1 1 3  33 24 o 31.69000 0.3804000 31.64000 0.4852000 31.73000 0.5860000 -0.9074000E-01 0.7607000 
1 1 1 3  33 26 o 14.22000 0.3980000 14.11000 0.5059000 14.33000 0.6147000 -0.2138000     0.7961000 
1 1 1 3  33 28 o 22.57000 0.3660000 22.61000 0.4866000 22.53000 0.5468000 0.7302000E-01  0.7320000 
1 1 1 3  33 30 o 16.87000 0.3602000 17.05000 0.4924000 16.69000 0.5259000 0.3556000      0.7204000 
1 1 1 3  33 32 o 14.13000 0.4054000 14.67000 0.5558000 13.60000 0.5903000 1.072000       0.8107000 
1 1 1 3  33 34 o 24.69000 0.3234000 24.97000 0.4563000 24.41000 0.4584000 0.5697000      0.6468000 
1 1 1 3  33 36 o 17.20000 0.3602000 17.33000 0.5200000 17.07000 0.4986000 0.2603000      0.7204000 
1 1 1 3  33 38 o 7.401000 0.7511000 7.499000 1.143000  7.304000 0.9752000 0.1943000      1.502000  
1 1 1 3  33 40 o 4.566000 1.027000  4.691000 1.402000  4.440000 1.500000  0.2510000      2.053000  
1 1 1 3  33 42 o 11.75000 0.4492000 11.97000 0.6047000 11.53000 0.6644000 0.4400000      0.8984000 
1 1 1 3  33 44 o 5.977000 0.9949000 7.312000 1.459000  4.642000 1.353000  2.670000       1.990000  
1 1 1 3  33 46 o 7.991000 0.6094000 7.574000 0.9436000 8.407000 0.7713000 -0.8328000     1.219000  
1 1 1 3  33 48 o 2.775000 0.8748000 2.853000 1.262000  2.696000 1.211000  0.1574000      1.750000  
1 1 1 3  33 50 o 5.390000 0.9641000 5.284000 1.532000  5.495000 1.171000  -0.2105000     1.928000  
1 1 1 3  33 52 o 5.505000 1.003000  5.751000 1.455000  5.259000 1.382000  0.4924000      2.007000  
1 1 1 3  33 54 o 3.092000 0.9604000 3.227000 1.372000  2.957000 1.345000  0.2694000      1.921000  
1 1 1 3  33 56 o 8.821000 0.6734000 9.041000 0.9292000 8.601000 0.9749000 0.4401000      1.347000  
1 1 1 3  33 58 o 7.058000 1.132000  5.562000 1.744000  8.555000 1.444000  -2.994000      2.264000  
1 1 1 3  34 1  o 13.93000 0.3389000 14.10000 0.4943000 13.76000 0.4637000 0.3434000      0.6777000 
1 1 1 3  34 3  o 22.53000 0.2936000 22.40000 0.4442000 22.67000 0.3842000 -0.2686000     0.5873000 
1 1 1 3  34 5  o 61.88000 0.4836000 60.98000 0.7229000 62.79000 0.6426000 -1.810000      0.9672000 
1 1 1 3  34 7  o 33.88000 0.3222000 33.74000 0.4859000 34.01000 0.4232000 -0.2626000     0.6443000 
1 1 1 3  34 9  f 64.66000 0.4669000 64.37000 0.6576000 64.94000 0.6631000 -0.5754000     0.9339000 
1 1 1 3  34 11 o 46.25000 0.3860000 45.44000 0.4989000 47.06000 0.5891000 -1.625000      0.7720000 
1 1 1 3  34 13 o 36.71000 0.3219000 36.89000 0.4032000 36.54000 0.5019000 0.3487000      0.6438000 
1 1 1 3  34 15 o 35.31000 0.3146000 35.34000 0.3916000 35.27000 0.4926000 0.7382000E-01  0.6293000 
1 1 1 3  34 17 o 30.35000 0.2999000 30.85000 0.3748000 29.85000 0.4684000 0.9999000      0.5999000 
1 1 1 3  34 19 o 19.74000 0.3394000 20.28000 0.3766000 19.19000 0.5648000 1.092000       0.6788000 
1 1 1 3  34 21 o 23.86000 0.4052000 24.82000 0.4066000 22.91000 0.7011000 1.915000       0.8105000 
1 1 1 3  34 23 o 31.49000 0.3099000 31.47000 0.4323000 31.51000 0.4441000 -0.3207000E-01 0.6197000 
1 1 1 3  34 25 o 14.52000 0.3981000 14.78000 0.5198000 14.25000 0.6032000 0.5262000      0.7963000 
1 1 1 3  34 27 o 4.541000 1.184000  4.070000 1.409000  5.012000 1.902000  -0.9428000     2.367000  
1 1 1 3  34 29 o 33.15000 0.3211000 32.88000 0.4483000 33.42000 0.4598000 -0.5409000     0.6422000 
1 1 1 3  34 31 o 27.10000 0.3128000 27.24000 0.4374000 26.97000 0.4472000 0.2737000      0.6256000 
1 1 1 3  34 33 o 21.49000 0.3611000 21.88000 0.5473000 21.10000 0.4714000 0.7852000      0.7223000 
1 1 1 3  34 35 o 16.57000 0.3691000 16.00000 0.5370000 17.13000 0.5065000 -1.132000      0.7382000 
1 1 1 3  34 37 f 13.91000 0.4812000 14.01000 0.7647000 13.82000 0.5845000 0.1826000      0.9625000 
1 1 1 3  34 39 o 8.763000 0.6169000 8.043000 0.8918000 9.482000 0.8525000 -1.438000      1.234000  
1 1 1 3  34 41 o 24.56000 0.3768000 25.23000 0.5286000 23.89000 0.5371000 1.335000       0.7536000 
1 1 1 3  34 43 o 12.84000 0.4402000 12.28000 0.6513000 13.39000 0.5924000 -1.117000      0.8804000 
1 1 1 3  34 45 o 8.275000 0.6118000 8.887000 0.8105000 7.663000 0.9168000 1.224000       1.224000  
1 1 1 3  34 47 o 6.414000 0.8504000 5.803000 1.350000  7.025000 1.034000  -1.222000      1.701000  
1 1 1 3  34 49 o 3.798000 1.014000  3.502000 1.541000  4.093000 1.318000  -0.5912000     2.027000  
1 1 1 3  34 51 o 4.392000 1.106000  5.362000 1.687000  3.421000 1.430000  1.941000       2.211000  
1 1 1 3  34 53 o 3.891000 0.9615000 4.781000 1.413000  3.002000 1.304000  1.779000       1.923000  
1 1 1 3  34 55 o 4.951000 1.012000  5.043000 1.469000  4.859000 1.391000  0.1836000      2.023000  
1 1 1 3  34 57 o 7.054000 0.8466000 8.049000 0.9978000 6.059000 1.368000  1.991000       1.693000  
1 1 1 3  35 0  o 50.95000 0.6245000 50.95000 0.6245000 50.95000 0.6245000 0.000000       0.000000  
1 1 1 3  35 2  o 20.56000 0.3025000 20.52000 0.3954000 20.59000 0.4580000 -0.7909000E-01 0.6050000 
1 1 1 3  35 4  f 34.75000 0.3308000 34.96000 0.5041000 34.54000 0.4285000 0.4260000      0.6616000 
1 1 1 3  35 6  f 42.16000 0.3365000 41.60000 0.4723000 42.71000 0.4795000 -1.106000      0.6731000 
1 1 1 3  35 8  f 28.22000 0.2806000 28.00000 0.3961000 28.43000 0.3976000 -0.4322000     0.5612000 
1 1 1 3  35 10 o 21.68000 0.2976000 21.94000 0.3907000 21.42000 0.4489000 0.5206000      0.5951000 
1 1 1 3  35 12 f 54.90000 0.4221000 55.18000 0.5220000 54.63000 0.6636000 0.5448000      0.8443000 
1 1 1 3  35 14 o 37.11000 0.3258000 37.00000 0.4046000 37.22000 0.5107000 -0.2110000     0.6515000 
1 1 1 3  35 16 o 19.48000 0.3282000 19.44000 0.3728000 19.53000 0.5403000 -0.9000000E-01 0.6564000 
1 1 1 3  35 18 o 11.51000 0.4496000 12.29000 0.4796000 10.74000 0.7606000 1.549000       0.8992000 
1 1 1 3  35 20 o 14.25000 0.3952000 14.57000 0.4355000 13.93000 0.6596000 0.6350000      0.7904000 
1 1 1 3  35 22 o 39.24000 0.3382000 39.28000 0.4765000 39.20000 0.4801000 0.8281000E-01  0.6764000 
1 1 1 3  35 24 o 24.18000 0.3275000 24.47000 0.4371000 23.89000 0.4878000 0.5779000      0.6550000 
1 1 1 3  35 26 o 22.85000 0.3436000 22.81000 0.4285000 22.89000 0.5373000 -0.8151000E-01 0.6872000 
1 1 1 3  35 28 o 9.779000 0.5469000 9.678000 0.7539000 9.881000 0.7924000 -0.2029000     1.094000  
1 1 1 3  35 30 o 11.92000 0.5263000 11.80000 0.6127000 12.03000 0.8559000 -0.2300000     1.053000  
1 1 1 3  35 32 o 16.21000 0.4024000 16.23000 0.6046000 16.19000 0.5313000 0.4946000E-01  0.8049000 
1 1 1 3  35 34 o 17.57000 0.3456000 17.74000 0.4819000 17.40000 0.4956000 0.3415000      0.6912000 
1 1 1 3  35 36 o 12.24000 0.4735000 11.84000 0.7150000 12.65000 0.6211000 -0.8054000     0.9471000 
1 1 1 3  35 38 o 9.022000 0.5974000 9.175000 0.7882000 8.869000 0.8979000 0.3060000      1.195000  
1 1 1 3  35 40 o 9.149000 0.7322000 9.025000 0.8831000 9.272000 1.168000  -0.2464000     1.464000  
1 1 1 3  35 42 o 2.532000 0.8122000 2.648000 1.192000  2.415000 1.104000  0.2325000      1.624000  
1 1 1 3  35 44 o 9.192000 0.6259000 8.384000 0.8442000 10.00000 0.9242000 -1.617000      1.252000  
1 1 1 3  35 46 o 9.649000 0.5386000 9.267000 0.7848000 10.03000 0.7379000 -0.7644000     1.077000  
1 1 1 3  35 48 f 3.955000 1.024000  5.160000 1.675000  2.751000 1.180000  2.410000       2.048000  
1 1 1 3  35 50 o 4.098000 1.094000  3.891000 1.521000  4.305000 1.572000  -0.4137000     2.187000  
1 1 1 3  35 52 o 7.447000 0.8007000 7.556000 1.181000  7.338000 1.081000  0.2182000      1.601000  
1 1 1 3  35 54 o 5.227000 0.9149000 6.357000 1.104000  4.098000 1.459000  2.259000       1.830000  
1 1 1 3  35 56 o 3.614000 0.9431000 2.983000 1.242000  4.244000 1.420000  -1.260000      1.886000  
1 1 1 3  36 1  f 37.76000 0.3646000 37.76000 0.5186000 37.76000 0.5125000 0.3052000E-02  0.7291000 
1 1 1 3  36 3  o 44.05000 0.4015000 44.06000 0.5702000 44.04000 0.5654000 0.1598000E-01  0.8030000 
1 1 1 3  36 5  o 28.81000 0.3077000 29.09000 0.4130000 28.53000 0.4563000 0.5567000      0.6154000 
1 1 1 3  36 7  o 34.15000 0.3243000 34.32000 0.4315000 33.99000 0.4842000 0.3359000      0.6486000 
1 1 1 3  36 9  o 45.76000 0.4339000 45.65000 0.5042000 45.86000 0.7064000 -0.2072000     0.8678000 
1 1 1 3  36 11 o 49.01000 0.4567000 49.02000 0.5314000 49.01000 0.7429000 0.1689000E-01  0.9134000 
1 1 1 3  36 13 o 33.72000 0.3539000 33.58000 0.3873000 33.86000 0.5925000 -0.2853000     0.7079000 
1 1 1 3  36 15 o 39.36000 0.3828000 39.51000 0.4207000 39.20000 0.6396000 0.3177000      0.7656000 
1 1 1 3  36 17 o 22.83000 0.3295000 23.69000 0.3661000 21.97000 0.5479000 1.719000       0.6590000 
1 1 1 3  36 19 o 25.35000 0.3004000 25.01000 0.3777000 25.69000 0.4673000 -0.6750000     0.6009000 
1 1 1 3  36 21 o 22.62000 0.3104000 22.99000 0.3855000 22.25000 0.4865000 0.7451000      0.6207000 
1 1 1 3  36 23 o 45.51000 0.3965000 45.33000 0.5201000 45.69000 0.5986000 -0.3633000     0.7930000 
1 1 1 3  36 25 o 4.321000 0.9456000 3.051000 1.282000  5.592000 1.390000  -2.541000      1.891000  
1 1 1 3  36 27 o 13.73000 0.4370000 13.64000 0.5492000 13.82000 0.6799000 -0.1751000     0.8740000 
1 1 1 3  36 29 o 20.81000 0.3230000 20.74000 0.4521000 20.89000 0.4615000 -0.1552000     0.6460000 
1 1 1 3  36 31 o 14.90000 0.4202000 15.08000 0.6268000 14.72000 0.5598000 0.3520000      0.8404000 
1 1 1 3  36 33 o 13.00000 0.4922000 12.81000 0.6090000 13.18000 0.7734000 -0.3690000     0.9844000 
1 1 1 3  36 35 o 9.039000 0.5523000 9.480000 0.7518000 8.598000 0.8093000 0.8829000      1.105000  
1 1 1 3  36 37 o 17.29000 0.3983000 17.04000 0.5697000 17.53000 0.5568000 -0.4911000     0.7966000 
1 1 1 3  36 39 o 12.97000 0.4594000 13.95000 0.6622000 11.98000 0.6370000 1.965000       0.9188000 
1 1 1 3  36 41 o 11.62000 0.4612000 11.79000 0.6372000 11.46000 0.6668000 0.3218000      0.9223000 
1 1 1 3  36 43 o 5.233000 0.9090000 4.692000 1.322000  5.773000 1.248000  -1.081000      1.818000  
1 1 1 3  36 45 o 3.037000 0.8787000 3.118000 1.248000  2.955000 1.238000  0.1633000      1.757000  
1 1 1 3  36 47 o 5.722000 0.9886000 4.874000 1.458000  6.570000 1.335000  -1.697000      1.977000  
1 1 1 3  36 49 o 7.285000 0.8604000 7.553000 1.047000  7.018000 1.366000  0.5354000      1.721000  
1 1 1 3  36 51 o 3.639000 0.9762000 4.101000 1.446000  3.177000 1.312000  0.9240000      1.952000  
1 1 1 3  36 53 o 2.452000 0.7783000 2.201000 1.043000  2.704000 1.156000  -0.5022000     1.557000  
1 1 1 3  36 55 o 6.464000 0.8371000 6.053000 1.228000  6.875000 1.138000  -0.8216000     1.674000  
1 1 1 3  37 0  o 21.75000 0.4034000 21.75000 0.4034000 21.75000 0.4034000 0.000000       0.000000  
1 1 1 3  37 2  o 14.35000 0.3631000 14.37000 0.5525000 14.34000 0.4713000 0.3212000E-01  0.7262000 
1 1 1 3  37 4  o 25.57000 0.2849000 25.57000 0.4013000 25.58000 0.4046000 -0.8944000E-02 0.5699000 
1 1 1 3  37 6  o 18.60000 0.3074000 18.34000 0.4180000 18.86000 0.4509000 -0.5157000     0.6148000 
1 1 1 3  37 8  o 23.04000 0.3392000 22.98000 0.4096000 23.10000 0.5408000 -0.1132000     0.6784000 
1 1 1 3  37 10 o 44.66000 0.3801000 45.00000 0.4997000 44.32000 0.5728000 0.6779000      0.7601000 
1 1 1 3  37 12 o 28.66000 0.3505000 28.52000 0.4090000 28.80000 0.5694000 -0.2857000     0.7011000 
1 1 1 3  37 14 o 13.10000 0.3734000 12.68000 0.4836000 13.52000 0.5691000 -0.8457000     0.7468000 
1 1 1 3  37 16 o 27.69000 0.2974000 27.43000 0.3735000 27.96000 0.4629000 -0.5311000     0.5948000 
1 1 1 3  37 18 o 35.56000 0.3280000 35.85000 0.4083000 35.27000 0.5133000 0.5748000      0.6559000 
1 1 1 3  37 20 o 27.59000 0.3095000 28.17000 0.3910000 27.01000 0.4797000 1.156000       0.6189000 
1 1 1 3  37 22 o 39.93000 0.3672000 39.40000 0.4755000 40.47000 0.5595000 -1.068000      0.7343000 
1 1 1 3  37 24 o 22.86000 0.3586000 22.64000 0.4538000 23.08000 0.5555000 -0.4409000     0.7173000 
1 1 1 3  37 26 o 26.91000 0.3436000 27.02000 0.4473000 26.79000 0.5218000 0.2285000      0.6872000 
1 1 1 3  37 28 o 23.20000 0.3138000 22.85000 0.4379000 23.55000 0.4497000 -0.6993000     0.6277000 
1 1 1 3  37 30 o 10.47000 0.4893000 10.10000 0.7137000 10.84000 0.6696000 -0.7471000     0.9787000 
1 1 1 3  37 32 o 4.243000 1.012000  4.078000 1.485000  4.409000 1.376000  -0.3306000     2.024000  
1 1 1 3  37 34 o 19.17000 0.3506000 19.12000 0.5085000 19.22000 0.4829000 -0.1004000     0.7013000 
1 1 1 3  37 36 o 18.43000 0.5063000 17.88000 0.4728000 18.98000 0.8955000 -1.092000      1.013000  
1 1 1 3  37 38 o 15.51000 0.4042000 15.48000 0.6082000 15.54000 0.5326000 -0.5358000E-01 0.8085000 
1 1 1 3  37 40 f 11.67000 0.4293000 12.04000 0.5859000 11.30000 0.6275000 0.7397000      0.8585000 
1 1 1 3  37 42 o 3.565000 0.9129000 4.198000 1.330000  2.931000 1.251000  1.267000       1.826000  
1 1 1 3  37 44 o 4.741000 0.9423000 4.955000 1.233000  4.528000 1.425000  0.4266000      1.885000  
1 1 1 3  37 46 o 4.775000 1.061000  5.014000 1.494000  4.536000 1.506000  0.4777000      2.121000  
1 1 1 3  37 48 o 7.976000 0.7867000 8.773000 0.9128000 7.179000 1.282000  1.594000       1.573000  
1 1 1 3  37 50 o 7.774000 0.7101000 7.247000 1.138000  8.300000 0.8492000 -1.054000      1.420000  
1 1 1 3  37 52 o 3.480000 0.9345000 3.525000 1.345000  3.434000 1.297000  0.9081000E-01  1.869000  
1 1 1 3  37 54 o 8.904000 0.6345000 9.580000 0.8492000 8.228000 0.9428000 1.352000       1.269000  
1 1 1 3  38 1  o 12.05000 0.4844000 11.06000 0.7475000 13.04000 0.6164000 -1.975000      0.9689000 
1 1 1 3  38 3  o 22.68000 0.2866000 22.53000 0.4013000 22.83000 0.4093000 -0.2974000     0.5732000 
1 1 1 3  38 5  o 31.73000 0.3032000 31.42000 0.4293000 32.04000 0.4284000 -0.6237000     0.6064000 
1 1 1 3  38 7  o 26.14000 0.3082000 25.70000 0.4034000 26.58000 0.4660000 -0.8752000     0.6163000 
1 1 1 3  38 9  o 29.39000 0.2941000 29.15000 0.4123000 29.62000 0.4196000 -0.4705000     0.5883000 
1 1 1 3  38 11 o 15.74000 0.3575000 15.92000 0.4583000 15.56000 0.5488000 0.3571000      0.7149000 
1 1 1 3  38 13 o 18.65000 0.3134000 18.36000 0.4006000 18.94000 0.4820000 -0.5779000     0.6267000 
1 1 1 3  38 15 o 33.20000 0.3574000 32.35000 0.3913000 34.04000 0.5982000 -1.688000      0.7148000 
1 1 1 3  38 17 o 14.34000 0.3714000 14.60000 0.4575000 14.08000 0.5850000 0.5172000      0.7427000 
1 1 1 3  38 19 o 9.492000 0.5162000 9.747000 0.6356000 9.236000 0.8136000 0.5109000      1.032000  
1 1 1 3  38 21 o 30.02000 0.3507000 30.48000 0.4978000 29.56000 0.4939000 0.9224000      0.7013000 
1 1 1 3  38 23 o 26.36000 0.3499000 26.14000 0.4410000 26.58000 0.5434000 -0.4421000     0.6998000 
1 1 1 3  38 25 o 17.17000 0.4049000 17.62000 0.5115000 16.71000 0.6279000 0.9088000      0.8099000 
1 1 1 3  38 27 o 18.64000 0.3318000 18.69000 0.4691000 18.59000 0.4693000 0.9916000E-01  0.6635000 
1 1 1 3  38 29 o 18.00000 0.3407000 18.27000 0.4689000 17.73000 0.4945000 0.5354000      0.6815000 
1 1 1 3  38 31 o 26.49000 0.3370000 26.28000 0.5090000 26.70000 0.4417000 -0.4270000     0.6739000 
1 1 1 3  38 33 o 16.44000 0.3821000 15.64000 0.5919000 17.23000 0.4833000 -1.599000      0.7641000 
1 1 1 3  38 35 o 3.189000 0.9058000 3.674000 1.382000  2.703000 1.172000  0.9716000      1.812000  
1 1 1 3  38 37 o 8.570000 0.5656000 8.509000 0.7772000 8.632000 0.8220000 -0.1232000     1.131000  
1 1 1 3  38 39 o 17.40000 0.4059000 18.06000 0.4640000 16.75000 0.6661000 1.309000       0.8117000 
1 1 1 3  38 41 o 11.75000 0.4494000 12.16000 0.6316000 11.33000 0.6395000 0.8265000      0.8988000 
1 1 1 3  38 43 o 2.973000 0.8887000 2.753000 1.206000  3.193000 1.306000  -0.4394000     1.777000  
1 1 1 3  38 45 o 5.341000 1.022000  4.626000 1.500000  6.056000 1.389000  -1.430000      2.045000  
1 1 1 3  38 47 o 10.74000 0.6153000 10.36000 0.8823000 11.13000 0.8578000 -0.7713000     1.231000  
1 1 1 3  38 49 o 5.957000 0.8804000 6.041000 1.333000  5.874000 1.150000  0.1671000      1.761000  
1 1 1 3  38 51 o 3.927000 0.9766000 3.201000 1.333000  4.653000 1.428000  -1.453000      1.953000  
1 1 1 3  38 53 o 3.263000 0.9289000 2.436000 1.147000  4.090000 1.462000  -1.653000      1.858000  
1 1 1 3  39 0  o 6.339000 0.9723000 6.339000 0.9723000 6.339000 0.9723000 0.000000       0.000000  
1 1 1 3  39 2  o 14.78000 0.3898000 15.00000 0.4867000 14.55000 0.6090000 0.4533000      0.7795000 
1 1 1 3  39 4  o 19.50000 0.2979000 19.09000 0.4161000 19.92000 0.4264000 -0.8225000     0.5958000 
1 1 1 3  39 6  o 12.00000 0.4164000 11.52000 0.5790000 12.49000 0.5987000 -0.9685000     0.8329000 
1 1 1 3  39 8  o 52.43000 0.3992000 52.92000 0.5693000 51.95000 0.5598000 0.9660000      0.7984000 
1 1 1 3  39 10 o 33.62000 0.3098000 33.92000 0.4363000 33.33000 0.4398000 0.5971000      0.6195000 
1 1 1 3  39 12 o 23.02000 0.3097000 22.54000 0.3845000 23.51000 0.4856000 -0.9718000     0.6194000 
1 1 1 3  39 14 o 33.66000 0.3648000 33.13000 0.3934000 34.19000 0.6144000 -1.065000      0.7295000 
1 1 1 3  39 16 o 35.23000 0.3298000 35.13000 0.4117000 35.32000 0.5153000 -0.1943000     0.6596000 
1 1 1 3  39 18 o 15.05000 0.3633000 14.60000 0.4776000 15.50000 0.5477000 -0.8985000     0.7267000 
1 1 1 3  39 20 o 20.00000 0.3478000 20.35000 0.4551000 19.64000 0.5259000 0.7168000      0.6955000 
1 1 1 3  39 22 o 12.19000 0.4796000 11.93000 0.5923000 12.45000 0.7545000 -0.5126000     0.9592000 
1 1 1 3  39 24 o 22.09000 0.3610000 22.23000 0.4592000 21.95000 0.5573000 0.2835000      0.7221000 
1 1 1 3  39 26 o 13.79000 0.3968000 14.11000 0.5549000 13.47000 0.5674000 0.6392000      0.7937000 
1 1 1 3  39 28 o 4.701000 0.9387000 4.655000 1.317000  4.746000 1.338000  -0.9187000E-01 1.877000  
1 1 1 3  39 30 o 9.873000 0.5425000 8.888000 0.8567000 10.86000 0.6659000 -1.970000      1.085000  
1 1 1 3  39 32 o 17.23000 0.4216000 17.11000 0.4988000 17.34000 0.6798000 -0.2380000     0.8432000 
1 1 1 3  39 34 o 14.68000 0.4561000 15.63000 0.7228000 13.73000 0.5564000 1.900000       0.9122000 
1 1 1 3  39 36 o 5.712000 0.7606000 5.725000 1.042000  5.700000 1.108000  0.2458000E-01  1.521000  
1 1 1 3  39 38 o 7.577000 0.6941000 8.079000 0.7755000 7.074000 1.151000  1.005000       1.388000  
1 1 1 3  39 40 o 5.669000 0.8523000 5.357000 1.283000  5.981000 1.122000  -0.6250000     1.705000  
1 1 1 3  39 42 o 4.112000 1.062000  3.718000 1.335000  4.506000 1.652000  -0.7883000     2.124000  
1 1 1 3  39 44 o 6.744000 0.9497000 6.598000 1.157000  6.891000 1.506000  -0.2929000     1.899000  
1 1 1 3  39 46 o 8.686000 0.6610000 8.272000 1.047000  9.100000 0.8069000 -0.8275000     1.322000  
1 1 1 3  39 48 f 10.24000 0.5619000 10.02000 0.8594000 10.45000 0.7243000 -0.4258000     1.124000  
1 1 1 3  39 50 o 4.892000 0.9626000 3.809000 1.413000  5.975000 1.308000  -2.165000      1.925000  
1 1 1 3  39 52 o 3.331000 0.9350000 3.538000 1.363000  3.124000 1.280000  0.4137000      1.870000  
1 1 1 3  40 1  o 37.18000 0.3247000 37.16000 0.4603000 37.21000 0.4580000 -0.5807000E-01 0.6494000 
1 1 1 3  40 3  o 13.71000 0.4710000 13.53000 0.5114000 13.89000 0.7911000 -0.3648000     0.9420000 
1 1 1 3  40 5  o 12.55000 0.4415000 12.36000 0.5742000 12.75000 0.6708000 -0.3910000     0.8830000 
1 1 1 3  40 7  o 31.93000 0.3071000 31.51000 0.4320000 32.36000 0.4366000 -0.8537000     0.6142000 
1 1 1 3  40 9  o 13.27000 0.3886000 13.56000 0.5437000 12.97000 0.5553000 0.5924000      0.7771000 
1 1 1 3  40 11 o 4.270000 0.9597000 4.581000 1.289000  3.959000 1.422000  0.6219000      1.919000  
1 1 1 3  40 13 o 12.12000 0.4740000 11.97000 0.5371000 12.27000 0.7812000 -0.2966000     0.9481000 
1 1 1 3  40 15 o 20.24000 0.3381000 20.48000 0.4446000 20.00000 0.5096000 0.4831000      0.6763000 
1 1 1 3  40 17 o 13.63000 0.3992000 13.62000 0.5181000 13.63000 0.6074000 -0.1212000E-01 0.7984000 
1 1 1 3  40 19 o 20.73000 0.4077000 20.77000 0.4609000 20.69000 0.6726000 0.7893000E-01  0.8154000 
1 1 1 3  40 21 o 42.57000 0.4257000 42.32000 0.4461000 42.82000 0.7250000 -0.4960000     0.8513000 
1 1 1 3  40 23 o 20.55000 0.3670000 20.40000 0.4970000 20.69000 0.5403000 -0.2956000     0.7341000 
1 1 1 3  40 25 o 5.384000 0.8593000 4.775000 1.289000  5.992000 1.137000  -1.218000      1.719000  
1 1 1 3  40 27 o 6.575000 0.7313000 5.937000 1.119000  7.212000 0.9422000 -1.275000      1.463000  
1 1 1 3  40 29 o 7.367000 0.6895000 7.082000 1.100000  7.653000 0.8312000 -0.5706000     1.379000  
1 1 1 3  40 31 f 19.97000 0.3439000 20.00000 0.4717000 19.93000 0.5007000 0.6417000E-01  0.6879000 
1 1 1 3  40 33 o 11.44000 0.5146000 12.02000 0.7903000 10.86000 0.6593000 1.160000       1.029000  
1 1 1 3  40 35 o 17.56000 0.3314000 17.58000 0.4645000 17.54000 0.4727000 0.3845000E-01  0.6627000 
1 1 1 3  40 37 o 15.62000 0.3933000 16.17000 0.5055000 15.07000 0.6027000 1.092000       0.7867000 
1 1 1 3  40 39 o 12.45000 0.4110000 13.02000 0.5758000 11.88000 0.5865000 1.147000       0.8219000 
1 1 1 3  40 41 o 17.55000 0.3876000 17.67000 0.5783000 17.43000 0.5161000 0.2419000      0.7751000 
1 1 1 3  40 43 o 10.65000 0.5097000 10.90000 0.6667000 10.40000 0.7712000 0.4935000      1.019000  
1 1 1 3  40 45 o 13.65000 0.4622000 13.56000 0.6340000 13.73000 0.6727000 -0.1783000     0.9244000 
1 1 1 3  40 47 o 9.458000 0.7205000 9.400000 1.097000  9.516000 0.9340000 -0.1169000     1.441000  
1 1 1 3  40 49 o 2.812000 0.8816000 2.966000 1.289000  2.658000 1.203000  0.3079000      1.763000  
1 1 1 3  40 51 o 3.633000 0.9475000 3.908000 1.388000  3.359000 1.290000  0.5487000      1.895000  
1 1 1 3  41 0  o 29.97000 0.4312000 29.97000 0.4312000 29.97000 0.4312000 0.000000       0.000000  
1 1 1 3  41 2  o 27.90000 0.3280000 27.36000 0.4248000 28.43000 0.4999000 -1.063000      0.6560000 
1 1 1 3  41 4  o 6.740000 0.7255000 7.577000 0.8487000 5.903000 1.177000  1.674000       1.451000  
1 1 1 3  41 6  o 20.10000 0.3407000 20.21000 0.4381000 19.99000 0.5218000 0.2193000      0.6813000 
1 1 1 3  41 8  o 33.71000 0.3464000 33.44000 0.4460000 33.98000 0.5303000 -0.5350000     0.6929000 
1 1 1 3  41 10 o 25.37000 0.3867000 25.06000 0.4338000 25.69000 0.6404000 -0.6253000     0.7735000 
1 1 1 3  41 12 f 32.58000 0.3636000 33.14000 0.3995000 32.01000 0.6077000 1.131000       0.7272000 
1 1 1 3  41 14 o 19.41000 0.3322000 19.59000 0.4192000 19.22000 0.5154000 0.3726000      0.6644000 
1 1 1 3  41 16 o 18.25000 0.4065000 17.91000 0.4739000 18.58000 0.6607000 -0.6709000     0.8131000 
1 1 1 3  41 18 o 19.88000 0.4229000 20.24000 0.5490000 19.51000 0.6435000 0.7254000      0.8459000 
1 1 1 3  41 20 o 21.43000 0.3793000 21.65000 0.3941000 21.21000 0.6483000 0.4423000      0.7587000 
1 1 1 3  41 22 o 11.46000 0.4717000 10.95000 0.7068000 11.97000 0.6247000 -1.026000      0.9433000 
1 1 1 3  41 24 o 15.90000 0.3480000 16.20000 0.4842000 15.61000 0.5000000 0.5926000      0.6960000 
1 1 1 3  41 26 o 17.96000 0.3348000 18.15000 0.4614000 17.77000 0.4851000 0.3730000      0.6695000 
1 1 1 3  41 28 o 13.64000 0.4493000 13.45000 0.5811000 13.83000 0.6854000 -0.3754000     0.8985000 
1 1 1 3  41 30 o 20.11000 0.3525000 20.05000 0.4773000 20.18000 0.5188000 -0.1340000     0.7050000 
1 1 1 3  41 32 o 7.807000 0.6619000 7.492000 1.100000  8.122000 0.7371000 -0.6304000     1.324000  
1 1 1 3  41 34 o 10.83000 0.4478000 10.58000 0.6450000 11.08000 0.6214000 -0.5080000     0.8956000 
1 1 1 3  41 36 o 12.93000 0.3930000 12.74000 0.5667000 13.13000 0.5447000 -0.3881000     0.7861000 
1 1 1 3  41 38 o 4.922000 0.9273000 4.601000 1.307000  5.242000 1.316000  -0.6415000     1.855000  
1 1 1 3  41 40 o 7.907000 0.6331000 8.694000 0.7411000 7.120000 1.027000  1.574000       1.266000  
1 1 1 3  41 42 o 2.925000 0.8815000 2.884000 1.207000  2.966000 1.285000  -0.8120000E-01 1.763000  
1 1 1 3  41 44 o 13.25000 0.4702000 13.25000 0.7173000 13.26000 0.6081000 -0.1017000E-01 0.9404000 
1 1 1 3  41 46 o 6.144000 0.9012000 5.711000 1.415000  6.577000 1.116000  -0.8659000     1.802000  
1 1 1 3  41 48 o 3.343000 0.9315000 3.469000 1.372000  3.216000 1.260000  0.2536000      1.863000  
1 1 1 3  41 50 o 3.439000 0.9486000 3.388000 1.342000  3.491000 1.341000  -0.1035000     1.897000  
1 1 1 3  42 1  o 8.907000 0.6148000 8.821000 0.8170000 8.994000 0.9191000 -0.1725000     1.230000  
1 1 1 3  42 3  o 6.121000 0.7719000 5.621000 1.132000  6.622000 1.049000  -1.001000      1.544000  
1 1 1 3  42 5  o 49.41000 0.4191000 49.47000 0.6344000 49.35000 0.5479000 0.1231000      0.8382000 
1 1 1 3  42 7  o 31.97000 0.3196000 32.30000 0.4562000 31.64000 0.4477000 0.6611000      0.6392000 
1 1 1 3  42 9  o 35.60000 0.4027000 36.01000 0.4624000 35.18000 0.6594000 0.8279000      0.8054000 
1 1 1 3  42 11 o 36.86000 0.4686000 36.86000 0.4686000 ?        ?         ?              ?         
1 1 1 3  42 13 o 10.13000 0.6238000 9.868000 0.6589000 10.39000 1.059000  -0.5248000     1.248000  
1 1 1 3  42 15 o 30.90000 0.3951000 30.37000 0.4435000 31.43000 0.6539000 -1.062000      0.7901000 
1 1 1 3  42 17 o 22.98000 0.4025000 23.00000 0.4563000 22.96000 0.6632000 0.3844000E-01  0.8050000 
1 1 1 3  42 19 o 31.35000 0.3886000 31.27000 0.4521000 31.43000 0.6322000 -0.1527000     0.7772000 
1 1 1 3  42 21 o 17.81000 0.3462000 17.67000 0.4669000 17.95000 0.5112000 -0.2827000     0.6923000 
1 1 1 3  42 23 o 11.01000 0.4227000 10.28000 0.6296000 11.73000 0.5641000 -1.455000      0.8453000 
1 1 1 3  42 25 o 33.41000 0.3719000 33.93000 0.5223000 32.88000 0.5297000 1.047000       0.7439000 
1 1 1 3  42 27 o 40.69000 0.3784000 40.89000 0.5689000 40.49000 0.4991000 0.4007000      0.7568000 
1 1 1 3  42 29 o 25.82000 0.3606000 25.50000 0.4983000 26.13000 0.5213000 -0.6247000     0.7212000 
1 1 1 3  42 31 o 10.48000 0.4745000 10.08000 0.7244000 10.88000 0.6132000 -0.8032000     0.9491000 
1 1 1 3  42 33 o 14.84000 0.3751000 14.40000 0.5477000 15.29000 0.5126000 -0.8898000     0.7501000 
1 1 1 3  42 35 o 7.822000 0.6343000 7.837000 0.9442000 7.807000 0.8472000 0.3069000E-01  1.269000  
1 1 1 3  42 37 o 3.297000 0.9479000 3.279000 1.293000  3.315000 1.387000  -0.3520000E-01 1.896000  
1 1 1 3  42 39 o 8.329000 0.5776000 8.153000 0.7890000 8.505000 0.8439000 -0.3525000     1.155000  
1 1 1 3  42 41 o 5.381000 0.8752000 4.859000 1.302000  5.902000 1.169000  -1.044000      1.750000  
1 1 1 3  42 43 o 15.16000 0.4091000 15.05000 0.5813000 15.27000 0.5757000 -0.2199000     0.8181000 
1 1 1 3  42 45 o 5.530000 0.8632000 4.707000 1.345000  6.354000 1.082000  -1.647000      1.726000  
1 1 1 3  42 47 o 2.484000 0.8053000 2.574000 1.183000  2.395000 1.094000  0.1788000      1.611000  
1 1 1 3  42 49 o 3.298000 0.9274000 3.441000 1.318000  3.156000 1.305000  0.2851000      1.855000  
1 1 1 3  43 0  o 69.93000 0.8336000 69.93000 0.8336000 69.93000 0.8336000 0.000000       0.000000  
1 1 1 3  43 2  o 26.19000 0.4628000 25.51000 0.8086000 26.88000 0.4502000 -1.362000      0.9255000 
1 1 1 3  43 4  o 25.51000 0.3300000 26.07000 0.4998000 24.95000 0.4312000 1.121000       0.6601000 
1 1 1 3  43 6  o 12.57000 0.4177000 12.88000 0.5998000 12.25000 0.5816000 0.6316000      0.8355000 
1 1 1 3  43 8  o 4.239000 0.9859000 4.700000 1.352000  3.777000 1.436000  0.9223000      1.972000  
1 1 1 3  43 10 o 9.969000 0.5130000 9.821000 0.7549000 10.12000 0.6948000 -0.2958000     1.026000  
1 1 1 3  43 12 o 16.53000 0.3693000 16.67000 0.4542000 16.40000 0.5823000 0.2741000      0.7385000 
1 1 1 3  43 14 o 20.09000 0.3436000 19.85000 0.4513000 20.32000 0.5184000 -0.4631000     0.6873000 
1 1 1 3  43 16 o 9.167000 0.5668000 9.346000 0.7769000 8.987000 0.8255000 0.3588000      1.134000  
1 1 1 3  43 18 o 4.105000 0.9439000 4.113000 1.272000  4.097000 1.395000  0.1606000E-01  1.888000  
1 1 1 3  43 20 o 24.02000 0.3276000 24.43000 0.4462000 23.60000 0.4799000 0.8303000      0.6553000 
1 1 1 3  43 22 o 12.79000 0.4202000 12.60000 0.6449000 12.98000 0.5387000 -0.3767000     0.8403000 
1 1 1 3  43 24 o 18.41000 0.3092000 18.56000 0.4283000 18.27000 0.4461000 0.2930000      0.6185000 
1 1 1 3  43 26 o 8.552000 0.5806000 8.779000 0.8543000 8.325000 0.7866000 0.4547000      1.161000  
1 1 1 3  43 28 o 10.98000 0.4870000 11.15000 0.6018000 10.82000 0.7657000 0.3211000      0.9739000 
1 1 1 3  43 30 o 21.76000 0.3571000 22.33000 0.5534000 21.19000 0.4516000 1.138000       0.7142000 
1 1 1 3  43 32 o 6.125000 0.7607000 5.616000 1.187000  6.635000 0.9512000 -1.020000      1.521000  
1 1 1 3  43 34 o 11.85000 0.4797000 12.25000 0.6601000 11.46000 0.6961000 0.7877000      0.9593000 
1 1 1 3  43 36 o 9.101000 0.5818000 8.120000 0.7869000 10.08000 0.8571000 -1.961000      1.164000  
1 1 1 3  43 38 o 11.43000 0.4588000 11.75000 0.6262000 11.11000 0.6708000 0.6419000      0.9177000 
1 1 1 3  43 40 o 8.290000 0.5814000 8.523000 0.8355000 8.057000 0.8087000 0.4657000      1.163000  
1 1 1 3  43 42 o 14.28000 0.4507000 14.00000 0.5974000 14.56000 0.6750000 -0.5630000     0.9014000 
1 1 1 3  43 44 o 12.20000 0.4291000 12.32000 0.6213000 12.07000 0.5919000 0.2497000      0.8581000 
1 1 1 3  43 46 o 6.878000 0.7568000 6.129000 1.194000  7.627000 0.9295000 -1.498000      1.514000  
1 1 1 3  43 48 o 2.625000 0.8324000 2.552000 1.147000  2.698000 1.207000  -0.1459000     1.665000  
1 1 1 3  44 1  f 23.13000 0.3272000 23.23000 0.4661000 23.02000 0.4594000 0.2134000      0.6545000 
1 1 1 3  44 3  o 13.12000 0.4376000 12.64000 0.6859000 13.61000 0.5437000 -0.9732000     0.8752000 
1 1 1 3  44 5  o 28.16000 0.3548000 27.85000 0.5026000 28.48000 0.5010000 -0.6342000     0.7096000 
1 1 1 3  44 7  o 29.72000 0.3369000 30.17000 0.4465000 29.27000 0.5046000 0.8918000      0.6738000 
1 1 1 3  44 9  o 15.48000 0.3620000 15.07000 0.5286000 15.89000 0.4947000 -0.8224000     0.7239000 
1 1 1 3  44 11 o 34.50000 0.3490000 34.46000 0.4652000 34.53000 0.5203000 -0.7563000E-01 0.6980000 
1 1 1 3  44 13 o 28.83000 0.3314000 28.92000 0.4412000 28.73000 0.4947000 0.1862000      0.6629000 
1 1 1 3  44 15 o 24.82000 0.3337000 24.98000 0.4485000 24.66000 0.4942000 0.3208000      0.6674000 
1 1 1 3  44 17 o 17.81000 0.3249000 18.16000 0.4214000 17.45000 0.4945000 0.7090000      0.6497000 
1 1 1 3  44 19 o 13.66000 0.3965000 13.72000 0.5645000 13.61000 0.5569000 0.1089000      0.7929000 
1 1 1 3  44 21 o 10.13000 0.5463000 10.37000 0.5587000 9.886000 0.9390000 0.4890000      1.093000  
1 1 1 3  44 23 o 4.892000 0.8219000 5.330000 1.097000  4.454000 1.224000  0.8764000      1.644000  
1 1 1 3  44 25 o 10.30000 0.4743000 9.889000 0.7369000 10.70000 0.5973000 -0.8133000     0.9486000 
1 1 1 3  44 27 o 15.51000 0.3694000 15.76000 0.4597000 15.25000 0.5782000 0.5128000      0.7387000 
1 1 1 3  44 29 o 9.038000 0.6167000 7.599000 1.025000  10.48000 0.6863000 -2.878000      1.233000  
1 1 1 3  44 31 o 8.216000 0.5856000 8.532000 0.7460000 7.901000 0.9030000 0.6317000      1.171000  
1 1 1 3  44 33 o 12.65000 0.5425000 12.22000 0.9087000 13.09000 0.5929000 -0.8775000     1.085000  
1 1 1 3  44 35 o 6.887000 0.7663000 5.863000 1.193000  7.912000 0.9616000 -2.049000      1.533000  
1 1 1 3  44 37 o 10.74000 0.4556000 10.73000 0.6602000 10.75000 0.6281000 -0.2008000E-01 0.9113000 
1 1 1 3  44 39 o 7.028000 0.6429000 7.310000 0.8556000 6.746000 0.9598000 0.5643000      1.286000  
1 1 1 3  44 41 o 3.779000 0.9560000 3.629000 1.288000  3.929000 1.413000  -0.2998000     1.912000  
1 1 1 3  44 43 o 6.540000 0.8138000 6.267000 1.119000  6.813000 1.182000  -0.5462000     1.628000  
1 1 1 3  44 45 o 2.868000 0.8909000 2.882000 1.292000  2.854000 1.227000  0.2713000E-01  1.782000  
1 1 1 3  44 47 o 7.418000 0.7023000 6.871000 1.104000  7.964000 0.8685000 -1.092000      1.405000  
1 1 1 3  45 0  o 42.38000 0.5107000 42.38000 0.5107000 42.38000 0.5107000 0.000000       0.000000  
1 1 1 3  45 2  o 16.49000 0.3601000 16.53000 0.5193000 16.44000 0.4991000 0.8949000E-01  0.7203000 
1 1 1 3  45 4  o 5.975000 0.8883000 6.396000 1.076000  5.555000 1.413000  0.8409000      1.777000  
1 1 1 3  45 6  o 6.274000 0.8409000 6.686000 1.218000  5.863000 1.160000  0.8226000      1.682000  
1 1 1 3  45 8  o 12.08000 0.4708000 11.81000 0.7525000 12.35000 0.5659000 -0.5412000     0.9416000 
1 1 1 3  45 10 f 15.90000 0.3752000 15.60000 0.5738000 16.20000 0.4835000 -0.6003000     0.7503000 
1 1 1 3  45 12 o 30.40000 0.3263000 30.57000 0.4038000 30.23000 0.5127000 0.3430000      0.6526000 
1 1 1 3  45 14 o 18.21000 0.3483000 18.75000 0.4704000 17.68000 0.5137000 1.076000       0.6965000 
1 1 1 3  45 16 o 6.599000 0.7054000 6.932000 0.8530000 6.265000 1.124000  0.6667000      1.411000  
1 1 1 3  45 18 o 6.727000 0.8261000 6.385000 0.9931000 7.069000 1.320000  -0.6837000     1.652000  
1 1 1 3  45 20 o 9.859000 0.4525000 10.06000 0.5886000 9.656000 0.6874000 0.4055000      0.9050000 
1 1 1 3  45 22 o 9.357000 0.5001000 9.736000 0.7371000 8.978000 0.6760000 0.7580000      1.000000  
1 1 1 3  45 24 o 12.44000 0.4128000 12.64000 0.6223000 12.24000 0.5425000 0.4018000      0.8256000 
1 1 1 3  45 26 o 6.808000 0.6385000 5.412000 0.9442000 8.203000 0.8598000 -2.791000      1.277000  
1 1 1 3  45 28 o 2.718000 0.8442000 3.033000 1.290000  2.403000 1.090000  0.6301000      1.688000  
1 1 1 3  45 30 o 9.668000 0.5520000 10.15000 0.7307000 9.187000 0.8275000 0.9619000      1.104000  
1 1 1 3  45 32 o 7.884000 0.7451000 8.714000 0.8487000 7.054000 1.225000  1.660000       1.490000  
1 1 1 3  45 34 o 10.08000 0.5220000 9.534000 0.7556000 10.62000 0.7203000 -1.086000      1.044000  
1 1 1 3  45 36 o 12.65000 0.4206000 12.66000 0.5996000 12.64000 0.5901000 0.2159000E-01  0.8413000 
1 1 1 3  45 38 o 5.130000 0.8423000 4.988000 1.197000  5.272000 1.186000  -0.2837000     1.685000  
1 1 1 3  45 40 o 12.79000 0.4261000 12.80000 0.5948000 12.78000 0.6103000 0.1311000E-01  0.8522000 
1 1 1 3  45 42 o 10.05000 0.5661000 10.11000 0.7516000 9.991000 0.8466000 0.1165000      1.132000  
1 1 1 3  45 44 f 6.273000 0.8214000 5.879000 1.342000  6.667000 0.9476000 -0.7875000     1.643000  
1 1 1 3  45 46 o 3.962000 0.9464000 3.793000 1.354000  4.131000 1.322000  -0.3380000     1.893000  
1 1 1 3  46 1  f 7.816000 0.6804000 7.660000 0.8711000 7.971000 1.045000  -0.3110000     1.361000  
1 1 1 3  46 3  o 18.41000 0.3603000 18.01000 0.4948000 18.81000 0.5238000 -0.8018000     0.7206000 
1 1 1 3  46 5  o 13.62000 0.4044000 13.50000 0.5885000 13.75000 0.5548000 -0.2495000     0.8088000 
1 1 1 3  46 7  o 2.997000 0.8789000 3.788000 1.415000  2.206000 1.043000  1.583000       1.758000  
1 1 1 3  46 9  o 26.26000 0.3813000 26.56000 0.6288000 25.96000 0.4314000 0.5951000      0.7625000 
1 1 1 3  46 11 o 13.84000 0.3867000 13.88000 0.5312000 13.80000 0.5622000 0.7801000E-01  0.7735000 
1 1 1 3  46 13 o 10.78000 0.4471000 10.38000 0.6315000 11.18000 0.6330000 -0.7963000     0.8941000 
1 1 1 3  46 15 o 17.24000 0.3370000 17.35000 0.4603000 17.13000 0.4923000 0.2184000      0.6740000 
1 1 1 3  46 17 o 16.36000 0.3763000 16.40000 0.5168000 16.32000 0.5472000 0.7402000E-01  0.7527000 
1 1 1 3  46 19 o 8.101000 0.5763000 8.310000 0.7554000 7.893000 0.8705000 0.4171000      1.153000  
1 1 1 3  46 21 o 8.323000 0.5761000 9.027000 0.7706000 7.619000 0.8565000 1.408000       1.152000  
1 1 1 3  46 23 o 14.51000 0.3768000 14.21000 0.5783000 14.81000 0.4831000 -0.6017000     0.7536000 
1 1 1 3  46 25 f 21.73000 0.3337000 22.10000 0.5130000 21.35000 0.4269000 0.7556000      0.6675000 
1 1 1 3  46 27 o 7.487000 0.6360000 7.089000 0.8193000 7.885000 0.9731000 -0.7957000     1.272000  
1 1 1 3  46 29 o 11.91000 0.4116000 11.91000 0.5825000 11.91000 0.5818000 0.5285000E-02  0.8233000 
1 1 1 3  46 31 o 6.556000 0.7712000 6.523000 1.116000  6.589000 1.065000  -0.6617000E-01 1.542000  
1 1 1 3  46 33 o 21.44000 0.3470000 21.94000 0.4485000 20.95000 0.5295000 0.9972000      0.6939000 
1 1 1 3  46 35 o 16.42000 0.3800000 16.52000 0.5269000 16.31000 0.5477000 0.2063000      0.7600000 
1 1 1 3  46 37 o 4.639000 0.9254000 3.769000 1.370000  5.508000 1.245000  -1.740000      1.851000  
1 1 1 3  46 39 o 6.769000 0.7672000 6.138000 1.198000  7.401000 0.9586000 -1.263000      1.534000  
1 1 1 3  46 41 o 11.69000 0.5970000 10.94000 0.8024000 12.44000 0.8841000 -1.504000      1.194000  
1 1 1 3  46 43 o 3.136000 0.9073000 3.249000 1.336000  3.024000 1.228000  0.2243000      1.815000  
1 1 1 3  46 45 o 2.941000 0.8621000 2.278000 1.075000  3.603000 1.348000  -1.325000      1.724000  
1 1 1 3  47 0  o 7.026000 1.120000  7.026000 1.120000  7.026000 1.120000  0.000000       0.000000  
1 1 1 3  47 2  o 21.29000 0.3424000 21.45000 0.5191000 21.13000 0.4468000 0.3236000      0.6849000 
1 1 1 3  47 4  o 18.97000 0.3297000 19.49000 0.4704000 18.46000 0.4620000 1.027000       0.6594000 
1 1 1 3  47 6  o 28.90000 0.3149000 28.71000 0.4514000 29.09000 0.4393000 -0.3788000     0.6299000 
1 1 1 3  47 8  o 37.73000 0.3649000 37.90000 0.5568000 37.56000 0.4719000 0.3454000      0.7298000 
1 1 1 3  47 10 o 7.967000 0.5558000 7.702000 0.8283000 8.231000 0.7413000 -0.5287000     1.112000  
1 1 1 3  47 12 o 13.39000 0.4052000 13.83000 0.5392000 12.95000 0.6049000 0.8837000      0.8103000 
1 1 1 3  47 14 o 2.528000 0.7957000 2.649000 1.155000  2.406000 1.095000  0.2423000      1.591000  
1 1 1 3  47 16 o 5.155000 0.8638000 5.361000 1.222000  4.949000 1.221000  0.4120000      1.728000  
1 1 1 3  47 18 o 16.33000 0.3530000 16.25000 0.4701000 16.40000 0.5268000 -0.1532000     0.7061000 
1 1 1 3  47 20 o 12.54000 0.3818000 11.91000 0.4922000 13.17000 0.5839000 -1.265000      0.7637000 
1 1 1 3  47 22 o 8.759000 0.5466000 8.215000 0.8709000 9.304000 0.6606000 -1.089000      1.093000  
1 1 1 3  47 24 o 3.832000 0.8611000 5.197000 1.325000  2.466000 1.101000  2.730000       1.722000  
1 1 1 3  47 26 o 14.81000 0.3854000 15.48000 0.5817000 14.14000 0.5058000 1.345000       0.7708000 
1 1 1 3  47 28 o 9.581000 0.4916000 9.062000 0.7174000 10.10000 0.6723000 -1.037000      0.9832000 
1 1 1 3  47 30 o 7.219000 0.6317000 7.600000 0.8652000 6.838000 0.9207000 0.7619000      1.263000  
1 1 1 3  47 32 o 13.59000 0.4284000 14.09000 0.5393000 13.08000 0.6657000 1.009000       0.8567000 
1 1 1 3  47 34 o 5.190000 0.9000000 5.307000 1.205000  5.073000 1.337000  0.2337000      1.800000  
1 1 1 3  47 36 o 9.549000 0.5611000 9.021000 0.7943000 10.08000 0.7927000 -1.056000      1.122000  
1 1 1 3  47 38 o 2.751000 0.8376000 2.876000 1.200000  2.626000 1.169000  0.2502000      1.675000  
1 1 1 3  47 40 o 5.059000 0.9891000 4.953000 1.286000  5.165000 1.503000  -0.2120000     1.978000  
1 1 1 3  47 42 o 3.039000 0.9035000 3.331000 1.365000  2.747000 1.184000  0.5834000      1.807000  
1 1 1 3  47 44 o 4.868000 0.9806000 4.600000 1.480000  5.137000 1.286000  -0.5369000     1.961000  
1 1 1 3  48 1  o 16.70000 0.3469000 16.19000 0.5033000 17.21000 0.4775000 -1.025000      0.6938000 
1 1 1 3  48 3  o 21.57000 0.3442000 21.80000 0.5318000 21.34000 0.4373000 0.4659000      0.6885000 
1 1 1 3  48 5  o 24.71000 0.3785000 24.61000 0.6241000 24.82000 0.4285000 -0.2154000     0.7570000 
1 1 1 3  48 7  o 13.16000 0.3763000 12.57000 0.5475000 13.75000 0.5165000 -1.177000      0.7527000 
1 1 1 3  48 9  o 9.536000 0.5949000 9.414000 1.005000  9.657000 0.6364000 -0.2432000     1.190000  
1 1 1 3  48 11 o 9.150000 0.4777000 8.900000 0.6482000 9.399000 0.7019000 -0.4984000     0.9554000 
1 1 1 3  48 13 o 2.847000 0.8367000 2.819000 1.159000  2.875000 1.207000  -0.5635000E-01 1.673000  
1 1 1 3  48 15 o 8.855000 0.5115000 8.377000 0.6870000 9.333000 0.7581000 -0.9553000     1.023000  
1 1 1 3  48 17 o 7.244000 0.5874000 6.872000 0.7992000 7.616000 0.8610000 -0.7434000     1.175000  
1 1 1 3  48 19 o 4.844000 0.8737000 4.722000 1.238000  4.967000 1.233000  -0.2451000     1.747000  
1 1 1 3  48 21 o 10.08000 0.4824000 10.40000 0.7268000 9.771000 0.6344000 0.6258000      0.9647000 
1 1 1 3  48 23 o 8.040000 0.6305000 8.468000 0.8130000 7.612000 0.9640000 0.8567000      1.261000  
1 1 1 3  48 25 o 6.192000 0.7321000 6.779000 0.9425000 5.604000 1.120000  1.175000       1.464000  
1 1 1 3  48 27 o 5.704000 0.7956000 6.415000 1.006000  4.992000 1.233000  1.423000       1.591000  
1 1 1 3  48 29 o 16.15000 0.3754000 16.97000 0.5315000 15.32000 0.5304000 1.644000       0.7509000 
1 1 1 3  48 31 o 3.577000 0.9244000 2.897000 1.183000  4.256000 1.421000  -1.359000      1.849000  
1 1 1 3  48 33 o 5.730000 0.7750000 6.002000 0.9744000 5.459000 1.206000  0.5436000      1.550000  
1 1 1 3  48 35 o 6.841000 0.7009000 6.693000 0.9089000 6.989000 1.067000  -0.2962000     1.402000  
1 1 1 3  48 37 o 7.729000 0.6309000 8.237000 0.8404000 7.221000 0.9411000 1.016000       1.262000  
1 1 1 3  48 39 o 3.964000 1.039000  3.343000 1.381000  4.586000 1.554000  -1.242000      2.079000  
1 1 1 3  48 41 o 7.550000 0.7367000 8.026000 1.074000  7.074000 1.009000  0.9520000      1.473000  
1 1 1 3  48 43 o 7.514000 0.6721000 6.516000 1.097000  8.511000 0.7770000 -1.995000      1.344000  
1 1 1 3  49 0  o 2.833000 1.222000  2.833000 1.222000  2.833000 1.222000  0.000000       0.000000  
1 1 1 3  49 2  o 10.85000 0.4382000 10.55000 0.6133000 11.16000 0.6261000 -0.6122000     0.8764000 
1 1 1 3  49 4  o 3.990000 0.9298000 4.770000 1.388000  3.210000 1.238000  1.560000       1.860000  
1 1 1 3  49 6  o 5.179000 0.9454000 6.553000 1.390000  3.805000 1.282000  2.748000       1.891000  
1 1 1 3  49 8  o 7.978000 0.6601000 8.907000 1.046000  7.048000 0.8052000 1.859000       1.320000  
1 1 1 3  49 10 o 11.10000 0.4487000 11.31000 0.6996000 10.89000 0.5620000 0.4123000      0.8974000 
1 1 1 3  49 12 o 15.88000 0.3602000 15.40000 0.5051000 16.37000 0.5137000 -0.9683000     0.7204000 
1 1 1 3  49 14 o 5.139000 0.8542000 4.097000 1.348000  6.182000 1.049000  -2.085000      1.708000  
1 1 1 3  49 16 o 12.14000 0.4269000 12.11000 0.5954000 12.17000 0.6120000 -0.6661000E-01 0.8539000 
1 1 1 3  49 18 o 18.71000 0.3428000 19.05000 0.4550000 18.38000 0.5128000 0.6704000      0.6856000 
1 1 1 3  49 20 o 15.64000 0.4746000 15.53000 0.4864000 15.75000 0.8152000 -0.2186000     0.9493000 
1 1 1 3  49 22 o 4.055000 0.8473000 3.285000 1.247000  4.826000 1.147000  -1.542000      1.695000  
1 1 1 3  49 24 o 6.336000 0.7164000 6.201000 1.003000  6.472000 1.023000  -0.2710000     1.433000  
1 1 1 3  49 26 o 2.828000 0.8341000 3.029000 1.229000  2.628000 1.128000  0.4004000      1.668000  
1 1 1 3  49 28 o 5.289000 0.9165000 5.169000 1.282000  5.408000 1.310000  -0.2393000     1.833000  
1 1 1 3  49 30 o 13.59000 0.4123000 14.15000 0.5179000 13.02000 0.6416000 1.131000       0.8245000 
1 1 1 3  49 32 o 7.144000 0.6533000 6.955000 0.9065000 7.334000 0.9411000 -0.3794000     1.307000  
1 1 1 3  49 34 o 3.937000 0.9153000 3.571000 1.297000  4.303000 1.292000  -0.7320000     1.831000  
1 1 1 3  49 36 o 5.917000 0.8931000 6.662000 1.020000  5.173000 1.466000  1.489000       1.786000  
1 1 1 3  49 38 o 3.552000 0.9335000 4.114000 1.370000  2.989000 1.269000  1.125000       1.867000  
1 1 1 3  49 40 o 2.499000 0.7913000 2.435000 1.082000  2.563000 1.155000  -0.1284000     1.583000  
1 1 1 3  49 42 o 4.817000 0.9266000 4.365000 1.307000  5.268000 1.314000  -0.9036000     1.853000  
1 1 1 3  50 1  o 23.65000 0.4600000 23.07000 0.6629000 24.24000 0.6380000 -1.170000      0.9200000 
1 1 1 3  50 3  o 9.086000 0.5401000 8.741000 0.8375000 9.431000 0.6823000 -0.6905000     1.080000  
1 1 1 3  50 5  f 13.15000 0.3736000 13.85000 0.5191000 12.45000 0.5373000 1.401000       0.7471000 
1 1 1 3  50 7  o 10.66000 0.4736000 10.59000 0.7440000 10.73000 0.5863000 -0.1432000     0.9473000 
1 1 1 3  50 9  o 2.705000 0.7930000 2.885000 1.137000  2.525000 1.106000  0.3598000      1.586000  
1 1 1 3  50 11 o 2.949000 0.8220000 2.298000 1.013000  3.599000 1.294000  -1.301000      1.644000  
1 1 1 3  50 13 o 7.599000 0.5492000 7.366000 0.7226000 7.832000 0.8272000 -0.4660000     1.098000  
1 1 1 3  50 15 o 10.19000 0.4513000 10.50000 0.5492000 9.880000 0.7163000 0.6224000      0.9026000 
1 1 1 3  50 17 o 7.599000 0.5231000 7.798000 0.6938000 7.400000 0.7832000 0.3975000      1.046000  
1 1 1 3  50 19 o 5.757000 0.8364000 7.132000 0.8632000 4.382000 1.433000  2.750000       1.673000  
1 1 1 3  50 21 o 4.837000 0.8268000 4.747000 1.166000  4.927000 1.173000  -0.1800000     1.654000  
1 1 1 3  50 23 o 3.846000 0.9241000 3.786000 1.295000  3.907000 1.318000  -0.1214000     1.848000  
1 1 1 3  50 25 o 4.562000 0.8899000 4.715000 1.240000  4.408000 1.276000  0.3066000      1.780000  
1 1 1 3  50 27 o 5.978000 0.7613000 6.656000 0.8320000 5.300000 1.275000  1.356000       1.523000  
1 1 1 3  50 29 o 9.160000 0.5094000 8.924000 0.7275000 9.396000 0.7133000 -0.4725000     1.019000  
1 1 1 3  50 31 o 6.640000 0.6931000 7.158000 0.9029000 6.121000 1.052000  1.038000       1.386000  
1 1 1 3  50 33 o 4.119000 0.9339000 3.895000 1.291000  4.342000 1.350000  -0.4470000     1.868000  
1 1 1 3  50 35 o 4.998000 0.9394000 4.965000 1.189000  5.030000 1.454000  -0.6539000E-01 1.879000  
1 1 1 3  50 37 o 4.092000 1.010000  3.403000 1.326000  4.781000 1.525000  -1.378000      2.021000  
1 1 1 3  50 39 o 3.644000 0.8980000 2.769000 1.184000  4.520000 1.350000  -1.750000      1.796000  
1 1 1 3  50 41 o 8.903000 0.6109000 8.599000 0.8776000 9.208000 0.8500000 -0.6089000     1.222000  
1 1 1 3  51 0  o 8.422000 1.138000  8.422000 1.138000  8.422000 1.138000  0.000000       0.000000  
1 1 1 3  51 2  o 3.247000 0.9209000 2.970000 1.206000  3.525000 1.392000  -0.5550000     1.842000  
1 1 1 3  51 4  o 14.04000 0.3690000 14.25000 0.5246000 13.83000 0.5192000 0.4174000      0.7380000 
1 1 1 3  51 6  f 13.84000 0.4090000 13.48000 0.6499000 14.20000 0.4967000 -0.7215000     0.8180000 
1 1 1 3  51 8  o 5.832000 0.7178000 5.527000 1.034000  6.137000 0.9962000 -0.6100000     1.436000  
1 1 1 3  51 10 o 10.79000 0.4420000 10.38000 0.6148000 11.20000 0.6353000 -0.8215000     0.8841000 
1 1 1 3  51 12 o 4.480000 0.8660000 3.835000 1.202000  5.124000 1.247000  -1.290000      1.732000  
1 1 1 3  51 14 o 12.63000 0.3828000 12.23000 0.4838000 13.03000 0.5934000 -0.8048000     0.7656000 
1 1 1 3  51 16 o 5.918000 0.7776000 5.380000 1.137000  6.456000 1.061000  -1.076000      1.555000  
1 1 1 3  51 18 o 11.11000 0.4519000 11.31000 0.5161000 10.92000 0.7419000 0.3966000      0.9038000 
1 1 1 3  51 20 o 6.233000 0.7033000 6.796000 0.7427000 5.669000 1.195000  1.128000       1.407000  
1 1 1 3  51 22 o 12.69000 0.4356000 13.54000 0.5396000 11.84000 0.6839000 1.700000       0.8712000 
1 1 1 3  51 24 o 16.39000 0.3749000 16.81000 0.4903000 15.97000 0.5674000 0.8315000      0.7499000 
1 1 1 3  51 26 o 6.588000 0.6705000 5.998000 0.9168000 7.178000 0.9787000 -1.180000      1.341000  
1 1 1 3  51 28 o 11.73000 0.4300000 12.09000 0.6024000 11.37000 0.6139000 0.7215000      0.8601000 
1 1 1 3  51 30 o 10.74000 0.4493000 11.27000 0.6117000 10.21000 0.6583000 1.062000       0.8987000 
1 1 1 3  51 32 o 13.86000 0.4008000 13.78000 0.5574000 13.93000 0.5760000 -0.1477000     0.8016000 
1 1 1 3  51 34 o 8.672000 0.5653000 8.920000 0.7720000 8.425000 0.8259000 0.4946000      1.131000  
1 1 1 3  51 36 o 4.239000 1.047000  4.286000 1.473000  4.192000 1.487000  0.9402000E-01  2.093000  
1 1 1 3  51 38 o 4.569000 0.9779000 3.800000 1.366000  5.338000 1.400000  -1.538000      1.956000  
1 1 1 3  51 40 o 4.839000 1.192000  5.700000 1.722000  3.978000 1.649000  1.722000       2.384000  
1 1 1 3  52 1  o 15.05000 0.3886000 14.46000 0.5599000 15.63000 0.5390000 -1.167000      0.7772000 
1 1 1 3  52 3  o 4.581000 1.002000  4.572000 1.429000  4.590000 1.404000  -0.1805000E-01 2.003000  
1 1 1 3  52 5  o 3.580000 0.8800000 4.111000 1.217000  3.049000 1.271000  1.062000       1.760000  
1 1 1 3  52 7  o 13.90000 0.3776000 13.26000 0.5229000 14.54000 0.5450000 -1.275000      0.7553000 
1 1 1 3  52 9  o 14.30000 0.3742000 14.05000 0.5117000 14.55000 0.5461000 -0.5028000     0.7484000 
1 1 1 3  52 11 o 14.44000 0.3503000 14.18000 0.4621000 14.70000 0.5267000 -0.5258000     0.7007000 
1 1 1 3  52 13 o 7.241000 0.6430000 7.750000 0.8862000 6.732000 0.9319000 1.018000       1.286000  
1 1 1 3  52 15 o 7.327000 0.5949000 7.121000 0.7517000 7.534000 0.9222000 -0.4133000     1.190000  
1 1 1 3  52 17 o 7.200000 0.6507000 6.814000 0.7691000 7.585000 1.050000  -0.7710000     1.301000  
1 1 1 3  52 19 o 4.370000 0.8434000 4.626000 1.106000  4.115000 1.274000  0.5104000      1.687000  
1 1 1 3  52 21 o 5.023000 0.8472000 6.238000 0.9523000 3.808000 1.402000  2.430000       1.694000  
1 1 1 3  52 23 o 3.033000 0.8529000 2.322000 1.062000  3.745000 1.335000  -1.423000      1.706000  
1 1 1 3  52 25 o 2.903000 0.8406000 2.952000 1.169000  2.854000 1.209000  0.9762000E-01  1.681000  
1 1 1 3  52 27 f 13.24000 0.3980000 13.20000 0.5768000 13.27000 0.5487000 -0.7373000E-01 0.7961000 
1 1 1 3  52 29 o 10.76000 0.4531000 10.83000 0.6173000 10.70000 0.6635000 0.1336000      0.9063000 
1 1 1 3  52 31 o 5.069000 0.8986000 4.860000 1.293000  5.278000 1.249000  -0.4177000     1.797000  
1 1 1 3  52 33 o 2.834000 0.8663000 2.540000 1.149000  3.127000 1.297000  -0.5871000     1.733000  
1 1 1 3  52 35 o 5.373000 0.9247000 6.958000 1.145000  3.788000 1.452000  3.170000       1.849000  
1 1 1 3  52 37 f 6.361000 0.7807000 6.854000 0.9501000 5.867000 1.239000  0.9875000      1.561000  
1 1 1 3  53 0  o 19.00000 0.5163000 19.00000 0.5163000 19.00000 0.5163000 0.000000       0.000000  
1 1 1 3  53 2  o 6.069000 0.7969000 5.777000 1.269000  6.361000 0.9640000 -0.5832000     1.594000  
1 1 1 3  53 4  o 10.73000 0.4220000 10.36000 0.6110000 11.10000 0.5822000 -0.7398000     0.8440000 
1 1 1 3  53 6  o 10.39000 0.4985000 10.29000 0.7672000 10.50000 0.6366000 -0.2078000     0.9969000 
1 1 1 3  53 8  o 3.758000 0.8778000 2.484000 1.090000  5.032000 1.376000  -2.548000      1.756000  
1 1 1 3  53 10 o 6.416000 0.7189000 6.921000 0.7960000 5.910000 1.197000  1.010000       1.438000  
1 1 1 3  53 12 o 13.50000 0.4030000 13.21000 0.4977000 13.78000 0.6339000 -0.5759000     0.8059000 
1 1 1 3  53 14 o 5.983000 0.7867000 6.605000 0.8407000 5.361000 1.330000  1.244000       1.573000  
1 1 1 3  53 16 o 16.92000 0.3755000 17.53000 0.4262000 16.31000 0.6184000 1.215000       0.7510000 
1 1 1 3  53 18 o 9.052000 0.5171000 8.702000 0.6283000 9.403000 0.8214000 -0.7009000     1.034000  
1 1 1 3  53 20 o 9.686000 0.4959000 9.519000 0.6566000 9.854000 0.7433000 -0.3346000     0.9918000 
1 1 1 3  53 22 o 14.80000 0.3751000 15.18000 0.5066000 14.42000 0.5532000 0.7604000      0.7501000 
1 1 1 3  53 24 o 4.237000 0.9592000 4.029000 1.383000  4.445000 1.329000  -0.4165000     1.918000  
1 1 1 3  53 26 o 5.422000 0.8427000 5.897000 1.091000  4.948000 1.285000  0.9493000      1.685000  
1 1 1 3  53 28 o 7.234000 0.6595000 7.401000 0.8909000 7.068000 0.9725000 0.3325000      1.319000  
1 1 1 3  53 30 o 3.786000 0.9437000 3.780000 1.301000  3.793000 1.368000  -0.1301000E-01 1.887000  
1 1 1 3  53 32 o 4.941000 0.8783000 5.966000 1.093000  3.916000 1.375000  2.050000       1.757000  
1 1 1 3  53 34 o 4.828000 0.9643000 4.478000 1.257000  5.178000 1.463000  -0.6994000     1.929000  
1 1 1 3  53 36 o 3.837000 0.9899000 3.832000 1.345000  3.843000 1.453000  -0.1137000E-01 1.980000  
1 1 1 3  54 1  o 3.558000 0.9565000 3.784000 1.402000  3.332000 1.301000  0.4512000      1.913000  
1 1 1 3  54 3  o 9.946000 0.4510000 9.727000 0.6526000 10.17000 0.6225000 -0.4385000     0.9019000 
1 1 1 3  54 5  o 8.556000 0.5273000 8.526000 0.7234000 8.586000 0.7675000 -0.6028000E-01 1.055000  
1 1 1 3  54 7  o 10.49000 0.4911000 11.10000 0.6872000 9.873000 0.7018000 1.229000       0.9822000 
1 1 1 3  54 9  o 9.366000 0.5077000 9.805000 0.6640000 8.926000 0.7682000 0.8794000      1.015000  
1 1 1 3  54 11 o 3.933000 0.8845000 4.362000 1.186000  3.503000 1.312000  0.8591000      1.769000  
1 1 1 3  54 13 o 5.363000 0.8490000 4.929000 1.094000  5.797000 1.299000  -0.8686000     1.698000  
1 1 1 3  54 15 o 11.66000 0.4222000 11.78000 0.5157000 11.54000 0.6686000 0.2398000      0.8444000 
1 1 1 3  54 17 o 10.67000 0.4565000 10.43000 0.5794000 10.91000 0.7057000 -0.4851000     0.9130000 
1 1 1 3  54 19 o 4.312000 0.8818000 3.784000 1.190000  4.839000 1.302000  -1.055000      1.764000  
1 1 1 3  54 21 o 5.070000 0.8509000 5.123000 1.142000  5.016000 1.262000  0.1062000      1.702000  
1 1 1 3  54 23 o 10.22000 0.5062000 10.87000 0.7077000 9.581000 0.7241000 1.286000       1.012000  
1 1 1 3  54 25 o 6.603000 0.7089000 6.806000 0.9331000 6.401000 1.067000  0.4043000      1.418000  
1 1 1 3  54 27 o 6.671000 0.7106000 7.262000 0.8749000 6.080000 1.120000  1.182000       1.421000  
1 1 1 3  54 29 f 3.463000 0.9338000 3.647000 1.341000  3.279000 1.300000  0.3678000      1.868000  
1 1 1 3  54 31 o 7.915000 0.6333000 7.448000 0.9537000 8.382000 0.8336000 -0.9341000     1.267000  
1 1 1 3  54 33 o 9.315000 0.6247000 9.936000 0.7331000 8.694000 1.012000  1.242000       1.249000  
1 1 1 3  54 35 o 6.263000 1.214000  7.509000 1.488000  5.017000 1.918000  2.492000       2.428000  
1 1 1 3  55 0  o 9.805000 0.7088000 9.805000 0.7088000 9.805000 0.7088000 0.000000       0.000000  
1 1 1 3  55 2  o 12.71000 0.4704000 13.29000 0.5888000 12.14000 0.7339000 1.147000       0.9409000 
1 1 1 3  55 4  o 12.30000 0.4696000 12.30000 0.6674000 12.31000 0.6607000 -0.8770000E-02 0.9391000 
1 1 1 3  55 6  o 3.740000 0.8933000 3.958000 1.227000  3.522000 1.298000  0.4357000      1.787000  
1 1 1 3  55 8  o 7.915000 0.5406000 7.787000 0.7896000 8.044000 0.7387000 -0.2573000     1.081000  
1 1 1 3  55 10 o 11.12000 0.4448000 10.54000 0.5849000 11.70000 0.6702000 -1.157000      0.8895000 
1 1 1 3  55 12 o 5.847000 0.8333000 5.656000 0.9552000 6.038000 1.366000  -0.3828000     1.667000  
1 1 1 3  55 14 o 6.087000 0.7893000 6.894000 0.9660000 5.280000 1.249000  1.614000       1.579000  
1 1 1 3  55 16 o 5.815000 0.8618000 6.526000 1.131000  5.103000 1.300000  1.423000       1.724000  
1 1 1 3  55 18 o 12.59000 0.4147000 12.50000 0.5244000 12.67000 0.6425000 -0.1647000     0.8293000 
1 1 1 3  55 20 o 3.884000 0.9092000 4.103000 1.305000  3.665000 1.266000  0.4382000      1.818000  
1 1 1 3  55 22 o 5.536000 0.8359000 4.474000 1.366000  6.598000 0.9645000 -2.124000      1.672000  
1 1 1 3  55 24 o 9.532000 0.5116000 10.26000 0.6672000 8.807000 0.7758000 1.450000       1.023000  
1 1 1 3  55 26 o 5.984000 0.7971000 5.523000 1.143000  6.444000 1.111000  -0.9205000     1.594000  
1 1 1 3  55 28 o 3.294000 0.9263000 3.134000 1.283000  3.453000 1.337000  -0.3184000     1.853000  
1 1 1 3  55 30 o 6.932000 0.7257000 6.262000 1.096000  7.602000 0.9519000 -1.340000      1.451000  
1 1 1 3  55 32 o 5.179000 0.9796000 5.019000 1.291000  5.339000 1.474000  -0.3196000     1.959000  
1 1 1 3  56 1  o 6.640000 0.9507000 6.039000 1.643000  7.241000 0.9566000 -1.202000      1.901000  
1 1 1 3  56 3  o 16.06000 0.4898000 16.33000 0.4830000 15.78000 0.8523000 0.5563000      0.9796000 
1 1 1 3  56 5  o 9.101000 0.4911000 8.718000 0.7357000 9.484000 0.6509000 -0.7653000     0.9823000 
1 1 1 3  56 7  o 6.919000 0.6544000 7.160000 0.8621000 6.678000 0.9848000 0.4825000      1.309000  
1 1 1 3  56 9  o 8.254000 0.5152000 8.909000 0.6282000 7.599000 0.8168000 1.310000       1.030000  
1 1 1 3  56 11 o 7.177000 0.7212000 7.263000 0.7442000 7.091000 1.236000  0.1722000      1.442000  
1 1 1 3  56 13 o 13.22000 0.4148000 12.80000 0.5561000 13.63000 0.6157000 -0.8245000     0.8297000 
1 1 1 3  56 15 o 5.350000 0.8341000 4.133000 1.294000  6.567000 1.053000  -2.433000      1.668000  
1 1 1 3  56 17 o 4.205000 0.8744000 4.465000 1.124000  3.944000 1.340000  0.5209000      1.749000  
1 1 1 3  56 19 o 5.718000 0.8463000 5.545000 1.221000  5.892000 1.172000  -0.3465000     1.693000  
1 1 1 3  56 21 o 5.994000 0.7955000 5.752000 1.195000  6.237000 1.050000  -0.4851000     1.591000  
1 1 1 3  56 23 f 5.958000 0.7731000 6.221000 1.042000  5.695000 1.143000  0.5261000      1.546000  
1 1 1 3  56 25 o 4.621000 0.9269000 4.015000 1.352000  5.226000 1.269000  -1.211000      1.854000  
1 1 1 3  56 27 o 5.628000 0.8514000 6.691000 1.004000  4.565000 1.376000  2.127000       1.703000  
1 1 1 3  56 29 o 6.349000 0.7599000 6.788000 1.013000  5.911000 1.133000  0.8774000      1.520000  
1 1 1 3  56 31 o 4.021000 1.057000  3.579000 1.418000  4.463000 1.568000  -0.8843000     2.114000  
1 1 1 3  57 0  o 2.606000 1.148000  2.606000 1.148000  2.606000 1.148000  0.000000       0.000000  
1 1 1 3  57 2  o 5.255000 0.9055000 6.171000 0.9839000 4.339000 1.520000  1.833000       1.811000  
1 1 1 3  57 4  o 2.862000 0.8545000 3.055000 1.254000  2.669000 1.161000  0.3863000      1.709000  
1 1 1 3  57 6  o 5.138000 0.9014000 5.756000 1.038000  4.520000 1.474000  1.235000       1.803000  
1 1 1 3  57 8  o 10.82000 0.5280000 11.23000 0.5869000 10.41000 0.8779000 0.8242000      1.056000  
1 1 1 3  57 10 o 15.02000 0.3753000 14.58000 0.4883000 15.46000 0.5699000 -0.8840000     0.7505000 
1 1 1 3  57 12 o 9.850000 0.4695000 9.646000 0.6275000 10.05000 0.6985000 -0.4089000     0.9389000 
1 1 1 3  57 14 o 3.439000 0.8393000 4.448000 1.265000  2.431000 1.104000  2.017000       1.679000  
1 1 1 3  57 16 o 6.538000 0.7568000 5.691000 1.172000  7.386000 0.9581000 -1.695000      1.514000  
1 1 1 3  57 18 o 6.400000 0.7014000 5.821000 0.9505000 6.979000 1.032000  -1.158000      1.403000  
1 1 1 3  57 20 o 4.642000 0.9430000 4.252000 1.404000  5.031000 1.259000  -0.7798000     1.886000  
1 1 1 3  57 22 o 7.273000 0.6589000 6.783000 0.9755000 7.764000 0.8860000 -0.9815000     1.318000  
1 1 1 3  57 24 o 8.021000 0.6803000 7.792000 1.037000  8.249000 0.8806000 -0.4570000     1.361000  
1 1 1 3  57 26 o 7.353000 0.7309000 7.917000 1.004000  6.789000 1.063000  1.128000       1.462000  
1 1 1 3  57 28 o 3.056000 0.8844000 3.601000 1.334000  2.512000 1.162000  1.089000       1.769000  
1 1 1 3  58 1  o 4.602000 0.9147000 4.459000 1.367000  4.744000 1.216000  -0.2845000     1.829000  
1 1 1 3  58 3  o 4.758000 0.8661000 3.865000 1.325000  5.650000 1.116000  -1.785000      1.732000  
1 1 1 3  58 5  o 3.310000 0.8783000 3.568000 1.273000  3.052000 1.210000  0.5161000      1.757000  
1 1 1 3  58 7  o 5.506000 0.9595000 5.861000 1.094000  5.151000 1.577000  0.7105000      1.919000  
1 1 1 3  58 9  o 4.654000 0.9619000 4.590000 1.122000  4.717000 1.563000  -0.1269000     1.924000  
1 1 1 3  58 11 o 5.316000 0.8101000 6.251000 0.9783000 4.382000 1.292000  1.869000       1.620000  
1 1 1 3  58 13 o 2.410000 0.7790000 2.169000 1.009000  2.650000 1.188000  -0.4808000     1.558000  
1 1 1 3  58 15 o 6.978000 0.7227000 6.501000 1.088000  7.454000 0.9519000 -0.9528000     1.445000  
1 1 1 3  58 17 o 6.583000 0.7721000 6.597000 1.041000  6.570000 1.140000  0.2778000E-01  1.544000  
1 1 1 3  58 19 o 3.226000 0.9089000 3.286000 1.341000  3.165000 1.227000  0.1217000      1.818000  
1 1 1 3  58 21 o 4.198000 0.9476000 4.517000 1.305000  3.879000 1.375000  0.6376000      1.895000  
1 1 1 3  58 23 o 3.427000 0.9074000 3.500000 1.295000  3.354000 1.271000  0.1459000      1.815000  
1 1 1 3  58 25 o 3.565000 0.9285000 4.036000 1.302000  3.094000 1.324000  0.9428000      1.857000  
1 1 1 3  59 0  o 7.400000 0.8817000 7.400000 0.8817000 7.400000 0.8817000 0.000000       0.000000  
1 1 1 3  59 2  o 7.677000 0.6062000 7.998000 0.8573000 7.356000 0.8572000 0.6423000      1.212000  
1 1 1 3  59 4  o 3.243000 0.8596000 3.913000 1.263000  2.573000 1.166000  1.340000       1.719000  
1 1 1 3  59 6  o 3.634000 0.8564000 4.536000 1.264000  2.732000 1.156000  1.804000       1.713000  
1 1 1 3  59 8  o 5.265000 0.8382000 5.474000 0.9927000 5.055000 1.351000  0.4183000      1.676000  
1 1 1 3  59 10 o 5.579000 1.125000  5.654000 1.093000  5.505000 1.966000  0.1488000      2.249000  
1 1 1 3  59 12 o 12.57000 0.5840000 13.51000 0.6598000 11.62000 0.9637000 1.894000       1.168000  
1 1 1 3  59 14 o 6.628000 0.9415000 6.671000 0.9480000 6.584000 1.627000  0.8699000E-01  1.883000  
1 1 1 3  59 16 o 3.319000 0.8854000 2.863000 1.159000  3.775000 1.339000  -0.9113000     1.771000  
1 1 1 3  59 18 o 7.609000 0.7220000 8.096000 0.9255000 7.122000 1.108000  0.9733000      1.444000  
1 1 1 3  59 20 o 5.648000 0.8052000 4.532000 1.305000  6.764000 0.9433000 -2.232000      1.610000  
1 1 1 3  59 22 o 4.878000 0.8904000 5.680000 1.154000  4.075000 1.356000  1.605000       1.781000  
1 1 1 3  59 24 o 8.735000 1.848000  8.735000 1.848000  ?        ?         ?              ?         
1 1 1 3  60 1  o 3.138000 0.8741000 3.532000 1.268000  2.744000 1.203000  0.7886000      1.748000  
1 1 1 3  60 3  o 4.194000 0.9455000 5.144000 1.347000  3.243000 1.327000  1.901000       1.891000  
1 1 1 3  60 5  o 6.971000 0.7121000 8.078000 0.9506000 5.865000 1.060000  2.213000       1.424000  
1 1 1 3  60 7  o 5.398000 0.7265000 3.505000 1.122000  7.291000 0.9228000 -3.786000      1.453000  
1 1 1 3  60 9  o 6.759000 0.7059000 5.956000 0.9662000 7.561000 1.029000  -1.605000      1.412000  
1 1 1 3  60 11 o 4.835000 0.9049000 4.179000 1.226000  5.492000 1.331000  -1.313000      1.810000  
1 1 1 3  60 13 o 9.212000 0.5350000 8.930000 0.7258000 9.494000 0.7861000 -0.5638000     1.070000  
1 1 1 3  60 15 o 4.801000 1.138000  4.607000 1.154000  4.995000 1.962000  -0.3887000     2.276000  
1 1 1 3  60 17 o 4.603000 0.9877000 3.160000 1.307000  6.046000 1.481000  -2.886000      1.975000  
1 1 1 3  60 19 o 5.535000 0.8897000 6.466000 1.005000  4.603000 1.468000  1.862000       1.779000  
1 1 1 3  61 0  f 3.891000 1.382000  3.891000 1.382000  3.891000 1.382000  0.000000       0.000000  
1 1 1 3  61 2  o 6.768000 0.7372000 6.374000 1.185000  7.163000 0.8767000 -0.7890000     1.474000  
1 1 1 3  61 4  o 4.913000 0.8697000 4.572000 1.289000  5.254000 1.167000  -0.6820000     1.739000  
1 1 1 3  61 6  o 5.211000 0.9416000 4.612000 1.503000  5.810000 1.135000  -1.198000      1.883000  
1 1 1 3  61 8  o 10.59000 0.5018000 10.97000 0.6697000 10.22000 0.7475000 0.7537000      1.004000  
1 1 1 3  61 10 o 8.239000 0.6406000 6.901000 0.9192000 9.577000 0.8924000 -2.676000      1.281000  
1 1 1 3  61 12 o 5.893000 0.8312000 5.800000 1.094000  5.985000 1.252000  -0.1843000     1.662000  
1 1 1 3  61 14 o 5.040000 0.8577000 4.454000 1.115000  5.627000 1.304000  -1.173000      1.715000  
1 1 1 3  61 16 o 2.970000 0.8857000 2.944000 1.178000  2.996000 1.323000  -0.5134000E-01 1.771000  
1 1 1 3  62 1  o 5.912000 0.7768000 5.029000 1.246000  6.794000 0.9278000 -1.766000      1.554000  
1 1 1 3  62 3  o 2.538000 0.8220000 2.669000 1.236000  2.407000 1.084000  0.2617000      1.644000  
1 1 1 3  62 5  o 6.062000 0.7391000 5.954000 1.114000  6.170000 0.9717000 -0.2164000     1.478000  
1 1 1 3  62 7  o 6.768000 0.7067000 7.360000 0.7575000 6.176000 1.193000  1.184000       1.413000  
1 1 1 3  62 9  o 3.522000 0.9792000 3.128000 1.233000  3.916000 1.522000  -0.7884000     1.958000  
1 1 1 3  62 11 o 5.814000 0.8224000 5.461000 0.9782000 6.167000 1.322000  -0.7065000     1.645000  
1 1 1 3  63 0  o 6.835000 1.304000  6.835000 1.304000  6.835000 1.304000  0.000000       0.000000  
1 1 1 3  63 2  o 7.713000 0.8672000 7.951000 1.186000  7.474000 1.265000  0.4764000      1.734000  
1 1 1 4  0  0  o 51.58000 0.7096000 51.58000 0.7096000 51.58000 0.7096000 0.000000       0.000000  
1 1 1 4  0  2  o 23.73000 0.2452000 23.73000 0.2452000 23.73000 0.2452000 0.000000       0.000000  
1 1 1 4  0  4  o 45.28000 0.4431000 45.28000 0.4431000 45.28000 0.4431000 0.000000       0.000000  
1 1 1 4  0  6  o 11.28000 0.2721000 11.28000 0.2721000 11.28000 0.2721000 0.000000       0.000000  
1 1 1 4  0  8  o 91.50000 0.8824000 91.50000 0.8824000 91.50000 0.8824000 0.000000       0.000000  
1 1 1 4  0  10 o 10.23000 0.2347000 10.23000 0.2347000 10.23000 0.2347000 0.000000       0.000000  
1 1 1 4  0  12 o 88.94000 0.8612000 88.94000 0.8612000 88.94000 0.8612000 0.000000       0.000000  
1 1 1 4  0  14 o 54.44000 0.6233000 54.44000 0.6233000 54.44000 0.6233000 0.000000       0.000000  
1 1 1 4  0  16 o 33.88000 0.3640000 33.88000 0.3640000 33.88000 0.3640000 0.000000       0.000000  
1 1 1 4  0  18 o 128.8000 1.435000  128.8000 1.435000  128.8000 1.435000  0.000000       0.000000  
1 1 1 4  0  20 o 48.30000 0.4956000 48.30000 0.4956000 48.30000 0.4956000 0.000000       0.000000  
1 1 1 4  0  22 f 114.0000 1.104000  114.0000 1.104000  114.0000 1.104000  0.000000       0.000000  
1 1 1 4  0  24 o 56.74000 0.6651000 56.74000 0.6651000 56.74000 0.6651000 0.000000       0.000000  
1 1 1 4  0  26 o 155.7000 1.733000  155.7000 1.733000  155.7000 1.733000  0.000000       0.000000  
1 1 1 4  0  28 o 114.0000 1.277000  114.0000 1.277000  114.0000 1.277000  0.000000       0.000000  
1 1 1 4  0  30 o 43.97000 0.5614000 43.97000 0.5614000 43.97000 0.5614000 0.000000       0.000000  
1 1 1 4  0  32 o 17.33000 0.5448000 17.33000 0.5448000 17.33000 0.5448000 0.000000       0.000000  
1 1 1 4  0  34 o 48.23000 0.5272000 48.23000 0.5272000 48.23000 0.5272000 0.000000       0.000000  
1 1 1 4  0  36 o 4.322000 1.356000  4.322000 1.356000  4.322000 1.356000  0.000000       0.000000  
1 1 1 4  0  38 o 9.850000 0.7821000 9.850000 0.7821000 9.850000 0.7821000 0.000000       0.000000  
1 1 1 4  0  40 o 30.23000 0.5114000 30.23000 0.5114000 30.23000 0.5114000 0.000000       0.000000  
1 1 1 4  0  42 o 30.76000 0.6200000 30.76000 0.6200000 30.76000 0.6200000 0.000000       0.000000  
1 1 1 4  0  44 o 16.77000 0.5448000 16.77000 0.5448000 16.77000 0.5448000 0.000000       0.000000  
1 1 1 4  0  46 o 9.041000 0.9493000 9.041000 0.9493000 9.041000 0.9493000 0.000000       0.000000  
1 1 1 4  0  48 o 17.81000 0.5256000 17.81000 0.5256000 17.81000 0.5256000 0.000000       0.000000  
1 1 1 4  0  50 o 10.28000 0.8175000 10.28000 0.8175000 10.28000 0.8175000 0.000000       0.000000  
1 1 1 4  0  52 o 3.732000 1.419000  3.732000 1.419000  3.732000 1.419000  0.000000       0.000000  
1 1 1 4  0  54 o 4.975000 1.709000  4.975000 1.709000  4.975000 1.709000  0.000000       0.000000  
1 1 1 4  0  56 o 3.571000 1.570000  3.571000 1.570000  3.571000 1.570000  0.000000       0.000000  
1 1 1 4  0  58 o 16.87000 0.5618000 16.87000 0.5618000 16.87000 0.5618000 0.000000       0.000000  
1 1 1 4  0  60 o 2.608000 1.202000  2.608000 1.202000  2.608000 1.202000  0.000000       0.000000  
1 1 1 4  0  62 f 5.401000 1.562000  5.401000 1.562000  5.401000 1.562000  0.000000       0.000000  
1 1 1 4  0  64 o 4.893000 1.570000  4.893000 1.570000  4.893000 1.570000  0.000000       0.000000  
1 1 1 4  0  66 o 3.338000 1.472000  3.338000 1.472000  3.338000 1.472000  0.000000       0.000000  
1 1 1 4  0  68 o 4.562000 1.439000  4.562000 1.439000  4.562000 1.439000  0.000000       0.000000  
1 1 1 4  1  1  o 29.48000 0.2090000 29.43000 0.2954000 29.52000 0.2958000 -0.9576000E-01 0.4181000 
1 1 1 4  1  3  o 143.6000 0.9743000 144.5000 1.385000  142.8000 1.370000  1.655000       1.949000  
1 1 1 4  1  5  o 108.7000 0.7385000 108.7000 1.045000  108.7000 1.044000  0.2924000E-01  1.477000  
1 1 1 4  1  7  f 20.78000 0.1673000 20.72000 0.2353000 20.83000 0.2379000 -0.1146000     0.3346000 
1 1 1 4  1  9  o 54.52000 0.3785000 53.97000 0.5295000 55.06000 0.5410000 -1.089000      0.7570000 
1 1 1 4  1  11 o 60.81000 0.5171000 61.09000 0.8456000 60.54000 0.5954000 0.5579000      1.034000  
1 1 1 4  1  13 o 31.53000 0.2578000 31.49000 0.3885000 31.58000 0.3388000 -0.9776000E-01 0.5155000 
1 1 1 4  1  15 o 38.07000 0.3630000 37.90000 0.4570000 38.24000 0.5641000 -0.3341000     0.7259000 
1 1 1 4  1  17 o 18.86000 0.2122000 18.69000 0.2757000 19.02000 0.3226000 -0.3306000     0.4243000 
1 1 1 4  1  19 o 22.87000 0.2144000 22.80000 0.3023000 22.93000 0.3040000 -0.1309000     0.4287000 
1 1 1 4  1  21 o 98.38000 0.6764000 98.36000 0.9561000 98.41000 0.9570000 -0.4186000E-01 1.353000  
1 1 1 4  1  23 o 54.86000 0.3951000 54.63000 0.5567000 55.09000 0.5608000 -0.4632000     0.7902000 
1 1 1 4  1  25 o 92.57000 0.6411000 93.49000 0.9158000 91.66000 0.8976000 1.834000       1.282000  
1 1 1 4  1  27 o 130.9000 0.8957000 130.3000 1.261000  131.4000 1.272000  -1.196000      1.791000  
1 1 1 4  1  29 o 74.83000 0.6103000 73.84000 0.8527000 75.82000 0.8735000 -1.980000      1.221000  
1 1 1 4  1  31 o 94.48000 0.6567000 94.18000 0.9252000 94.77000 0.9323000 -0.5945000     1.313000  
1 1 1 4  1  33 o 37.21000 0.3486000 37.02000 0.5304000 37.39000 0.4525000 -0.3767000     0.6972000 
1 1 1 4  1  35 o 32.39000 0.3501000 32.38000 0.5019000 32.40000 0.4882000 -0.2639000E-01 0.7002000 
1 1 1 4  1  37 o 49.14000 0.3794000 48.82000 0.5346000 49.47000 0.5385000 -0.6522000     0.7588000 
1 1 1 4  1  39 o 14.18000 0.4914000 13.80000 0.5219000 14.55000 0.8327000 -0.7510000     0.9828000 
1 1 1 4  1  41 o 41.29000 0.3486000 40.83000 0.4896000 41.74000 0.4963000 -0.9130000     0.6971000 
1 1 1 4  1  43 o 42.08000 0.4111000 42.25000 0.5812000 41.92000 0.5814000 0.3302000      0.8221000 
1 1 1 4  1  45 f 9.536000 0.7658000 10.43000 0.9740000 8.638000 1.182000  1.795000       1.532000  
1 1 1 4  1  47 o 22.40000 0.3505000 22.48000 0.5053000 22.32000 0.4859000 0.1552000      0.7011000 
1 1 1 4  1  49 o 22.83000 0.3417000 22.70000 0.4867000 22.96000 0.4799000 -0.2536000     0.6835000 
1 1 1 4  1  51 o 11.48000 0.5653000 11.51000 0.7424000 11.45000 0.8528000 0.5623000E-01  1.131000  
1 1 1 4  1  53 o 11.00000 0.5576000 10.69000 0.7108000 11.31000 0.8593000 -0.6209000     1.115000  
1 1 1 4  1  55 f 13.28000 0.4521000 13.08000 0.6404000 13.48000 0.6383000 -0.3938000     0.9042000 
1 1 1 4  1  57 o 11.95000 0.5981000 11.85000 0.8353000 12.06000 0.8562000 -0.2099000     1.196000  
1 1 1 4  1  59 o 3.794000 0.9869000 4.161000 1.422000  3.428000 1.368000  0.7335000      1.974000  
1 1 1 4  1  61 o 10.19000 0.5935000 10.74000 0.8174000 9.647000 0.8607000 1.089000       1.187000  
1 1 1 4  1  63 o 3.660000 0.9991000 3.010000 1.309000  4.310000 1.509000  -1.300000      1.998000  
1 1 1 4  1  65 o 5.807000 1.001000  6.932000 1.206000  4.682000 1.597000  2.249000       2.001000  
1 1 1 4  1  67 o 2.924000 0.8904000 2.565000 1.173000  3.283000 1.340000  -0.7189000     1.781000  
1 1 1 4  2  0  o 91.17000 0.8770000 91.17000 0.8770000 91.17000 0.8770000 0.000000       0.000000  
1 1 1 4  2  2  o 75.01000 0.5113000 75.69000 0.7295000 74.34000 0.7167000 1.354000       1.023000  
1 1 1 4  2  4  o 88.56000 0.6028000 88.64000 0.8533000 88.49000 0.8518000 0.1493000      1.206000  
1 1 1 4  2  6  o 102.5000 0.6974000 101.9000 0.9801000 103.2000 0.9923000 -1.262000      1.395000  
1 1 1 4  2  8  o 60.70000 0.4327000 60.52000 0.5275000 60.89000 0.6861000 -0.3785000     0.8654000 
1 1 1 4  2  10 o 90.08000 0.6361000 90.32000 1.007000  89.83000 0.7773000 0.4879000      1.272000  
1 1 1 4  2  12 o 33.42000 0.2677000 33.52000 0.4040000 33.32000 0.3515000 0.2042000      0.5355000 
1 1 1 4  2  14 f 46.65000 0.3597000 46.44000 0.4685000 46.87000 0.5459000 -0.4298000     0.7194000 
1 1 1 4  2  16 o 99.01000 0.7315000 99.54000 0.9639000 98.47000 1.100000  1.071000       1.463000  
1 1 1 4  2  18 o 58.48000 0.4453000 57.70000 0.6668000 59.26000 0.5903000 -1.557000      0.8906000 
1 1 1 4  2  20 o 85.02000 0.5872000 84.06000 0.8213000 85.97000 0.8395000 -1.913000      1.174000  
1 1 1 4  2  22 o 54.93000 0.3946000 54.58000 0.5548000 55.28000 0.5612000 -0.7044000     0.7891000 
1 1 1 4  2  24 o 73.88000 0.5178000 73.06000 0.7248000 74.70000 0.7397000 -1.641000      1.036000  
1 1 1 4  2  26 o 63.33000 0.5228000 63.50000 0.7402000 63.15000 0.7384000 0.3452000      1.046000  
1 1 1 4  2  28 o 79.64000 0.6018000 79.47000 0.9069000 79.80000 0.7914000 -0.3286000     1.204000  
1 1 1 4  2  30 o 80.60000 0.6560000 81.05000 0.9329000 80.16000 0.9224000 0.8966000      1.312000  
1 1 1 4  2  32 o 59.00000 0.4329000 58.87000 0.6098000 59.13000 0.6147000 -0.2643000     0.8659000 
1 1 1 4  2  34 o 19.23000 0.3638000 19.30000 0.5135000 19.15000 0.5155000 0.1487000      0.7276000 
1 1 1 4  2  36 o 30.45000 0.3016000 30.37000 0.4255000 30.52000 0.4277000 -0.1483000     0.6033000 
1 1 1 4  2  38 o 10.55000 0.4904000 10.35000 0.6843000 10.75000 0.7026000 -0.3984000     0.9808000 
1 1 1 4  2  40 o 28.62000 0.3396000 28.65000 0.5074000 28.60000 0.4516000 0.5141000E-01  0.6793000 
1 1 1 4  2  42 o 20.42000 0.3963000 20.29000 0.6389000 20.56000 0.4690000 -0.2679000     0.7926000 
1 1 1 4  2  44 o 6.946000 0.8966000 6.707000 1.175000  7.185000 1.355000  -0.4779000     1.793000  
1 1 1 4  2  46 f 10.16000 0.6583000 9.963000 1.038000  10.36000 0.8099000 -0.3968000     1.317000  
1 1 1 4  2  48 o 9.933000 0.6392000 10.23000 0.8695000 9.631000 0.9371000 0.6029000      1.278000  
1 1 1 4  2  50 o 11.55000 0.5221000 11.73000 0.7276000 11.36000 0.7490000 0.3718000      1.044000  
1 1 1 4  2  52 o 7.675000 0.8248000 7.800000 1.127000  7.550000 1.205000  0.2498000      1.650000  
1 1 1 4  2  54 o 9.971000 0.6365000 9.086000 0.8371000 10.86000 0.9590000 -1.771000      1.273000  
1 1 1 4  2  56 o 14.36000 0.4231000 14.61000 0.6030000 14.11000 0.5935000 0.4992000      0.8461000 
1 1 1 4  2  58 o 8.904000 0.6392000 8.595000 0.9636000 9.214000 0.8401000 -0.6187000     1.278000  
1 1 1 4  2  60 f 3.333000 0.9615000 2.952000 1.285000  3.714000 1.431000  -0.7613000     1.923000  
1 1 1 4  2  62 o 3.942000 1.024000  5.142000 1.625000  2.743000 1.247000  2.399000       2.048000  
1 1 1 4  2  64 o 8.309000 0.8063000 9.016000 0.9895000 7.602000 1.273000  1.414000       1.613000  
1 1 1 4  2  66 o 2.622000 0.8739000 2.603000 1.238000  2.642000 1.234000  -0.3894000E-01 1.748000  
1 1 1 4  2  68 o 3.230000 0.9522000 3.232000 1.331000  3.229000 1.362000  0.2877000E-02  1.904000  
1 1 1 4  3  1  o 58.33000 0.3994000 58.30000 0.5645000 58.36000 0.5650000 -0.5555000E-01 0.7987000 
1 1 1 4  3  3  o 89.55000 0.6588000 89.04000 0.8567000 90.06000 1.001000  -1.017000      1.318000  
1 1 1 4  3  5  o 44.95000 0.3123000 45.31000 0.4449000 44.59000 0.4384000 0.7131000      0.6246000 
1 1 1 4  3  7  o 79.98000 0.5654000 79.57000 0.6875000 80.38000 0.8977000 -0.8135000     1.131000  
1 1 1 4  3  9  o 73.47000 0.5042000 73.70000 0.7148000 73.24000 0.7112000 0.4612000      1.008000  
1 1 1 4  3  11 o 38.49000 0.3567000 38.00000 0.5442000 38.98000 0.4612000 -0.9861000     0.7133000 
1 1 1 4  3  13 o 43.67000 0.3228000 44.03000 0.5114000 43.31000 0.3939000 0.7133000      0.6455000 
1 1 1 4  3  15 o 58.56000 0.5303000 58.95000 0.6760000 58.16000 0.8173000 0.7819000      1.061000  
1 1 1 4  3  17 o 57.38000 0.4041000 57.10000 0.5684000 57.65000 0.5746000 -0.5479000     0.8082000 
1 1 1 4  3  19 o 57.82000 0.4425000 57.80000 0.6704000 57.84000 0.5777000 -0.4711000E-01 0.8850000 
1 1 1 4  3  21 o 63.15000 0.4448000 63.51000 0.6323000 62.78000 0.6257000 0.7326000      0.8895000 
1 1 1 4  3  23 o 88.41000 0.6119000 88.84000 0.8695000 87.98000 0.8611000 0.8534000      1.224000  
1 1 1 4  3  25 o 80.91000 0.6096000 80.93000 0.7986000 80.88000 0.9212000 0.5804000E-01  1.219000  
1 1 1 4  3  27 o 52.88000 0.4794000 54.12000 0.7910000 51.64000 0.5417000 2.483000       0.9587000 
1 1 1 4  3  29 o 58.37000 0.5490000 57.36000 0.8431000 59.39000 0.7035000 -2.022000      1.098000  
1 1 1 4  3  31 o 42.74000 0.4413000 42.65000 0.5654000 42.83000 0.6778000 -0.1729000     0.8827000 
1 1 1 4  3  33 f 17.58000 0.3629000 17.46000 0.5524000 17.71000 0.4707000 -0.2423000     0.7258000 
1 1 1 4  3  35 o 63.85000 0.4635000 63.26000 0.6489000 64.43000 0.6620000 -1.167000      0.9270000 
1 1 1 4  3  37 o 38.00000 0.3278000 37.67000 0.4611000 38.33000 0.4660000 -0.6555000     0.6556000 
1 1 1 4  3  39 o 29.29000 0.3320000 29.38000 0.4294000 29.20000 0.5066000 0.1760000      0.6641000 
1 1 1 4  3  41 f 65.01000 0.5114000 64.92000 0.7693000 65.09000 0.6739000 -0.1664000     1.023000  
1 1 1 4  3  43 o 15.63000 0.6536000 15.75000 0.6203000 15.50000 1.151000  0.2572000      1.307000  
1 1 1 4  3  45 o 31.19000 0.3318000 31.02000 0.4685000 31.36000 0.4699000 -0.3398000     0.6635000 
1 1 1 4  3  47 o 13.21000 0.4908000 13.07000 0.6966000 13.34000 0.6914000 -0.2609000     0.9815000 
1 1 1 4  3  49 o 19.42000 0.3924000 19.36000 0.5367000 19.49000 0.5727000 -0.1265000     0.7849000 
1 1 1 4  3  51 o 9.302000 0.6755000 9.134000 0.9236000 9.470000 0.9860000 -0.3360000     1.351000  
1 1 1 4  3  53 o 19.84000 0.4146000 19.82000 0.6759000 19.86000 0.4804000 -0.4346000E-01 0.8293000 
1 1 1 4  3  55 o 19.99000 0.4489000 19.99000 0.5027000 20.00000 0.7438000 -0.1310000E-01 0.8977000 
1 1 1 4  3  57 o 12.25000 0.4900000 12.24000 0.7406000 12.25000 0.6419000 -0.1051000E-01 0.9801000 
1 1 1 4  3  59 o 8.402000 0.7006000 7.925000 1.046000  8.878000 0.9321000 -0.9531000     1.401000  
1 1 1 4  3  61 o 13.61000 0.5352000 13.62000 0.7660000 13.61000 0.7477000 0.1314000E-01  1.070000  
1 1 1 4  3  63 o 6.928000 0.9732000 6.568000 1.589000  7.288000 1.124000  -0.7192000     1.946000  
1 1 1 4  3  65 o 9.697000 0.8118000 8.696000 1.000000  10.70000 1.279000  -2.002000      1.624000  
1 1 1 4  3  67 o 3.339000 0.9516000 2.950000 1.258000  3.728000 1.429000  -0.7778000     1.903000  
1 1 1 4  4  0  f 107.9000 1.036000  107.9000 1.036000  107.9000 1.036000  0.000000       0.000000  
1 1 1 4  4  2  o 56.69000 0.4204000 56.96000 0.5529000 56.42000 0.6336000 0.5400000      0.8409000 
1 1 1 4  4  4  o 84.12000 0.6193000 84.25000 0.8119000 83.98000 0.9354000 0.2675000      1.239000  
1 1 1 4  4  6  o 73.05000 0.5169000 73.03000 0.6319000 73.07000 0.8183000 -0.3773000E-01 1.034000  
1 1 1 4  4  8  o 39.82000 0.2824000 39.99000 0.4005000 39.65000 0.3981000 0.3397000      0.5647000 
1 1 1 4  4  10 o 72.22000 0.5360000 72.06000 0.8082000 72.37000 0.7041000 -0.3081000     1.072000  
1 1 1 4  4  12 o 6.151000 0.2513000 6.089000 0.3933000 6.212000 0.3130000 -0.1222000     0.5027000 
1 1 1 4  4  14 o 71.99000 0.5888000 72.47000 0.9973000 71.50000 0.6261000 0.9752000      1.178000  
1 1 1 4  4  16 o 34.44000 0.3000000 34.85000 0.4232000 34.02000 0.4252000 0.8389000      0.5999000 
1 1 1 4  4  18 o 34.90000 0.2677000 34.40000 0.3734000 35.40000 0.3837000 -0.9934000     0.5354000 
1 1 1 4  4  20 o 90.19000 0.6216000 88.92000 0.8670000 91.46000 0.8911000 -2.536000      1.243000  
1 1 1 4  4  22 o 86.87000 0.6012000 87.05000 0.8519000 86.70000 0.8487000 0.3479000      1.202000  
1 1 1 4  4  24 o 115.3000 0.7907000 114.7000 1.112000  115.9000 1.124000  -1.180000      1.581000  
1 1 1 4  4  26 o 73.62000 0.5596000 73.57000 0.8462000 73.67000 0.7326000 -0.9863000E-01 1.119000  
1 1 1 4  4  28 o 14.86000 0.3603000 14.72000 0.4683000 15.00000 0.5476000 -0.2808000     0.7205000 
1 1 1 4  4  30 f 41.97000 0.5412000 41.82000 0.4770000 42.12000 0.9716000 -0.2988000     1.082000  
1 1 1 4  4  32 f 33.99000 0.3081000 33.99000 0.4385000 33.99000 0.4330000 0.3323000E-02  0.6163000 
1 1 1 4  4  34 o 39.79000 0.3857000 40.49000 0.5502000 39.09000 0.5408000 1.402000       0.7715000 
1 1 1 4  4  36 o 56.80000 0.4206000 56.32000 0.5913000 57.28000 0.5982000 -0.9567000     0.8411000 
1 1 1 4  4  38 o 20.03000 0.3124000 19.97000 0.4415000 20.08000 0.4420000 -0.1079000     0.6248000 
1 1 1 4  4  40 o 19.50000 0.4086000 20.44000 0.6044000 18.56000 0.5499000 1.884000       0.8171000 
1 1 1 4  4  42 o 24.69000 0.3542000 24.48000 0.5396000 24.91000 0.4589000 -0.4266000     0.7084000 
1 1 1 4  4  44 o 22.37000 0.3816000 22.30000 0.4899000 22.43000 0.5851000 -0.1324000     0.7631000 
1 1 1 4  4  46 o 34.88000 0.4151000 34.05000 0.6701000 35.72000 0.4900000 -1.669000      0.8301000 
1 1 1 4  4  48 o 38.05000 0.4043000 37.90000 0.5713000 38.20000 0.5721000 -0.3017000     0.8085000 
1 1 1 4  4  50 o 4.579000 1.065000  4.452000 1.533000  4.706000 1.479000  -0.2535000     2.130000  
1 1 1 4  4  52 o 15.82000 0.4598000 16.41000 0.7271000 15.23000 0.5631000 1.184000       0.9197000 
1 1 1 4  4  54 o 11.33000 0.5165000 11.51000 0.7093000 11.15000 0.7510000 0.3503000      1.033000  
1 1 1 4  4  56 o 25.07000 0.3322000 24.86000 0.4734000 25.29000 0.4662000 -0.4333000     0.6644000 
1 1 1 4  4  58 o 12.97000 0.4643000 12.60000 0.6810000 13.34000 0.6314000 -0.7386000     0.9287000 
1 1 1 4  4  60 o 5.309000 1.005000  5.830000 1.385000  4.788000 1.457000  1.042000       2.011000  
1 1 1 4  4  62 o 14.56000 0.5718000 14.13000 0.9794000 14.98000 0.5906000 -0.8451000     1.144000  
1 1 1 4  4  64 o 10.91000 0.5891000 10.66000 0.7546000 11.16000 0.9049000 -0.4913000     1.178000  
1 1 1 4  4  66 o 3.840000 1.032000  3.453000 1.386000  4.227000 1.530000  -0.7742000     2.064000  
1 1 1 4  5  1  o 53.12000 0.3954000 53.06000 0.5156000 53.19000 0.5995000 -0.1225000     0.7907000 
1 1 1 4  5  3  o 86.01000 0.6777000 86.19000 0.9600000 85.84000 0.9569000 0.3416000      1.355000  
1 1 1 4  5  5  o 105.3000 0.7738000 105.6000 1.017000  104.9000 1.166000  0.7782000      1.548000  
1 1 1 4  5  7  o 33.78000 0.2437000 33.90000 0.3454000 33.66000 0.3438000 0.2391000      0.4874000 
1 1 1 4  5  9  o 62.93000 0.4343000 62.93000 0.6143000 62.93000 0.6141000 0.4879000E-02  0.8686000 
1 1 1 4  5  11 o 43.55000 0.3980000 43.45000 0.5031000 43.65000 0.6169000 -0.2053000     0.7960000 
1 1 1 4  5  13 o 31.88000 0.2493000 32.47000 0.3944000 31.29000 0.3049000 1.179000       0.4985000 
1 1 1 4  5  15 o 51.54000 0.4199000 51.02000 0.5855000 52.06000 0.6019000 -1.042000      0.8397000 
1 1 1 4  5  17 o 54.22000 0.3950000 54.04000 0.6210000 54.40000 0.4882000 -0.3682000     0.7899000 
1 1 1 4  5  19 o 30.64000 0.2723000 30.69000 0.4144000 30.58000 0.3535000 0.1097000      0.5447000 
1 1 1 4  5  21 o 65.23000 0.4593000 64.98000 0.6471000 65.48000 0.6519000 -0.5029000     0.9185000 
1 1 1 4  5  23 o 34.13000 0.2811000 34.41000 0.4001000 33.85000 0.3950000 0.5584000      0.5622000 
1 1 1 4  5  25 o 84.21000 0.6331000 83.99000 0.8270000 84.44000 0.9589000 -0.4502000     1.266000  
1 1 1 4  5  27 o 96.77000 1.081000  94.86000 1.854000  98.69000 1.114000  -3.826000      2.163000  
1 1 1 4  5  29 o 32.99000 0.3233000 32.73000 0.4808000 33.24000 0.4324000 -0.5020000     0.6466000 
1 1 1 4  5  31 o 57.48000 0.4220000 57.03000 0.5924000 57.94000 0.6011000 -0.9103000     0.8439000 
1 1 1 4  5  33 o 46.12000 0.3603000 46.12000 0.5108000 46.11000 0.5083000 0.1754000E-01  0.7206000 
1 1 1 4  5  35 o 21.50000 0.3025000 21.39000 0.4274000 21.60000 0.4282000 -0.2051000     0.6050000 
1 1 1 4  5  37 o 57.82000 0.4276000 58.04000 0.6061000 57.60000 0.6033000 0.4365000      0.8552000 
1 1 1 4  5  39 o 36.33000 0.3469000 36.42000 0.4537000 36.23000 0.5249000 0.1925000      0.6938000 
1 1 1 4  5  41 o 32.70000 0.3495000 32.50000 0.5318000 32.90000 0.4536000 -0.3958000     0.6990000 
1 1 1 4  5  43 o 27.41000 0.5262000 27.93000 0.4606000 26.89000 0.9462000 1.040000       1.052000  
1 1 1 4  5  45 o 22.81000 0.3769000 22.62000 0.5008000 23.00000 0.5635000 -0.3819000     0.7539000 
1 1 1 4  5  47 o 9.792000 0.7218000 9.665000 1.042000  9.919000 0.9987000 -0.2542000     1.444000  
1 1 1 4  5  49 o 8.900000 0.6927000 9.655000 0.8860000 8.145000 1.065000  1.510000       1.385000  
1 1 1 4  5  51 o 10.49000 0.5478000 10.89000 0.7736000 10.09000 0.7759000 0.7977000      1.096000  
1 1 1 4  5  53 o 3.746000 1.031000  3.853000 1.534000  3.640000 1.379000  0.2136000      2.063000  
1 1 1 4  5  55 o 3.703000 1.006000  4.093000 1.394000  3.312000 1.450000  0.7811000      2.012000  
1 1 1 4  5  57 o 6.384000 0.8021000 6.000000 1.216000  6.768000 1.047000  -0.7683000     1.604000  
1 1 1 4  5  59 o 14.37000 0.4417000 14.24000 0.6527000 14.50000 0.5952000 -0.2518000     0.8833000 
1 1 1 4  5  61 o 10.82000 0.5761000 10.86000 0.7324000 10.79000 0.8894000 0.7030000E-01  1.152000  
1 1 1 4  5  63 o 5.556000 1.013000  4.157000 1.614000  6.955000 1.224000  -2.798000      2.026000  
1 1 1 4  5  65 o 4.533000 1.191000  3.754000 1.417000  5.312000 1.913000  -1.559000      2.381000  
1 1 1 4  5  67 o 3.625000 0.9914000 3.269000 1.367000  3.982000 1.436000  -0.7123000     1.983000  
1 1 1 4  6  0  o 55.98000 0.5440000 55.98000 0.5440000 55.98000 0.5440000 0.000000       0.000000  
1 1 1 4  6  2  o 70.01000 0.5540000 69.10000 0.7732000 70.91000 0.7936000 -1.811000      1.108000  
1 1 1 4  6  4  o 40.83000 0.3329000 40.60000 0.4683000 41.06000 0.4731000 -0.4591000     0.6657000 
1 1 1 4  6  6  o 109.5000 0.7451000 109.2000 1.051000  109.7000 1.056000  -0.4586000     1.490000  
1 1 1 4  6  8  o 44.32000 0.3120000 44.44000 0.4420000 44.20000 0.4404000 0.2347000      0.6239000 
1 1 1 4  6  10 o 41.92000 0.3831000 41.90000 0.4867000 41.94000 0.5917000 -0.4436000E-01 0.7661000 
1 1 1 4  6  12 o 40.89000 0.2945000 40.95000 0.4159000 40.83000 0.4171000 0.1246000      0.5890000 
1 1 1 4  6  14 o 41.70000 0.3863000 41.46000 0.5930000 41.94000 0.4954000 -0.4776000     0.7727000 
1 1 1 4  6  16 o 44.64000 0.3492000 45.01000 0.5262000 44.27000 0.4592000 0.7330000      0.6984000 
1 1 1 4  6  18 o 98.14000 0.6960000 98.97000 1.106000  97.31000 0.8454000 1.663000       1.392000  
1 1 1 4  6  20 o 49.35000 0.4368000 49.26000 0.7110000 49.43000 0.5077000 -0.1653000     0.8737000 
1 1 1 4  6  22 f 68.77000 0.4831000 68.70000 0.6832000 68.84000 0.6833000 -0.1342000     0.9663000 
1 1 1 4  6  24 o 60.03000 0.4677000 60.73000 0.7140000 59.33000 0.6042000 1.394000       0.9353000 
1 1 1 4  6  26 o 70.64000 0.6095000 70.88000 0.9944000 70.40000 0.7049000 0.4820000      1.219000  
1 1 1 4  6  28 o 69.02000 0.5305000 68.48000 0.7978000 69.55000 0.6996000 -1.072000      1.061000  
1 1 1 4  6  30 o 87.58000 0.9642000 88.53000 0.8734000 86.62000 1.719000  1.911000       1.928000  
1 1 1 4  6  32 o 26.12000 0.3145000 25.49000 0.4191000 26.75000 0.4691000 -1.259000      0.6290000 
1 1 1 4  6  34 o 7.601000 0.6891000 7.213000 1.089000  7.989000 0.8443000 -0.7758000     1.378000  
1 1 1 4  6  36 o 68.99000 0.4958000 69.47000 0.7049000 68.51000 0.6974000 0.9564000      0.9916000 
1 1 1 4  6  38 o 25.52000 0.4723000 24.93000 0.4231000 26.11000 0.8446000 -1.182000      0.9447000 
1 1 1 4  6  40 o 28.73000 0.3714000 28.19000 0.5968000 29.28000 0.4423000 -1.086000      0.7428000 
1 1 1 4  6  42 o 15.60000 0.4034000 15.90000 0.5542000 15.31000 0.5863000 0.5968000      0.8068000 
1 1 1 4  6  44 o 30.76000 0.4182000 31.42000 0.5360000 30.10000 0.6421000 1.319000       0.8364000 
1 1 1 4  6  46 o 54.37000 0.4236000 54.15000 0.5975000 54.58000 0.6005000 -0.4268000     0.8472000 
1 1 1 4  6  48 o 39.63000 0.3598000 39.94000 0.5100000 39.33000 0.5076000 0.6067000      0.7195000 
1 1 1 4  6  50 o 32.06000 0.3586000 31.85000 0.4743000 32.28000 0.5379000 -0.4252000     0.7171000 
1 1 1 4  6  52 o 14.89000 0.5408000 14.20000 0.9058000 15.57000 0.5912000 -1.364000      1.082000  
1 1 1 4  6  54 o 20.05000 0.3749000 20.43000 0.4809000 19.66000 0.5754000 0.7647000      0.7499000 
1 1 1 4  6  56 o 11.06000 0.5228000 10.66000 0.7633000 11.45000 0.7146000 -0.7885000     1.046000  
1 1 1 4  6  58 o 2.718000 0.8598000 3.347000 1.384000  2.089000 1.021000  1.258000       1.720000  
1 1 1 4  6  60 o 14.78000 0.4273000 14.71000 0.6169000 14.86000 0.5913000 -0.1592000     0.8546000 
1 1 1 4  6  62 o 3.755000 1.077000  4.067000 1.628000  3.444000 1.410000  0.6227000      2.154000  
1 1 1 4  6  64 o 7.966000 0.7992000 6.780000 1.158000  9.153000 1.101000  -2.373000      1.598000  
1 1 1 4  6  66 o 4.775000 1.161000  5.208000 1.650000  4.341000 1.633000  0.8677000      2.322000  
1 1 1 4  7  1  o 81.80000 0.6038000 81.52000 0.7874000 82.08000 0.9156000 -0.5589000     1.208000  
1 1 1 4  7  3  o 113.7000 0.8935000 113.7000 1.263000  113.7000 1.264000  0.1102000E-01  1.787000  
1 1 1 4  7  5  o 25.70000 0.2285000 25.76000 0.3233000 25.64000 0.3229000 0.1122000      0.4570000 
1 1 1 4  7  7  o 30.41000 0.2238000 30.12000 0.3135000 30.70000 0.3194000 -0.5819000     0.4476000 
1 1 1 4  7  9  o 111.1000 0.8739000 110.6000 1.231000  111.6000 1.241000  -0.9761000     1.748000  
1 1 1 4  7  11 o 34.47000 0.2545000 34.42000 0.3585000 34.51000 0.3614000 -0.9198000E-01 0.5091000 
1 1 1 4  7  13 o 55.60000 0.4201000 55.82000 0.6351000 55.38000 0.5500000 0.4329000      0.8402000 
1 1 1 4  7  15 o 38.09000 0.3041000 38.82000 0.4621000 37.35000 0.3956000 1.474000       0.6083000 
1 1 1 4  7  17 o 29.27000 0.2553000 29.19000 0.3785000 29.35000 0.3427000 -0.1623000     0.5106000 
1 1 1 4  7  19 o 74.35000 0.5322000 74.05000 0.8367000 74.64000 0.6579000 -0.5926000     1.064000  
1 1 1 4  7  21 o 78.00000 0.5587000 77.74000 0.8791000 78.27000 0.6898000 -0.5348000     1.117000  
1 1 1 4  7  23 o 93.26000 0.7450000 93.68000 1.059000  92.84000 1.048000  0.8447000      1.490000  
1 1 1 4  7  25 o 75.86000 0.6131000 76.24000 0.8691000 75.48000 0.8650000 0.7612000      1.226000  
1 1 1 4  7  27 o 33.92000 0.3201000 34.41000 0.4856000 33.43000 0.4172000 0.9807000      0.6402000 
1 1 1 4  7  29 o 81.33000 0.6167000 81.29000 0.8077000 81.36000 0.9321000 -0.6957000E-01 1.233000  
1 1 1 4  7  31 o 56.04000 0.4480000 55.68000 0.5827000 56.40000 0.6808000 -0.7166000     0.8961000 
1 1 1 4  7  33 o 43.20000 0.3471000 42.86000 0.4862000 43.55000 0.4955000 -0.6979000     0.6942000 
1 1 1 4  7  35 o 17.13000 0.3386000 16.34000 0.4966000 17.92000 0.4604000 -1.578000      0.6772000 
1 1 1 4  7  37 o 12.12000 0.4228000 12.07000 0.5914000 12.17000 0.6045000 -0.1000000     0.8456000 
1 1 1 4  7  39 o 16.80000 0.3792000 16.65000 0.5664000 16.95000 0.5044000 -0.2978000     0.7585000 
1 1 1 4  7  41 o 19.35000 0.3880000 18.61000 0.5531000 20.08000 0.5441000 -1.469000      0.7759000 
1 1 1 4  7  43 o 17.06000 0.4528000 17.47000 0.5165000 16.64000 0.7440000 0.8320000      0.9057000 
1 1 1 4  7  45 o 23.50000 0.3403000 23.29000 0.4924000 23.71000 0.4698000 -0.4220000     0.6806000 
1 1 1 4  7  47 o 11.03000 0.6143000 11.54000 0.8904000 10.51000 0.8464000 1.031000       1.229000  
1 1 1 4  7  49 o 21.15000 0.3595000 20.63000 0.5118000 21.67000 0.5049000 -1.038000      0.7189000 
1 1 1 4  7  51 f 29.57000 0.3806000 29.75000 0.5243000 29.39000 0.5518000 0.3557000      0.7612000 
1 1 1 4  7  53 o 10.20000 0.5542000 10.31000 0.7565000 10.10000 0.8102000 0.2130000      1.108000  
1 1 1 4  7  55 o 22.20000 0.3724000 21.99000 0.4910000 22.40000 0.5601000 -0.4033000     0.7449000 
1 1 1 4  7  57 o 10.35000 0.5565000 10.15000 0.7779000 10.54000 0.7959000 -0.3922000     1.113000  
1 1 1 4  7  59 o 12.69000 0.4899000 12.18000 0.7069000 13.20000 0.6783000 -1.025000      0.9797000 
1 1 1 4  7  61 o 5.299000 0.9821000 5.206000 1.407000  5.391000 1.370000  -0.1853000     1.964000  
1 1 1 4  7  63 o 14.82000 0.5076000 15.28000 0.7323000 14.37000 0.7031000 0.9008000      1.015000  
1 1 1 4  7  65 o 14.30000 0.4571000 14.99000 0.6444000 13.62000 0.6485000 1.368000       0.9142000 
1 1 1 4  7  67 o 4.594000 1.077000  4.311000 1.644000  4.876000 1.393000  -0.5648000     2.155000  
1 1 1 4  8  0  o 81.98000 0.7921000 81.98000 0.7921000 81.98000 0.7921000 0.000000       0.000000  
1 1 1 4  8  2  o 107.9000 0.8491000 109.5000 1.217000  106.2000 1.185000  3.276000       1.698000  
1 1 1 4  8  4  o 84.97000 0.6283000 84.88000 0.8220000 85.06000 0.9505000 -0.1734000     1.257000  
1 1 1 4  8  6  o 46.12000 0.3485000 45.92000 0.4555000 46.33000 0.5275000 -0.4115000     0.6969000 
1 1 1 4  8  8  o 66.27000 0.5268000 66.18000 0.7448000 66.36000 0.7453000 -0.1734000     1.054000  
1 1 1 4  8  10 o 33.44000 0.2669000 33.70000 0.3525000 33.17000 0.4009000 0.5240000      0.5338000 
1 1 1 4  8  12 o 40.38000 0.3142000 40.42000 0.4728000 40.34000 0.4139000 0.7865000E-01  0.6283000 
1 1 1 4  8  14 o 74.51000 0.6283000 74.17000 1.020000  74.85000 0.7344000 -0.6831000     1.257000  
1 1 1 4  8  16 o 51.99000 0.3821000 52.71000 0.6069000 51.27000 0.4645000 1.440000       0.7642000 
1 1 1 4  8  18 o 55.14000 0.4035000 55.24000 0.6357000 55.05000 0.4971000 0.1861000      0.8070000 
1 1 1 4  8  20 o 20.90000 0.2787000 21.06000 0.4479000 20.74000 0.3317000 0.3187000      0.5573000 
1 1 1 4  8  22 o 8.739000 0.3873000 9.032000 0.6060000 8.445000 0.4826000 0.5872000      0.7747000 
1 1 1 4  8  24 o 58.57000 0.4538000 57.67000 0.6753000 59.47000 0.6064000 -1.796000      0.9076000 
1 1 1 4  8  26 o 15.53000 0.4215000 15.41000 0.7099000 15.64000 0.4546000 -0.2344000     0.8430000 
1 1 1 4  8  28 o 37.05000 0.3593000 36.62000 0.5029000 37.49000 0.5133000 -0.8665000     0.7186000 
1 1 1 4  8  30 o 40.33000 0.3823000 39.88000 0.5359000 40.78000 0.5453000 -0.8930000     0.7646000 
1 1 1 4  8  32 o 39.88000 0.3582000 39.78000 0.4635000 39.98000 0.5463000 -0.1998000     0.7164000 
1 1 1 4  8  34 o 15.06000 0.3870000 14.57000 0.6010000 15.54000 0.4878000 -0.9719000     0.7740000 
1 1 1 4  8  36 o 31.93000 0.3315000 32.02000 0.4330000 31.84000 0.5021000 0.1808000      0.6630000 
1 1 1 4  8  38 o 12.82000 0.4485000 13.05000 0.5772000 12.59000 0.6867000 0.4606000      0.8971000 
1 1 1 4  8  40 o 30.14000 0.3613000 29.43000 0.5087000 30.85000 0.5131000 -1.425000      0.7225000 
1 1 1 4  8  42 o 14.60000 0.4530000 14.05000 0.5939000 15.15000 0.6842000 -1.101000      0.9060000 
1 1 1 4  8  44 o 22.94000 0.4019000 22.80000 0.4837000 23.09000 0.6419000 -0.2825000     0.8038000 
1 1 1 4  8  46 o 28.46000 0.3302000 28.33000 0.4626000 28.60000 0.4713000 -0.2774000     0.6604000 
1 1 1 4  8  48 o 3.706000 0.9995000 4.511000 1.522000  2.901000 1.296000  1.610000       1.999000  
1 1 1 4  8  50 f 15.41000 0.4601000 15.41000 0.5987000 15.40000 0.6989000 0.8128000E-02  0.9203000 
1 1 1 4  8  52 o 12.47000 0.5658000 11.49000 0.8396000 13.45000 0.7587000 -1.964000      1.132000  
1 1 1 4  8  54 o 13.61000 0.4458000 13.72000 0.6316000 13.50000 0.6294000 0.2220000      0.8917000 
1 1 1 4  8  56 o 12.84000 0.4781000 11.88000 0.6500000 13.80000 0.7013000 -1.922000      0.9562000 
1 1 1 4  8  58 o 11.75000 0.5477000 11.30000 0.8427000 12.20000 0.6999000 -0.8913000     1.095000  
1 1 1 4  8  60 o 4.640000 1.073000  4.537000 1.489000  4.742000 1.546000  -0.2044000     2.146000  
1 1 1 4  8  62 o 9.937000 0.6458000 10.64000 0.9381000 9.235000 0.8878000 1.403000       1.292000  
1 1 1 4  8  64 o 5.384000 1.053000  6.277000 1.359000  4.492000 1.608000  1.785000       2.106000  
1 1 1 4  8  66 o 5.835000 1.038000  5.924000 1.498000  5.746000 1.438000  0.1779000      2.076000  
1 1 1 4  9  1  o 95.98000 0.6552000 96.30000 0.9303000 95.66000 0.9228000 0.6418000      1.310000  
1 1 1 4  9  3  o 61.27000 0.4899000 60.90000 0.6892000 61.63000 0.6964000 -0.7312000     0.9798000 
1 1 1 4  9  5  o 31.85000 0.3055000 31.79000 0.3872000 31.91000 0.4726000 -0.1157000     0.6110000 
1 1 1 4  9  7  o 57.53000 0.4311000 57.50000 0.6510000 57.56000 0.5653000 -0.5550000E-01 0.8622000 
1 1 1 4  9  9  o 33.47000 0.2850000 33.55000 0.4033000 33.40000 0.4027000 0.1547000      0.5700000 
1 1 1 4  9  11 o 26.86000 0.2463000 27.15000 0.3424000 26.57000 0.3542000 0.5859000      0.4926000 
1 1 1 4  9  13 o 9.919000 0.2121000 10.43000 0.3203000 9.406000 0.2781000 1.027000       0.4242000 
1 1 1 4  9  15 o 50.80000 0.3727000 50.76000 0.5856000 50.84000 0.4613000 -0.7482000E-01 0.7454000 
1 1 1 4  9  17 f 107.7000 0.7948000 106.3000 1.186000  109.0000 1.058000  -2.625000      1.590000  
1 1 1 4  9  19 o 107.5000 0.7944000 106.1000 1.185000  108.9000 1.058000  -2.840000      1.589000  
1 1 1 4  9  21 o 15.24000 0.3024000 15.22000 0.5092000 15.26000 0.3263000 -0.4412000E-01 0.6048000 
1 1 1 4  9  23 o 40.86000 0.3271000 41.27000 0.5138000 40.46000 0.4050000 0.8090000      0.6543000 
1 1 1 4  9  25 o 138.9000 0.9815000 139.9000 1.559000  137.9000 1.193000  1.993000       1.963000  
1 1 1 4  9  27 o 87.59000 0.9535000 86.85000 1.697000  88.34000 0.8702000 -1.485000      1.907000  
1 1 1 4  9  29 o 39.50000 0.3249000 39.47000 0.4581000 39.53000 0.4609000 -0.5251000E-01 0.6499000 
1 1 1 4  9  31 o 78.35000 0.5975000 78.38000 0.7818000 78.33000 0.9038000 0.5666000E-01  1.195000  
1 1 1 4  9  33 o 20.25000 0.3116000 19.99000 0.4409000 20.51000 0.4405000 -0.5205000     0.6232000 
1 1 1 4  9  35 o 14.00000 0.4119000 14.51000 0.6251000 13.48000 0.5367000 1.028000       0.8239000 
1 1 1 4  9  37 o 17.83000 0.3903000 18.32000 0.4498000 17.35000 0.6380000 0.9671000      0.7806000 
1 1 1 4  9  39 f 35.59000 0.3252000 35.09000 0.4568000 36.10000 0.4629000 -1.007000      0.6504000 
1 1 1 4  9  41 o 33.90000 0.3760000 33.40000 0.5271000 34.40000 0.5365000 -1.006000      0.7521000 
1 1 1 4  9  43 o 26.93000 0.3516000 27.23000 0.4603000 26.63000 0.5315000 0.6032000      0.7031000 
1 1 1 4  9  45 o 15.54000 0.4111000 16.09000 0.5816000 14.99000 0.5812000 1.096000       0.8222000 
1 1 1 4  9  47 o 9.549000 0.6983000 9.669000 1.087000  9.429000 0.8768000 0.2405000      1.397000  
1 1 1 4  9  49 o 6.892000 0.9052000 6.258000 1.291000  7.526000 1.269000  -1.267000      1.810000  
1 1 1 4  9  51 o 14.15000 0.4781000 13.93000 0.7334000 14.36000 0.6136000 -0.4332000     0.9562000 
1 1 1 4  9  53 o 6.200000 0.9757000 6.269000 1.444000  6.130000 1.312000  0.1389000      1.951000  
1 1 1 4  9  55 f 4.708000 1.048000  4.708000 1.482000  4.708000 1.483000  -0.8411000E-03 2.096000  
1 1 1 4  9  57 o 5.261000 0.9606000 6.149000 1.309000  4.373000 1.406000  1.776000       1.921000  
1 1 1 4  9  59 o 4.659000 0.9897000 3.990000 1.446000  5.328000 1.352000  -1.338000      1.979000  
1 1 1 4  9  61 o 7.487000 0.7904000 6.680000 1.298000  8.294000 0.9028000 -1.614000      1.581000  
1 1 1 4  9  63 o 9.313000 0.7937000 9.530000 1.058000  9.096000 1.184000  0.4338000      1.587000  
1 1 1 4  9  65 o 2.968000 0.9414000 2.643000 1.228000  3.293000 1.427000  -0.6494000     1.883000  
1 1 1 4  9  67 o 3.314000 0.9472000 3.210000 1.363000  3.418000 1.315000  -0.2081000     1.894000  
1 1 1 4  10 0  o 29.99000 0.3139000 29.99000 0.3139000 29.99000 0.3139000 0.000000       0.000000  
1 1 1 4  10 2  o 69.42000 0.5629000 69.71000 0.6055000 69.13000 0.9491000 0.5714000      1.126000  
1 1 1 4  10 4  o 46.09000 0.3486000 46.48000 0.4615000 45.70000 0.5226000 0.7810000      0.6972000 
1 1 1 4  10 6  o 52.70000 0.3966000 52.42000 0.5964000 52.99000 0.5230000 -0.5746000     0.7933000 
1 1 1 4  10 8  o 57.53000 0.4326000 57.92000 0.6573000 57.13000 0.5627000 0.7900000      0.8652000 
1 1 1 4  10 10 o 60.91000 0.4573000 61.68000 0.6967000 60.14000 0.5925000 1.538000       0.9146000 
1 1 1 4  10 12 o 34.88000 0.2606000 34.67000 0.3650000 35.09000 0.3720000 -0.4200000     0.5211000 
1 1 1 4  10 14 o 69.21000 0.5192000 69.26000 0.6796000 69.16000 0.7851000 0.9801000E-01  1.038000  
1 1 1 4  10 16 o 57.32000 0.4992000 57.85000 0.8161000 56.80000 0.5750000 1.047000       0.9983000 
1 1 1 4  10 18 o 82.38000 0.5864000 81.32000 0.9162000 83.44000 0.7320000 -2.118000      1.173000  
1 1 1 4  10 20 o 44.36000 0.3382000 43.84000 0.5259000 44.88000 0.4256000 -1.035000      0.6765000 
1 1 1 4  10 22 o 21.41000 0.2580000 21.49000 0.4009000 21.34000 0.3247000 0.1475000      0.5160000 
1 1 1 4  10 24 o 63.31000 0.5197000 62.84000 0.7273000 63.78000 0.7427000 -0.9375000     1.039000  
1 1 1 4  10 26 o 39.37000 0.3726000 39.54000 0.6258000 39.21000 0.4044000 0.3297000      0.7451000 
1 1 1 4  10 28 o 38.03000 0.3247000 37.79000 0.5061000 38.26000 0.4068000 -0.4703000     0.6493000 
1 1 1 4  10 30 o 16.88000 0.3763000 17.08000 0.5468000 16.68000 0.5172000 0.4043000      0.7526000 
1 1 1 4  10 32 o 24.61000 0.3296000 25.09000 0.4247000 24.12000 0.5042000 0.9738000      0.6592000 
1 1 1 4  10 34 f 28.30000 0.2994000 28.37000 0.4237000 28.24000 0.4230000 0.1261000      0.5988000 
1 1 1 4  10 36 o 8.105000 0.6362000 8.884000 0.8623000 7.326000 0.9357000 1.558000       1.272000  
1 1 1 4  10 38 o 4.594000 1.005000  4.817000 1.479000  4.370000 1.361000  0.4474000      2.010000  
1 1 1 4  10 40 o 9.059000 0.6491000 8.232000 1.052000  9.886000 0.7607000 -1.654000      1.298000  
1 1 1 4  10 42 o 13.48000 0.4458000 12.81000 0.6461000 14.14000 0.6145000 -1.330000      0.8917000 
1 1 1 4  10 44 o 46.56000 0.4109000 47.03000 0.5406000 46.10000 0.6191000 0.9297000      0.8219000 
1 1 1 4  10 46 o 4.997000 1.083000  4.921000 1.572000  5.074000 1.491000  -0.1530000     2.167000  
1 1 1 4  10 48 o 27.24000 0.3680000 27.80000 0.5536000 26.69000 0.4849000 1.111000       0.7359000 
1 1 1 4  10 50 o 13.59000 0.4911000 13.30000 0.7853000 13.87000 0.5900000 -0.5740000     0.9822000 
1 1 1 4  10 52 o 3.567000 0.9790000 3.259000 1.358000  3.875000 1.411000  -0.6160000     1.958000  
1 1 1 4  10 54 o 3.735000 0.9368000 4.515000 1.397000  2.955000 1.249000  1.560000       1.874000  
1 1 1 4  10 56 o 4.279000 1.115000  4.313000 1.409000  4.246000 1.729000  0.6655000E-01  2.230000  
1 1 1 4  10 58 o 7.193000 0.7744000 6.920000 1.202000  7.466000 0.9768000 -0.5462000     1.549000  
1 1 1 4  10 60 o 9.435000 0.6014000 9.258000 0.8907000 9.612000 0.8085000 -0.3537000     1.203000  
1 1 1 4  10 62 o 4.953000 0.9970000 5.165000 1.389000  4.741000 1.431000  0.4240000      1.994000  
1 1 1 4  10 64 o 12.93000 0.5206000 12.69000 0.7637000 13.17000 0.7078000 -0.4813000     1.041000  
1 1 1 4  10 66 o 3.260000 0.9967000 3.446000 1.510000  3.073000 1.301000  0.3737000      1.993000  
1 1 1 4  11 1  o 52.67000 0.4473000 52.91000 0.5189000 52.43000 0.7288000 0.4770000      0.8946000 
1 1 1 4  11 3  o 64.20000 0.5426000 63.93000 0.6232000 64.48000 0.8883000 -0.5487000     1.085000  
1 1 1 4  11 5  o 57.25000 0.4300000 57.42000 0.6508000 57.07000 0.5621000 0.3423000      0.8599000 
1 1 1 4  11 7  o 31.86000 0.2561000 31.27000 0.3812000 32.46000 0.3421000 -1.190000      0.5122000 
1 1 1 4  11 9  o 55.85000 0.4496000 56.10000 0.6366000 55.61000 0.6352000 0.4865000      0.8993000 
1 1 1 4  11 11 o 30.05000 0.2326000 30.09000 0.3282000 30.00000 0.3298000 0.8985000E-01  0.4653000 
1 1 1 4  11 13 o 41.61000 0.3918000 41.80000 0.5026000 41.42000 0.6011000 0.3817000      0.7835000 
1 1 1 4  11 15 o 164.9000 1.122000  164.1000 1.578000  165.7000 1.594000  -1.682000      2.243000  
1 1 1 4  11 17 o 103.7000 0.7691000 104.3000 1.165000  103.0000 1.004000  1.314000       1.538000  
1 1 1 4  11 19 o 63.11000 0.4833000 63.87000 0.7320000 62.34000 0.6312000 1.532000       0.9666000 
1 1 1 4  11 21 o 17.90000 0.3237000 17.17000 0.5305000 18.63000 0.3709000 -1.465000      0.6473000 
1 1 1 4  11 23 o 13.79000 0.3550000 14.15000 0.5067000 13.43000 0.4973000 0.7189000      0.7100000 
1 1 1 4  11 25 f 122.2000 0.8666000 123.3000 1.378000  121.1000 1.052000  2.267000       1.733000  
1 1 1 4  11 27 o 51.34000 0.4664000 51.20000 0.7558000 51.48000 0.5468000 -0.2827000     0.9329000 
1 1 1 4  11 29 o 37.43000 0.3881000 37.16000 0.6300000 37.70000 0.4532000 -0.5459000     0.7761000 
1 1 1 4  11 31 o 116.6000 0.8680000 117.4000 1.317000  115.9000 1.131000  1.445000       1.736000  
1 1 1 4  11 33 o 14.97000 0.3801000 15.40000 0.5691000 14.53000 0.5041000 0.8694000      0.7603000 
1 1 1 4  11 35 o 32.08000 0.3302000 31.95000 0.5016000 32.20000 0.4296000 -0.2490000     0.6604000 
1 1 1 4  11 37 o 4.825000 1.021000  4.724000 1.443000  4.927000 1.446000  -0.2033000     2.043000  
1 1 1 4  11 39 o 27.62000 0.3069000 27.95000 0.4373000 27.29000 0.4306000 0.6570000      0.6137000 
1 1 1 4  11 41 o 4.425000 1.025000  4.089000 1.547000  4.761000 1.344000  -0.6718000     2.049000  
1 1 1 4  11 43 o 11.62000 0.5273000 12.06000 0.7349000 11.19000 0.7565000 0.8707000      1.055000  
1 1 1 4  11 45 o 5.827000 1.081000  5.749000 1.454000  5.905000 1.600000  -0.1559000     2.162000  
1 1 1 4  11 47 o 6.967000 0.8873000 7.539000 1.171000  6.395000 1.333000  1.145000       1.775000  
1 1 1 4  11 49 o 18.16000 0.4249000 18.51000 0.5605000 17.82000 0.6387000 0.6921000      0.8498000 
1 1 1 4  11 51 o 13.76000 0.4661000 13.73000 0.7205000 13.79000 0.5914000 -0.5497000E-01 0.9321000 
1 1 1 4  11 53 o 25.25000 0.3592000 25.66000 0.5413000 24.85000 0.4723000 0.8126000      0.7184000 
1 1 1 4  11 55 o 10.91000 0.5263000 10.33000 0.7631000 11.50000 0.7249000 -1.169000      1.053000  
1 1 1 4  11 57 o 7.099000 0.7688000 7.721000 0.9421000 6.477000 1.215000  1.244000       1.538000  
1 1 1 4  11 59 o 7.597000 0.7977000 8.224000 0.9933000 6.970000 1.248000  1.253000       1.595000  
1 1 1 4  11 61 o 3.874000 1.129000  4.540000 1.796000  3.209000 1.367000  1.331000       2.257000  
1 1 1 4  11 63 o 5.272000 1.051000  7.460000 1.667000  3.083000 1.281000  4.377000       2.102000  
1 1 1 4  11 65 o 4.154000 1.022000  3.246000 1.467000  5.061000 1.422000  -1.815000      2.043000  
1 1 1 4  11 67 o 6.191000 1.036000  6.351000 1.594000  6.031000 1.324000  0.3194000      2.072000  
1 1 1 4  12 0  o 59.04000 0.8187000 59.04000 0.8187000 59.04000 0.8187000 0.000000       0.000000  
1 1 1 4  12 2  o 21.86000 0.1935000 22.22000 0.2533000 21.49000 0.2927000 0.7282000      0.3871000 
1 1 1 4  12 4  o 34.60000 0.2731000 34.34000 0.3537000 34.85000 0.4163000 -0.5030000     0.5462000 
1 1 1 4  12 6  o 39.53000 0.2854000 39.42000 0.4027000 39.65000 0.4047000 -0.2223000     0.5709000 
1 1 1 4  12 8  o 80.64000 0.6392000 81.35000 0.9112000 79.94000 0.8965000 1.409000       1.278000  
1 1 1 4  12 10 o 97.68000 0.6689000 98.23000 0.9507000 97.14000 0.9412000 1.088000       1.338000  
1 1 1 4  12 12 o 41.15000 0.3951000 40.86000 0.4868000 41.43000 0.6224000 -0.5705000     0.7902000 
1 1 1 4  12 14 o 60.49000 0.4250000 60.28000 0.5985000 60.70000 0.6036000 -0.4122000     0.8500000 
1 1 1 4  12 16 o 96.05000 0.6609000 95.65000 0.9308000 96.45000 0.9386000 -0.8077000     1.322000  
1 1 1 4  12 18 o 82.57000 0.5893000 82.26000 0.9266000 82.88000 0.7284000 -0.6221000     1.179000  
1 1 1 4  12 20 o 56.99000 0.4212000 57.01000 0.6617000 56.97000 0.5214000 0.4122000E-01  0.8424000 
1 1 1 4  12 22 o 54.93000 0.4303000 54.97000 0.6470000 54.88000 0.5673000 0.9645000E-01  0.8605000 
1 1 1 4  12 24 o 64.62000 0.4762000 65.09000 0.7531000 64.16000 0.5829000 0.9237000      0.9524000 
1 1 1 4  12 26 o 23.16000 0.4173000 22.53000 0.7188000 23.78000 0.4241000 -1.249000      0.8346000 
1 1 1 4  12 28 o 82.42000 0.5969000 83.24000 0.9463000 81.60000 0.7277000 1.637000       1.194000  
1 1 1 4  12 30 o 22.32000 0.3470000 22.40000 0.4738000 22.24000 0.5072000 0.1607000      0.6941000 
1 1 1 4  12 32 o 28.35000 0.3829000 28.47000 0.5832000 28.23000 0.4963000 0.2465000      0.7658000 
1 1 1 4  12 34 o 66.57000 0.4958000 67.41000 0.7861000 65.73000 0.6043000 1.679000       0.9915000 
1 1 1 4  12 36 o 37.23000 0.3468000 37.09000 0.5179000 37.37000 0.4615000 -0.2802000     0.6937000 
1 1 1 4  12 38 o 20.89000 0.3288000 20.85000 0.5175000 20.93000 0.4057000 -0.8471000E-01 0.6576000 
1 1 1 4  12 40 o 12.57000 0.4999000 11.73000 0.6980000 13.40000 0.7157000 -1.677000      0.9997000 
1 1 1 4  12 42 f 23.73000 0.3208000 24.10000 0.4507000 23.37000 0.4566000 0.7293000      0.6416000 
1 1 1 4  12 44 o 19.70000 0.3843000 19.46000 0.5070000 19.94000 0.5776000 -0.4775000     0.7686000 
1 1 1 4  12 46 o 20.65000 0.3605000 20.54000 0.5046000 20.77000 0.5150000 -0.2312000     0.7210000 
1 1 1 4  12 48 o 26.03000 0.3790000 25.96000 0.5367000 26.09000 0.5352000 -0.1299000     0.7580000 
1 1 1 4  12 50 o 20.60000 0.3495000 20.54000 0.4992000 20.66000 0.4892000 -0.1268000     0.6990000 
1 1 1 4  12 52 o 11.54000 0.5282000 12.31000 0.6532000 10.77000 0.8303000 1.544000       1.056000  
1 1 1 4  12 54 o 7.776000 0.6984000 8.009000 0.9653000 7.542000 1.010000  0.4667000      1.397000  
1 1 1 4  12 56 o 6.328000 0.8723000 6.555000 1.318000  6.101000 1.143000  0.4540000      1.745000  
1 1 1 4  12 58 o 14.35000 0.4427000 14.39000 0.7128000 14.31000 0.5252000 0.7819000E-01  0.8854000 
1 1 1 4  12 60 o 8.822000 0.7531000 9.407000 1.022000  8.236000 1.107000  1.170000       1.506000  
1 1 1 4  12 62 o 2.727000 0.9062000 2.582000 1.249000  2.872000 1.313000  -0.2901000     1.812000  
1 1 1 4  12 64 o 4.140000 1.037000  3.568000 1.544000  4.712000 1.386000  -1.143000      2.075000  
1 1 1 4  12 66 o 6.724000 0.8721000 8.140000 1.253000  5.309000 1.214000  2.831000       1.744000  
1 1 1 4  13 1  o 59.13000 0.4111000 58.92000 0.5792000 59.35000 0.5836000 -0.4210000     0.8222000 
1 1 1 4  13 3  o 34.63000 0.2645000 34.26000 0.3192000 34.99000 0.4217000 -0.7224000     0.5289000 
1 1 1 4  13 5  o 41.95000 0.3252000 42.52000 0.4341000 41.38000 0.4843000 1.138000       0.6504000 
1 1 1 4  13 7  o 14.82000 0.1858000 14.80000 0.2619000 14.85000 0.2636000 -0.5180000E-01 0.3716000 
1 1 1 4  13 9  o 37.39000 0.3246000 37.64000 0.4609000 37.14000 0.4571000 0.5009000      0.6492000 
1 1 1 4  13 11 o 86.75000 0.6890000 87.66000 0.9835000 85.85000 0.9651000 1.804000       1.378000  
1 1 1 4  13 13 o 79.55000 0.5499000 79.37000 0.7750000 79.73000 0.7802000 -0.3541000     1.100000  
1 1 1 4  13 15 o 116.9000 0.7994000 116.3000 1.123000  117.5000 1.138000  -1.251000      1.599000  
1 1 1 4  13 17 o 42.92000 0.3466000 42.98000 0.5163000 42.85000 0.4627000 0.1292000      0.6933000 
1 1 1 4  13 19 o 85.45000 0.6103000 85.30000 0.9605000 85.60000 0.7531000 -0.2975000     1.221000  
1 1 1 4  13 21 o 54.46000 0.4827000 53.84000 0.7813000 55.08000 0.5670000 -1.238000      0.9654000 
1 1 1 4  13 23 o 38.65000 0.4503000 38.59000 0.6088000 38.72000 0.6637000 -0.1349000     0.9007000 
1 1 1 4  13 25 o 34.75000 0.3222000 34.96000 0.4859000 34.54000 0.4233000 0.4279000      0.6444000 
1 1 1 4  13 27 o 55.98000 0.4239000 55.80000 0.6649000 56.16000 0.5261000 -0.3580000     0.8479000 
1 1 1 4  13 29 o 50.36000 0.4626000 50.28000 0.7494000 50.44000 0.5424000 -0.1602000     0.9251000 
1 1 1 4  13 31 o 37.08000 0.3236000 36.31000 0.5026000 37.85000 0.4078000 -1.542000      0.6472000 
1 1 1 4  13 33 o 4.661000 0.9352000 4.507000 1.461000  4.814000 1.168000  -0.3067000     1.870000  
1 1 1 4  13 35 o 26.93000 0.3479000 27.04000 0.5831000 26.82000 0.3798000 0.2199000      0.6959000 
1 1 1 4  13 37 o 13.93000 0.3943000 13.92000 0.6012000 13.93000 0.5104000 -0.2815000E-02 0.7886000 
1 1 1 4  13 39 o 39.80000 0.4114000 39.96000 0.6638000 39.64000 0.4864000 0.3113000      0.8229000 
1 1 1 4  13 41 o 42.40000 0.4156000 42.99000 0.7005000 41.81000 0.4474000 1.182000       0.8312000 
1 1 1 4  13 43 o 25.82000 0.3324000 25.71000 0.5210000 25.92000 0.4128000 -0.2185000     0.6647000 
1 1 1 4  13 45 o 10.41000 0.6209000 10.48000 0.9558000 10.35000 0.7927000 0.1357000      1.242000  
1 1 1 4  13 47 o 44.40000 0.3836000 43.76000 0.6003000 45.03000 0.4778000 -1.276000      0.7672000 
1 1 1 4  13 49 o 28.31000 0.3498000 28.25000 0.5255000 28.36000 0.4619000 -0.1129000     0.6996000 
1 1 1 4  13 51 o 7.003000 0.8110000 7.946000 1.085000  6.060000 1.206000  1.886000       1.622000  
1 1 1 4  13 53 o 9.069000 0.6973000 9.080000 1.195000  9.059000 0.7185000 0.2154000E-01  1.395000  
1 1 1 4  13 55 o 11.71000 0.5092000 11.44000 0.7959000 11.97000 0.6354000 -0.5331000     1.018000  
1 1 1 4  13 57 o 10.54000 0.5685000 10.42000 0.8654000 10.66000 0.7375000 -0.2341000     1.137000  
1 1 1 4  13 59 o 7.256000 0.8449000 7.271000 1.410000  7.242000 0.9313000 0.2852000E-01  1.690000  
1 1 1 4  13 61 o 4.997000 1.107000  4.301000 1.620000  5.693000 1.509000  -1.392000      2.214000  
1 1 1 4  13 63 f 4.900000 1.163000  5.733000 1.851000  4.067000 1.409000  1.666000       2.326000  
1 1 1 4  13 65 o 4.519000 1.082000  5.381000 1.619000  3.656000 1.436000  1.725000       2.164000  
1 1 1 4  14 0  o 77.28000 0.7519000 77.28000 0.7519000 77.28000 0.7519000 0.000000       0.000000  
1 1 1 4  14 2  o 46.48000 0.3420000 46.15000 0.4146000 46.80000 0.5440000 -0.6539000     0.6840000 
1 1 1 4  14 4  f 28.36000 0.2365000 28.41000 0.3091000 28.31000 0.3580000 0.1046000      0.4730000 
1 1 1 4  14 6  o 52.52000 0.4786000 52.80000 0.7457000 52.25000 0.6001000 0.5497000      0.9572000 
1 1 1 4  14 8  o 45.83000 0.3550000 45.81000 0.4657000 45.86000 0.5360000 -0.5841000E-01 0.7100000 
1 1 1 4  14 10 o 88.71000 0.6581000 89.22000 0.8676000 88.20000 0.9898000 1.025000       1.316000  
1 1 1 4  14 12 o 57.54000 0.4066000 57.99000 0.5782000 57.09000 0.5718000 0.8979000      0.8132000 
1 1 1 4  14 14 o 91.46000 0.6297000 91.06000 0.8857000 91.85000 0.8955000 -0.7920000     1.259000  
1 1 1 4  14 16 o 93.70000 0.6460000 93.67000 0.9119000 93.73000 0.9152000 -0.5702000E-01 1.292000  
1 1 1 4  14 18 o 69.62000 0.5043000 69.91000 0.7957000 69.33000 0.6197000 0.5804000      1.009000  
1 1 1 4  14 20 o 118.2000 0.8729000 116.7000 1.303000  119.7000 1.162000  -3.014000      1.746000  
1 1 1 4  14 22 o 57.19000 0.4463000 56.63000 0.6655000 57.76000 0.5948000 -1.125000      0.8926000 
1 1 1 4  14 24 o 52.48000 0.4180000 52.14000 0.6258000 52.82000 0.5542000 -0.6828000     0.8359000 
1 1 1 4  14 26 o 72.99000 0.7911000 72.65000 1.436000  73.32000 0.6633000 -0.6753000     1.582000  
1 1 1 4  14 28 o 29.90000 0.3494000 29.83000 0.5545000 29.97000 0.4254000 -0.1430000     0.6988000 
1 1 1 4  14 30 o 31.37000 0.3214000 30.96000 0.4769000 31.78000 0.4312000 -0.8227000     0.6429000 
1 1 1 4  14 32 o 22.35000 0.3106000 22.90000 0.4563000 21.80000 0.4216000 1.098000       0.6213000 
1 1 1 4  14 34 o 20.94000 0.3125000 20.95000 0.4889000 20.93000 0.3894000 0.1852000E-01  0.6250000 
1 1 1 4  14 36 o 7.363000 0.8267000 7.881000 1.233000  6.845000 1.102000  1.036000       1.653000  
1 1 1 4  14 38 o 24.75000 0.3187000 24.41000 0.4991000 25.09000 0.3965000 -0.6825000     0.6374000 
1 1 1 4  14 40 o 11.01000 0.5941000 10.34000 1.019000  11.69000 0.6111000 -1.355000      1.188000  
1 1 1 4  14 42 o 23.91000 0.3322000 23.89000 0.5245000 23.93000 0.4077000 -0.4096000E-01 0.6643000 
1 1 1 4  14 44 o 18.25000 0.4029000 17.87000 0.6118000 18.63000 0.5244000 -0.7566000     0.8058000 
1 1 1 4  14 46 o 17.55000 0.4077000 17.26000 0.6416000 17.84000 0.5034000 -0.5821000     0.8155000 
1 1 1 4  14 48 o 22.75000 0.4310000 22.60000 0.6561000 22.89000 0.5591000 -0.2901000     0.8621000 
1 1 1 4  14 50 o 38.25000 0.4127000 38.37000 0.6963000 38.13000 0.4434000 0.2409000      0.8255000 
1 1 1 4  14 52 o 13.19000 0.4646000 12.82000 0.7468000 13.56000 0.5527000 -0.7464000     0.9291000 
1 1 1 4  14 54 o 3.459000 0.9629000 3.327000 1.422000  3.592000 1.299000  -0.2641000     1.926000  
1 1 1 4  14 56 o 10.52000 0.5608000 10.00000 0.9221000 11.04000 0.6384000 -1.038000      1.122000  
1 1 1 4  14 58 o 6.606000 0.8620000 6.543000 1.313000  6.668000 1.118000  -0.1252000     1.724000  
1 1 1 4  14 60 o 4.260000 1.134000  4.314000 1.764000  4.206000 1.426000  0.1080000      2.268000  
1 1 1 4  14 62 o 10.75000 0.6655000 10.22000 1.108000  11.28000 0.7381000 -1.060000      1.331000  
1 1 1 4  14 64 o 14.27000 0.5015000 14.72000 0.7769000 13.82000 0.6345000 0.9000000      1.003000  
1 1 1 4  14 66 o 3.907000 1.022000  3.754000 1.552000  4.060000 1.329000  -0.3055000     2.043000  
1 1 1 4  15 1  o 63.13000 0.4386000 63.41000 0.6231000 62.84000 0.6174000 0.5700000      0.8771000 
1 1 1 4  15 3  o 21.45000 0.2205000 21.46000 0.3149000 21.45000 0.3088000 0.1263000E-01  0.4410000 
1 1 1 4  15 5  o 75.76000 0.6203000 75.84000 0.6624000 75.68000 1.049000  0.1586000      1.241000  
1 1 1 4  15 7  o 48.06000 0.4060000 47.80000 0.4330000 48.31000 0.6869000 -0.5111000     0.8120000 
1 1 1 4  15 9  o 38.22000 0.3325000 38.24000 0.3599000 38.20000 0.5593000 0.4017000E-01  0.6651000 
1 1 1 4  15 11 o 40.15000 0.2985000 40.11000 0.4210000 40.18000 0.4233000 -0.6808000E-01 0.5970000 
1 1 1 4  15 13 o 40.14000 0.3005000 40.48000 0.4266000 39.79000 0.4233000 0.6882000      0.6010000 
1 1 1 4  15 15 o 109.2000 0.7485000 109.2000 1.058000  109.2000 1.059000  -0.4281000E-01 1.497000  
1 1 1 4  15 17 o 28.66000 0.2778000 28.59000 0.3535000 28.73000 0.4285000 -0.1466000     0.5555000 
1 1 1 4  15 19 o 101.3000 0.7204000 101.3000 1.137000  101.2000 0.8857000 0.7627000E-01  1.441000  
1 1 1 4  15 21 o 78.68000 0.6741000 78.87000 1.099000  78.49000 0.7805000 0.3759000      1.348000  
1 1 1 4  15 23 o 72.66000 0.5287000 72.46000 0.8304000 72.86000 0.6546000 -0.3968000     1.057000  
1 1 1 4  15 25 o 94.45000 1.033000  94.78000 1.845000  94.12000 0.9284000 0.6571000      2.065000  
1 1 1 4  15 27 o 104.3000 0.7465000 105.7000 1.189000  103.0000 0.9032000 2.676000       1.493000  
1 1 1 4  15 29 o 18.96000 0.3678000 18.87000 0.4859000 19.05000 0.5523000 -0.1758000     0.7356000 
1 1 1 4  15 31 o 34.09000 0.3170000 34.34000 0.4944000 33.84000 0.3969000 0.4989000      0.6340000 
1 1 1 4  15 33 o 53.72000 0.4149000 53.86000 0.6509000 53.59000 0.5148000 0.2694000      0.8299000 
1 1 1 4  15 35 o 16.83000 0.4171000 16.85000 0.6414000 16.82000 0.5333000 0.2978000E-01  0.8342000 
1 1 1 4  15 37 o 57.78000 0.4436000 57.89000 0.6973000 57.68000 0.5487000 0.2133000      0.8873000 
1 1 1 4  15 39 o 28.00000 0.3223000 28.59000 0.5112000 27.40000 0.3928000 1.191000       0.6447000 
1 1 1 4  15 41 o 9.549000 0.6049000 8.527000 1.025000  10.57000 0.6432000 -2.043000      1.210000  
1 1 1 4  15 43 o 33.54000 0.3544000 33.38000 0.5285000 33.70000 0.4722000 -0.3238000     0.7087000 
1 1 1 4  15 45 o 17.08000 0.4418000 17.21000 0.6514000 16.94000 0.5972000 0.2682000      0.8837000 
1 1 1 4  15 47 o 24.51000 0.3668000 25.06000 0.5425000 23.97000 0.4940000 1.097000       0.7337000 
1 1 1 4  15 49 o 6.567000 0.8921000 5.676000 1.533000  7.458000 0.9131000 -1.782000      1.784000  
1 1 1 4  15 51 o 6.950000 0.7873000 8.218000 1.090000  5.683000 1.136000  2.535000       1.575000  
1 1 1 4  15 53 o 19.32000 0.4104000 19.42000 0.6878000 19.21000 0.4481000 0.2106000      0.8209000 
1 1 1 4  15 55 o 6.235000 0.9195000 6.022000 1.497000  6.448000 1.069000  -0.4264000     1.839000  
1 1 1 4  15 57 f 3.674000 1.017000  3.851000 1.461000  3.497000 1.414000  0.3535000      2.033000  
1 1 1 4  15 59 o 17.66000 0.4674000 17.62000 0.7546000 17.71000 0.5518000 -0.8886000E-01 0.9348000 
1 1 1 4  15 61 o 12.38000 0.5299000 12.60000 0.8434000 12.16000 0.6419000 0.4454000      1.060000  
1 1 1 4  15 63 o 3.544000 1.067000  4.451000 1.761000  2.637000 1.206000  1.814000       2.134000  
1 1 1 4  15 65 o 5.297000 1.123000  6.158000 1.535000  4.436000 1.641000  1.722000       2.247000  
1 1 1 4  16 0  o 32.79000 0.4024000 32.79000 0.4024000 32.79000 0.4024000 0.000000       0.000000  
1 1 1 4  16 2  o 53.75000 0.5367000 54.30000 0.7659000 53.21000 0.7521000 1.089000       1.073000  
1 1 1 4  16 4  f 15.68000 0.2029000 15.75000 0.2310000 15.62000 0.3335000 0.1231000      0.4057000 
1 1 1 4  16 6  o 43.47000 0.3835000 43.41000 0.4458000 43.54000 0.6241000 -0.1348000     0.7670000 
1 1 1 4  16 8  o 63.19000 0.5229000 62.79000 0.5562000 63.59000 0.8856000 -0.7955000     1.046000  
1 1 1 4  16 10 o 129.3000 0.9532000 129.1000 1.246000  129.5000 1.443000  -0.4091000     1.906000  
1 1 1 4  16 12 o 93.71000 0.6452000 93.23000 0.9075000 94.20000 0.9174000 -0.9734000     1.290000  
1 1 1 4  16 14 o 92.45000 0.6372000 92.21000 0.8982000 92.69000 0.9040000 -0.4795000     1.274000  
1 1 1 4  16 16 o 195.1000 1.533000  195.9000 2.177000  194.2000 2.159000  1.796000       3.066000  
1 1 1 4  16 18 o 51.95000 0.4084000 52.08000 0.6139000 51.82000 0.5388000 0.2609000      0.8168000 
1 1 1 4  16 20 o 33.13000 0.2941000 33.03000 0.4528000 33.22000 0.3753000 -0.1921000     0.5881000 
1 1 1 4  16 22 o 8.413000 0.5880000 6.813000 0.9917000 10.01000 0.6322000 -3.200000      1.176000  
1 1 1 4  16 24 o 45.45000 0.5248000 44.71000 0.9453000 46.19000 0.4562000 -1.476000      1.050000  
1 1 1 4  16 26 o 23.48000 0.3040000 23.44000 0.4589000 23.51000 0.3988000 -0.6418000E-01 0.6079000 
1 1 1 4  16 28 o 30.22000 0.3015000 30.06000 0.4726000 30.39000 0.3743000 -0.3309000     0.6029000 
1 1 1 4  16 30 f 48.74000 0.4029000 48.60000 0.6018000 48.87000 0.5358000 -0.2653000     0.8058000 
1 1 1 4  16 32 o 18.05000 0.3464000 18.48000 0.5052000 17.62000 0.4742000 0.8533000      0.6929000 
1 1 1 4  16 34 o 40.75000 0.3612000 41.42000 0.5407000 40.08000 0.4791000 1.339000       0.7224000 
1 1 1 4  16 36 o 4.141000 0.9479000 3.278000 1.440000  5.004000 1.233000  -1.726000      1.896000  
1 1 1 4  16 38 o 26.08000 0.3786000 26.13000 0.6124000 26.03000 0.4455000 0.9964000E-01  0.7573000 
1 1 1 4  16 40 o 29.88000 0.3689000 30.05000 0.6197000 29.72000 0.4002000 0.3297000      0.7377000 
1 1 1 4  16 42 o 30.92000 0.3327000 30.69000 0.5175000 31.16000 0.4184000 -0.4695000     0.6654000 
1 1 1 4  16 44 o 12.72000 0.5159000 13.49000 0.7267000 11.95000 0.7325000 1.541000       1.032000  
1 1 1 4  16 46 o 12.91000 0.5387000 11.97000 0.8304000 13.85000 0.6867000 -1.875000      1.077000  
1 1 1 4  16 48 o 20.13000 0.4086000 20.05000 0.6774000 20.22000 0.4572000 -0.1703000     0.8173000 
1 1 1 4  16 50 o 23.81000 0.3560000 23.72000 0.5414000 23.91000 0.4626000 -0.1898000     0.7121000 
1 1 1 4  16 52 o 17.73000 0.3760000 17.84000 0.6035000 17.62000 0.4487000 0.2226000      0.7521000 
1 1 1 4  16 54 o 7.816000 0.6946000 7.900000 1.124000  7.733000 0.8158000 0.1664000      1.389000  
1 1 1 4  16 56 o 3.454000 0.9646000 4.131000 1.514000  2.778000 1.196000  1.353000       1.929000  
1 1 1 4  16 58 o 3.867000 1.036000  4.099000 1.515000  3.634000 1.413000  0.4651000      2.072000  
1 1 1 4  16 60 o 3.384000 0.9990000 3.008000 1.365000  3.759000 1.459000  -0.7511000     1.998000  
1 1 1 4  16 62 o 3.825000 1.063000  3.718000 1.564000  3.931000 1.440000  -0.2132000     2.126000  
1 1 1 4  16 64 o 7.394000 0.8815000 7.117000 1.471000  7.671000 0.9721000 -0.5547000     1.763000  
1 1 1 4  17 1  o 76.75000 0.6848000 76.56000 0.8653000 76.95000 1.062000  -0.3986000     1.370000  
1 1 1 4  17 3  o 63.04000 0.4753000 62.73000 0.6203000 63.35000 0.7203000 -0.6243000     0.9505000 
1 1 1 4  17 5  o 119.2000 0.9950000 119.5000 1.155000  118.8000 1.621000  0.7284000      1.990000  
1 1 1 4  17 7  f 60.54000 0.4394000 60.22000 0.5364000 60.87000 0.6962000 -0.6511000     0.8789000 
1 1 1 4  17 9  o 77.08000 0.5768000 76.88000 0.7543000 77.27000 0.8728000 -0.3885000     1.154000  
1 1 1 4  17 11 o 77.79000 0.5574000 77.62000 0.6818000 77.96000 0.8821000 -0.3414000     1.115000  
1 1 1 4  17 13 o 73.51000 0.5296000 73.55000 0.6492000 73.46000 0.8369000 0.9860000E-01  1.059000  
1 1 1 4  17 15 o 67.37000 0.4749000 67.13000 0.6681000 67.62000 0.6752000 -0.4879000     0.9499000 
1 1 1 4  17 17 o 113.7000 0.8461000 112.9000 1.097000  114.4000 1.289000  -1.424000      1.692000  
1 1 1 4  17 19 o 46.27000 0.3756000 46.09000 0.5590000 46.45000 0.5017000 -0.3652000     0.7512000 
1 1 1 4  17 21 o 77.68000 0.8572000 76.50000 1.524000  78.87000 0.7845000 -2.374000      1.714000  
1 1 1 4  17 23 o 110.0000 0.8175000 109.8000 1.232000  110.1000 1.074000  -0.2415000     1.635000  
1 1 1 4  17 25 o 50.71000 0.4677000 51.24000 0.7571000 50.17000 0.5492000 1.069000       0.9353000 
1 1 1 4  17 27 o 57.95000 0.4378000 57.63000 0.6844000 58.27000 0.5462000 -0.6367000     0.8756000 
1 1 1 4  17 29 o 24.51000 0.3095000 24.60000 0.4534000 24.42000 0.4214000 0.1740000      0.6190000 
1 1 1 4  17 31 o 34.68000 0.3157000 34.42000 0.4925000 34.95000 0.3949000 -0.5363000     0.6313000 
1 1 1 4  17 33 f 17.62000 0.3168000 18.30000 0.4899000 16.95000 0.4017000 1.357000       0.6335000 
1 1 1 4  17 35 o 18.76000 0.3206000 18.82000 0.4876000 18.71000 0.4164000 0.1126000      0.6412000 
1 1 1 4  17 37 o 7.936000 0.8332000 8.258000 1.332000  7.615000 1.002000  0.6437000      1.666000  
1 1 1 4  17 39 o 31.45000 0.3210000 31.72000 0.5021000 31.17000 0.4001000 0.5430000      0.6420000 
1 1 1 4  17 41 o 23.74000 0.3421000 23.00000 0.5430000 24.48000 0.4162000 -1.480000      0.6842000 
1 1 1 4  17 43 o 11.67000 0.5514000 12.05000 0.8194000 11.29000 0.7382000 0.7619000      1.103000  
1 1 1 4  17 45 o 37.57000 0.3555000 37.75000 0.5589000 37.39000 0.4396000 0.3584000      0.7110000 
1 1 1 4  17 47 o 4.963000 1.131000  5.092000 1.619000  4.833000 1.580000  0.2583000      2.262000  
1 1 1 4  17 49 o 16.03000 0.6127000 15.56000 1.101000  16.49000 0.5370000 -0.9279000     1.225000  
1 1 1 4  17 51 o 11.57000 0.4900000 11.79000 0.7960000 11.34000 0.5716000 0.4422000      0.9800000 
1 1 1 4  17 53 o 10.39000 0.5929000 10.64000 1.013000  10.13000 0.6166000 0.5087000      1.186000  
1 1 1 4  17 55 o 2.851000 0.8831000 2.614000 1.212000  3.088000 1.284000  -0.4738000     1.766000  
1 1 1 4  17 57 o 6.426000 0.9560000 5.746000 1.489000  7.106000 1.199000  -1.359000      1.912000  
1 1 1 4  17 59 o 5.871000 1.049000  5.387000 1.818000  6.355000 1.047000  -0.9678000     2.098000  
1 1 1 4  17 61 o 5.458000 1.043000  4.797000 1.654000  6.119000 1.271000  -1.322000      2.086000  
1 1 1 4  17 63 o 5.822000 1.126000  6.171000 1.842000  5.474000 1.296000  0.6969000      2.253000  
1 1 1 4  17 65 o 7.812000 0.8133000 8.430000 1.191000  7.194000 1.108000  1.236000       1.627000  
1 1 1 4  18 0  o 40.75000 0.4229000 40.75000 0.4229000 40.75000 0.4229000 0.000000       0.000000  
1 1 1 4  18 2  o 76.03000 0.5263000 76.17000 0.7461000 75.90000 0.7426000 0.2772000      1.053000  
1 1 1 4  18 4  o 78.25000 0.6252000 78.86000 0.8917000 77.64000 0.8766000 1.225000       1.250000  
1 1 1 4  18 6  o 5.011000 0.3683000 4.281000 0.5479000 5.741000 0.4925000 -1.460000      0.7367000 
1 1 1 4  18 8  o 104.4000 0.7736000 104.0000 1.009000  104.8000 1.173000  -0.8408000     1.547000  
1 1 1 4  18 10 o 110.1000 0.7792000 110.2000 0.9562000 110.0000 1.231000  0.1324000      1.558000  
1 1 1 4  18 12 o 107.9000 0.7635000 108.4000 0.9411000 107.4000 1.202000  1.009000       1.527000  
1 1 1 4  18 14 o 81.41000 0.5843000 81.39000 0.7165000 81.44000 0.9232000 -0.5569000E-01 1.169000  
1 1 1 4  18 16 o 65.25000 0.5032000 65.11000 0.6522000 65.39000 0.7664000 -0.2735000     1.006000  
1 1 1 4  18 18 o 99.63000 0.8881000 99.48000 1.123000  99.78000 1.376000  -0.2989000     1.776000  
1 1 1 4  18 20 o 33.54000 0.3750000 33.47000 0.5793000 33.61000 0.4765000 -0.1393000     0.7501000 
1 1 1 4  18 22 o 9.624000 0.4864000 9.776000 0.6821000 9.471000 0.6937000 0.3048000      0.9729000 
1 1 1 4  18 24 o 31.41000 0.4328000 ?        ?         31.41000 0.4328000 ?              ?         
1 1 1 4  18 26 f 41.22000 0.3409000 41.19000 0.5298000 41.25000 0.4293000 -0.6545000E-01 0.6819000 
1 1 1 4  18 28 o 26.83000 0.2940000 27.09000 0.4556000 26.57000 0.3717000 0.5208000      0.5880000 
1 1 1 4  18 30 o 51.27000 0.3997000 51.42000 0.6271000 51.12000 0.4959000 0.2985000      0.7994000 
1 1 1 4  18 32 o 23.46000 0.3195000 23.99000 0.4705000 22.94000 0.4323000 1.049000       0.6389000 
1 1 1 4  18 34 o 36.92000 0.3425000 36.82000 0.5111000 37.01000 0.4563000 -0.1907000     0.6851000 
1 1 1 4  18 36 o 27.12000 0.3521000 27.24000 0.5898000 27.00000 0.3849000 0.2396000      0.7043000 
1 1 1 4  18 38 o 30.55000 0.3228000 30.81000 0.5046000 30.29000 0.4026000 0.5205000      0.6455000 
1 1 1 4  18 40 o 37.93000 0.3937000 37.84000 0.6606000 38.02000 0.4284000 -0.1795000     0.7874000 
1 1 1 4  18 42 o 28.96000 0.3350000 28.63000 0.5237000 29.30000 0.4178000 -0.6694000     0.6699000 
1 1 1 4  18 44 o 21.07000 0.3760000 20.76000 0.5685000 21.38000 0.4923000 -0.6210000     0.7520000 
1 1 1 4  18 46 o 7.239000 0.9999000 8.716000 1.060000  5.762000 1.696000  2.955000       2.000000  
1 1 1 4  18 48 o 24.49000 0.3405000 23.95000 0.5319000 25.03000 0.4254000 -1.081000      0.6811000 
1 1 1 4  18 50 o 12.71000 0.4768000 12.44000 0.7703000 12.97000 0.5622000 -0.5230000     0.9536000 
1 1 1 4  18 52 o 17.89000 0.3711000 18.20000 0.5911000 17.58000 0.4489000 0.6145000      0.7422000 
1 1 1 4  18 54 o 14.04000 0.4092000 13.96000 0.6404000 14.11000 0.5097000 -0.1520000     0.8184000 
1 1 1 4  18 56 o 10.78000 0.5387000 10.89000 0.8197000 10.67000 0.6991000 0.2196000      1.077000  
1 1 1 4  18 58 o 13.00000 0.4975000 13.86000 0.7667000 12.13000 0.6343000 1.729000       0.9951000 
1 1 1 4  18 60 o 9.218000 0.7393000 9.347000 1.219000  9.089000 0.8376000 0.2584000      1.479000  
1 1 1 4  18 62 o 5.838000 0.9548000 5.140000 1.602000  6.537000 1.039000  -1.396000      1.910000  
1 1 1 4  18 64 o 4.487000 0.9817000 6.160000 1.563000  2.813000 1.188000  3.346000       1.963000  
1 1 1 4  19 1  o 55.03000 0.3901000 54.82000 0.5501000 55.25000 0.5532000 -0.4237000     0.7802000 
1 1 1 4  19 3  o 46.05000 0.3609000 45.53000 0.5415000 46.57000 0.4773000 -1.039000      0.7219000 
1 1 1 4  19 5  o 75.18000 0.5648000 74.13000 0.7285000 76.22000 0.8634000 -2.088000      1.130000  
1 1 1 4  19 7  o 59.34000 0.4525000 60.01000 0.6014000 58.68000 0.6763000 1.325000       0.9050000 
1 1 1 4  19 9  o 117.2000 0.8287000 117.2000 1.015000  117.2000 1.310000  -0.1694000E-01 1.657000  
1 1 1 4  19 11 o 112.6000 0.7986000 112.0000 0.9734000 113.2000 1.266000  -1.261000      1.597000  
1 1 1 4  19 13 o 63.61000 0.4653000 63.62000 0.5715000 63.60000 0.7345000 0.1971000E-01  0.9307000 
1 1 1 4  19 15 o 98.88000 1.064000  99.02000 0.8648000 98.75000 1.944000  0.2729000      2.128000  
1 1 1 4  19 17 o 54.93000 0.4865000 54.70000 0.5663000 55.17000 0.7911000 -0.4705000     0.9730000 
1 1 1 4  19 19 o 22.85000 0.2918000 23.31000 0.4073000 22.40000 0.4179000 0.9160000      0.5835000 
1 1 1 4  19 21 f 18.11000 0.3654000 18.98000 0.5937000 17.25000 0.4263000 1.736000       0.7309000 
1 1 1 4  19 23 o 91.95000 0.7552000 92.18000 1.273000  91.72000 0.8125000 0.4591000      1.510000  
1 1 1 4  19 25 f 63.52000 0.4714000 62.99000 0.7361000 64.05000 0.5892000 -1.060000      0.9428000 
1 1 1 4  19 27 o 49.83000 0.3886000 50.34000 0.6108000 49.31000 0.4806000 1.037000       0.7772000 
1 1 1 4  19 29 o 26.01000 0.3073000 25.74000 0.4525000 26.28000 0.4159000 -0.5447000     0.6146000 
1 1 1 4  19 31 o 29.19000 0.3017000 29.30000 0.4692000 29.09000 0.3794000 0.2088000      0.6034000 
1 1 1 4  19 33 o 20.64000 0.3910000 20.01000 0.4902000 21.28000 0.6094000 -1.275000      0.7821000 
1 1 1 4  19 35 o 11.79000 0.4414000 12.38000 0.6794000 11.21000 0.5637000 1.171000       0.8828000 
1 1 1 4  19 37 o 29.93000 0.4742000 29.80000 0.8616000 30.06000 0.3964000 -0.2635000     0.9484000 
1 1 1 4  19 39 o 26.43000 0.3744000 26.59000 0.6319000 26.26000 0.4016000 0.3291000      0.7487000 
1 1 1 4  19 41 o 38.25000 0.3523000 38.46000 0.5544000 38.05000 0.4350000 0.4043000      0.7047000 
1 1 1 4  19 43 o 30.28000 0.3506000 30.01000 0.5215000 30.55000 0.4687000 -0.5399000     0.7012000 
1 1 1 4  19 45 o 8.689000 0.6998000 9.234000 1.089000  8.143000 0.8793000 1.092000       1.400000  
1 1 1 4  19 47 o 13.34000 0.4635000 13.40000 0.7408000 13.27000 0.5572000 0.1232000      0.9269000 
1 1 1 4  19 49 o 20.06000 0.4170000 19.71000 0.7061000 20.41000 0.4439000 -0.7033000     0.8341000 
1 1 1 4  19 51 o 7.053000 0.7871000 6.619000 1.332000  7.487000 0.8389000 -0.8682000     1.574000  
1 1 1 4  19 53 o 4.733000 1.003000  4.834000 1.625000  4.632000 1.176000  0.2026000      2.006000  
1 1 1 4  19 55 f 6.551000 0.8120000 6.743000 1.208000  6.358000 1.085000  0.3846000      1.624000  
1 1 1 4  19 57 o 7.731000 0.7567000 8.632000 1.036000  6.829000 1.103000  1.803000       1.513000  
1 1 1 4  19 59 o 5.557000 1.034000  4.657000 1.636000  6.457000 1.266000  -1.800000      2.068000  
1 1 1 4  19 61 o 6.110000 0.9985000 6.430000 1.555000  5.790000 1.253000  0.6400000      1.997000  
1 1 1 4  19 63 o 5.410000 1.293000  6.121000 2.145000  4.699000 1.445000  1.421000       2.586000  
1 1 1 4  20 0  o 100.4000 0.9746000 100.4000 0.9746000 100.4000 0.9746000 0.000000       0.000000  
1 1 1 4  20 2  o 82.33000 0.6145000 81.74000 0.9234000 82.91000 0.8109000 -1.170000      1.229000  
1 1 1 4  20 4  o 42.36000 0.3139000 42.56000 0.4460000 42.16000 0.4419000 0.3999000      0.6279000 
1 1 1 4  20 6  f 38.82000 0.3169000 38.87000 0.4178000 38.78000 0.4767000 0.8815000E-01  0.6339000 
1 1 1 4  20 8  o 126.2000 0.9955000 125.7000 1.403000  126.6000 1.413000  -0.9490000     1.991000  
1 1 1 4  20 10 o 34.24000 0.2816000 34.53000 0.3520000 33.96000 0.4396000 0.5639000      0.5632000 
1 1 1 4  20 12 o 118.0000 0.8354000 117.7000 1.021000  118.3000 1.323000  -0.6182000     1.671000  
1 1 1 4  20 14 o 122.0000 1.024000  123.3000 1.196000  120.7000 1.663000  2.599000       2.048000  
1 1 1 4  20 16 o 126.5000 1.349000  125.7000 1.091000  127.3000 2.467000  -1.556000      2.698000  
1 1 1 4  20 18 o 42.99000 0.3436000 43.27000 0.4262000 42.70000 0.5390000 0.5679000      0.6871000 
1 1 1 4  20 20 o 126.9000 1.125000  128.0000 1.755000  125.7000 1.407000  2.314000       2.249000  
1 1 1 4  20 22 o 66.26000 0.5605000 67.17000 0.9480000 65.34000 0.5983000 1.835000       1.121000  
1 1 1 4  20 24 o 42.67000 0.3979000 43.08000 0.6676000 42.25000 0.4332000 0.8279000      0.7958000 
1 1 1 4  20 26 o 89.57000 0.6456000 90.14000 1.022000  88.99000 0.7895000 1.153000       1.291000  
1 1 1 4  20 28 o 51.85000 0.4218000 52.02000 0.6291000 51.68000 0.5620000 0.3441000      0.8435000 
1 1 1 4  20 30 o 33.54000 0.3134000 33.76000 0.4862000 33.32000 0.3955000 0.4355000      0.6268000 
1 1 1 4  20 32 o 33.55000 0.3619000 33.45000 0.4883000 33.66000 0.5343000 -0.2144000     0.7238000 
1 1 1 4  20 34 o 25.87000 0.3051000 26.11000 0.4760000 25.63000 0.3817000 0.4815000      0.6102000 
1 1 1 4  20 36 o 21.96000 0.4919000 22.41000 0.8950000 21.51000 0.4086000 0.8993000      0.9839000 
1 1 1 4  20 38 o 22.93000 0.3350000 22.29000 0.5276000 23.57000 0.4128000 -1.274000      0.6699000 
1 1 1 4  20 40 o 18.07000 0.4279000 18.59000 0.7156000 17.55000 0.4694000 1.040000       0.8558000 
1 1 1 4  20 42 o 36.46000 0.3990000 36.07000 0.6676000 36.86000 0.4371000 -0.7856000     0.7979000 
1 1 1 4  20 44 f 25.45000 0.3475000 25.17000 0.5433000 25.73000 0.4333000 -0.5686000     0.6949000 
1 1 1 4  20 46 o 8.164000 0.7379000 8.507000 1.092000  7.820000 0.9924000 0.6874000      1.476000  
1 1 1 4  20 48 o 27.12000 0.3990000 26.94000 0.6543000 27.29000 0.4569000 -0.3534000     0.7981000 
1 1 1 4  20 50 o 13.83000 0.4233000 13.74000 0.6717000 13.91000 0.5155000 -0.1656000     0.8467000 
1 1 1 4  20 52 o 24.77000 0.3392000 24.47000 0.5370000 25.06000 0.4144000 -0.5917000     0.6783000 
1 1 1 4  20 54 o 15.72000 0.3845000 16.06000 0.5995000 15.37000 0.4816000 0.6904000      0.7690000 
1 1 1 4  20 56 o 4.397000 1.056000  3.952000 1.496000  4.842000 1.491000  -0.8898000     2.112000  
1 1 1 4  20 58 o 8.267000 0.9541000 8.918000 1.510000  7.616000 1.166000  1.302000       1.908000  
1 1 1 4  20 60 o 4.403000 1.041000  3.742000 1.624000  5.065000 1.302000  -1.323000      2.082000  
1 1 1 4  20 62 o 5.272000 1.087000  5.715000 1.751000  4.830000 1.289000  0.8848000      2.174000  
1 1 1 4  20 64 o 3.180000 0.9792000 3.468000 1.518000  2.892000 1.238000  0.5759000      1.958000  
1 1 1 4  21 1  o 31.79000 0.3002000 31.84000 0.4255000 31.74000 0.4237000 0.9588000E-01  0.6005000 
1 1 1 4  21 3  o 80.44000 0.5574000 79.85000 0.7827000 81.03000 0.7938000 -1.180000      1.115000  
1 1 1 4  21 5  o 114.1000 0.8431000 114.9000 1.113000  113.3000 1.267000  1.606000       1.686000  
1 1 1 4  21 7  o 62.00000 0.4536000 62.20000 0.5589000 61.80000 0.7147000 0.4021000      0.9072000 
1 1 1 4  21 9  o 110.3000 0.7826000 110.1000 0.9567000 110.6000 1.239000  -0.5380000     1.565000  
1 1 1 4  21 11 o 92.49000 1.097000  93.17000 1.289000  91.82000 1.777000  1.346000       2.195000  
1 1 1 4  21 13 o 53.02000 0.4639000 52.62000 0.4877000 53.41000 0.7893000 -0.7955000     0.9278000 
1 1 1 4  21 15 o 76.89000 0.8327000 77.40000 0.6871000 76.37000 1.517000  1.026000       1.665000  
1 1 1 4  21 17 o 96.40000 0.6895000 96.12000 0.8430000 96.68000 1.091000  -0.5613000     1.379000  
1 1 1 4  21 19 o 11.16000 0.4067000 11.55000 0.5002000 10.77000 0.6415000 0.7707000      0.8134000 
1 1 1 4  21 21 o 83.40000 0.6326000 83.99000 0.9608000 82.80000 0.8230000 1.197000       1.265000  
1 1 1 4  21 23 o 20.74000 0.3296000 20.37000 0.5392000 21.11000 0.3790000 -0.7403000     0.6591000 
1 1 1 4  21 25 o 11.06000 0.4615000 11.44000 0.7241000 10.67000 0.5725000 0.7704000      0.9231000 
1 1 1 4  21 27 o 15.06000 0.3378000 15.30000 0.5310000 14.82000 0.4175000 0.4774000      0.6755000 
1 1 1 4  21 29 o 37.04000 0.3248000 37.04000 0.5048000 37.03000 0.4088000 0.9613000E-02  0.6496000 
1 1 1 4  21 31 o 38.10000 0.3473000 37.77000 0.5176000 38.42000 0.4632000 -0.6501000     0.6946000 
1 1 1 4  21 33 o 22.28000 0.3560000 21.95000 0.4743000 22.60000 0.5311000 -0.6429000     0.7121000 
1 1 1 4  21 35 o 10.33000 0.5274000 10.42000 0.7681000 10.24000 0.7229000 0.1799000      1.055000  
1 1 1 4  21 37 o 4.451000 0.9953000 4.242000 1.550000  4.660000 1.249000  -0.4183000     1.991000  
1 1 1 4  21 39 o 31.49000 0.3770000 32.25000 0.6304000 30.72000 0.4137000 1.529000       0.7540000 
1 1 1 4  21 41 o 19.77000 0.3652000 20.14000 0.5806000 19.40000 0.4432000 0.7327000      0.7304000 
1 1 1 4  21 43 o 33.81000 0.4114000 34.81000 0.6673000 32.81000 0.4815000 1.999000       0.8229000 
1 1 1 4  21 45 o 10.44000 0.6182000 11.05000 0.8700000 9.837000 0.8786000 1.209000       1.236000  
1 1 1 4  21 47 o 4.665000 1.084000  4.855000 1.712000  4.474000 1.329000  0.3811000      2.167000  
1 1 1 4  21 49 o 3.496000 0.9739000 3.227000 1.449000  3.765000 1.302000  -0.5386000     1.948000  
1 1 1 4  21 51 o 9.108000 0.5932000 9.080000 0.9308000 9.136000 0.7356000 -0.5536000E-01 1.186000  
1 1 1 4  21 53 o 4.486000 0.9009000 3.324000 1.439000  5.648000 1.084000  -2.324000      1.802000  
1 1 1 4  21 55 o 6.632000 0.8705000 7.890000 1.049000  5.373000 1.390000  2.517000       1.741000  
1 1 1 4  21 57 o 3.968000 0.9932000 4.704000 1.512000  3.233000 1.288000  1.471000       1.986000  
1 1 1 4  21 59 o 5.291000 1.012000  6.519000 1.469000  4.062000 1.393000  2.457000       2.024000  
1 1 1 4  21 61 o 4.196000 1.064000  3.662000 1.511000  4.729000 1.498000  -1.067000      2.128000  
1 1 1 4  21 63 o 3.810000 1.110000  5.138000 1.920000  2.481000 1.115000  2.657000       2.220000  
1 1 1 4  22 0  o 77.16000 0.8782000 77.16000 0.8782000 77.16000 0.8782000 0.000000       0.000000  
1 1 1 4  22 2  o 97.37000 0.7248000 97.03000 0.9441000 97.70000 1.100000  -0.6685000     1.450000  
1 1 1 4  22 4  o 50.07000 0.3941000 50.17000 0.5163000 49.96000 0.5956000 0.2087000      0.7882000 
1 1 1 4  22 6  o 51.50000 0.3839000 52.67000 0.4837000 50.33000 0.5962000 2.349000       0.7677000 
1 1 1 4  22 8  o 40.69000 0.3649000 40.74000 0.3989000 40.64000 0.6111000 0.9765000E-01  0.7298000 
1 1 1 4  22 10 o 46.76000 0.3592000 46.54000 0.4417000 46.98000 0.5667000 -0.4446000     0.7185000 
1 1 1 4  22 12 o 32.34000 0.3520000 32.50000 0.4060000 32.18000 0.5752000 0.3221000      0.7040000 
1 1 1 4  22 14 o 80.96000 0.9212000 81.48000 0.9285000 80.45000 1.591000  1.038000       1.842000  
1 1 1 4  22 16 o 42.97000 0.3447000 42.51000 0.4214000 43.43000 0.5456000 -0.9213000     0.6894000 
1 1 1 4  22 18 o 9.310000 0.4664000 9.947000 0.6269000 8.672000 0.6906000 1.275000       0.9327000 
1 1 1 4  22 20 o 76.22000 0.5815000 76.75000 0.7714000 75.69000 0.8703000 1.057000       1.163000  
1 1 1 4  22 22 o 46.29000 0.3855000 46.06000 0.5772000 46.52000 0.5110000 -0.4530000     0.7709000 
1 1 1 4  22 24 o 81.72000 0.5741000 81.29000 0.8053000 82.16000 0.8185000 -0.8791000     1.148000  
1 1 1 4  22 26 o 59.33000 0.4675000 59.98000 0.7065000 58.68000 0.6123000 1.302000       0.9349000 
1 1 1 4  22 28 o 70.59000 0.5453000 70.74000 0.8189000 70.44000 0.7202000 0.3093000      1.091000  
1 1 1 4  22 30 o 14.98000 0.3698000 15.07000 0.5392000 14.88000 0.5063000 0.1840000      0.7397000 
1 1 1 4  22 32 o 29.13000 0.3516000 29.14000 0.4745000 29.12000 0.5189000 0.2015000E-01  0.7031000 
1 1 1 4  22 34 f 24.19000 0.3272000 24.11000 0.4939000 24.27000 0.4293000 -0.1590000     0.6544000 
1 1 1 4  22 36 o 8.201000 0.7829000 8.620000 1.328000  7.783000 0.8303000 0.8377000      1.566000  
1 1 1 4  22 38 o 15.77000 0.4199000 15.69000 0.6698000 15.85000 0.5067000 -0.1647000     0.8398000 
1 1 1 4  22 40 o 10.67000 0.6381000 10.08000 1.101000  11.26000 0.6447000 -1.184000      1.276000  
1 1 1 4  22 42 o 22.93000 0.3499000 23.01000 0.5379000 22.85000 0.4476000 0.1580000      0.6997000 
1 1 1 4  22 44 o 15.99000 0.4596000 15.89000 0.6714000 16.08000 0.6279000 -0.1922000     0.9192000 
1 1 1 4  22 46 o 5.712000 0.9426000 6.445000 1.288000  4.978000 1.376000  1.467000       1.885000  
1 1 1 4  22 48 o 15.55000 0.4174000 15.08000 0.6765000 16.01000 0.4893000 -0.9255000     0.8349000 
1 1 1 4  22 50 o 24.00000 0.3374000 23.69000 0.5265000 24.31000 0.4220000 -0.6188000     0.6748000 
1 1 1 4  22 52 o 22.24000 0.3818000 23.10000 0.6352000 21.38000 0.4238000 1.722000       0.7636000 
1 1 1 4  22 54 o 10.05000 0.5176000 10.42000 0.7886000 9.677000 0.6706000 0.7438000      1.035000  
1 1 1 4  22 56 o 3.069000 0.8903000 2.518000 1.188000  3.620000 1.327000  -1.102000      1.781000  
1 1 1 4  22 58 o 5.024000 1.016000  4.057000 1.551000  5.992000 1.313000  -1.935000      2.032000  
1 1 1 4  22 60 o 11.65000 0.6091000 12.84000 0.9832000 10.47000 0.7192000 2.366000       1.218000  
1 1 1 4  22 62 o 3.650000 1.029000  3.851000 1.544000  3.449000 1.360000  0.4014000      2.058000  
1 1 1 4  23 1  o 67.58000 0.4752000 68.00000 0.6760000 67.16000 0.6681000 0.8402000      0.9505000 
1 1 1 4  23 3  o 35.55000 0.3714000 35.43000 0.4552000 35.67000 0.5870000 -0.2340000     0.7428000 
1 1 1 4  23 5  o 64.17000 0.5580000 64.16000 0.6415000 64.19000 0.9131000 -0.2451000E-01 1.116000  
1 1 1 4  23 7  o 61.40000 0.4725000 61.40000 0.6206000 61.39000 0.7126000 0.9422000E-02  0.9450000 
1 1 1 4  23 9  o 87.29000 0.6246000 87.43000 0.7682000 87.14000 0.9851000 0.2875000      1.249000  
1 1 1 4  23 11 o 95.34000 1.030000  94.21000 0.8257000 96.48000 1.888000  -2.262000      2.061000  
1 1 1 4  23 13 o 58.14000 0.5055000 57.25000 0.5276000 59.02000 0.8625000 -1.771000      1.011000  
1 1 1 4  23 15 o 28.54000 0.2753000 28.68000 0.3478000 28.40000 0.4269000 0.2816000      0.5506000 
1 1 1 4  23 17 o 47.61000 0.4570000 47.59000 0.7023000 47.64000 0.5849000 -0.4511000E-01 0.9140000 
1 1 1 4  23 19 o 24.10000 0.2918000 24.31000 0.3985000 23.88000 0.4262000 0.4264000      0.5835000 
1 1 1 4  23 21 o 58.25000 0.5209000 58.12000 0.8470000 58.37000 0.6066000 -0.2505000     1.042000  
1 1 1 4  23 23 o 8.299000 0.5022000 8.058000 0.6800000 8.540000 0.7393000 -0.4819000     1.004000  
1 1 1 4  23 25 o 18.17000 0.2895000 18.26000 0.3995000 18.08000 0.4192000 0.1824000      0.5791000 
1 1 1 4  23 27 o 35.55000 0.3342000 35.77000 0.4343000 35.34000 0.5080000 0.4302000      0.6684000 
1 1 1 4  23 29 o 21.84000 0.2880000 22.25000 0.4099000 21.42000 0.4048000 0.8271000      0.5761000 
1 1 1 4  23 31 o 61.12000 0.4812000 60.59000 0.7181000 61.65000 0.6408000 -1.066000      0.9624000 
1 1 1 4  23 33 o 30.16000 0.3277000 30.46000 0.4887000 29.86000 0.4366000 0.6000000      0.6553000 
1 1 1 4  23 35 o 38.44000 0.3917000 38.24000 0.6533000 38.63000 0.4323000 -0.3892000     0.7834000 
1 1 1 4  23 37 o 16.08000 0.3845000 15.93000 0.6094000 16.23000 0.4690000 -0.2951000     0.7690000 
1 1 1 4  23 39 o 9.199000 0.7204000 9.103000 1.216000  9.296000 0.7725000 -0.1930000     1.441000  
1 1 1 4  23 41 o 33.98000 0.3417000 34.13000 0.5308000 33.82000 0.4304000 0.3110000      0.6834000 
1 1 1 4  23 43 o 34.54000 0.3867000 34.68000 0.5320000 34.41000 0.5614000 0.2676000      0.7734000 
1 1 1 4  23 45 o 17.59000 0.3667000 17.69000 0.5726000 17.48000 0.4583000 0.2101000      0.7334000 
1 1 1 4  23 47 o 11.63000 0.4906000 11.66000 0.7439000 11.60000 0.6397000 0.5951000E-01  0.9811000 
1 1 1 4  23 49 o 12.57000 0.5369000 12.18000 0.9220000 12.95000 0.5503000 -0.7735000     1.074000  
1 1 1 4  23 51 o 4.598000 0.9522000 4.142000 1.497000  5.053000 1.177000  -0.9109000     1.904000  
1 1 1 4  23 53 o 15.09000 0.4067000 14.74000 0.6672000 15.43000 0.4655000 -0.6882000     0.8135000 
1 1 1 4  23 55 o 7.611000 0.9221000 8.463000 0.9359000 6.758000 1.589000  1.705000       1.844000  
1 1 1 4  23 57 o 3.807000 1.068000  3.555000 1.574000  4.059000 1.445000  -0.5041000     2.137000  
1 1 1 4  23 59 o 6.551000 0.8822000 7.895000 1.205000  5.208000 1.289000  2.686000       1.764000  
1 1 1 4  23 61 o 5.395000 0.9703000 4.788000 1.574000  6.003000 1.135000  -1.216000      1.941000  
1 1 1 4  23 63 o 4.386000 1.111000  4.219000 1.775000  4.553000 1.335000  -0.3336000     2.221000  
1 1 1 4  24 0  o 2.848000 1.081000  2.848000 1.081000  2.848000 1.081000  0.000000       0.000000  
1 1 1 4  24 2  o 25.85000 0.2698000 25.73000 0.3522000 25.97000 0.4088000 -0.2359000     0.5396000 
1 1 1 4  24 4  o 75.89000 0.6862000 75.92000 0.8666000 75.87000 1.064000  0.4537000E-01  1.372000  
1 1 1 4  24 6  o 143.2000 1.056000  143.3000 1.384000  143.1000 1.596000  0.2114000      2.112000  
1 1 1 4  24 8  o 114.0000 0.9308000 113.3000 0.9862000 114.7000 1.579000  -1.415000      1.862000  
1 1 1 4  24 10 o 33.91000 0.4459000 33.18000 0.3608000 34.65000 0.8157000 -1.469000      0.8919000 
1 1 1 4  24 12 o 31.87000 0.3376000 31.88000 0.3548000 31.85000 0.5743000 0.3320000E-01  0.6751000 
1 1 1 4  24 14 o 60.43000 0.4491000 60.53000 0.5540000 60.33000 0.7070000 0.1987000      0.8982000 
1 1 1 4  24 16 o 32.28000 0.3578000 32.41000 0.4504000 32.15000 0.5560000 0.2651000      0.7155000 
1 1 1 4  24 18 o 45.41000 0.3789000 45.21000 0.4995000 45.61000 0.5698000 -0.3970000     0.7578000 
1 1 1 4  24 20 o 6.346000 0.6253000 6.576000 0.6802000 6.115000 1.049000  0.4612000      1.251000  
1 1 1 4  24 22 o 21.16000 0.2973000 20.75000 0.4386000 21.57000 0.4015000 -0.8161000     0.5946000 
1 1 1 4  24 24 o 61.56000 0.4475000 61.60000 0.6300000 61.51000 0.6356000 0.9913000E-01  0.8949000 
1 1 1 4  24 26 o 57.62000 0.4615000 57.55000 0.5971000 57.69000 0.7038000 -0.1415000     0.9230000 
1 1 1 4  24 28 o 40.83000 0.3363000 40.87000 0.4699000 40.79000 0.4812000 0.7554000E-01  0.6726000 
1 1 1 4  24 30 o 48.10000 0.3760000 47.64000 0.5247000 48.55000 0.5388000 -0.9124000     0.7520000 
1 1 1 4  24 32 o 19.87000 0.3948000 18.89000 0.4485000 20.85000 0.6499000 -1.967000      0.7896000 
1 1 1 4  24 34 f 22.43000 0.3785000 22.48000 0.6120000 22.37000 0.4454000 0.1035000      0.7569000 
1 1 1 4  24 36 o 11.39000 0.5537000 11.56000 0.9286000 11.22000 0.6032000 0.3476000      1.107000  
1 1 1 4  24 38 o 40.78000 0.3610000 41.25000 0.5675000 40.31000 0.4465000 0.9376000      0.7221000 
1 1 1 4  24 40 o 22.62000 0.3575000 22.86000 0.5596000 22.38000 0.4449000 0.4807000      0.7150000 
1 1 1 4  24 42 o 19.41000 0.3900000 18.98000 0.5908000 19.84000 0.5092000 -0.8599000     0.7800000 
1 1 1 4  24 44 f 13.22000 0.4475000 13.51000 0.6839000 12.94000 0.5774000 0.5682000      0.8950000 
1 1 1 4  24 46 o 11.73000 0.5561000 11.99000 0.8721000 11.47000 0.6904000 0.5218000      1.112000  
1 1 1 4  24 48 o 9.239000 0.5927000 8.825000 0.9690000 9.653000 0.6828000 -0.8274000     1.185000  
1 1 1 4  24 50 f 7.065000 0.7776000 6.625000 1.315000  7.506000 0.8301000 -0.8814000     1.555000  
1 1 1 4  24 52 o 6.094000 0.9356000 5.853000 1.564000  6.336000 1.027000  -0.4829000     1.871000  
1 1 1 4  24 54 o 8.039000 0.7711000 8.525000 0.9559000 7.554000 1.210000  0.9706000      1.542000  
1 1 1 4  24 56 o 7.613000 1.138000  6.341000 2.078000  8.885000 0.9285000 -2.544000      2.276000  
1 1 1 4  24 58 o 4.799000 1.046000  4.326000 1.529000  5.272000 1.428000  -0.9463000     2.092000  
1 1 1 4  24 60 o 10.07000 0.7006000 10.67000 1.088000  9.471000 0.8830000 1.199000       1.401000  
1 1 1 4  24 62 o 8.087000 0.6793000 7.779000 1.014000  8.396000 0.9049000 -0.6168000     1.359000  
1 1 1 4  25 1  o 65.61000 0.5983000 66.57000 0.7688000 64.65000 0.9170000 1.916000       1.197000  
1 1 1 4  25 3  o 25.79000 0.2709000 25.75000 0.4054000 25.83000 0.3596000 -0.8030000E-01 0.5419000 
1 1 1 4  25 5  o 52.91000 0.3863000 53.02000 0.5480000 52.80000 0.5447000 0.2207000      0.7727000 
1 1 1 4  25 7  o 18.53000 0.3181000 18.69000 0.3247000 18.37000 0.5471000 0.3270000      0.6362000 
1 1 1 4  25 9  o 62.01000 0.6932000 61.74000 0.5619000 62.28000 1.267000  -0.5411000     1.386000  
1 1 1 4  25 11 o 53.26000 0.4036000 52.85000 0.4936000 53.66000 0.6386000 -0.8088000     0.8072000 
1 1 1 4  25 13 o 29.32000 0.2770000 29.35000 0.3491000 29.28000 0.4303000 0.6756000E-01  0.5541000 
1 1 1 4  25 15 o 16.92000 0.3486000 17.04000 0.4931000 16.80000 0.4930000 0.2343000      0.6972000 
1 1 1 4  25 17 o 98.08000 0.7014000 98.30000 0.8633000 97.86000 1.106000  0.4414000      1.403000  
1 1 1 4  25 19 o 86.35000 0.7841000 85.92000 1.216000  86.78000 0.9897000 -0.8646000     1.568000  
1 1 1 4  25 21 o 30.88000 0.3245000 30.81000 0.4602000 30.95000 0.4577000 -0.1365000     0.6490000 
1 1 1 4  25 23 o 15.50000 0.3554000 14.83000 0.5475000 16.17000 0.4533000 -1.348000      0.7108000 
1 1 1 4  25 25 o 12.50000 0.3940000 12.41000 0.5033000 12.58000 0.6064000 -0.1704000     0.7880000 
1 1 1 4  25 27 o 23.38000 0.2866000 23.32000 0.3957000 23.45000 0.4147000 -0.1274000     0.5732000 
1 1 1 4  25 29 o 19.66000 0.3095000 19.78000 0.4223000 19.54000 0.4525000 0.2410000      0.6189000 
1 1 1 4  25 31 o 42.28000 0.3481000 42.22000 0.4923000 42.34000 0.4924000 -0.1275000     0.6963000 
1 1 1 4  25 33 o 43.68000 0.3848000 43.46000 0.5770000 43.90000 0.5092000 -0.4425000     0.7696000 
1 1 1 4  25 35 o 13.24000 0.4144000 12.83000 0.6156000 13.66000 0.5550000 -0.8274000     0.8288000 
1 1 1 4  25 37 o 14.39000 0.4124000 14.46000 0.5840000 14.33000 0.5823000 0.1354000      0.8247000 
1 1 1 4  25 39 o 6.929000 0.8532000 7.690000 1.122000  6.168000 1.286000  1.522000       1.706000  
1 1 1 4  25 41 o 25.23000 0.3299000 25.24000 0.4720000 25.21000 0.4611000 0.2229000E-01  0.6598000 
1 1 1 4  25 43 o 4.759000 1.001000  3.907000 1.504000  5.610000 1.322000  -1.702000      2.002000  
1 1 1 4  25 45 o 9.256000 0.6653000 8.936000 0.9535000 9.575000 0.9280000 -0.6392000     1.331000  
1 1 1 4  25 47 o 8.261000 0.6470000 7.959000 1.066000  8.564000 0.7341000 -0.6051000     1.294000  
1 1 1 4  25 49 o 5.366000 1.004000  5.556000 1.579000  5.177000 1.239000  0.3786000      2.007000  
1 1 1 4  25 51 o 20.51000 0.3711000 20.20000 0.5725000 20.83000 0.4723000 -0.6377000     0.7422000 
1 1 1 4  25 53 o 6.356000 0.8778000 6.402000 1.291000  6.310000 1.189000  0.9197000E-01  1.756000  
1 1 1 4  25 55 o 19.78000 0.4658000 19.77000 0.5801000 19.79000 0.7289000 -0.2413000E-01 0.9316000 
1 1 1 4  25 57 o 3.143000 0.9178000 3.352000 1.322000  2.934000 1.273000  0.4178000      1.836000  
1 1 1 4  25 59 o 4.795000 0.8978000 5.920000 1.157000  3.669000 1.373000  2.251000       1.796000  
1 1 1 4  25 61 o 3.211000 0.9082000 2.864000 1.272000  3.559000 1.296000  -0.6950000     1.816000  
1 1 1 4  26 0  o 70.01000 0.8089000 70.01000 0.8089000 70.01000 0.8089000 0.000000       0.000000  
1 1 1 4  26 2  o 83.99000 0.6740000 84.06000 0.9541000 83.92000 0.9522000 0.1384000      1.348000  
1 1 1 4  26 4  o 25.03000 0.2567000 24.77000 0.3590000 25.28000 0.3669000 -0.5118000     0.5133000 
1 1 1 4  26 6  o 82.40000 0.5751000 82.65000 0.8164000 82.16000 0.8101000 0.4927000      1.150000  
1 1 1 4  26 8  o 45.17000 0.4016000 45.07000 0.4370000 45.26000 0.6738000 -0.1942000     0.8031000 
1 1 1 4  26 10 o 48.08000 0.3709000 48.21000 0.4600000 47.95000 0.5820000 0.2658000      0.7419000 
1 1 1 4  26 12 o 33.61000 0.2965000 33.30000 0.3673000 33.92000 0.4655000 -0.6221000     0.5929000 
1 1 1 4  26 14 o 99.11000 0.7912000 97.98000 1.106000  100.2000 1.131000  -2.257000      1.582000  
1 1 1 4  26 16 o 46.12000 0.3816000 46.40000 0.5058000 45.83000 0.5716000 0.5675000      0.7633000 
1 1 1 4  26 18 o 52.65000 0.5146000 52.82000 0.8085000 52.47000 0.6367000 0.3413000      1.029000  
1 1 1 4  26 20 o 59.94000 0.4713000 60.45000 0.6253000 59.44000 0.7054000 1.017000       0.9427000 
1 1 1 4  26 22 o 42.23000 0.3384000 42.22000 0.4737000 42.25000 0.4835000 -0.2538000E-01 0.6768000 
1 1 1 4  26 24 o 49.86000 0.4089000 49.69000 0.6106000 50.03000 0.5441000 -0.3351000     0.8178000 
1 1 1 4  26 26 o 50.20000 0.4433000 50.84000 0.6270000 49.57000 0.6267000 1.265000       0.8865000 
1 1 1 4  26 28 o 45.26000 0.3846000 44.85000 0.5008000 45.68000 0.5837000 -0.8346000     0.7691000 
1 1 1 4  26 30 o 21.36000 0.3240000 21.42000 0.4757000 21.30000 0.4401000 0.1194000      0.6480000 
1 1 1 4  26 32 o 27.36000 0.3345000 27.56000 0.4355000 27.17000 0.5079000 0.3971000      0.6690000 
1 1 1 4  26 34 o 35.89000 0.3279000 35.73000 0.4617000 36.04000 0.4658000 -0.3053000     0.6559000 
1 1 1 4  26 36 o 10.61000 0.5710000 10.56000 0.9103000 10.66000 0.6896000 -0.9991000E-01 1.142000  
1 1 1 4  26 38 o 30.60000 0.3452000 30.81000 0.5207000 30.39000 0.4534000 0.4232000      0.6904000 
1 1 1 4  26 40 o 8.506000 0.6319000 8.716000 0.9066000 8.296000 0.8806000 0.4200000      1.264000  
1 1 1 4  26 42 o 12.37000 0.5304000 12.83000 0.7177000 11.92000 0.7812000 0.9048000      1.061000  
1 1 1 4  26 44 o 15.32000 0.4592000 15.43000 0.5374000 15.21000 0.7448000 0.2210000      0.9185000 
1 1 1 4  26 46 o 18.33000 0.3896000 18.28000 0.5083000 18.37000 0.5907000 -0.9057000E-01 0.7793000 
1 1 1 4  26 48 o 8.743000 0.5915000 9.675000 0.7510000 7.810000 0.9140000 1.865000       1.183000  
1 1 1 4  26 50 o 3.306000 0.9341000 3.487000 1.365000  3.126000 1.275000  0.3609000      1.868000  
1 1 1 4  26 52 o 3.515000 0.9832000 3.497000 1.442000  3.533000 1.337000  -0.3654000E-01 1.966000  
1 1 1 4  26 54 o 5.403000 1.010000  5.578000 1.342000  5.229000 1.510000  0.3491000      2.020000  
1 1 1 4  26 56 o 18.87000 0.4100000 18.63000 0.6088000 19.12000 0.5494000 -0.4882000     0.8200000 
1 1 1 4  26 58 o 5.302000 0.9893000 5.791000 1.323000  4.814000 1.472000  0.9763000      1.979000  
1 1 1 4  26 60 o 6.090000 0.8644000 5.890000 1.305000  6.291000 1.134000  -0.4017000     1.729000  
1 1 1 4  26 62 o 5.737000 1.239000  5.996000 1.733000  5.478000 1.771000  0.5179000      2.478000  
1 1 1 4  27 1  o 83.97000 0.6324000 84.01000 0.9568000 83.92000 0.8271000 0.8970000E-01  1.265000  
1 1 1 4  27 3  o 34.93000 0.3342000 35.15000 0.4795000 34.71000 0.4656000 0.4386000      0.6683000 
1 1 1 4  27 5  o 61.84000 0.5096000 62.04000 0.7226000 61.64000 0.7187000 0.3996000      1.019000  
1 1 1 4  27 7  o 89.65000 0.6725000 89.21000 0.8769000 90.09000 1.020000  -0.8733000     1.345000  
1 1 1 4  27 9  o 5.749000 0.6482000 5.768000 0.8284000 5.731000 0.9971000 0.3730000E-01  1.296000  
1 1 1 4  27 11 o 68.55000 0.5271000 68.61000 0.6927000 68.49000 0.7946000 0.1277000      1.054000  
1 1 1 4  27 13 o 45.49000 0.3756000 45.06000 0.4891000 45.93000 0.5703000 -0.8642000     0.7513000 
1 1 1 4  27 15 o 15.20000 0.3311000 15.51000 0.4594000 14.90000 0.4770000 0.6087000      0.6623000 
1 1 1 4  27 17 o 10.34000 0.4542000 10.16000 0.7046000 10.53000 0.5734000 -0.3668000     0.9084000 
1 1 1 4  27 19 o 37.23000 0.3347000 37.45000 0.4464000 37.01000 0.4988000 0.4454000      0.6694000 
1 1 1 4  27 21 f 39.93000 0.3345000 39.52000 0.4071000 40.35000 0.5308000 -0.8285000     0.6689000 
1 1 1 4  27 23 o 44.79000 0.3522000 44.57000 0.4921000 45.01000 0.5039000 -0.4431000     0.7043000 
1 1 1 4  27 25 o 48.14000 0.4061000 47.68000 0.5184000 48.61000 0.6253000 -0.9364000     0.8122000 
1 1 1 4  27 27 o 28.25000 0.3106000 28.47000 0.4015000 28.03000 0.4741000 0.4468000      0.6213000 
1 1 1 4  27 29 o 23.00000 0.3524000 22.61000 0.5577000 23.39000 0.4310000 -0.7815000     0.7048000 
1 1 1 4  27 31 o 24.92000 0.3605000 24.86000 0.4942000 24.97000 0.5250000 -0.1117000     0.7210000 
1 1 1 4  27 33 o 26.10000 0.3121000 25.68000 0.4402000 26.52000 0.4425000 -0.8386000     0.6242000 
1 1 1 4  27 35 o 39.77000 0.3764000 39.67000 0.5716000 39.87000 0.4900000 -0.2007000     0.7529000 
1 1 1 4  27 37 o 36.15000 0.3352000 36.00000 0.4705000 36.30000 0.4775000 -0.3010000     0.6704000 
1 1 1 4  27 39 o 5.695000 0.9010000 4.785000 1.470000  6.605000 1.042000  -1.820000      1.802000  
1 1 1 4  27 41 o 19.24000 0.3955000 19.17000 0.5214000 19.31000 0.5948000 -0.1394000     0.7910000 
1 1 1 4  27 43 o 9.484000 0.5410000 9.154000 0.8423000 9.814000 0.6791000 -0.6596000     1.082000  
1 1 1 4  27 45 o 7.064000 0.7464000 7.358000 0.9583000 6.770000 1.145000  0.5888000      1.493000  
1 1 1 4  27 47 o 3.453000 0.9450000 3.020000 1.264000  3.887000 1.405000  -0.8663000     1.890000  
1 1 1 4  27 49 o 7.870000 0.6295000 8.416000 0.9442000 7.323000 0.8329000 1.093000       1.259000  
1 1 1 4  27 51 o 6.474000 0.8529000 5.383000 1.426000  7.564000 0.9366000 -2.181000      1.706000  
1 1 1 4  27 53 o 5.295000 1.028000  5.348000 1.523000  5.243000 1.383000  0.1047000      2.057000  
1 1 1 4  27 55 o 15.02000 0.4755000 15.31000 0.7014000 14.73000 0.6423000 0.5794000      0.9510000 
1 1 1 4  27 57 o 6.860000 0.8584000 7.695000 1.079000  6.024000 1.335000  1.671000       1.717000  
1 1 1 4  27 59 o 4.721000 1.023000  5.007000 1.443000  4.436000 1.450000  0.5711000      2.046000  
1 1 1 4  27 61 o 3.340000 0.9481000 2.858000 1.262000  3.821000 1.415000  -0.9628000     1.896000  
1 1 1 4  28 0  o 2.968000 1.132000  2.968000 1.132000  2.968000 1.132000  0.000000       0.000000  
1 1 1 4  28 2  f 90.13000 0.6762000 89.73000 0.8819000 90.52000 1.025000  -0.7954000     1.352000  
1 1 1 4  28 4  o 42.63000 0.4246000 42.77000 0.5447000 42.49000 0.6515000 0.2881000      0.8493000 
1 1 1 4  28 6  o 56.02000 0.4710000 55.98000 0.6702000 56.05000 0.6619000 -0.6265000E-01 0.9420000 
1 1 1 4  28 8  o 62.29000 0.4826000 62.23000 0.6305000 62.35000 0.7308000 -0.1177000     0.9652000 
1 1 1 4  28 10 o 58.32000 0.4579000 57.91000 0.5949000 58.74000 0.6963000 -0.8263000     0.9158000 
1 1 1 4  28 12 o 46.42000 0.3836000 46.40000 0.5039000 46.45000 0.5785000 -0.4958000E-01 0.7671000 
1 1 1 4  28 14 o 68.99000 0.5328000 68.91000 0.7022000 69.06000 0.8015000 -0.1422000     1.066000  
1 1 1 4  28 16 o 49.00000 0.4339000 48.31000 0.6178000 49.69000 0.6094000 -1.384000      0.8678000 
1 1 1 4  28 18 o 46.33000 0.3852000 46.47000 0.5114000 46.18000 0.5762000 0.2892000      0.7705000 
1 1 1 4  28 20 o 13.38000 0.3371000 14.06000 0.4087000 12.70000 0.5362000 1.360000       0.6742000 
1 1 1 4  28 22 o 20.99000 0.2741000 20.76000 0.3849000 21.22000 0.3902000 -0.4641000     0.5481000 
1 1 1 4  28 24 o 32.35000 0.3200000 31.90000 0.4112000 32.81000 0.4904000 -0.9106000     0.6400000 
1 1 1 4  28 26 o 39.71000 0.3562000 39.93000 0.4662000 39.49000 0.5386000 0.4427000      0.7124000 
1 1 1 4  28 28 o 43.78000 0.3775000 43.20000 0.5564000 44.36000 0.5102000 -1.159000      0.7550000 
1 1 1 4  28 30 f 16.41000 0.3973000 16.70000 0.5353000 16.13000 0.5872000 0.5676000      0.7946000 
1 1 1 4  28 32 o 25.66000 0.3599000 25.52000 0.4985000 25.80000 0.5193000 -0.2777000     0.7199000 
1 1 1 4  28 34 f 21.32000 0.3320000 21.22000 0.4686000 21.42000 0.4703000 -0.1982000     0.6640000 
1 1 1 4  28 36 o 28.43000 0.3466000 28.41000 0.5324000 28.45000 0.4438000 -0.3136000E-01 0.6931000 
1 1 1 4  28 38 o 34.67000 0.3572000 35.36000 0.5421000 33.98000 0.4653000 1.378000       0.7144000 
1 1 1 4  28 40 o 12.15000 0.5150000 12.41000 0.6881000 11.89000 0.7664000 0.5249000      1.030000  
1 1 1 4  28 42 o 16.64000 0.3948000 16.72000 0.5410000 16.57000 0.5750000 0.1438000      0.7896000 
1 1 1 4  28 44 o 15.44000 0.4205000 15.04000 0.6289000 15.84000 0.5584000 -0.7971000     0.8410000 
1 1 1 4  28 46 o 22.40000 0.3545000 22.47000 0.4523000 22.32000 0.5460000 0.1516000      0.7090000 
1 1 1 4  28 48 o 11.80000 0.4322000 11.41000 0.6479000 12.20000 0.5721000 -0.7881000     0.8643000 
1 1 1 4  28 50 f 3.073000 0.9252000 2.446000 1.146000  3.701000 1.453000  -1.255000      1.850000  
1 1 1 4  28 52 o 4.882000 1.092000  6.084000 1.606000  3.680000 1.480000  2.404000       2.183000  
1 1 1 4  28 54 o 4.934000 1.113000  4.017000 1.504000  5.850000 1.640000  -1.833000      2.225000  
1 1 1 4  28 56 o 4.281000 0.9023000 3.068000 1.316000  5.493000 1.235000  -2.425000      1.805000  
1 1 1 4  28 58 o 3.470000 0.9628000 3.074000 1.309000  3.865000 1.413000  -0.7906000     1.926000  
1 1 1 4  28 60 o 3.774000 1.015000  3.562000 1.449000  3.987000 1.421000  -0.4251000     2.029000  
1 1 1 4  29 1  o 76.47000 0.6207000 76.56000 0.8799000 76.38000 0.8756000 0.1793000      1.241000  
1 1 1 4  29 3  o 26.76000 0.3101000 27.00000 0.4465000 26.53000 0.4305000 0.4742000      0.6202000 
1 1 1 4  29 5  o 86.45000 0.6524000 87.04000 0.9931000 85.86000 0.8463000 1.180000       1.305000  
1 1 1 4  29 7  f 62.49000 0.4870000 62.19000 0.7363000 62.78000 0.6376000 -0.5848000     0.9740000 
1 1 1 4  29 9  o 57.57000 0.5402000 57.14000 0.6830000 58.00000 0.8371000 -0.8620000     1.080000  
1 1 1 4  29 11 o 34.75000 0.3247000 34.71000 0.4375000 34.78000 0.4800000 -0.6755000E-01 0.6495000 
1 1 1 4  29 13 o 28.54000 0.3287000 28.90000 0.4891000 28.18000 0.4394000 0.7139000      0.6574000 
1 1 1 4  29 15 o 66.93000 0.6205000 66.22000 0.7881000 67.63000 0.9587000 -1.410000      1.241000  
1 1 1 4  29 17 f 19.92000 0.2916000 19.99000 0.3911000 19.85000 0.4325000 0.1364000      0.5831000 
1 1 1 4  29 19 o 11.73000 0.3623000 12.06000 0.4379000 11.41000 0.5774000 0.6524000      0.7247000 
1 1 1 4  29 21 o 17.82000 0.2981000 18.34000 0.3624000 17.30000 0.4734000 1.039000       0.5962000 
1 1 1 4  29 23 o 18.71000 0.3162000 18.57000 0.4003000 18.85000 0.4896000 -0.2822000     0.6324000 
1 1 1 4  29 25 o 25.81000 0.3036000 25.53000 0.3943000 26.10000 0.4617000 -0.5713000     0.6072000 
1 1 1 4  29 27 o 13.58000 0.4115000 13.64000 0.5086000 13.53000 0.6470000 0.1100000      0.8230000 
1 1 1 4  29 29 o 41.94000 0.3752000 41.90000 0.4877000 41.97000 0.5702000 -0.6835000E-01 0.7503000 
1 1 1 4  29 31 o 23.26000 0.3712000 23.58000 0.5036000 22.95000 0.5455000 0.6230000      0.7424000 
1 1 1 4  29 33 o 5.815000 0.8867000 5.451000 1.281000  6.180000 1.227000  -0.7288000     1.773000  
1 1 1 4  29 35 o 10.14000 0.7053000 9.312000 1.229000  10.97000 0.6919000 -1.662000      1.411000  
1 1 1 4  29 37 o 12.82000 0.4860000 12.93000 0.7072000 12.71000 0.6667000 0.2166000      0.9719000 
1 1 1 4  29 39 o 12.57000 0.4938000 12.74000 0.6672000 12.40000 0.7282000 0.3396000      0.9876000 
1 1 1 4  29 41 o 16.84000 0.4073000 16.16000 0.5924000 17.52000 0.5591000 -1.368000      0.8146000 
1 1 1 4  29 43 o 15.93000 0.4206000 15.42000 0.6404000 16.44000 0.5455000 -1.026000      0.8413000 
1 1 1 4  29 45 o 14.56000 0.3968000 14.21000 0.5713000 14.91000 0.5509000 -0.7073000     0.7937000 
1 1 1 4  29 47 o 4.279000 0.9279000 4.510000 1.362000  4.047000 1.261000  0.4633000      1.856000  
1 1 1 4  29 49 o 8.602000 0.7118000 8.101000 1.058000  9.104000 0.9529000 -1.003000      1.424000  
1 1 1 4  29 51 o 9.154000 0.7062000 9.537000 0.9577000 8.772000 1.038000  0.7644000      1.412000  
1 1 1 4  29 53 o 4.879000 0.9774000 5.986000 1.298000  3.772000 1.462000  2.213000       1.955000  
1 1 1 4  29 55 o 6.467000 0.8337000 6.994000 1.200000  5.940000 1.157000  1.055000       1.667000  
1 1 1 4  29 57 o 5.271000 0.9791000 5.584000 1.378000  4.958000 1.391000  0.6255000      1.958000  
1 1 1 4  29 59 o 4.170000 1.020000  3.913000 1.391000  4.427000 1.491000  -0.5135000     2.040000  
1 1 1 4  30 0  o 23.89000 0.4243000 23.89000 0.4243000 23.89000 0.4243000 0.000000       0.000000  
1 1 1 4  30 2  o 31.43000 0.3034000 30.84000 0.4548000 32.01000 0.4017000 -1.177000      0.6068000 
1 1 1 4  30 4  o 46.56000 0.3817000 46.24000 0.5749000 46.87000 0.5023000 -0.6390000     0.7635000 
1 1 1 4  30 6  f 60.44000 0.4736000 60.91000 0.7206000 59.97000 0.6148000 0.9430000      0.9472000 
1 1 1 4  30 8  o 28.25000 0.4492000 28.84000 0.7830000 27.66000 0.4407000 1.178000       0.8985000 
1 1 1 4  30 10 o 3.497000 0.8390000 2.652000 1.178000  4.342000 1.195000  -1.690000      1.678000  
1 1 1 4  30 12 o 22.63000 0.4837000 22.53000 0.8203000 22.72000 0.5127000 -0.1922000     0.9673000 
1 1 1 4  30 14 o 36.47000 0.3329000 36.29000 0.4442000 36.66000 0.4960000 -0.3677000     0.6658000 
1 1 1 4  30 16 o 22.45000 0.2900000 22.88000 0.3874000 22.02000 0.4317000 0.8612000      0.5800000 
1 1 1 4  30 18 o 11.92000 0.3488000 11.96000 0.4424000 11.89000 0.5394000 0.7250000E-01  0.6976000 
1 1 1 4  30 20 o 38.24000 0.3290000 38.18000 0.4054000 38.31000 0.5182000 -0.1361000     0.6580000 
1 1 1 4  30 22 o 38.07000 0.3862000 37.56000 0.4462000 38.58000 0.6304000 -1.024000      0.7723000 
1 1 1 4  30 24 o 15.47000 0.3429000 14.92000 0.4417000 16.03000 0.5247000 -1.109000      0.6858000 
1 1 1 4  30 26 o 48.90000 0.3805000 48.34000 0.5290000 49.46000 0.5471000 -1.126000      0.7610000 
1 1 1 4  30 28 o 29.14000 0.3231000 29.48000 0.4184000 28.79000 0.4925000 0.6868000      0.6463000 
1 1 1 4  30 30 o 27.93000 0.3611000 28.07000 0.4903000 27.79000 0.5303000 0.2835000      0.7222000 
1 1 1 4  30 32 o 15.69000 0.3798000 15.75000 0.5351000 15.63000 0.5391000 0.1217000      0.7596000 
1 1 1 4  30 34 o 8.386000 0.6187000 8.533000 0.8998000 8.239000 0.8494000 0.2947000      1.237000  
1 1 1 4  30 36 f 14.85000 0.4089000 14.03000 0.6121000 15.68000 0.5424000 -1.650000      0.8178000 
1 1 1 4  30 38 o 10.52000 0.5208000 9.498000 0.7939000 11.54000 0.6741000 -2.040000      1.042000  
1 1 1 4  30 40 o 17.26000 0.3865000 16.80000 0.5927000 17.71000 0.4961000 -0.9123000     0.7729000 
1 1 1 4  30 42 o 28.57000 0.3134000 28.59000 0.4478000 28.54000 0.4387000 0.4996000E-01  0.6268000 
1 1 1 4  30 44 o 23.07000 0.3298000 23.10000 0.4671000 23.04000 0.4657000 0.5643000E-01  0.6596000 
1 1 1 4  30 46 o 10.44000 0.5523000 10.23000 0.8414000 10.65000 0.7157000 -0.4212000     1.105000  
1 1 1 4  30 48 o 7.356000 0.7229000 7.866000 0.9756000 6.845000 1.067000  1.020000       1.446000  
1 1 1 4  30 50 o 5.489000 0.9161000 5.655000 1.358000  5.323000 1.230000  0.3314000      1.832000  
1 1 1 4  30 52 o 9.895000 0.5676000 9.751000 0.8483000 10.04000 0.7543000 -0.2883000     1.135000  
1 1 1 4  30 54 o 4.845000 1.045000  5.270000 1.457000  4.420000 1.499000  0.8501000      2.090000  
1 1 1 4  30 56 o 4.653000 1.043000  4.286000 1.469000  5.020000 1.481000  -0.7340000     2.086000  
1 1 1 4  30 58 o 6.227000 0.9920000 7.617000 1.151000  4.836000 1.616000  2.782000       1.984000  
1 1 1 4  31 1  o 67.02000 0.4777000 66.49000 0.6709000 67.55000 0.6803000 -1.052000      0.9555000 
1 1 1 4  31 3  f 47.88000 0.3619000 46.99000 0.5043000 48.76000 0.5191000 -1.776000      0.7238000 
1 1 1 4  31 5  o 26.07000 0.3188000 26.07000 0.5155000 26.08000 0.3754000 -0.9577000E-02 0.6377000 
1 1 1 4  31 7  f 21.79000 0.3747000 22.12000 0.5214000 21.46000 0.5383000 0.6595000      0.7494000 
1 1 1 4  31 9  o 101.6000 0.7598000 101.9000 0.9992000 101.3000 1.145000  0.5540000      1.520000  
1 1 1 4  31 11 o 48.72000 0.4284000 48.48000 0.6068000 48.95000 0.6049000 -0.4710000     0.8568000 
1 1 1 4  31 13 o 30.41000 0.2918000 30.74000 0.3648000 30.08000 0.4556000 0.6515000      0.5836000 
1 1 1 4  31 15 o 80.05000 0.7242000 80.10000 0.9191000 80.00000 1.119000  0.9917000E-01  1.448000  
1 1 1 4  31 17 o 25.88000 0.2956000 25.95000 0.3927000 25.82000 0.4419000 0.1375000      0.5912000 
1 1 1 4  31 19 o 37.70000 0.3256000 37.68000 0.4027000 37.71000 0.5117000 -0.2826000E-01 0.6511000 
1 1 1 4  31 21 o 15.48000 0.3644000 16.25000 0.3885000 14.71000 0.6166000 1.535000       0.7288000 
1 1 1 4  31 23 o 38.52000 0.3489000 38.20000 0.4514000 38.83000 0.5322000 -0.6247000     0.6978000 
1 1 1 4  31 25 o 33.12000 0.3079000 33.05000 0.4255000 33.19000 0.4450000 -0.1339000     0.6157000 
1 1 1 4  31 27 o 10.62000 0.4858000 10.47000 0.6165000 10.78000 0.7509000 -0.3069000     0.9715000 
1 1 1 4  31 29 o 33.85000 0.3206000 34.14000 0.4469000 33.56000 0.4599000 0.5834000      0.6413000 
1 1 1 4  31 31 o 8.292000 0.6908000 8.611000 0.8271000 7.973000 1.107000  0.6375000      1.382000  
1 1 1 4  31 33 o 6.842000 0.7572000 7.141000 1.016000  6.543000 1.123000  0.5973000      1.514000  
1 1 1 4  31 35 o 13.11000 0.5033000 12.69000 0.7969000 13.54000 0.6151000 -0.8467000     1.007000  
1 1 1 4  31 37 o 22.86000 0.3493000 23.31000 0.5221000 22.41000 0.4642000 0.9056000      0.6986000 
1 1 1 4  31 39 o 18.00000 0.3755000 17.79000 0.5651000 18.20000 0.4947000 -0.4054000     0.7510000 
1 1 1 4  31 41 o 5.140000 1.180000  5.025000 1.692000  5.255000 1.645000  -0.2305000     2.360000  
1 1 1 4  31 43 o 3.303000 0.9211000 3.742000 1.370000  2.865000 1.231000  0.8775000      1.842000  
1 1 1 4  31 45 o 10.43000 0.5691000 9.660000 0.8797000 11.19000 0.7222000 -1.534000      1.138000  
1 1 1 4  31 47 o 11.51000 0.4602000 11.24000 0.6660000 11.78000 0.6352000 -0.5379000     0.9203000 
1 1 1 4  31 49 o 23.59000 0.3627000 23.75000 0.5414000 23.43000 0.4829000 0.3198000      0.7254000 
1 1 1 4  31 51 o 11.47000 0.5612000 12.51000 0.8445000 10.44000 0.7392000 2.071000       1.122000  
1 1 1 4  31 53 o 3.618000 0.9485000 2.722000 1.263000  4.515000 1.416000  -1.793000      1.897000  
1 1 1 4  31 55 o 4.227000 0.9983000 4.577000 1.436000  3.877000 1.387000  0.6992000      1.997000  
1 1 1 4  31 57 o 6.005000 0.9611000 6.547000 1.259000  5.462000 1.452000  1.085000       1.922000  
1 1 1 4  31 59 o 8.537000 0.7482000 7.583000 1.077000  9.492000 1.039000  -1.910000      1.496000  
1 1 1 4  32 0  o 53.94000 0.5638000 53.94000 0.5638000 53.94000 0.5638000 0.000000       0.000000  
1 1 1 4  32 2  o 27.89000 0.2746000 27.30000 0.3884000 28.48000 0.3882000 -1.184000      0.5491000 
1 1 1 4  32 4  o 10.79000 0.3895000 10.19000 0.5950000 11.39000 0.5029000 -1.194000      0.7791000 
1 1 1 4  32 6  o 39.74000 0.3192000 39.94000 0.4540000 39.54000 0.4489000 0.3911000      0.6384000 
1 1 1 4  32 8  o 63.51000 0.4578000 63.37000 0.6467000 63.65000 0.6483000 -0.2829000     0.9157000 
1 1 1 4  32 10 o 55.48000 0.4428000 55.24000 0.5809000 55.73000 0.6684000 -0.4854000     0.8856000 
1 1 1 4  32 12 o 62.43000 0.4662000 62.77000 0.5763000 62.08000 0.7330000 0.6951000      0.9324000 
1 1 1 4  32 14 o 26.67000 0.2989000 26.19000 0.3885000 27.15000 0.4544000 -0.9660000     0.5978000 
1 1 1 4  32 16 o 31.39000 0.2961000 31.99000 0.3730000 30.78000 0.4600000 1.213000       0.5922000 
1 1 1 4  32 18 o 19.27000 0.3810000 19.78000 0.3878000 18.75000 0.6559000 1.034000       0.7620000 
1 1 1 4  32 20 o 24.90000 0.3198000 25.17000 0.3608000 24.63000 0.5281000 0.5407000      0.6396000 
1 1 1 4  32 22 o 31.98000 0.3409000 32.17000 0.3803000 31.79000 0.5659000 0.3746000      0.6818000 
1 1 1 4  32 24 o 15.68000 0.3269000 15.74000 0.4443000 15.63000 0.4795000 0.1054000      0.6537000 
1 1 1 4  32 26 o 20.30000 0.3469000 19.92000 0.4801000 20.68000 0.5008000 -0.7616000     0.6938000 
1 1 1 4  32 28 o 20.30000 0.3218000 19.88000 0.4494000 20.71000 0.4606000 -0.8374000     0.6435000 
1 1 1 4  32 30 o 24.00000 0.3400000 24.81000 0.4406000 23.18000 0.5180000 1.625000       0.6801000 
1 1 1 4  32 32 o 17.15000 0.3692000 17.26000 0.5137000 17.03000 0.5303000 0.2322000      0.7384000 
1 1 1 4  32 34 o 16.84000 0.4113000 16.90000 0.6167000 16.77000 0.5444000 0.1240000      0.8226000 
1 1 1 4  32 36 o 14.66000 0.4571000 14.73000 0.7050000 14.59000 0.5818000 0.1438000      0.9141000 
1 1 1 4  32 38 o 4.531000 1.004000  4.780000 1.460000  4.281000 1.379000  0.4992000      2.009000  
1 1 1 4  32 40 o 7.713000 0.8414000 7.896000 0.9276000 7.530000 1.404000  0.3659000      1.683000  
1 1 1 4  32 42 o 19.28000 0.3744000 18.55000 0.5686000 20.00000 0.4874000 -1.449000      0.7489000 
1 1 1 4  32 44 o 8.286000 0.6666000 7.888000 0.9936000 8.684000 0.8889000 -0.7966000     1.333000  
1 1 1 4  32 46 o 7.385000 0.6718000 6.679000 0.9605000 8.091000 0.9396000 -1.413000      1.344000  
1 1 1 4  32 48 o 14.58000 0.3943000 14.41000 0.5632000 14.74000 0.5521000 -0.3248000     0.7887000 
1 1 1 4  32 50 o 10.67000 0.5142000 10.43000 0.7697000 10.91000 0.6820000 -0.4781000     1.028000  
1 1 1 4  32 52 o 3.503000 0.9723000 3.443000 1.394000  3.564000 1.356000  -0.1215000     1.945000  
1 1 1 4  32 54 o 5.315000 0.8869000 6.275000 1.091000  4.356000 1.399000  1.919000       1.774000  
1 1 1 4  32 56 o 8.827000 0.6070000 8.023000 0.9253000 9.631000 0.7859000 -1.608000      1.214000  
1 1 1 4  32 58 o 5.682000 0.9758000 5.260000 1.306000  6.104000 1.451000  -0.8442000     1.952000  
1 1 1 4  33 1  o 37.33000 0.3324000 36.99000 0.4973000 37.67000 0.4412000 -0.6840000     0.6648000 
1 1 1 4  33 3  o 57.58000 0.4533000 57.40000 0.6824000 57.75000 0.5968000 -0.3462000     0.9066000 
1 1 1 4  33 5  o 37.18000 0.3097000 37.54000 0.4426000 36.82000 0.4333000 0.7211000      0.6194000 
1 1 1 4  33 7  o 28.42000 0.2755000 28.46000 0.3898000 28.38000 0.3895000 0.8569000E-01  0.5511000 
1 1 1 4  33 9  o 21.68000 0.2919000 22.08000 0.3884000 21.29000 0.4360000 0.7829000      0.5839000 
1 1 1 4  33 11 o 38.33000 0.3253000 38.52000 0.4042000 38.14000 0.5099000 0.3784000      0.6506000 
1 1 1 4  33 13 o 53.31000 0.4299000 53.82000 0.5721000 52.80000 0.6419000 1.017000       0.8599000 
1 1 1 4  33 15 o 17.14000 0.2951000 17.43000 0.3746000 16.84000 0.4560000 0.5952000      0.5902000 
1 1 1 4  33 17 o 60.95000 0.5266000 60.43000 0.5623000 61.47000 0.8904000 -1.036000      1.053000  
1 1 1 4  33 19 o 28.49000 0.3334000 28.36000 0.3707000 28.62000 0.5542000 -0.2599000     0.6668000 
1 1 1 4  33 21 o 14.92000 0.4076000 15.27000 0.5067000 14.56000 0.6387000 0.7141000      0.8153000 
1 1 1 4  33 23 o 49.69000 0.3849000 49.60000 0.5408000 49.78000 0.5479000 -0.1760000     0.7698000 
1 1 1 4  33 25 o 24.51000 0.3877000 24.06000 0.4573000 24.96000 0.6262000 -0.8925000     0.7754000 
1 1 1 4  33 27 f 25.84000 0.3006000 25.82000 0.4186000 25.87000 0.4315000 -0.4524000E-01 0.6011000 
1 1 1 4  33 29 f 26.78000 0.3606000 26.57000 0.4908000 26.98000 0.5284000 -0.4074000     0.7212000 
1 1 1 4  33 31 o 15.48000 0.3762000 15.61000 0.5079000 15.36000 0.5551000 0.2479000      0.7524000 
1 1 1 4  33 33 o 33.15000 0.3272000 33.18000 0.4600000 33.12000 0.4654000 0.6204000E-01  0.6543000 
1 1 1 4  33 35 o 3.936000 1.057000  3.690000 1.586000  4.182000 1.398000  -0.4919000     2.114000  
1 1 1 4  33 37 o 22.24000 0.3245000 22.01000 0.4530000 22.48000 0.4647000 -0.4703000     0.6490000 
1 1 1 4  33 39 o 7.376000 0.6960000 7.357000 1.037000  7.394000 0.9287000 -0.3753000E-01 1.392000  
1 1 1 4  33 41 o 14.85000 0.4734000 14.79000 0.7627000 14.91000 0.5610000 -0.1138000     0.9468000 
1 1 1 4  33 43 o 13.85000 0.3998000 13.87000 0.5841000 13.84000 0.5460000 0.3662000E-01  0.7995000 
1 1 1 4  33 45 o 10.64000 0.4873000 10.64000 0.7036000 10.64000 0.6745000 0.2227000E-02  0.9747000 
1 1 1 4  33 47 o 2.816000 0.8849000 2.879000 1.302000  2.754000 1.199000  0.1252000      1.770000  
1 1 1 4  33 49 o 3.309000 0.9581000 3.826000 1.489000  2.791000 1.206000  1.035000       1.916000  
1 1 1 4  33 51 o 7.835000 0.7180000 6.956000 1.070000  8.715000 0.9574000 -1.760000      1.436000  
1 1 1 4  33 53 o 3.232000 0.9727000 2.858000 1.242000  3.606000 1.497000  -0.7487000     1.945000  
1 1 1 4  33 55 o 5.411000 0.9154000 7.139000 1.199000  3.682000 1.384000  3.457000       1.831000  
1 1 1 4  33 57 o 4.492000 0.9698000 4.012000 1.369000  4.972000 1.374000  -0.9605000     1.940000  
1 1 1 4  34 0  f 43.86000 0.5554000 43.86000 0.5554000 43.86000 0.5554000 0.000000       0.000000  
1 1 1 4  34 2  o 32.69000 0.3126000 32.48000 0.4111000 32.89000 0.4711000 -0.4127000     0.6253000 
1 1 1 4  34 4  o 20.83000 0.3168000 21.45000 0.4619000 20.20000 0.4338000 1.245000       0.6336000 
1 1 1 4  34 6  o 23.41000 0.2686000 23.29000 0.3791000 23.53000 0.3807000 -0.2402000     0.5373000 
1 1 1 4  34 8  o 11.68000 0.3873000 12.29000 0.5687000 11.06000 0.5258000 1.229000       0.7746000 
1 1 1 4  34 10 o 43.21000 0.3528000 43.01000 0.4324000 43.42000 0.5575000 -0.4151000     0.7055000 
1 1 1 4  34 12 o 55.24000 0.5006000 54.74000 0.5771000 55.74000 0.8181000 -1.006000      1.001000  
1 1 1 4  34 14 o 46.50000 0.4388000 46.52000 0.5199000 46.48000 0.7071000 0.4016000E-01  0.8776000 
1 1 1 4  34 16 o 9.207000 0.5011000 9.980000 0.5435000 8.434000 0.8421000 1.546000       1.002000  
1 1 1 4  34 18 o 25.68000 0.2939000 26.05000 0.3605000 25.32000 0.4642000 0.7287000      0.5877000 
1 1 1 4  34 20 o 36.93000 0.3704000 36.62000 0.4036000 37.25000 0.6212000 -0.6249000     0.7408000 
1 1 1 4  34 22 o 18.28000 0.3188000 18.18000 0.4017000 18.38000 0.4951000 -0.2000000     0.6375000 
1 1 1 4  34 24 o 29.74000 0.3729000 30.00000 0.4830000 29.48000 0.5682000 0.5179000      0.7457000 
1 1 1 4  34 26 f 18.47000 0.3282000 18.32000 0.4539000 18.63000 0.4743000 -0.3063000     0.6565000 
1 1 1 4  34 28 o 32.17000 0.3429000 32.63000 0.5167000 31.70000 0.4509000 0.9351000      0.6858000 
1 1 1 4  34 30 o 33.81000 0.3584000 34.55000 0.4617000 33.07000 0.5483000 1.473000       0.7168000 
1 1 1 4  34 32 o 4.045000 0.9724000 4.232000 1.368000  3.859000 1.382000  0.3731000      1.945000  
1 1 1 4  34 34 o 15.48000 0.4022000 15.28000 0.6205000 15.69000 0.5119000 -0.4092000     0.8044000 
1 1 1 4  34 36 o 6.186000 0.8316000 6.455000 1.134000  5.918000 1.217000  0.5378000      1.663000  
1 1 1 4  34 38 o 15.40000 0.4294000 15.10000 0.6213000 15.70000 0.5928000 -0.6010000     0.8588000 
1 1 1 4  34 40 o 10.09000 0.5862000 9.706000 0.8406000 10.47000 0.8173000 -0.7636000     1.172000  
1 1 1 4  34 42 o 8.806000 0.5652000 9.882000 0.7504000 7.730000 0.8453000 2.152000       1.130000  
1 1 1 4  34 44 o 9.149000 0.5771000 8.823000 0.8844000 9.476000 0.7417000 -0.6529000     1.154000  
1 1 1 4  34 46 o 5.576000 0.8325000 6.559000 1.075000  4.592000 1.272000  1.967000       1.665000  
1 1 1 4  34 48 o 8.895000 0.6096000 8.616000 0.8719000 9.174000 0.8522000 -0.5578000     1.219000  
1 1 1 4  34 50 o 4.011000 1.078000  3.902000 1.571000  4.121000 1.475000  -0.2188000     2.155000  
1 1 1 4  34 52 f 5.471000 1.032000  4.621000 1.538000  6.321000 1.377000  -1.700000      2.064000  
1 1 1 4  34 54 f 4.046000 0.9444000 3.163000 1.364000  4.929000 1.306000  -1.767000      1.889000  
1 1 1 4  34 56 o 5.569000 0.9519000 5.540000 1.410000  5.599000 1.279000  -0.5867000E-01 1.904000  
1 1 1 4  35 1  o 27.88000 0.2805000 28.30000 0.3975000 27.46000 0.3960000 0.8335000      0.5611000 
1 1 1 4  35 3  o 29.71000 0.3058000 29.56000 0.4057000 29.86000 0.4578000 -0.3010000     0.6117000 
1 1 1 4  35 5  o 19.11000 0.3312000 18.78000 0.4900000 19.45000 0.4457000 -0.6648000     0.6624000 
1 1 1 4  35 7  o 20.41000 0.2937000 20.27000 0.3897000 20.54000 0.4394000 -0.2650000     0.5873000 
1 1 1 4  35 9  f 22.62000 0.3164000 22.67000 0.3593000 22.56000 0.5209000 0.1070000      0.6328000 
1 1 1 4  35 11 o 36.70000 0.3755000 36.69000 0.4410000 36.70000 0.6079000 -0.1308000E-01 0.7510000 
1 1 1 4  35 13 o 28.60000 0.3345000 28.22000 0.3626000 28.99000 0.5622000 -0.7695000     0.6689000 
1 1 1 4  35 15 f 29.56000 0.2995000 30.14000 0.3773000 28.98000 0.4652000 1.167000       0.5990000 
1 1 1 4  35 17 o 15.34000 0.3374000 15.79000 0.4040000 14.88000 0.5406000 0.9084000      0.6748000 
1 1 1 4  35 19 o 23.56000 0.3275000 23.94000 0.3675000 23.19000 0.5422000 0.7520000      0.6550000 
1 1 1 4  35 21 o 16.50000 0.3416000 16.85000 0.4248000 16.16000 0.5350000 0.6890000      0.6832000 
1 1 1 4  35 23 o 9.351000 0.5630000 8.818000 0.8273000 9.884000 0.7640000 -1.066000      1.126000  
1 1 1 4  35 25 o 19.23000 0.3286000 19.27000 0.4504000 19.19000 0.4785000 0.8419000E-01  0.6571000 
1 1 1 4  35 27 o 32.82000 0.3949000 32.94000 0.4999000 32.69000 0.6114000 0.2492000      0.7898000 
1 1 1 4  35 29 o 16.77000 0.4002000 16.84000 0.4952000 16.70000 0.6289000 0.1438000      0.8004000 
1 1 1 4  35 31 o 7.844000 0.6257000 8.291000 0.7729000 7.398000 0.9843000 0.8926000      1.251000  
1 1 1 4  35 33 o 7.997000 0.6763000 7.501000 1.094000  8.494000 0.7954000 -0.9931000     1.353000  
1 1 1 4  35 35 o 12.48000 0.4875000 12.30000 0.7072000 12.66000 0.6711000 -0.3543000     0.9749000 
1 1 1 4  35 37 o 7.586000 0.7647000 8.745000 1.067000  6.426000 1.095000  2.318000       1.529000  
1 1 1 4  35 39 o 16.04000 0.4032000 16.33000 0.5194000 15.74000 0.6168000 0.5904000      0.8063000 
1 1 1 4  35 41 o 9.980000 0.5087000 9.714000 0.7594000 10.25000 0.6769000 -0.5330000     1.017000  
1 1 1 4  35 43 o 3.297000 0.9068000 2.680000 1.213000  3.914000 1.349000  -1.234000      1.814000  
1 1 1 4  35 45 o 4.964000 0.8986000 5.326000 1.211000  4.602000 1.328000  0.7241000      1.797000  
1 1 1 4  35 47 o 3.477000 0.9579000 3.084000 1.291000  3.871000 1.416000  -0.7873000     1.916000  
1 1 1 4  35 49 o 4.449000 1.108000  4.734000 1.580000  4.165000 1.553000  0.5687000      2.215000  
1 1 1 4  35 51 o 9.354000 0.6115000 8.310000 0.9815000 10.40000 0.7297000 -2.089000      1.223000  
1 1 1 4  35 53 o 3.583000 0.9857000 3.674000 1.420000  3.493000 1.368000  0.1812000      1.971000  
1 1 1 4  35 55 o 3.844000 1.043000  3.465000 1.577000  4.222000 1.364000  -0.7572000     2.085000  
1 1 1 4  36 0  o 28.71000 0.4004000 28.71000 0.4004000 28.71000 0.4004000 0.000000       0.000000  
1 1 1 4  36 2  o 24.88000 0.2794000 24.37000 0.3933000 25.38000 0.3971000 -1.004000      0.5589000 
1 1 1 4  36 4  o 15.22000 0.3512000 15.10000 0.5317000 15.34000 0.4591000 -0.2337000     0.7025000 
1 1 1 4  36 6  o 8.338000 0.4893000 9.068000 0.6284000 7.609000 0.7500000 1.459000       0.9785000 
1 1 1 4  36 8  o 17.66000 0.2946000 17.46000 0.4244000 17.85000 0.4088000 -0.3856000     0.5892000 
1 1 1 4  36 10 o 33.38000 0.3235000 33.16000 0.4212000 33.59000 0.4911000 -0.4329000     0.6470000 
1 1 1 4  36 12 o 48.73000 0.3888000 48.28000 0.4745000 49.18000 0.6162000 -0.8941000     0.7777000 
1 1 1 4  36 14 o 53.10000 0.4135000 52.71000 0.5044000 53.49000 0.6553000 -0.7728000     0.8269000 
1 1 1 4  36 16 o 46.55000 0.3758000 46.57000 0.4646000 46.53000 0.5908000 0.3970000E-01  0.7516000 
1 1 1 4  36 18 o 13.26000 0.3679000 13.58000 0.4637000 12.94000 0.5713000 0.6376000      0.7358000 
1 1 1 4  36 20 o 8.458000 0.5426000 8.021000 0.7247000 8.896000 0.8077000 -0.8747000     1.085000  
1 1 1 4  36 22 o 7.381000 0.6852000 7.232000 0.8682000 7.529000 1.060000  -0.2961000     1.370000  
1 1 1 4  36 24 o 23.10000 0.3145000 22.94000 0.4424000 23.25000 0.4471000 -0.3060000     0.6290000 
1 1 1 4  36 26 o 11.96000 0.4889000 12.03000 0.7008000 11.89000 0.6818000 0.1428000      0.9777000 
1 1 1 4  36 28 o 12.95000 0.4718000 12.96000 0.5822000 12.95000 0.7425000 0.9840000E-02  0.9436000 
1 1 1 4  36 30 o 15.20000 0.3858000 15.50000 0.5176000 14.90000 0.5721000 0.5970000      0.7715000 
1 1 1 4  36 32 o 14.25000 0.3778000 14.39000 0.5371000 14.11000 0.5316000 0.2732000      0.7557000 
1 1 1 4  36 34 o 36.03000 0.4259000 36.47000 0.6652000 35.59000 0.5321000 0.8762000      0.8518000 
1 1 1 4  36 36 o 21.91000 0.3752000 22.15000 0.5185000 21.68000 0.5426000 0.4699000      0.7505000 
1 1 1 4  36 38 o 19.00000 0.3767000 19.24000 0.4848000 18.76000 0.5766000 0.4761000      0.7533000 
1 1 1 4  36 40 o 8.182000 0.5830000 8.145000 0.8119000 8.220000 0.8370000 -0.7561000E-01 1.166000  
1 1 1 4  36 42 o 5.769000 0.8487000 4.639000 1.367000  6.898000 1.006000  -2.259000      1.697000  
1 1 1 4  36 44 o 3.869000 0.8084000 5.423000 1.211000  2.315000 1.071000  3.107000       1.617000  
1 1 1 4  36 46 o 8.903000 0.6666000 9.658000 0.8108000 8.148000 1.058000  1.510000       1.333000  
1 1 1 4  36 48 o 3.605000 1.058000  4.375000 1.723000  2.835000 1.227000  1.541000       2.115000  
1 1 1 4  36 50 o 7.245000 0.8782000 7.143000 1.480000  7.348000 0.9456000 -0.2050000     1.756000  
1 1 1 4  36 52 f 3.326000 0.9492000 3.333000 1.314000  3.319000 1.371000  0.1440000E-01  1.898000  
1 1 1 4  36 54 o 3.354000 0.9569000 3.105000 1.293000  3.604000 1.412000  -0.4990000     1.914000  
1 1 1 4  37 1  o 19.35000 0.2889000 19.46000 0.4092000 19.25000 0.4079000 0.2037000      0.5777000 
1 1 1 4  37 3  o 44.19000 0.3794000 43.68000 0.5738000 44.71000 0.4966000 -1.031000      0.7588000 
1 1 1 4  37 5  o 27.56000 0.3051000 27.40000 0.4576000 27.73000 0.4036000 -0.3310000     0.6102000 
1 1 1 4  37 7  o 38.03000 0.3450000 37.76000 0.5203000 38.31000 0.4531000 -0.5445000     0.6899000 
1 1 1 4  37 9  o 42.36000 0.3707000 42.14000 0.4823000 42.57000 0.5629000 -0.4312000     0.7413000 
1 1 1 4  37 11 o 26.85000 0.2985000 26.96000 0.3693000 26.74000 0.4690000 0.2125000      0.5970000 
1 1 1 4  37 13 o 9.842000 0.4617000 9.960000 0.5827000 9.724000 0.7164000 0.2360000      0.9234000 
1 1 1 4  37 15 o 31.42000 0.3462000 30.86000 0.3786000 31.99000 0.5798000 -1.132000      0.6924000 
1 1 1 4  37 17 o 11.83000 0.3985000 12.38000 0.4971000 11.29000 0.6229000 1.083000       0.7969000 
1 1 1 4  37 19 o 24.07000 0.3023000 24.34000 0.3819000 23.80000 0.4687000 0.5458000      0.6046000 
1 1 1 4  37 21 o 21.30000 0.3315000 21.42000 0.4397000 21.18000 0.4961000 0.2371000      0.6629000 
1 1 1 4  37 23 o 27.15000 0.3114000 26.95000 0.4359000 27.35000 0.4447000 -0.4016000     0.6227000 
1 1 1 4  37 25 o 16.52000 0.3855000 16.46000 0.5747000 16.59000 0.5140000 -0.1211000     0.7710000 
1 1 1 4  37 27 o 9.703000 0.5846000 9.720000 0.7149000 9.686000 0.9251000 0.3461000E-01  1.169000  
1 1 1 4  37 29 o 16.82000 0.3560000 16.66000 0.4862000 16.98000 0.5203000 -0.3131000     0.7121000 
1 1 1 4  37 31 o 5.728000 0.7874000 5.435000 1.117000  6.022000 1.110000  -0.5865000     1.575000  
1 1 1 4  37 33 o 14.87000 0.4961000 16.18000 0.6258000 13.56000 0.7700000 2.627000       0.9922000 
1 1 1 4  37 35 o 11.97000 0.4300000 12.19000 0.5914000 11.76000 0.6243000 0.4341000      0.8599000 
1 1 1 4  37 37 o 13.22000 0.3888000 13.29000 0.5734000 13.15000 0.5254000 0.1419000      0.7777000 
1 1 1 4  37 39 o 10.86000 0.4573000 9.963000 0.6790000 11.75000 0.6128000 -1.788000      0.9146000 
1 1 1 4  37 41 o 6.748000 0.7140000 7.303000 0.9585000 6.193000 1.059000  1.111000       1.428000  
1 1 1 4  37 43 o 5.614000 0.8370000 5.058000 1.217000  6.169000 1.149000  -1.110000      1.674000  
1 1 1 4  37 45 o 7.709000 0.7077000 8.196000 0.8655000 7.222000 1.120000  0.9739000      1.415000  
1 1 1 4  37 47 f 7.900000 0.7516000 7.584000 1.103000  8.215000 1.021000  -0.6306000     1.503000  
1 1 1 4  37 49 o 5.523000 1.003000  6.395000 1.482000  4.652000 1.352000  1.743000       2.006000  
1 1 1 4  37 51 o 3.244000 0.9042000 3.762000 1.339000  2.726000 1.216000  1.036000       1.808000  
1 1 1 4  37 53 o 3.255000 0.9198000 3.168000 1.278000  3.341000 1.323000  -0.1733000     1.840000  
1 1 1 4  37 55 o 4.035000 1.091000  3.667000 1.482000  4.403000 1.601000  -0.7362000     2.181000  
1 1 1 4  38 0  o 22.09000 0.4056000 22.09000 0.4056000 22.09000 0.4056000 0.000000       0.000000  
1 1 1 4  38 2  f 30.97000 0.3236000 31.39000 0.4974000 30.55000 0.4140000 0.8446000      0.6472000 
1 1 1 4  38 4  o 23.32000 0.3092000 23.57000 0.4668000 23.08000 0.4056000 0.4905000      0.6184000 
1 1 1 4  38 6  f 39.05000 0.3263000 39.15000 0.4605000 38.95000 0.4625000 0.2018000      0.6527000 
1 1 1 4  38 8  o 27.65000 0.3088000 27.54000 0.4037000 27.76000 0.4675000 -0.2160000     0.6177000 
1 1 1 4  38 10 o 39.98000 0.3461000 39.68000 0.4206000 40.28000 0.5497000 -0.5996000     0.6921000 
1 1 1 4  38 12 o 36.14000 0.3264000 35.76000 0.3988000 36.52000 0.5169000 -0.7552000     0.6529000 
1 1 1 4  38 14 o 37.22000 0.3757000 37.44000 0.4117000 37.00000 0.6286000 0.4411000      0.7514000 
1 1 1 4  38 16 o 38.85000 0.3422000 38.69000 0.4218000 39.01000 0.5390000 -0.3186000     0.6844000 
1 1 1 4  38 18 f 19.10000 0.3303000 19.06000 0.4212000 19.14000 0.5089000 -0.8091000E-01 0.6606000 
1 1 1 4  38 20 o 15.98000 0.3647000 16.28000 0.4877000 15.67000 0.5422000 0.6068000      0.7293000 
1 1 1 4  38 22 o 22.79000 0.3155000 22.86000 0.3965000 22.71000 0.4907000 0.1433000      0.6309000 
1 1 1 4  38 24 f 16.51000 0.3616000 16.33000 0.4918000 16.69000 0.5302000 -0.3578000     0.7232000 
1 1 1 4  38 26 o 10.09000 0.5675000 9.439000 0.7613000 10.74000 0.8417000 -1.299000      1.135000  
1 1 1 4  38 28 o 9.001000 0.5351000 8.580000 0.7632000 9.422000 0.7503000 -0.8421000     1.070000  
1 1 1 4  38 30 o 12.65000 0.4062000 12.61000 0.5909000 12.69000 0.5576000 -0.8095000E-01 0.8125000 
1 1 1 4  38 32 o 23.25000 0.4462000 23.63000 0.6121000 22.87000 0.6494000 0.7652000      0.8924000 
1 1 1 4  38 34 o 23.94000 0.3141000 24.19000 0.4427000 23.70000 0.4457000 0.4940000      0.6282000 
1 1 1 4  38 36 o 17.46000 0.3961000 17.37000 0.4688000 17.56000 0.6385000 -0.1862000     0.7921000 
1 1 1 4  38 38 o 8.422000 0.5986000 8.533000 0.8984000 8.310000 0.7912000 0.2238000      1.197000  
1 1 1 4  38 40 o 6.251000 0.7450000 6.032000 1.105000  6.470000 0.9992000 -0.4379000     1.490000  
1 1 1 4  38 42 o 5.794000 0.8078000 6.698000 0.9417000 4.890000 1.313000  1.808000       1.616000  
1 1 1 4  38 44 o 12.03000 0.4486000 12.02000 0.6315000 12.03000 0.6373000 -0.8331000E-02 0.8972000 
1 1 1 4  38 46 o 7.616000 0.7337000 6.671000 1.207000  8.561000 0.8351000 -1.889000      1.467000  
1 1 1 4  38 48 o 6.901000 0.8506000 5.841000 1.399000  7.961000 0.9675000 -2.120000      1.701000  
1 1 1 4  38 50 o 3.668000 0.9745000 3.903000 1.375000  3.433000 1.381000  0.4705000      1.949000  
1 1 1 4  38 52 o 6.465000 0.8651000 6.738000 1.185000  6.192000 1.260000  0.5463000      1.730000  
1 1 1 4  38 54 o 5.002000 0.9584000 5.028000 1.444000  4.975000 1.260000  0.5294000E-01  1.917000  
1 1 1 4  39 1  o 20.44000 0.3254000 20.63000 0.4992000 20.25000 0.4177000 0.3784000      0.6509000 
1 1 1 4  39 3  f 30.41000 0.3004000 30.11000 0.4226000 30.71000 0.4270000 -0.5961000     0.6007000 
1 1 1 4  39 5  o 30.67000 0.3903000 31.61000 0.6012000 29.72000 0.4980000 1.888000       0.7807000 
1 1 1 4  39 7  o 36.73000 0.3459000 36.07000 0.4487000 37.39000 0.5265000 -1.322000      0.6918000 
1 1 1 4  39 9  o 8.763000 0.5661000 9.099000 0.7400000 8.426000 0.8569000 0.6732000      1.132000  
1 1 1 4  39 11 o 36.44000 0.3342000 35.91000 0.4043000 36.98000 0.5322000 -1.072000      0.6684000 
1 1 1 4  39 13 o 16.33000 0.3589000 16.36000 0.4231000 16.30000 0.5798000 0.6842000E-01  0.7177000 
1 1 1 4  39 15 o 27.62000 0.3065000 27.46000 0.3762000 27.78000 0.4840000 -0.3110000     0.6131000 
1 1 1 4  39 17 o 10.20000 0.5033000 10.34000 0.6572000 10.07000 0.7625000 0.2680000      1.007000  
1 1 1 4  39 19 o 33.49000 0.3260000 33.45000 0.4036000 33.53000 0.5122000 -0.7694000E-01 0.6521000 
1 1 1 4  39 21 o 32.31000 0.3223000 32.75000 0.4048000 31.86000 0.5015000 0.8828000      0.6445000 
1 1 1 4  39 23 o 16.99000 0.3476000 17.70000 0.4716000 16.29000 0.5109000 1.407000       0.6953000 
1 1 1 4  39 25 o 16.73000 0.4060000 17.17000 0.4782000 16.30000 0.6562000 0.8678000      0.8119000 
1 1 1 4  39 27 o 13.48000 0.4443000 13.51000 0.5693000 13.46000 0.6822000 0.5017000E-01  0.8885000 
1 1 1 4  39 29 o 11.91000 0.4644000 12.33000 0.6945000 11.48000 0.6168000 0.8517000      0.9289000 
1 1 1 4  39 31 o 9.089000 0.6051000 8.342000 0.9014000 9.836000 0.8076000 -1.494000      1.210000  
1 1 1 4  39 33 o 3.711000 0.9143000 3.991000 1.309000  3.431000 1.277000  0.5602000      1.829000  
1 1 1 4  39 35 o 8.915000 0.5100000 9.062000 0.7299000 8.767000 0.7125000 0.2952000      1.020000  
1 1 1 4  39 37 o 13.07000 0.4647000 13.54000 0.6304000 12.59000 0.6829000 0.9490000      0.9294000 
1 1 1 4  39 39 o 4.323000 1.016000  3.994000 1.258000  4.652000 1.596000  -0.6576000     2.032000  
1 1 1 4  39 41 o 8.109000 0.6005000 7.722000 0.9189000 8.496000 0.7733000 -0.7746000     1.201000  
1 1 1 4  39 43 o 13.19000 0.4441000 13.49000 0.5693000 12.89000 0.6818000 0.5997000      0.8883000 
1 1 1 4  39 45 o 7.635000 0.7323000 7.979000 0.9712000 7.292000 1.096000  0.6865000      1.465000  
1 1 1 4  39 47 o 4.161000 0.9721000 4.436000 1.363000  3.886000 1.387000  0.5491000      1.944000  
1 1 1 4  39 49 o 2.822000 0.8532000 2.179000 1.046000  3.464000 1.349000  -1.285000      1.706000  
1 1 1 4  39 51 o 6.406000 0.8715000 5.735000 1.348000  7.077000 1.105000  -1.342000      1.743000  
1 1 1 4  39 53 o 3.694000 0.9370000 4.700000 1.431000  2.688000 1.211000  2.012000       1.874000  
1 1 1 4  40 0  o 6.072000 1.215000  6.072000 1.215000  6.072000 1.215000  0.000000       0.000000  
1 1 1 4  40 2  o 5.056000 0.9602000 4.618000 1.301000  5.494000 1.413000  -0.8756000     1.920000  
1 1 1 4  40 4  o 7.785000 0.5788000 7.647000 0.8132000 7.923000 0.8239000 -0.2763000     1.158000  
1 1 1 4  40 6  o 17.81000 0.3466000 17.49000 0.4558000 18.12000 0.5222000 -0.6308000     0.6931000 
1 1 1 4  40 8  o 16.38000 0.3334000 16.32000 0.4796000 16.43000 0.4633000 -0.1091000     0.6668000 
1 1 1 4  40 10 o 14.61000 0.3649000 14.74000 0.4586000 14.48000 0.5677000 0.2601000      0.7297000 
1 1 1 4  40 12 o 28.31000 0.3515000 27.93000 0.3821000 28.68000 0.5902000 -0.7475000     0.7031000 
1 1 1 4  40 14 o 39.98000 0.3496000 40.24000 0.4380000 39.73000 0.5450000 0.5135000      0.6992000 
1 1 1 4  40 16 o 21.50000 0.3331000 21.27000 0.4521000 21.73000 0.4893000 -0.4635000     0.6662000 
1 1 1 4  40 18 o 20.43000 0.3273000 20.48000 0.4206000 20.38000 0.5017000 0.1033000      0.6547000 
1 1 1 4  40 20 o 15.58000 0.3660000 15.75000 0.4644000 15.41000 0.5657000 0.3474000      0.7319000 
1 1 1 4  40 22 o 13.40000 0.4065000 13.71000 0.4961000 13.10000 0.6440000 0.6095000      0.8129000 
1 1 1 4  40 24 o 11.87000 0.4898000 11.42000 0.6406000 12.32000 0.7411000 -0.8984000     0.9797000 
1 1 1 4  40 26 o 9.113000 0.6050000 9.145000 0.7633000 9.081000 0.9388000 0.6384000E-01  1.210000  
1 1 1 4  40 28 o 3.464000 0.9332000 3.825000 1.340000  3.102000 1.299000  0.7235000      1.866000  
1 1 1 4  40 30 o 16.38000 0.4068000 16.55000 0.5964000 16.22000 0.5534000 0.3308000      0.8136000 
1 1 1 4  40 32 o 6.646000 0.7758000 6.309000 1.237000  6.984000 0.9369000 -0.6749000     1.552000  
1 1 1 4  40 34 o 2.965000 0.8586000 2.794000 1.170000  3.135000 1.257000  -0.3418000     1.717000  
1 1 1 4  40 36 o 8.358000 0.6754000 9.018000 0.8337000 7.699000 1.063000  1.319000       1.351000  
1 1 1 4  40 38 o 3.469000 0.8682000 2.556000 1.124000  4.382000 1.324000  -1.826000      1.736000  
1 1 1 4  40 40 o 3.760000 0.9055000 4.678000 1.333000  2.842000 1.226000  1.836000       1.811000  
1 1 1 4  40 42 o 5.477000 0.8909000 5.972000 1.155000  4.981000 1.357000  0.9916000      1.782000  
1 1 1 4  40 44 o 17.22000 0.4556000 16.33000 0.5372000 18.11000 0.7360000 -1.786000      0.9112000 
1 1 1 4  40 46 o 6.796000 0.7952000 5.915000 1.177000  7.678000 1.070000  -1.763000      1.590000  
1 1 1 4  40 48 o 3.444000 0.9780000 3.228000 1.425000  3.660000 1.340000  -0.4322000     1.956000  
1 1 1 4  40 50 o 4.174000 0.9923000 4.197000 1.430000  4.152000 1.376000  0.4437000E-01  1.985000  
1 1 1 4  40 52 o 5.974000 0.8566000 5.811000 1.227000  6.137000 1.196000  -0.3258000     1.713000  
1 1 1 4  41 1  o 9.027000 0.5348000 8.610000 0.7751000 9.445000 0.7371000 -0.8352000     1.070000  
1 1 1 4  41 3  o 14.43000 0.4767000 14.56000 0.4966000 14.29000 0.8139000 0.2661000      0.9534000 
1 1 1 4  41 5  o 27.55000 0.3032000 27.64000 0.4339000 27.45000 0.4238000 0.1868000      0.6065000 
1 1 1 4  41 7  o 29.37000 0.3514000 29.92000 0.4860000 28.83000 0.5077000 1.095000       0.7028000 
1 1 1 4  41 9  o 43.24000 0.5576000 43.45000 0.5860000 43.04000 0.9487000 0.4112000      1.115000  
1 1 1 4  41 11 o 16.93000 0.3425000 17.19000 0.4414000 16.66000 0.5238000 0.5349000      0.6850000 
1 1 1 4  41 13 o 13.93000 0.3831000 14.11000 0.4928000 13.74000 0.5868000 0.3715000      0.7662000 
1 1 1 4  41 15 o 10.82000 0.4819000 10.74000 0.6606000 10.90000 0.7018000 -0.1630000     0.9638000 
1 1 1 4  41 17 o 24.01000 0.3126000 24.30000 0.4012000 23.72000 0.4793000 0.5847000      0.6251000 
1 1 1 4  41 19 o 4.990000 0.8861000 5.692000 1.077000  4.288000 1.408000  1.403000       1.772000  
1 1 1 4  41 21 o 22.33000 0.3174000 22.20000 0.3973000 22.47000 0.4951000 -0.2631000     0.6348000 
1 1 1 4  41 23 o 13.95000 0.4097000 13.74000 0.5277000 14.16000 0.6270000 -0.4236000     0.8195000 
1 1 1 4  41 25 o 14.18000 0.4629000 13.98000 0.6422000 14.38000 0.6668000 -0.4006000     0.9257000 
1 1 1 4  41 27 o 27.83000 0.3121000 28.24000 0.4372000 27.41000 0.4456000 0.8253000      0.6243000 
1 1 1 4  41 29 f 14.57000 0.4441000 14.69000 0.6509000 14.44000 0.6043000 0.2455000      0.8882000 
1 1 1 4  41 31 o 12.23000 0.4534000 12.33000 0.6970000 12.12000 0.5801000 0.2106000      0.9068000 
1 1 1 4  41 33 o 8.286000 0.5682000 8.322000 0.8082000 8.250000 0.7988000 0.7174000E-01  1.136000  
1 1 1 4  41 35 o 20.02000 0.3474000 19.89000 0.4550000 20.14000 0.5251000 -0.2535000     0.6948000 
1 1 1 4  41 37 o 17.29000 0.3514000 17.55000 0.4988000 17.02000 0.4951000 0.5301000      0.7028000 
1 1 1 4  41 39 o 12.49000 0.4106000 12.54000 0.5933000 12.43000 0.5678000 0.1179000      0.8212000 
1 1 1 4  41 41 o 6.941000 0.7418000 8.492000 0.8497000 5.390000 1.216000  3.102000       1.484000  
1 1 1 4  41 43 o 8.839000 0.5834000 8.671000 0.8284000 9.006000 0.8216000 -0.3357000     1.167000  
1 1 1 4  41 45 o 5.363000 0.9458000 3.358000 1.266000  7.368000 1.406000  -4.010000      1.892000  
1 1 1 4  41 47 o 3.953000 1.006000  3.096000 1.365000  4.810000 1.478000  -1.714000      2.012000  
1 1 1 4  41 49 o 3.229000 0.9399000 3.319000 1.331000  3.139000 1.327000  0.1798000      1.880000  
1 1 1 4  41 51 o 3.362000 0.9084000 4.128000 1.377000  2.597000 1.185000  1.531000       1.817000  
1 1 1 4  42 0  o 10.04000 0.7175000 10.04000 0.7175000 10.04000 0.7175000 0.000000       0.000000  
1 1 1 4  42 2  o 12.28000 0.4681000 12.32000 0.5827000 12.25000 0.7328000 0.6764000E-01  0.9363000 
1 1 1 4  42 4  o 28.49000 0.3332000 28.16000 0.4299000 28.81000 0.5092000 -0.6427000     0.6664000 
1 1 1 4  42 6  o 18.17000 0.3634000 17.88000 0.4687000 18.46000 0.5554000 -0.5816000     0.7267000 
1 1 1 4  42 8  o 11.46000 0.4808000 12.02000 0.6244000 10.89000 0.7313000 1.130000       0.9616000 
1 1 1 4  42 10 o 21.05000 0.3248000 21.64000 0.4062000 20.46000 0.5069000 1.174000       0.6496000 
1 1 1 4  42 12 o 38.66000 0.3502000 38.29000 0.4270000 39.04000 0.5552000 -0.7547000     0.7004000 
1 1 1 4  42 14 o 40.25000 0.3730000 39.91000 0.4858000 40.58000 0.5661000 -0.6721000     0.7460000 
1 1 1 4  42 16 o 23.49000 0.3185000 24.13000 0.4001000 22.86000 0.4958000 1.266000       0.6371000 
1 1 1 4  42 18 o 10.61000 0.4778000 10.40000 0.6155000 10.81000 0.7311000 -0.4057000     0.9556000 
1 1 1 4  42 20 o 24.70000 0.3807000 25.38000 0.4533000 24.03000 0.6118000 1.344000       0.7614000 
1 1 1 4  42 22 o 25.28000 0.3673000 25.22000 0.3762000 25.33000 0.6310000 -0.1072000     0.7346000 
1 1 1 4  42 24 o 16.04000 0.3803000 15.67000 0.4812000 16.40000 0.5892000 -0.7280000     0.7607000 
1 1 1 4  42 26 o 17.17000 0.3380000 17.30000 0.4647000 17.04000 0.4909000 0.2517000      0.6760000 
1 1 1 4  42 28 o 8.145000 0.6781000 7.931000 0.9420000 8.360000 0.9757000 -0.4287000     1.356000  
1 1 1 4  42 30 o 6.775000 0.7456000 7.361000 0.9614000 6.189000 1.140000  1.173000       1.491000  
1 1 1 4  42 32 o 11.36000 0.4988000 11.30000 0.7569000 11.41000 0.6499000 -0.1067000     0.9976000 
1 1 1 4  42 34 o 7.371000 0.6508000 8.154000 0.7928000 6.589000 1.032000  1.566000       1.302000  
1 1 1 4  42 36 o 12.68000 0.4040000 12.62000 0.5829000 12.74000 0.5595000 -0.1138000     0.8079000 
1 1 1 4  42 38 o 8.561000 0.5824000 8.828000 0.7207000 8.293000 0.9151000 0.5354000      1.165000  
1 1 1 4  42 40 o 6.126000 0.7829000 4.833000 1.258000  7.419000 0.9325000 -2.586000      1.566000  
1 1 1 4  42 42 o 10.02000 0.5679000 10.59000 0.7007000 9.441000 0.8940000 1.153000       1.136000  
1 1 1 4  42 44 o 6.070000 0.9968000 6.034000 1.351000  6.105000 1.466000  -0.7107000E-01 1.994000  
1 1 1 4  42 46 o 2.833000 0.8924000 2.885000 1.297000  2.782000 1.226000  0.1029000      1.785000  
1 1 1 4  42 48 o 4.462000 1.025000  4.222000 1.543000  4.703000 1.348000  -0.4801000     2.049000  
1 1 1 4  42 50 o 3.646000 0.9712000 2.597000 1.179000  4.695000 1.543000  -2.098000      1.942000  
1 1 1 4  43 1  o 27.29000 0.3424000 27.16000 0.4509000 27.42000 0.5154000 -0.2527000     0.6848000 
1 1 1 4  43 3  o 49.35000 0.3881000 49.62000 0.5524000 49.08000 0.5453000 0.5380000      0.7762000 
1 1 1 4  43 5  o 22.32000 0.3377000 22.07000 0.4474000 22.57000 0.5061000 -0.4968000     0.6755000 
1 1 1 4  43 7  o 8.823000 0.7317000 7.611000 0.9680000 10.04000 1.097000  -2.425000      1.463000  
1 1 1 4  43 9  o 11.05000 0.5916000 11.46000 0.6489000 10.64000 0.9895000 0.8131000      1.183000  
1 1 1 4  43 11 o 14.37000 0.4544000 15.61000 0.4731000 13.13000 0.7760000 2.474000       0.9088000 
1 1 1 4  43 13 o 13.68000 0.5248000 13.50000 0.5494000 13.86000 0.8944000 -0.3593000     1.050000  
1 1 1 4  43 15 o 20.04000 0.4041000 20.21000 0.4083000 19.87000 0.6974000 0.3393000      0.8081000 
1 1 1 4  43 17 o 24.37000 0.3650000 24.03000 0.3911000 24.71000 0.6164000 -0.6842000     0.7300000 
1 1 1 4  43 19 o 30.47000 0.3800000 31.08000 0.4069000 29.85000 0.6418000 1.226000       0.7600000 
1 1 1 4  43 21 o 3.694000 0.9751000 3.878000 1.281000  3.510000 1.471000  0.3681000      1.950000  
1 1 1 4  43 23 o 24.69000 0.2975000 24.79000 0.4188000 24.60000 0.4227000 0.1877000      0.5951000 
1 1 1 4  43 25 o 10.88000 0.4301000 10.56000 0.6023000 11.19000 0.6142000 -0.6269000     0.8603000 
1 1 1 4  43 27 o 8.930000 0.6165000 8.571000 0.8453000 9.288000 0.8976000 -0.7174000     1.233000  
1 1 1 4  43 29 o 8.377000 0.5609000 8.132000 0.8168000 8.623000 0.7691000 -0.4915000     1.122000  
1 1 1 4  43 31 o 14.08000 0.4322000 14.37000 0.6242000 13.78000 0.5980000 0.5969000      0.8644000 
1 1 1 4  43 33 o 13.18000 0.4322000 12.99000 0.5884000 13.38000 0.6333000 -0.3849000     0.8644000 
1 1 1 4  43 35 o 15.04000 0.3584000 15.11000 0.5123000 14.96000 0.5013000 0.1471000      0.7167000 
1 1 1 4  43 37 f 16.65000 0.3623000 16.86000 0.5341000 16.44000 0.4897000 0.4198000      0.7246000 
1 1 1 4  43 39 o 3.411000 0.9362000 3.479000 1.317000  3.343000 1.331000  0.1354000      1.872000  
1 1 1 4  43 41 o 4.078000 0.9054000 5.196000 1.272000  2.961000 1.288000  2.235000       1.811000  
1 1 1 4  43 43 o 4.782000 0.9585000 6.218000 1.337000  3.345000 1.374000  2.873000       1.917000  
1 1 1 4  43 45 o 4.829000 0.9803000 4.310000 1.454000  5.348000 1.315000  -1.039000      1.961000  
1 1 1 4  43 47 o 3.855000 1.047000  4.326000 1.633000  3.385000 1.311000  0.9411000      2.094000  
1 1 1 4  43 49 o 3.742000 0.9202000 4.509000 1.357000  2.974000 1.244000  1.535000       1.840000  
1 1 1 4  44 0  o 50.32000 0.6520000 50.32000 0.6520000 50.32000 0.6520000 0.000000       0.000000  
1 1 1 4  44 2  o 30.21000 0.3878000 30.20000 0.6329000 30.22000 0.4484000 -0.1945000E-01 0.7757000 
1 1 1 4  44 4  o 11.12000 0.5059000 11.01000 0.6950000 11.23000 0.7354000 -0.2241000     1.012000  
1 1 1 4  44 6  o 20.98000 0.3167000 20.68000 0.4550000 21.29000 0.4406000 -0.6126000     0.6333000 
1 1 1 4  44 8  o 13.99000 0.3944000 13.91000 0.5829000 14.07000 0.5316000 -0.1614000     0.7889000 
1 1 1 4  44 10 o 16.36000 0.4568000 16.76000 0.4996000 15.95000 0.7649000 0.8135000      0.9136000 
1 1 1 4  44 12 o 28.70000 0.3780000 29.09000 0.3954000 28.31000 0.6445000 0.7738000      0.7561000 
1 1 1 4  44 14 o 25.99000 0.3715000 26.99000 0.3960000 25.00000 0.6286000 1.997000       0.7430000 
1 1 1 4  44 16 o 16.67000 0.4210000 16.49000 0.4518000 16.85000 0.7104000 -0.3531000     0.8419000 
1 1 1 4  44 18 o 19.16000 0.3893000 19.19000 0.4615000 19.13000 0.6270000 0.5850000E-01  0.7786000 
1 1 1 4  44 20 o 8.592000 0.5572000 9.570000 0.6382000 7.613000 0.9135000 1.957000       1.114000  
1 1 1 4  44 22 o 4.555000 0.8439000 5.118000 1.009000  3.992000 1.353000  1.126000       1.688000  
1 1 1 4  44 24 o 9.565000 0.4281000 9.102000 0.5761000 10.03000 0.6333000 -0.9263000     0.8561000 
1 1 1 4  44 26 o 8.878000 0.6053000 9.954000 0.7268000 7.801000 0.9682000 2.152000       1.211000  
1 1 1 4  44 28 o 8.892000 0.5216000 9.493000 0.7451000 8.292000 0.7301000 1.201000       1.043000  
1 1 1 4  44 30 o 9.419000 0.5397000 9.761000 0.7397000 9.077000 0.7862000 0.6838000      1.079000  
1 1 1 4  44 32 o 11.91000 0.4715000 12.23000 0.6082000 11.60000 0.7207000 0.6318000      0.9431000 
1 1 1 4  44 34 o 4.811000 1.027000  5.024000 1.464000  4.597000 1.441000  0.4274000      2.054000  
1 1 1 4  44 36 o 3.389000 0.9129000 3.244000 1.265000  3.534000 1.317000  -0.2897000     1.826000  
1 1 1 4  44 38 o 8.465000 0.5838000 9.123000 0.7437000 7.808000 0.9001000 1.314000       1.168000  
1 1 1 4  44 40 o 4.003000 0.9870000 3.983000 1.351000  4.023000 1.439000  -0.4020000E-01 1.974000  
1 1 1 4  44 42 o 10.14000 0.5633000 10.53000 0.8106000 9.741000 0.7824000 0.7900000      1.127000  
1 1 1 4  44 44 o 9.544000 0.5071000 9.473000 0.7070000 9.616000 0.7273000 -0.1427000     1.014000  
1 1 1 4  44 46 o 6.712000 0.7459000 6.286000 1.135000  7.138000 0.9685000 -0.8516000     1.492000  
1 1 1 4  44 48 o 2.801000 0.8408000 2.379000 1.080000  3.223000 1.289000  -0.8441000     1.682000  
1 1 1 4  45 1  o 21.23000 0.3481000 21.81000 0.4693000 20.64000 0.5141000 1.162000       0.6961000 
1 1 1 4  45 3  o 18.10000 0.3801000 17.63000 0.5403000 18.57000 0.5348000 -0.9472000     0.7603000 
1 1 1 4  45 5  o 12.16000 0.4344000 11.90000 0.6344000 12.43000 0.5936000 -0.5279000     0.8688000 
1 1 1 4  45 7  o 21.78000 0.3112000 21.84000 0.4495000 21.71000 0.4306000 0.1287000      0.6225000 
1 1 1 4  45 9  o 6.994000 0.7024000 7.316000 0.8780000 6.672000 1.097000  0.6440000      1.405000  
1 1 1 4  45 11 o 14.26000 0.3730000 14.29000 0.4920000 14.22000 0.5607000 0.7283000E-01  0.7460000 
1 1 1 4  45 13 o 15.68000 0.3645000 15.32000 0.4794000 16.03000 0.5492000 -0.7058000     0.7290000 
1 1 1 4  45 15 o 15.85000 0.3776000 16.36000 0.4883000 15.34000 0.5762000 1.021000       0.7552000 
1 1 1 4  45 17 o 14.25000 0.3769000 14.95000 0.4694000 13.56000 0.5898000 1.395000       0.7538000 
1 1 1 4  45 19 o 10.78000 0.4265000 10.48000 0.5651000 11.07000 0.6391000 -0.5900000     0.8531000 
1 1 1 4  45 21 o 9.319000 0.4577000 8.692000 0.6224000 9.946000 0.6713000 -1.254000      0.9154000 
1 1 1 4  45 23 o 3.978000 0.9127000 4.515000 1.356000  3.441000 1.222000  1.073000       1.825000  
1 1 1 4  45 25 o 18.53000 0.3661000 18.69000 0.5074000 18.37000 0.5278000 0.3164000      0.7321000 
1 1 1 4  45 27 o 12.00000 0.4386000 12.39000 0.6234000 11.62000 0.6171000 0.7676000      0.8772000 
1 1 1 4  45 29 o 2.925000 0.8532000 2.555000 1.148000  3.295000 1.262000  -0.7398000     1.706000  
1 1 1 4  45 31 o 11.36000 0.4615000 11.70000 0.5658000 11.01000 0.7291000 0.6954000      0.9229000 
1 1 1 4  45 33 o 9.098000 0.6537000 8.406000 1.087000  9.789000 0.7269000 -1.384000      1.307000  
1 1 1 4  45 35 o 6.592000 0.7275000 6.316000 1.106000  6.868000 0.9456000 -0.5513000     1.455000  
1 1 1 4  45 37 o 7.799000 0.6391000 6.734000 1.023000  8.864000 0.7669000 -2.130000      1.278000  
1 1 1 4  45 39 o 14.10000 0.4355000 14.30000 0.5357000 13.91000 0.6868000 0.3908000      0.8711000 
1 1 1 4  45 41 o 3.136000 0.9026000 3.328000 1.297000  2.944000 1.256000  0.3843000      1.805000  
1 1 1 4  45 43 o 3.927000 0.9437000 3.188000 1.284000  4.666000 1.384000  -1.479000      1.887000  
1 1 1 4  45 45 o 4.384000 0.9626000 5.383000 1.367000  3.385000 1.356000  1.998000       1.925000  
1 1 1 4  45 47 o 8.631000 0.6316000 8.412000 0.9921000 8.850000 0.7820000 -0.4380000     1.263000  
1 1 1 4  46 0  o 21.62000 0.5426000 21.62000 0.5426000 21.62000 0.5426000 0.000000       0.000000  
1 1 1 4  46 2  o 4.566000 0.9633000 4.939000 1.369000  4.193000 1.356000  0.7457000      1.927000  
1 1 1 4  46 4  o 9.194000 0.5627000 8.969000 0.8296000 9.420000 0.7603000 -0.4512000     1.125000  
1 1 1 4  46 6  o 17.43000 0.3641000 17.94000 0.5589000 16.92000 0.4667000 1.021000       0.7281000 
1 1 1 4  46 8  o 12.66000 0.4255000 11.98000 0.6661000 13.35000 0.5297000 -1.368000      0.8511000 
1 1 1 4  46 10 o 20.27000 0.3210000 20.58000 0.4129000 19.97000 0.4915000 0.6068000      0.6419000 
1 1 1 4  46 12 o 26.31000 0.3305000 26.48000 0.4464000 26.15000 0.4875000 0.3298000      0.6610000 
1 1 1 4  46 14 o 11.80000 0.5343000 13.06000 0.5107000 10.54000 0.9387000 2.520000       1.069000  
1 1 1 4  46 16 o 3.241000 0.8607000 3.772000 1.237000  2.709000 1.197000  1.063000       1.721000  
1 1 1 4  46 18 f 14.51000 0.3490000 14.39000 0.4519000 14.62000 0.5319000 -0.2277000     0.6980000 
1 1 1 4  46 20 o 21.60000 0.3282000 21.57000 0.4403000 21.63000 0.4869000 -0.5609000E-01 0.6564000 
1 1 1 4  46 22 o 12.18000 0.4007000 11.76000 0.5423000 12.60000 0.5901000 -0.8342000     0.8014000 
1 1 1 4  46 24 o 14.29000 0.3749000 14.69000 0.4945000 13.88000 0.5637000 0.8102000      0.7498000 
1 1 1 4  46 26 o 19.11000 0.3464000 18.95000 0.5163000 19.28000 0.4620000 -0.3375000     0.6928000 
1 1 1 4  46 28 o 9.514000 0.4610000 8.834000 0.6093000 10.19000 0.6919000 -1.360000      0.9219000 
1 1 1 4  46 30 o 16.90000 0.3852000 17.46000 0.5294000 16.34000 0.5597000 1.124000       0.7704000 
1 1 1 4  46 32 o 16.63000 0.3906000 16.80000 0.5828000 16.46000 0.5204000 0.3421000      0.7813000 
1 1 1 4  46 34 o 8.032000 0.5828000 7.999000 0.7653000 8.065000 0.8791000 -0.6650000E-01 1.166000  
1 1 1 4  46 36 o 13.22000 0.4198000 12.60000 0.5870000 13.85000 0.6002000 -1.244000      0.8395000 
1 1 1 4  46 38 o 2.800000 0.8798000 2.907000 1.254000  2.693000 1.234000  0.2136000      1.760000  
1 1 1 4  46 40 o 6.436000 0.8275000 7.130000 0.9942000 5.741000 1.323000  1.390000       1.655000  
1 1 1 4  46 42 o 6.467000 0.7774000 6.818000 0.9547000 6.115000 1.227000  0.7039000      1.555000  
1 1 1 4  46 44 o 5.421000 0.8411000 6.695000 0.9559000 4.148000 1.384000  2.547000       1.682000  
1 1 1 4  46 46 o 4.015000 0.9658000 4.388000 1.463000  3.641000 1.261000  0.7472000      1.932000  
1 1 1 4  47 1  o 8.424000 0.5791000 8.664000 0.8056000 8.183000 0.8322000 0.4816000      1.158000  
1 1 1 4  47 3  o 17.66000 0.3724000 17.65000 0.5722000 17.67000 0.4768000 -0.1787000E-01 0.7448000 
1 1 1 4  47 5  o 9.989000 0.5796000 9.755000 0.9490000 10.22000 0.6655000 -0.4685000     1.159000  
1 1 1 4  47 7  o 8.220000 0.7138000 7.840000 1.224000  8.600000 0.7354000 -0.7603000     1.428000  
1 1 1 4  47 9  o 27.93000 0.3525000 27.33000 0.5103000 28.52000 0.4865000 -1.193000      0.7050000 
1 1 1 4  47 11 o 2.633000 0.8289000 2.778000 1.151000  2.488000 1.193000  0.2902000      1.658000  
1 1 1 4  47 13 o 5.250000 0.7175000 5.363000 0.8914000 5.136000 1.124000  0.2267000      1.435000  
1 1 1 4  47 15 f 3.817000 0.9069000 3.179000 1.266000  4.455000 1.299000  -1.276000      1.814000  
1 1 1 4  47 17 o 18.07000 0.3482000 18.38000 0.4652000 17.76000 0.5183000 0.6239000      0.6965000 
1 1 1 4  47 19 o 17.60000 0.3475000 17.46000 0.4880000 17.74000 0.4948000 -0.2811000     0.6950000 
1 1 1 4  47 21 o 5.920000 0.7392000 5.897000 0.8557000 5.943000 1.206000  -0.4625000E-01 1.478000  
1 1 1 4  47 23 o 8.620000 0.5302000 8.249000 0.8150000 8.992000 0.6784000 -0.7427000     1.060000  
1 1 1 4  47 25 o 7.349000 0.6423000 6.979000 0.9987000 7.719000 0.8081000 -0.7401000     1.285000  
1 1 1 4  47 27 o 7.028000 0.6770000 7.384000 0.8179000 6.672000 1.079000  0.7120000      1.354000  
1 1 1 4  47 29 o 4.750000 0.8523000 5.847000 1.050000  3.653000 1.343000  2.195000       1.705000  
1 1 1 4  47 31 o 4.128000 0.8929000 3.096000 1.306000  5.161000 1.218000  -2.065000      1.786000  
1 1 1 4  47 33 o 13.10000 0.4073000 12.75000 0.5739000 13.44000 0.5782000 -0.6838000     0.8146000 
1 1 1 4  47 35 o 9.353000 0.5522000 8.771000 0.7770000 9.935000 0.7850000 -1.165000      1.104000  
1 1 1 4  47 37 o 8.214000 0.6853000 7.688000 0.9221000 8.739000 1.014000  -1.051000      1.371000  
1 1 1 4  47 39 o 4.439000 0.9982000 4.600000 1.345000  4.278000 1.475000  0.3222000      1.996000  
1 1 1 4  47 41 o 6.677000 0.7058000 6.478000 0.9786000 6.877000 1.017000  -0.3987000     1.412000  
1 1 1 4  47 43 o 3.280000 0.8991000 3.366000 1.274000  3.194000 1.269000  0.1726000      1.798000  
1 1 1 4  47 45 o 4.869000 1.018000  4.615000 1.425000  5.122000 1.454000  -0.5065000     2.036000  
1 1 1 4  48 0  o 2.934000 1.225000  2.934000 1.225000  2.934000 1.225000  0.000000       0.000000  
1 1 1 4  48 2  o 10.31000 0.5145000 10.69000 0.7173000 9.941000 0.7378000 0.7471000      1.029000  
1 1 1 4  48 4  o 12.12000 0.4264000 12.78000 0.6088000 11.46000 0.5971000 1.319000       0.8528000 
1 1 1 4  48 6  f 20.62000 0.3678000 19.94000 0.5824000 21.30000 0.4494000 -1.353000      0.7356000 
1 1 1 4  48 8  o 20.96000 0.4342000 20.87000 0.6066000 21.05000 0.6214000 -0.1748000     0.8684000 
1 1 1 4  48 10 o 16.60000 0.4359000 16.91000 0.7043000 16.30000 0.5136000 0.6093000      0.8717000 
1 1 1 4  48 12 o 9.452000 0.5380000 9.119000 0.8227000 9.784000 0.6934000 -0.6646000     1.076000  
1 1 1 4  48 14 o 6.454000 0.7869000 5.261000 1.321000  7.646000 0.8559000 -2.385000      1.574000  
1 1 1 4  48 16 o 9.292000 0.5646000 9.478000 0.8125000 9.107000 0.7842000 0.3717000      1.129000  
1 1 1 4  48 18 o 11.36000 0.4377000 11.28000 0.5754000 11.45000 0.6597000 -0.1696000     0.8753000 
1 1 1 4  48 20 o 3.225000 0.8671000 2.711000 1.158000  3.739000 1.291000  -1.028000      1.734000  
1 1 1 4  48 22 o 3.894000 0.7865000 5.208000 1.048000  2.580000 1.173000  2.628000       1.573000  
1 1 1 4  48 24 o 14.65000 0.4314000 14.56000 0.5799000 14.74000 0.6389000 -0.1836000     0.8629000 
1 1 1 4  48 26 o 18.02000 0.3791000 18.08000 0.5481000 17.95000 0.5240000 0.1359000      0.7583000 
1 1 1 4  48 28 o 2.705000 0.8334000 2.590000 1.123000  2.819000 1.232000  -0.2294000     1.667000  
1 1 1 4  48 30 o 9.864000 0.4908000 9.611000 0.7173000 10.12000 0.6700000 -0.5059000     0.9815000 
1 1 1 4  48 32 o 4.657000 0.8744000 5.438000 1.133000  3.877000 1.332000  1.561000       1.749000  
1 1 1 4  48 34 o 7.753000 0.6240000 7.617000 0.8546000 7.889000 0.9094000 -0.2717000     1.248000  
1 1 1 4  48 36 o 9.365000 0.6148000 10.48000 0.6220000 8.251000 1.061000  2.230000       1.230000  
1 1 1 4  48 38 o 3.272000 0.9299000 2.800000 1.170000  3.745000 1.445000  -0.9451000     1.860000  
1 1 1 4  48 40 o 5.832000 0.8190000 5.279000 1.272000  6.386000 1.032000  -1.108000      1.638000  
1 1 1 4  48 42 o 5.334000 0.9602000 3.905000 1.473000  6.763000 1.233000  -2.858000      1.920000  
1 1 1 4  48 44 o 4.543000 1.205000  2.885000 1.400000  6.201000 1.961000  -3.316000      2.410000  
1 1 1 4  49 1  o 4.068000 0.9965000 3.734000 1.385000  4.402000 1.433000  -0.6685000     1.993000  
1 1 1 4  49 3  o 24.15000 0.3345000 24.28000 0.5152000 24.02000 0.4268000 0.2553000      0.6690000 
1 1 1 4  49 5  o 20.06000 0.3639000 20.61000 0.4622000 19.51000 0.5621000 1.100000       0.7278000 
1 1 1 4  49 7  o 9.067000 0.4867000 9.154000 0.7091000 8.981000 0.6668000 0.1730000      0.9734000 
1 1 1 4  49 9  o 9.551000 0.4883000 9.715000 0.6765000 9.387000 0.7042000 0.3277000      0.9765000 
1 1 1 4  49 11 o 3.470000 0.8672000 3.281000 1.170000  3.658000 1.281000  -0.3770000     1.734000  
1 1 1 4  49 13 o 8.986000 0.4978000 9.037000 0.6778000 8.936000 0.7292000 0.1010000      0.9956000 
1 1 1 4  49 15 o 9.672000 0.4831000 9.593000 0.6796000 9.751000 0.6867000 -0.1580000     0.9661000 
1 1 1 4  49 17 o 8.256000 0.5459000 7.941000 0.7324000 8.571000 0.8098000 -0.6307000     1.092000  
1 1 1 4  49 19 o 10.50000 0.5413000 11.19000 0.5815000 9.817000 0.9133000 1.368000       1.083000  
1 1 1 4  49 21 o 10.58000 0.4522000 10.34000 0.6150000 10.82000 0.6631000 -0.4856000     0.9044000 
1 1 1 4  49 23 o 4.729000 0.8661000 5.991000 1.074000  3.467000 1.359000  2.524000       1.732000  
1 1 1 4  49 25 o 3.899000 0.9126000 4.572000 1.318000  3.225000 1.263000  1.347000       1.825000  
1 1 1 4  49 27 o 4.393000 0.8579000 5.271000 1.149000  3.516000 1.274000  1.755000       1.716000  
1 1 1 4  49 29 o 12.38000 0.4179000 12.91000 0.6085000 11.84000 0.5729000 1.068000       0.8357000 
1 1 1 4  49 31 o 2.437000 0.7734000 2.614000 1.119000  2.260000 1.068000  0.3542000      1.547000  
1 1 1 4  49 33 o 3.338000 0.8933000 3.137000 1.191000  3.539000 1.332000  -0.4019000     1.787000  
1 1 1 4  49 35 f 3.570000 0.9788000 3.235000 1.252000  3.906000 1.505000  -0.6709000     1.958000  
1 1 1 4  49 37 o 9.664000 0.5766000 9.241000 0.7626000 10.09000 0.8651000 -0.8464000     1.153000  
1 1 1 4  49 39 o 6.125000 0.8429000 6.521000 1.118000  5.730000 1.261000  0.7914000      1.686000  
1 1 1 4  49 41 o 5.046000 1.020000  5.455000 1.436000  4.638000 1.449000  0.8171000      2.040000  
1 1 1 4  49 43 o 4.246000 1.794000  4.246000 1.794000  ?        ?         ?              ?         
1 1 1 4  50 0  o 23.58000 0.6513000 23.58000 0.6513000 23.58000 0.6513000 0.000000       0.000000  
1 1 1 4  50 2  o 11.57000 0.5368000 11.43000 0.6056000 11.70000 0.8864000 -0.2755000     1.074000  
1 1 1 4  50 4  f 18.74000 0.3402000 19.13000 0.4597000 18.35000 0.5014000 0.7787000      0.6803000 
1 1 1 4  50 6  o 8.154000 0.5381000 8.353000 0.7671000 7.956000 0.7547000 0.3975000      1.076000  
1 1 1 4  50 8  o 6.252000 0.7722000 6.538000 1.100000  5.966000 1.084000  0.5726000      1.544000  
1 1 1 4  50 10 o 4.272000 0.8185000 4.972000 1.010000  3.572000 1.288000  1.400000       1.637000  
1 1 1 4  50 12 o 3.319000 0.8628000 2.831000 1.142000  3.806000 1.293000  -0.9747000     1.726000  
1 1 1 4  50 14 o 17.14000 0.3293000 16.83000 0.4196000 17.44000 0.5075000 -0.6086000     0.6585000 
1 1 1 4  50 16 o 8.146000 0.5474000 8.331000 0.6995000 7.961000 0.8421000 0.3704000      1.095000  
1 1 1 4  50 18 o 10.05000 0.5139000 10.32000 0.5330000 9.788000 0.8788000 0.5287000      1.028000  
1 1 1 4  50 20 o 9.182000 0.5486000 9.313000 0.5980000 9.051000 0.9198000 0.2612000      1.097000  
1 1 1 4  50 22 o 4.469000 0.9263000 4.689000 1.208000  4.249000 1.405000  0.4401000      1.853000  
1 1 1 4  50 24 o 5.086000 0.8738000 5.150000 1.169000  5.022000 1.299000  0.1274000      1.748000  
1 1 1 4  50 26 o 6.237000 0.7075000 5.756000 1.075000  6.719000 0.9203000 -0.9634000     1.415000  
1 1 1 4  50 28 o 2.978000 0.8843000 2.909000 1.248000  3.047000 1.253000  -0.1376000     1.769000  
1 1 1 4  50 30 o 11.48000 0.4305000 11.68000 0.5926000 11.27000 0.6245000 0.4086000      0.8609000 
1 1 1 4  50 32 o 8.029000 0.6030000 8.296000 0.8075000 7.762000 0.8957000 0.5344000      1.206000  
1 1 1 4  50 34 o 8.821000 0.5935000 8.643000 0.7913000 9.000000 0.8849000 -0.3572000     1.187000  
1 1 1 4  50 36 o 3.859000 0.9772000 3.725000 1.320000  3.992000 1.441000  -0.2666000     1.954000  
1 1 1 4  50 38 o 4.047000 0.9705000 3.916000 1.359000  4.179000 1.386000  -0.2632000     1.941000  
1 1 1 4  50 40 o 7.361000 0.7298000 7.624000 1.053000  7.097000 1.011000  0.5270000      1.460000  
1 1 1 4  51 1  o 9.392000 0.5108000 9.024000 0.7229000 9.760000 0.7218000 -0.7352000     1.022000  
1 1 1 4  51 3  o 14.12000 0.3987000 13.57000 0.5206000 14.67000 0.6041000 -1.104000      0.7975000 
1 1 1 4  51 5  o 15.70000 0.3624000 15.82000 0.4912000 15.58000 0.5330000 0.2367000      0.7248000 
1 1 1 4  51 7  o 9.523000 0.5226000 9.479000 0.7792000 9.567000 0.6966000 -0.8783000E-01 1.045000  
1 1 1 4  51 9  o 10.46000 0.4532000 10.26000 0.5458000 10.66000 0.7236000 -0.4016000     0.9063000 
1 1 1 4  51 11 o 14.89000 0.3850000 14.42000 0.4768000 15.35000 0.6047000 -0.9310000     0.7701000 
1 1 1 4  51 13 o 8.339000 0.5713000 9.274000 0.6003000 7.405000 0.9722000 1.869000       1.143000  
1 1 1 4  51 15 o 10.52000 0.4835000 10.96000 0.5283000 10.09000 0.8100000 0.8770000      0.9670000 
1 1 1 4  51 17 o 9.245000 0.5997000 9.241000 0.5867000 9.249000 1.046000  -0.8464000E-02 1.199000  
1 1 1 4  51 19 o 3.767000 0.9108000 3.666000 1.189000  3.868000 1.380000  -0.2025000     1.822000  
1 1 1 4  51 21 o 8.619000 0.6088000 9.265000 0.6734000 7.974000 1.014000  1.291000       1.218000  
1 1 1 4  51 23 o 4.132000 0.9180000 4.433000 1.301000  3.831000 1.296000  0.6016000      1.836000  
1 1 1 4  51 25 o 4.892000 0.8572000 5.240000 1.177000  4.543000 1.246000  0.6969000      1.714000  
1 1 1 4  51 27 o 8.695000 0.5782000 8.047000 0.9004000 9.344000 0.7258000 -1.297000      1.156000  
1 1 1 4  51 29 o 3.181000 0.8965000 2.907000 1.221000  3.454000 1.313000  -0.5467000     1.793000  
1 1 1 4  51 31 o 4.898000 0.8848000 4.942000 1.195000  4.853000 1.305000  0.8928000E-01  1.770000  
1 1 1 4  51 33 o 5.182000 0.9126000 5.196000 1.160000  5.169000 1.409000  0.2658000E-01  1.825000  
1 1 1 4  51 35 o 4.732000 0.9462000 4.972000 1.156000  4.493000 1.498000  0.4788000      1.892000  
1 1 1 4  51 37 o 8.321000 0.6348000 9.308000 0.8613000 7.335000 0.9327000 1.973000       1.270000  
1 1 1 4  51 39 o 9.483000 0.5748000 10.65000 0.8027000 8.318000 0.8228000 2.329000       1.150000  
1 1 1 4  52 0  o 23.85000 0.5367000 23.85000 0.5367000 23.85000 0.5367000 0.000000       0.000000  
1 1 1 4  52 2  o 6.678000 0.6344000 6.640000 0.9373000 6.716000 0.8553000 -0.7514000E-01 1.269000  
1 1 1 4  52 4  o 5.597000 0.7640000 5.610000 1.076000  5.584000 1.084000  0.2578000E-01  1.528000  
1 1 1 4  52 6  o 7.435000 0.6502000 6.887000 0.9902000 7.984000 0.8429000 -1.097000      1.300000  
1 1 1 4  52 8  o 2.797000 0.8210000 2.300000 1.027000  3.293000 1.282000  -0.9928000     1.642000  
1 1 1 4  52 10 o 4.086000 0.9031000 3.466000 1.239000  4.705000 1.314000  -1.239000      1.806000  
1 1 1 4  52 12 o 8.945000 0.5255000 8.948000 0.6531000 8.941000 0.8235000 0.7154000E-02  1.051000  
1 1 1 4  52 14 o 5.404000 0.8168000 4.964000 1.057000  5.843000 1.245000  -0.8786000     1.634000  
1 1 1 4  52 16 o 10.64000 0.4655000 10.44000 0.6169000 10.85000 0.6973000 -0.4104000     0.9310000 
1 1 1 4  52 18 o 5.803000 0.7065000 6.084000 0.8613000 5.521000 1.120000  0.5630000      1.413000  
1 1 1 4  52 20 o 7.042000 0.6380000 7.332000 0.7625000 6.752000 1.023000  0.5801000      1.276000  
1 1 1 4  52 22 o 9.184000 0.4845000 9.718000 0.6592000 8.650000 0.7103000 1.068000       0.9690000 
1 1 1 4  52 24 o 6.626000 0.6942000 7.281000 0.8560000 5.972000 1.093000  1.309000       1.388000  
1 1 1 4  52 26 o 7.845000 0.6451000 7.861000 0.9679000 7.828000 0.8532000 0.3303000E-01  1.290000  
1 1 1 4  52 28 o 6.143000 0.7636000 7.152000 0.9235000 5.135000 1.216000  2.017000       1.527000  
1 1 1 4  52 30 o 8.911000 0.5429000 8.719000 0.7637000 9.103000 0.7717000 -0.3830000     1.086000  
1 1 1 4  52 32 o 12.82000 0.4692000 13.47000 0.5769000 12.17000 0.7402000 1.297000       0.9385000 
1 1 1 4  52 34 o 7.239000 0.7438000 7.526000 0.9008000 6.951000 1.184000  0.5743000      1.488000  
1 1 1 4  52 36 o 3.241000 0.9494000 3.271000 1.363000  3.212000 1.322000  0.5930000E-01  1.899000  
1 1 1 4  52 38 o 3.485000 1.034000  3.203000 1.460000  3.767000 1.464000  -0.5644000     2.067000  
1 1 1 4  53 1  o 5.038000 0.8422000 4.486000 1.277000  5.590000 1.099000  -1.103000      1.684000  
1 1 1 4  53 3  o 8.166000 0.5246000 8.304000 0.7254000 8.028000 0.7580000 0.2755000      1.049000  
1 1 1 4  53 5  o 8.687000 0.4807000 8.376000 0.6696000 8.999000 0.6900000 -0.6228000     0.9615000 
1 1 1 4  53 7  o 11.30000 0.4294000 11.28000 0.5835000 11.32000 0.6301000 -0.4281000E-01 0.8588000 
1 1 1 4  53 9  f 3.817000 0.9382000 4.101000 1.377000  3.533000 1.274000  0.5674000      1.876000  
1 1 1 4  53 11 o 17.81000 0.3774000 17.01000 0.4850000 18.61000 0.5784000 -1.606000      0.7548000 
1 1 1 4  53 13 o 13.74000 0.4483000 13.24000 0.5952000 14.25000 0.6706000 -1.016000      0.8966000 
1 1 1 4  53 15 o 3.706000 0.8980000 3.300000 1.230000  4.111000 1.309000  -0.8105000     1.796000  
1 1 1 4  53 17 o 8.066000 0.5205000 7.984000 0.7001000 8.147000 0.7704000 -0.1629000     1.041000  
1 1 1 4  53 19 o 11.50000 0.4147000 12.34000 0.4994000 10.66000 0.6621000 1.685000       0.8293000 
1 1 1 4  53 21 o 12.51000 0.4376000 13.53000 0.4680000 11.49000 0.7397000 2.042000       0.8753000 
1 1 1 4  53 23 o 17.73000 0.3432000 17.80000 0.4661000 17.65000 0.5039000 0.1515000      0.6864000 
1 1 1 4  53 25 o 8.802000 0.5708000 9.614000 0.7886000 7.989000 0.8256000 1.625000       1.142000  
1 1 1 4  53 27 o 5.589000 0.8011000 5.300000 1.168000  5.879000 1.096000  -0.5790000     1.602000  
1 1 1 4  53 29 o 5.890000 0.7952000 5.860000 1.101000  5.920000 1.147000  -0.6005000E-01 1.590000  
1 1 1 4  53 31 o 5.909000 0.8732000 6.444000 1.092000  5.374000 1.363000  1.071000       1.746000  
1 1 1 4  53 33 o 5.669000 0.9154000 6.080000 1.085000  5.259000 1.475000  0.8202000      1.831000  
1 1 1 4  53 35 o 5.846000 0.8727000 5.385000 1.308000  6.308000 1.155000  -0.9231000     1.745000  
1 1 1 4  53 37 o 5.419000 2.209000  5.419000 2.209000  ?        ?         ?              ?         
1 1 1 4  54 0  o 2.313000 1.066000  2.313000 1.066000  2.313000 1.066000  0.000000       0.000000  
1 1 1 4  54 2  o 3.531000 0.9071000 3.831000 1.330000  3.230000 1.233000  0.6014000      1.814000  
1 1 1 4  54 4  f 3.585000 0.8812000 4.376000 1.293000  2.793000 1.198000  1.582000       1.762000  
1 1 1 4  54 6  o 7.809000 0.5476000 7.407000 0.8208000 8.210000 0.7250000 -0.8026000     1.095000  
1 1 1 4  54 8  o 9.104000 0.5567000 9.075000 0.6938000 9.133000 0.8709000 -0.5749000E-01 1.113000  
1 1 1 4  54 10 o 8.693000 0.5620000 9.184000 0.7120000 8.201000 0.8698000 0.9834000      1.124000  
1 1 1 4  54 12 o 3.109000 0.8858000 3.071000 1.167000  3.147000 1.333000  -0.7640000E-01 1.772000  
1 1 1 4  54 14 o 7.434000 0.6405000 6.942000 0.9487000 7.926000 0.8609000 -0.9840000     1.281000  
1 1 1 4  54 16 o 8.397000 0.5904000 7.828000 0.9051000 8.966000 0.7585000 -1.137000      1.181000  
1 1 1 4  54 18 o 8.632000 0.5186000 8.251000 0.6879000 9.012000 0.7761000 -0.7610000     1.037000  
1 1 1 4  54 20 o 10.32000 0.4815000 9.790000 0.6145000 10.85000 0.7416000 -1.061000      0.9631000 
1 1 1 4  54 22 f 15.19000 0.3714000 15.33000 0.4946000 15.04000 0.5543000 0.2844000      0.7428000 
1 1 1 4  54 24 o 12.35000 0.4454000 12.96000 0.6338000 11.74000 0.6259000 1.225000       0.8908000 
1 1 1 4  54 26 o 10.80000 0.4714000 11.01000 0.6537000 10.58000 0.6794000 0.4337000      0.9428000 
1 1 1 4  54 28 o 2.944000 0.8594000 3.402000 1.287000  2.486000 1.140000  0.9162000      1.719000  
1 1 1 4  54 30 o 5.745000 0.8196000 7.282000 0.8986000 4.207000 1.371000  3.075000       1.639000  
1 1 1 4  54 32 o 5.088000 0.9778000 5.813000 1.254000  4.362000 1.501000  1.452000       1.956000  
1 1 1 4  54 34 o 5.323000 0.8966000 6.775000 1.178000  3.872000 1.352000  2.903000       1.793000  
1 1 1 4  55 1  o 4.401000 0.9510000 3.850000 1.370000  4.953000 1.320000  -1.102000      1.902000  
1 1 1 4  55 3  o 5.419000 0.8084000 6.575000 0.9267000 4.263000 1.325000  2.312000       1.617000  
1 1 1 4  55 5  o 15.43000 0.3814000 15.10000 0.5071000 15.75000 0.5699000 -0.6526000     0.7628000 
1 1 1 4  55 7  o 14.74000 0.4157000 14.26000 0.6065000 15.23000 0.5688000 -0.9653000     0.8315000 
1 1 1 4  55 9  o 5.488000 0.7642000 6.007000 0.9117000 4.968000 1.227000  1.039000       1.528000  
1 1 1 4  55 11 o 11.41000 0.4935000 11.17000 0.5423000 11.64000 0.8246000 -0.4654000     0.9870000 
1 1 1 4  55 13 o 4.432000 0.8485000 3.631000 1.181000  5.233000 1.218000  -1.602000      1.697000  
1 1 1 4  55 15 o 4.730000 0.8846000 3.965000 1.299000  5.495000 1.201000  -1.531000      1.769000  
1 1 1 4  55 17 o 4.219000 0.9327000 4.126000 1.318000  4.311000 1.321000  -0.1853000     1.865000  
1 1 1 4  55 19 o 4.072000 0.9105000 3.745000 1.236000  4.400000 1.337000  -0.6545000     1.821000  
1 1 1 4  55 21 o 8.917000 0.5510000 8.831000 0.8454000 9.004000 0.7068000 -0.1730000     1.102000  
1 1 1 4  55 23 o 11.41000 0.4627000 11.43000 0.6797000 11.40000 0.6281000 0.3497000E-01  0.9255000 
1 1 1 4  55 25 o 4.056000 0.9341000 3.844000 1.302000  4.268000 1.340000  -0.4239000     1.868000  
1 1 1 4  55 27 o 6.344000 0.7741000 6.358000 1.072000  6.331000 1.118000  0.2691000E-01  1.548000  
1 1 1 4  55 29 o 4.697000 0.9022000 3.767000 1.293000  5.627000 1.258000  -1.861000      1.804000  
1 1 1 4  55 31 o 3.883000 0.9940000 4.098000 1.350000  3.668000 1.459000  0.4300000      1.988000  
1 1 1 4  55 33 o 4.682000 1.332000  5.866000 2.178000  3.498000 1.534000  2.367000       2.664000  
1 1 1 4  56 0  o 7.625000 1.063000  7.625000 1.063000  7.625000 1.063000  0.000000       0.000000  
1 1 1 4  56 2  o 10.22000 0.4826000 10.70000 0.6629000 9.738000 0.7016000 0.9620000      0.9652000 
1 1 1 4  56 4  o 9.466000 0.5729000 9.030000 0.8842000 9.902000 0.7289000 -0.8720000     1.146000  
1 1 1 4  56 6  o 10.52000 0.4430000 10.28000 0.6256000 10.76000 0.6274000 -0.4836000     0.8860000 
1 1 1 4  56 8  o 7.108000 0.7954000 8.418000 0.6350000 5.798000 1.459000  2.620000       1.591000  
1 1 1 4  56 10 o 11.26000 0.4410000 10.77000 0.5746000 11.75000 0.6691000 -0.9833000     0.8820000 
1 1 1 4  56 12 o 11.24000 0.4382000 11.80000 0.5672000 10.68000 0.6681000 1.127000       0.8764000 
1 1 1 4  56 14 o 5.989000 0.7501000 7.019000 0.8616000 4.958000 1.228000  2.061000       1.500000  
1 1 1 4  56 16 f 8.235000 0.5478000 7.794000 0.7275000 8.676000 0.8192000 -0.8817000     1.096000  
1 1 1 4  56 18 o 5.358000 0.8649000 5.029000 1.234000  5.688000 1.212000  -0.6586000     1.730000  
1 1 1 4  56 20 o 3.447000 0.8253000 2.161000 0.9882000 4.733000 1.322000  -2.573000      1.651000  
1 1 1 4  56 22 o 3.486000 0.9544000 4.104000 1.463000  2.867000 1.226000  1.237000       1.909000  
1 1 1 4  56 24 o 3.976000 0.9814000 4.285000 1.433000  3.667000 1.341000  0.6178000      1.963000  
1 1 1 4  56 26 o 4.185000 0.9459000 3.143000 1.323000  5.228000 1.352000  -2.086000      1.892000  
1 1 1 4  56 28 o 5.076000 0.8885000 4.639000 1.295000  5.514000 1.217000  -0.8751000     1.777000  
1 1 1 4  56 30 o 2.920000 0.9034000 2.301000 1.065000  3.539000 1.460000  -1.237000      1.807000  
1 1 1 4  57 1  o 3.462000 0.8487000 2.504000 1.137000  4.419000 1.260000  -1.915000      1.697000  
1 1 1 4  57 3  o 5.845000 0.9227000 6.485000 0.9340000 5.205000 1.592000  1.281000       1.845000  
1 1 1 4  57 5  o 14.41000 0.4010000 14.42000 0.5135000 14.39000 0.6160000 0.2784000E-01  0.8020000 
1 1 1 4  57 7  f 13.76000 0.4442000 13.89000 0.4924000 13.64000 0.7394000 0.2452000      0.8884000 
1 1 1 4  57 9  f 9.796000 0.4752000 9.459000 0.6184000 10.13000 0.7217000 -0.6740000     0.9504000 
1 1 1 4  57 11 o 9.106000 0.5510000 8.868000 0.7622000 9.345000 0.7957000 -0.4769000     1.102000  
1 1 1 4  57 13 o 3.924000 0.8295000 4.818000 1.096000  3.031000 1.245000  1.787000       1.659000  
1 1 1 4  57 15 o 8.372000 0.5283000 8.387000 0.6636000 8.357000 0.8222000 0.3054000E-01  1.057000  
1 1 1 4  57 17 o 7.483000 0.6478000 7.420000 0.8958000 7.545000 0.9359000 -0.1252000     1.296000  
1 1 1 4  57 19 o 8.161000 0.5866000 8.250000 0.7472000 8.073000 0.9044000 0.1774000      1.173000  
1 1 1 4  57 21 o 4.347000 0.9250000 3.423000 1.390000  5.270000 1.220000  -1.847000      1.850000  
1 1 1 4  57 23 o 4.724000 0.8795000 5.688000 1.092000  3.760000 1.379000  1.927000       1.759000  
1 1 1 4  57 25 o 4.134000 0.8937000 5.274000 1.233000  2.994000 1.294000  2.279000       1.787000  
1 1 1 4  57 27 o 3.813000 0.9495000 3.917000 1.292000  3.709000 1.392000  0.2082000      1.899000  
1 1 1 4  57 29 o 5.849000 1.495000  6.212000 2.164000  5.487000 2.063000  0.7253000      2.990000  
1 1 1 4  58 0  o 5.986000 0.9850000 5.986000 0.9850000 5.986000 0.9850000 0.000000       0.000000  
1 1 1 4  58 2  o 5.665000 0.8801000 5.194000 1.250000  6.136000 1.239000  -0.9414000     1.760000  
1 1 1 4  58 4  o 6.457000 0.8743000 6.802000 0.9285000 6.113000 1.482000  0.6886000      1.749000  
1 1 1 4  58 6  o 5.722000 0.7200000 6.661000 0.8142000 4.783000 1.188000  1.877000       1.440000  
1 1 1 4  58 8  o 3.708000 0.8754000 4.233000 1.195000  3.184000 1.280000  1.049000       1.751000  
1 1 1 4  58 10 o 3.572000 0.9196000 3.642000 1.279000  3.501000 1.322000  0.1413000      1.839000  
1 1 1 4  58 12 o 8.009000 0.5925000 7.799000 0.7485000 8.219000 0.9186000 -0.4205000     1.185000  
1 1 1 4  58 14 o 6.614000 0.6637000 6.308000 0.8647000 6.921000 1.007000  -0.6135000     1.327000  
1 1 1 4  58 16 o 8.770000 0.5790000 8.070000 0.7997000 9.470000 0.8375000 -1.400000      1.158000  
1 1 1 4  58 18 o 7.342000 0.6823000 7.975000 0.7379000 6.710000 1.148000  1.265000       1.365000  
1 1 1 4  58 20 o 13.68000 0.4700000 13.34000 0.6623000 14.02000 0.6671000 -0.6821000     0.9400000 
1 1 1 4  58 22 o 3.353000 0.9079000 3.117000 1.261000  3.588000 1.306000  -0.4710000     1.816000  
1 1 1 4  58 24 o 5.005000 0.8954000 5.179000 1.165000  4.831000 1.360000  0.3486000      1.791000  
1 1 1 4  58 26 o 3.749000 1.011000  4.310000 1.565000  3.187000 1.281000  1.122000       2.022000  
1 1 1 4  59 1  f 6.922000 0.7855000 6.784000 0.9480000 7.059000 1.253000  -0.2753000     1.571000  
1 1 1 4  59 3  o 2.601000 0.8072000 2.429000 1.094000  2.772000 1.187000  -0.3431000     1.614000  
1 1 1 4  59 5  o 4.370000 0.9305000 4.024000 1.294000  4.717000 1.337000  -0.6933000     1.861000  
1 1 1 4  59 7  o 8.522000 1.058000  9.957000 0.6691000 7.086000 2.007000  2.871000       2.116000  
1 1 1 4  59 9  o 4.498000 0.9275000 4.574000 1.227000  4.423000 1.391000  0.1514000      1.855000  
1 1 1 4  59 11 o 4.153000 0.9262000 4.092000 1.229000  4.215000 1.386000  -0.1231000     1.852000  
1 1 1 4  59 13 o 9.297000 0.5348000 8.691000 0.6779000 9.903000 0.8274000 -1.212000      1.070000  
1 1 1 4  59 15 o 4.966000 0.8479000 4.747000 1.185000  5.185000 1.213000  -0.4380000     1.696000  
1 1 1 4  59 17 o 4.863000 0.9004000 5.053000 1.108000  4.673000 1.420000  0.3804000      1.801000  
1 1 1 4  59 19 o 7.734000 0.7365000 9.544000 0.6671000 5.924000 1.313000  3.621000       1.473000  
1 1 1 4  59 21 o 7.527000 0.6739000 8.762000 0.7504000 6.292000 1.120000  2.470000       1.348000  
1 1 1 4  59 23 o 3.515000 0.9310000 3.209000 1.271000  3.820000 1.360000  -0.6112000     1.862000  
1 1 1 4  60 0  o 4.212000 1.372000  4.212000 1.372000  4.212000 1.372000  0.000000       0.000000  
1 1 1 4  60 2  o 6.748000 0.8034000 7.654000 1.212000  5.843000 1.055000  1.811000       1.607000  
1 1 1 4  60 4  o 7.281000 0.6323000 6.963000 0.9529000 7.600000 0.8314000 -0.6374000     1.265000  
1 1 1 4  60 6  o 3.608000 0.8677000 4.530000 1.257000  2.685000 1.196000  1.846000       1.735000  
1 1 1 4  60 8  o 4.239000 1.025000  4.148000 1.237000  4.329000 1.636000  -0.1805000     2.051000  
1 1 1 4  60 10 o 6.246000 0.9120000 5.788000 0.9927000 6.704000 1.530000  -0.9166000     1.824000  
1 1 1 4  60 12 f 8.402000 0.6090000 8.391000 0.6787000 8.413000 1.011000  -0.2176000E-01 1.218000  
1 1 1 4  60 14 o 2.723000 0.8563000 3.039000 1.282000  2.407000 1.135000  0.6325000      1.713000  
1 1 1 4  60 16 o 4.933000 0.8770000 3.900000 1.172000  5.966000 1.305000  -2.067000      1.754000  
1 1 1 4  60 18 o 5.878000 0.8286000 4.472000 1.302000  7.283000 1.025000  -2.810000      1.657000  
1 1 1 4  60 20 o 6.945000 0.7719000 6.913000 1.130000  6.976000 1.052000  -0.6330000E-01 1.544000  
1 1 1 4  61 1  o 5.375000 0.8116000 4.909000 1.236000  5.842000 1.052000  -0.9330000     1.623000  
1 1 1 4  61 3  o 3.899000 0.9717000 3.909000 1.461000  3.888000 1.281000  0.2117000E-01  1.943000  
1 1 1 4  61 5  o 4.315000 0.9371000 4.945000 1.259000  3.686000 1.388000  1.259000       1.874000  
1 1 1 4  61 7  o 9.394000 0.5519000 9.281000 0.7879000 9.506000 0.7731000 -0.2254000     1.104000  
1 1 1 4  61 9  o 7.945000 0.6075000 7.685000 0.7293000 8.206000 0.9717000 -0.5209000     1.215000  
1 1 1 4  61 11 o 4.801000 1.042000  4.131000 1.211000  5.470000 1.697000  -1.339000      2.084000  
1 1 1 4  61 13 o 4.879000 1.043000  3.806000 1.260000  5.952000 1.662000  -2.146000      2.086000  
1 1 1 4  61 15 o 4.500000 0.8275000 3.068000 1.186000  5.932000 1.154000  -2.864000      1.655000  
1 1 1 4  62 0  o 11.47000 0.6952000 11.47000 0.6952000 11.47000 0.6952000 0.000000       0.000000  
1 1 1 4  62 2  o 8.447000 0.5983000 9.049000 0.8543000 7.845000 0.8380000 1.204000       1.197000  
1 1 1 4  62 4  o 4.255000 0.8785000 4.807000 1.103000  3.703000 1.368000  1.105000       1.757000  
1 1 1 4  62 6  o 5.147000 0.8869000 5.343000 1.149000  4.950000 1.352000  0.3929000      1.774000  
1 1 1 4  62 8  o 3.873000 0.9342000 4.262000 1.265000  3.485000 1.375000  0.7763000      1.868000  
1 1 1 4  62 10 o 8.157000 0.6083000 7.805000 0.7767000 8.508000 0.9365000 -0.7030000     1.217000  
1 1 1 5  0  1  o 8.181000 0.1682000 8.181000 0.1682000 8.181000 0.1682000 0.000000       0.000000  
1 1 1 5  0  3  f 29.17000 0.2976000 29.17000 0.2976000 29.17000 0.2976000 0.000000       0.000000  
1 1 1 5  0  5  o 82.13000 0.7924000 82.13000 0.7924000 82.13000 0.7924000 0.000000       0.000000  
1 1 1 5  0  7  o 41.79000 0.4168000 41.79000 0.4168000 41.79000 0.4168000 0.000000       0.000000  
1 1 1 5  0  9  o 26.95000 0.2915000 26.95000 0.2915000 26.95000 0.2915000 0.000000       0.000000  
1 1 1 5  0  11 o 48.10000 0.5554000 48.10000 0.5554000 48.10000 0.5554000 0.000000       0.000000  
1 1 1 5  0  13 o 37.69000 0.4508000 37.69000 0.4508000 37.69000 0.4508000 0.000000       0.000000  
1 1 1 5  0  15 o 42.41000 0.5041000 42.41000 0.5041000 42.41000 0.5041000 0.000000       0.000000  
1 1 1 5  0  17 o 114.0000 1.272000  114.0000 1.272000  114.0000 1.272000  0.000000       0.000000  
1 1 1 5  0  19 f 142.4000 1.372000  142.4000 1.372000  142.4000 1.372000  0.000000       0.000000  
1 1 1 5  0  21 o 54.30000 0.5507000 54.30000 0.5507000 54.30000 0.5507000 0.000000       0.000000  
1 1 1 5  0  23 o 47.72000 0.4989000 47.72000 0.4989000 47.72000 0.4989000 0.000000       0.000000  
1 1 1 5  0  25 o 133.1000 1.487000  133.1000 1.487000  133.1000 1.487000  0.000000       0.000000  
1 1 1 5  0  27 o 33.85000 0.4169000 33.85000 0.4169000 33.85000 0.4169000 0.000000       0.000000  
1 1 1 5  0  29 o 55.97000 0.8224000 55.97000 0.8224000 55.97000 0.8224000 0.000000       0.000000  
1 1 1 5  0  31 o 51.94000 0.5535000 51.94000 0.5535000 51.94000 0.5535000 0.000000       0.000000  
1 1 1 5  0  33 o 28.81000 0.4253000 28.81000 0.4253000 28.81000 0.4253000 0.000000       0.000000  
1 1 1 5  0  35 o 11.74000 0.8864000 11.74000 0.8864000 11.74000 0.8864000 0.000000       0.000000  
1 1 1 5  0  37 f 48.28000 0.5335000 48.28000 0.5335000 48.28000 0.5335000 0.000000       0.000000  
1 1 1 5  0  39 o 37.42000 0.5413000 37.42000 0.5413000 37.42000 0.5413000 0.000000       0.000000  
1 1 1 5  0  41 o 24.20000 0.4450000 24.20000 0.4450000 24.20000 0.4450000 0.000000       0.000000  
1 1 1 5  0  43 f 27.43000 0.4533000 27.43000 0.4533000 27.43000 0.4533000 0.000000       0.000000  
1 1 1 5  0  45 o 45.69000 0.6225000 45.69000 0.6225000 45.69000 0.6225000 0.000000       0.000000  
1 1 1 5  0  47 o 37.69000 0.4947000 37.69000 0.4947000 37.69000 0.4947000 0.000000       0.000000  
1 1 1 5  0  49 o 27.28000 0.4686000 27.28000 0.4686000 27.28000 0.4686000 0.000000       0.000000  
1 1 1 5  0  51 o 5.532000 1.521000  5.532000 1.521000  5.532000 1.521000  0.000000       0.000000  
1 1 1 5  0  53 o 13.66000 0.6101000 13.66000 0.6101000 13.66000 0.6101000 0.000000       0.000000  
1 1 1 5  0  55 o 18.60000 0.5182000 18.60000 0.5182000 18.60000 0.5182000 0.000000       0.000000  
1 1 1 5  0  57 o 3.704000 1.490000  3.704000 1.490000  3.704000 1.490000  0.000000       0.000000  
1 1 1 5  0  59 o 3.147000 1.340000  3.147000 1.340000  3.147000 1.340000  0.000000       0.000000  
1 1 1 5  0  61 o 7.503000 1.032000  7.503000 1.032000  7.503000 1.032000  0.000000       0.000000  
1 1 1 5  0  63 o 6.224000 1.452000  6.224000 1.452000  6.224000 1.452000  0.000000       0.000000  
1 1 1 5  0  65 o 4.137000 1.517000  4.137000 1.517000  4.137000 1.517000  0.000000       0.000000  
1 1 1 5  0  67 o 5.987000 1.348000  5.987000 1.348000  5.987000 1.348000  0.000000       0.000000  
1 1 1 5  1  0  o 14.09000 0.1787000 14.09000 0.1787000 14.09000 0.1787000 0.000000       0.000000  
1 1 1 5  1  2  o 128.6000 0.8734000 127.4000 1.223000  129.8000 1.247000  -2.441000      1.747000  
1 1 1 5  1  4  o 39.48000 0.2766000 39.35000 0.3901000 39.61000 0.3923000 -0.2555000     0.5533000 
1 1 1 5  1  6  o 14.12000 0.1433000 14.25000 0.2016000 13.98000 0.2036000 0.2776000      0.2865000 
1 1 1 5  1  8  o 79.49000 0.5443000 79.02000 0.7651000 79.96000 0.7744000 -0.9340000     1.089000  
1 1 1 5  1  10 o 56.27000 0.4794000 56.50000 0.5559000 56.04000 0.7812000 0.4638000      0.9588000 
1 1 1 5  1  12 o 57.05000 0.3981000 57.79000 0.5693000 56.30000 0.5567000 1.483000       0.7963000 
1 1 1 5  1  14 o 20.25000 0.2447000 20.16000 0.3771000 20.34000 0.3120000 -0.1762000     0.4894000 
1 1 1 5  1  16 o 70.04000 0.4862000 70.14000 0.6883000 69.94000 0.6868000 0.2024000      0.9724000 
1 1 1 5  1  18 o 55.68000 0.4275000 56.08000 0.6503000 55.29000 0.5551000 0.7913000      0.8550000 
1 1 1 5  1  20 o 115.7000 0.7917000 115.0000 1.113000  116.3000 1.126000  -1.299000      1.583000  
1 1 1 5  1  22 o 122.1000 0.8358000 123.1000 1.192000  121.1000 1.172000  2.019000       1.672000  
1 1 1 5  1  24 o 49.75000 0.3681000 49.90000 0.5216000 49.60000 0.5194000 0.2988000      0.7361000 
1 1 1 5  1  26 f 45.72000 0.4467000 45.40000 0.6850000 46.05000 0.5734000 -0.6477000     0.8934000 
1 1 1 5  1  28 o 62.61000 0.4871000 63.20000 0.7402000 62.01000 0.6335000 1.191000       0.9743000 
1 1 1 5  1  30 o 67.09000 0.4813000 67.46000 0.6831000 66.72000 0.6781000 0.7471000      0.9625000 
1 1 1 5  1  32 o 53.13000 0.4639000 53.60000 0.6614000 52.66000 0.6508000 0.9435000      0.9279000 
1 1 1 5  1  34 o 48.78000 0.3771000 48.95000 0.5349000 48.62000 0.5316000 0.3253000      0.7541000 
1 1 1 5  1  36 o 33.01000 0.3380000 32.88000 0.4439000 33.14000 0.5099000 -0.2532000     0.6761000 
1 1 1 5  1  38 f 20.32000 0.3219000 20.34000 0.4556000 20.31000 0.4549000 0.3899000E-01  0.6438000 
1 1 1 5  1  40 o 8.992000 0.5854000 8.867000 0.8492000 9.118000 0.8061000 -0.2505000     1.171000  
1 1 1 5  1  42 o 3.864000 1.106000  3.461000 1.507000  4.266000 1.619000  -0.8044000     2.212000  
1 1 1 5  1  44 o 23.12000 0.3350000 22.70000 0.4686000 23.53000 0.4790000 -0.8360000     0.6700000 
1 1 1 5  1  46 o 13.45000 0.4760000 12.89000 0.6808000 14.01000 0.6654000 -1.119000      0.9520000 
1 1 1 5  1  48 o 24.47000 0.3391000 24.42000 0.4826000 24.52000 0.4765000 -0.1016000     0.6782000 
1 1 1 5  1  50 o 13.06000 0.4775000 12.51000 0.7043000 13.60000 0.6450000 -1.089000      0.9551000 
1 1 1 5  1  52 o 13.55000 0.4369000 14.00000 0.5987000 13.09000 0.6364000 0.9150000      0.8737000 
1 1 1 5  1  54 o 3.600000 1.044000  3.886000 1.501000  3.313000 1.450000  0.5734000      2.087000  
1 1 1 5  1  56 o 10.73000 0.6494000 11.67000 0.8480000 9.800000 0.9838000 1.868000       1.299000  
1 1 1 5  1  58 o 8.625000 0.6520000 8.340000 0.9641000 8.910000 0.8780000 -0.5700000     1.304000  
1 1 1 5  1  60 o 8.943000 0.6193000 8.772000 0.8652000 9.114000 0.8863000 -0.3419000     1.239000  
1 1 1 5  1  62 o 8.883000 0.6990000 8.529000 1.051000  9.236000 0.9217000 -0.7071000     1.398000  
1 1 1 5  1  64 o 3.042000 0.9513000 2.863000 1.322000  3.222000 1.369000  -0.3587000     1.903000  
1 1 1 5  1  66 o 4.602000 1.008000  3.856000 1.517000  5.347000 1.327000  -1.491000      2.015000  
1 1 1 5  2  1  o 75.30000 0.5140000 74.69000 0.7209000 75.91000 0.7328000 -1.223000      1.028000  
1 1 1 5  2  3  o 111.5000 0.7578000 112.0000 1.076000  111.1000 1.067000  0.8973000      1.516000  
1 1 1 5  2  5  o 123.7000 0.8399000 123.5000 1.186000  123.8000 1.189000  -0.2980000     1.680000  
1 1 1 5  2  7  o 29.63000 0.2189000 29.93000 0.3119000 29.33000 0.3072000 0.5928000      0.4377000 
1 1 1 5  2  9  o 31.88000 0.2438000 31.87000 0.2977000 31.89000 0.3861000 -0.2569000E-01 0.4876000 
1 1 1 5  2  11 o 58.30000 0.4816000 58.02000 0.5099000 58.59000 0.8172000 -0.5781000     0.9633000 
1 1 1 5  2  13 o 85.87000 0.6366000 85.97000 0.9627000 85.77000 0.8331000 0.2037000      1.273000  
1 1 1 5  2  15 o 71.02000 0.5312000 71.24000 0.8043000 70.81000 0.6943000 0.4248000      1.062000  
1 1 1 5  2  17 o 43.50000 0.3419000 43.25000 0.5115000 43.74000 0.4540000 -0.4877000     0.6839000 
1 1 1 5  2  19 o 59.49000 0.4546000 59.39000 0.6873000 59.59000 0.5952000 -0.2009000     0.9092000 
1 1 1 5  2  21 o 116.8000 0.7994000 116.6000 1.129000  116.9000 1.132000  -0.3015000     1.599000  
1 1 1 5  2  23 o 90.49000 0.6256000 90.49000 0.8850000 90.49000 0.8846000 0.1221000E-02  1.251000  
1 1 1 5  2  25 o 95.42000 0.7131000 95.61000 0.9347000 95.24000 1.077000  0.3765000      1.426000  
1 1 1 5  2  27 o 78.19000 0.5489000 78.37000 0.7778000 78.01000 0.7746000 0.3617000      1.098000  
1 1 1 5  2  29 o 70.86000 0.6506000 70.63000 0.8205000 71.09000 1.010000  -0.4595000     1.301000  
1 1 1 5  2  31 o 22.65000 0.3957000 22.81000 0.5014000 22.50000 0.6123000 0.3110000      0.7914000 
1 1 1 5  2  33 o 67.17000 0.5234000 66.02000 0.7840000 68.31000 0.6936000 -2.294000      1.047000  
1 1 1 5  2  35 o 33.97000 0.3080000 33.75000 0.4331000 34.18000 0.4381000 -0.4318000     0.6160000 
1 1 1 5  2  37 o 20.16000 0.3128000 20.16000 0.4449000 20.15000 0.4399000 0.2657000E-02  0.6256000 
1 1 1 5  2  39 o 36.87000 0.4610000 36.98000 0.6386000 36.75000 0.6650000 0.2304000      0.9220000 
1 1 1 5  2  41 o 34.40000 0.3901000 34.29000 0.6298000 34.52000 0.4603000 -0.2299000     0.7801000 
1 1 1 5  2  43 o 30.81000 0.3497000 31.13000 0.4617000 30.49000 0.5254000 0.6411000      0.6994000 
1 1 1 5  2  45 o 22.53000 0.3458000 22.33000 0.4869000 22.73000 0.4911000 -0.4058000     0.6916000 
1 1 1 5  2  47 o 34.67000 0.3367000 34.23000 0.4756000 35.12000 0.4767000 -0.8903000     0.6734000 
1 1 1 5  2  49 o 18.44000 0.3862000 18.37000 0.5541000 18.51000 0.5382000 -0.1400000     0.7725000 
1 1 1 5  2  51 o 8.858000 0.7661000 8.996000 1.067000  8.720000 1.099000  0.2761000      1.532000  
1 1 1 5  2  53 o 14.88000 0.5267000 14.55000 0.8199000 15.22000 0.6615000 -0.6642000     1.053000  
1 1 1 5  2  55 o 5.923000 0.8984000 5.031000 1.415000  6.815000 1.107000  -1.784000      1.797000  
1 1 1 5  2  57 o 16.03000 0.4264000 16.14000 0.6554000 15.93000 0.5456000 0.2088000      0.8528000 
1 1 1 5  2  59 o 11.57000 0.5041000 11.12000 0.7300000 12.02000 0.6953000 -0.9036000     1.008000  
1 1 1 5  2  61 o 6.127000 1.030000  6.149000 1.469000  6.105000 1.445000  0.4393000E-01  2.061000  
1 1 1 5  2  63 o 4.781000 1.035000  5.546000 1.415000  4.016000 1.512000  1.530000       2.071000  
1 1 1 5  2  65 o 4.347000 1.117000  3.633000 1.426000  5.061000 1.719000  -1.428000      2.233000  
1 1 1 5  2  67 o 3.950000 1.059000  4.082000 1.523000  3.817000 1.472000  0.2647000      2.118000  
1 1 1 5  3  0  o 73.66000 0.7113000 73.66000 0.7113000 73.66000 0.7113000 0.000000       0.000000  
1 1 1 5  3  2  o 19.46000 0.1526000 19.34000 0.2145000 19.59000 0.2171000 -0.2480000     0.3052000 
1 1 1 5  3  4  o 93.86000 0.6393000 93.79000 0.9038000 93.93000 0.9044000 -0.1404000     1.279000  
1 1 1 5  3  6  o 27.33000 0.2036000 27.32000 0.2879000 27.35000 0.2879000 -0.2630000E-01 0.4072000 
1 1 1 5  3  8  o 34.00000 0.2553000 34.16000 0.3130000 33.84000 0.4033000 0.3238000      0.5105000 
1 1 1 5  3  10 o 37.75000 0.3362000 37.68000 0.3836000 37.82000 0.5523000 -0.1471000     0.6725000 
1 1 1 5  3  12 o 21.96000 0.2447000 22.31000 0.3143000 21.61000 0.3751000 0.7065000      0.4894000 
1 1 1 5  3  14 o 77.11000 0.6516000 77.50000 1.066000  76.73000 0.7500000 0.7665000      1.303000  
1 1 1 5  3  16 o 19.60000 0.2579000 19.98000 0.3993000 19.23000 0.3264000 0.7570000      0.5157000 
1 1 1 5  3  18 o 79.73000 0.5685000 79.71000 0.8970000 79.75000 0.6986000 -0.3431000E-01 1.137000  
1 1 1 5  3  20 o 115.9000 0.7935000 114.8000 1.111000  117.0000 1.133000  -2.249000      1.587000  
1 1 1 5  3  22 o 27.62000 0.3217000 27.14000 0.4964000 28.09000 0.4093000 -0.9554000     0.6434000 
1 1 1 5  3  24 o 40.40000 0.3426000 40.20000 0.4465000 40.61000 0.5198000 -0.4135000     0.6853000 
1 1 1 5  3  26 o 51.23000 0.4115000 50.80000 0.6177000 51.65000 0.5439000 -0.8556000     0.8231000 
1 1 1 5  3  28 f 26.45000 0.3554000 25.67000 0.5872000 27.23000 0.4007000 -1.557000      0.7109000 
1 1 1 5  3  30 o 61.45000 0.5463000 60.95000 0.6252000 61.95000 0.8960000 -0.9955000     1.093000  
1 1 1 5  3  32 f 25.76000 0.2965000 25.66000 0.4237000 25.85000 0.4148000 -0.1974000     0.5930000 
1 1 1 5  3  34 o 48.57000 0.3756000 47.83000 0.5248000 49.31000 0.5376000 -1.483000      0.7512000 
1 1 1 5  3  36 o 9.281000 0.5329000 8.995000 0.7547000 9.568000 0.7524000 -0.5736000     1.066000  
1 1 1 5  3  38 o 35.87000 0.3190000 36.71000 0.4550000 35.03000 0.4471000 1.677000       0.6379000 
1 1 1 5  3  40 f 50.79000 0.4551000 50.11000 0.6362000 51.48000 0.6510000 -1.373000      0.9102000 
1 1 1 5  3  42 o 37.36000 0.3907000 36.87000 0.5498000 37.86000 0.5553000 -0.9908000     0.7815000 
1 1 1 5  3  44 o 12.84000 0.5322000 12.71000 0.6809000 12.97000 0.8182000 -0.2534000     1.064000  
1 1 1 5  3  46 o 8.584000 0.7576000 8.668000 1.155000  8.500000 0.9805000 0.1681000      1.515000  
1 1 1 5  3  48 o 24.77000 0.3370000 24.79000 0.4748000 24.75000 0.4784000 0.3717000E-01  0.6740000 
1 1 1 5  3  50 o 20.46000 0.3548000 20.52000 0.5036000 20.40000 0.4999000 0.1204000      0.7096000 
1 1 1 5  3  52 o 16.93000 0.4371000 16.55000 0.6268000 17.30000 0.6094000 -0.7455000     0.8742000 
1 1 1 5  3  54 o 14.53000 0.4459000 14.79000 0.5940000 14.28000 0.6653000 0.5084000      0.8918000 
1 1 1 5  3  56 o 15.38000 0.4012000 16.10000 0.5358000 14.65000 0.5972000 1.444000       0.8023000 
1 1 1 5  3  58 o 16.21000 0.3969000 16.44000 0.5587000 15.97000 0.5640000 0.4690000      0.7938000 
1 1 1 5  3  60 o 11.58000 0.5032000 11.57000 0.7257000 11.59000 0.6972000 -0.1455000E-01 1.006000  
1 1 1 5  3  62 o 4.379000 1.129000  4.133000 1.673000  4.625000 1.515000  -0.4915000     2.257000  
1 1 1 5  3  64 o 4.503000 1.141000  4.473000 1.551000  4.533000 1.674000  -0.6004000E-01 2.282000  
1 1 1 5  3  66 o 8.369000 0.6773000 8.059000 0.9927000 8.678000 0.9218000 -0.6187000     1.355000  
1 1 1 5  4  1  o 34.89000 0.2460000 34.96000 0.3485000 34.83000 0.3473000 0.1367000      0.4920000 
1 1 1 5  4  3  o 39.09000 0.2740000 38.98000 0.3862000 39.21000 0.3887000 -0.2291000     0.5480000 
1 1 1 5  4  5  o 49.00000 0.3402000 48.96000 0.4810000 49.05000 0.4811000 -0.8462000E-01 0.6803000 
1 1 1 5  4  7  o 79.26000 0.5602000 79.47000 0.6878000 79.05000 0.8845000 0.4183000      1.120000  
1 1 1 5  4  9  f 47.77000 0.3624000 48.11000 0.4761000 47.43000 0.5464000 0.6791000      0.7247000 
1 1 1 5  4  11 o 46.24000 0.3531000 46.28000 0.4631000 46.19000 0.5333000 0.9022000E-01  0.7063000 
1 1 1 5  4  13 o 66.79000 0.4768000 66.53000 0.7499000 67.06000 0.5889000 -0.5277000     0.9535000 
1 1 1 5  4  15 o 24.61000 0.2711000 24.46000 0.3351000 24.76000 0.4263000 -0.3030000     0.5423000 
1 1 1 5  4  17 o 57.04000 0.4144000 56.94000 0.6525000 57.14000 0.5111000 -0.1931000     0.8289000 
1 1 1 5  4  19 f 24.70000 0.2699000 25.34000 0.4589000 24.05000 0.2843000 1.287000       0.5398000 
1 1 1 5  4  21 o 37.16000 0.2890000 37.18000 0.4081000 37.14000 0.4095000 0.4010000E-01  0.5781000 
1 1 1 5  4  23 o 89.20000 0.6182000 89.79000 0.8787000 88.60000 0.8697000 1.186000       1.236000  
1 1 1 5  4  25 o 53.34000 0.4244000 53.06000 0.5524000 53.63000 0.6446000 -0.5684000     0.8489000 
1 1 1 5  4  27 o 39.15000 0.4105000 38.83000 0.6316000 39.48000 0.5246000 -0.6420000     0.8210000 
1 1 1 5  4  29 o 56.18000 0.5363000 55.93000 0.6760000 56.42000 0.8328000 -0.4971000     1.073000  
1 1 1 5  4  31 o 8.079000 0.5547000 8.272000 0.7688000 7.887000 0.8000000 0.3841000      1.109000  
1 1 1 5  4  33 o 85.05000 0.6438000 84.54000 0.9693000 85.57000 0.8475000 -1.035000      1.288000  
1 1 1 5  4  35 o 38.60000 0.3276000 37.94000 0.4584000 39.25000 0.4680000 -1.310000      0.6551000 
1 1 1 5  4  37 o 24.49000 0.3007000 24.81000 0.4158000 24.16000 0.4343000 0.6514000      0.6013000 
1 1 1 5  4  39 o 4.584000 0.9443000 4.915000 1.269000  4.254000 1.399000  0.6612000      1.889000  
1 1 1 5  4  41 o 14.75000 0.4841000 14.54000 0.7723000 14.95000 0.5839000 -0.4061000     0.9682000 
1 1 1 5  4  43 o 18.01000 0.5789000 16.88000 0.6221000 19.14000 0.9766000 -2.258000      1.158000  
1 1 1 5  4  45 o 16.23000 0.4149000 16.75000 0.5847000 15.71000 0.5887000 1.048000       0.8297000 
1 1 1 5  4  47 o 26.77000 0.3404000 27.20000 0.4806000 26.33000 0.4821000 0.8658000      0.6807000 
1 1 1 5  4  49 o 15.62000 0.4470000 15.33000 0.6152000 15.91000 0.6488000 -0.5836000     0.8941000 
1 1 1 5  4  51 o 13.82000 0.4499000 13.26000 0.6635000 14.38000 0.6079000 -1.124000      0.8999000 
1 1 1 5  4  53 o 7.230000 0.9356000 6.037000 1.659000  8.423000 0.8660000 -2.386000      1.871000  
1 1 1 5  4  55 o 9.886000 0.7862000 10.99000 0.7091000 8.780000 1.403000  2.213000       1.572000  
1 1 1 5  4  57 o 10.04000 0.5471000 9.010000 0.8325000 11.07000 0.7101000 -2.056000      1.094000  
1 1 1 5  4  59 o 8.154000 0.6799000 7.846000 1.000000  8.462000 0.9215000 -0.6166000     1.360000  
1 1 1 5  4  61 f 7.485000 0.8121000 6.929000 1.178000  8.041000 1.118000  -1.111000      1.624000  
1 1 1 5  4  63 o 3.324000 1.010000  3.950000 1.579000  2.699000 1.259000  1.250000       2.019000  
1 1 1 5  4  65 o 7.970000 1.327000  6.265000 1.450000  9.675000 2.222000  -3.410000      2.653000  
1 1 1 5  4  67 o 8.477000 0.7283000 8.402000 1.149000  8.552000 0.8952000 -0.1503000     1.457000  
1 1 1 5  5  0  o 19.80000 0.2191000 19.80000 0.2191000 19.80000 0.2191000 0.000000       0.000000  
1 1 1 5  5  2  o 87.78000 0.6474000 86.85000 0.8373000 88.72000 0.9878000 -1.875000      1.295000  
1 1 1 5  5  4  f 67.52000 0.4999000 68.10000 0.6599000 66.94000 0.7511000 1.157000       0.9998000 
1 1 1 5  5  6  o 122.9000 0.8627000 122.9000 1.057000  122.8000 1.364000  0.9264000E-01  1.725000  
1 1 1 5  5  8  o 76.64000 0.5678000 76.85000 0.7446000 76.43000 0.8574000 0.4193000      1.136000  
1 1 1 5  5  10 o 59.71000 0.5064000 59.85000 0.5870000 59.57000 0.8253000 0.2865000      1.013000  
1 1 1 5  5  12 o 22.36000 0.1923000 22.54000 0.2711000 22.18000 0.2729000 0.3600000      0.3847000 
1 1 1 5  5  14 o 50.76000 0.4622000 50.90000 0.7144000 50.61000 0.5867000 0.2921000      0.9244000 
1 1 1 5  5  16 o 39.12000 0.3122000 38.90000 0.4656000 39.34000 0.4161000 -0.4351000     0.6244000 
1 1 1 5  5  18 f 123.5000 0.8693000 122.8000 1.368000  124.2000 1.074000  -1.360000      1.739000  
1 1 1 5  5  20 o 24.87000 0.2773000 24.64000 0.4672000 25.10000 0.2990000 -0.4650000     0.5547000 
1 1 1 5  5  22 o 93.88000 0.6683000 94.09000 1.057000  93.67000 0.8183000 0.4204000      1.337000  
1 1 1 5  5  24 o 30.13000 0.3987000 29.96000 0.5769000 30.30000 0.5506000 -0.3345000     0.7975000 
1 1 1 5  5  26 o 14.16000 0.4000000 15.45000 0.6042000 12.86000 0.5245000 2.584000       0.8001000 
1 1 1 5  5  28 o 8.993000 0.5454000 8.601000 0.8345000 9.385000 0.7023000 -0.7836000     1.091000  
1 1 1 5  5  30 o 42.90000 0.5417000 42.63000 0.4833000 43.17000 0.9696000 -0.5418000     1.083000  
1 1 1 5  5  32 o 24.98000 0.3402000 24.43000 0.4826000 25.53000 0.4796000 -1.103000      0.6804000 
1 1 1 5  5  34 o 19.42000 0.3458000 18.96000 0.5370000 19.88000 0.4359000 -0.9169000     0.6917000 
1 1 1 5  5  36 o 10.04000 0.4861000 10.37000 0.6632000 9.714000 0.7107000 0.6550000      0.9721000 
1 1 1 5  5  38 o 9.852000 0.5455000 10.01000 0.6821000 9.698000 0.8515000 0.3083000      1.091000  
1 1 1 5  5  40 o 10.60000 0.6207000 9.848000 1.067000  11.35000 0.6344000 -1.499000      1.241000  
1 1 1 5  5  42 f 12.84000 0.4659000 13.09000 0.6349000 12.59000 0.6821000 0.5032000      0.9318000 
1 1 1 5  5  44 o 15.53000 0.5334000 16.18000 0.5774000 14.89000 0.8970000 1.289000       1.067000  
1 1 1 5  5  46 o 17.31000 0.4032000 17.19000 0.5678000 17.44000 0.5728000 -0.2514000     0.8065000 
1 1 1 5  5  48 o 5.757000 1.029000  4.074000 1.634000  7.440000 1.251000  -3.366000      2.058000  
1 1 1 5  5  50 o 9.150000 0.7227000 9.545000 0.8936000 8.755000 1.136000  0.7901000      1.445000  
1 1 1 5  5  52 o 18.85000 0.5376000 18.88000 0.9475000 18.82000 0.5081000 0.6352000E-01  1.075000  
1 1 1 5  5  54 o 11.20000 0.5344000 11.95000 0.6637000 10.45000 0.8378000 1.495000       1.069000  
1 1 1 5  5  56 o 17.66000 0.3761000 17.41000 0.5499000 17.91000 0.5131000 -0.5000000     0.7521000 
1 1 1 5  5  58 o 20.98000 0.3834000 21.06000 0.5655000 20.90000 0.5180000 0.1641000      0.7669000 
1 1 1 5  5  60 o 14.00000 0.4332000 14.95000 0.6029000 13.04000 0.6223000 1.911000       0.8664000 
1 1 1 5  5  62 o 5.914000 1.084000  5.299000 1.757000  6.529000 1.271000  -1.230000      2.168000  
1 1 1 5  5  64 o 9.495000 0.8413000 9.309000 0.9403000 9.680000 1.395000  -0.3709000     1.683000  
1 1 1 5  5  66 o 8.668000 0.7330000 9.164000 1.066000  8.172000 1.007000  0.9919000      1.466000  
1 1 1 5  6  1  o 111.2000 0.8169000 111.5000 1.072000  111.0000 1.232000  0.5198000      1.634000  
1 1 1 5  6  3  o 69.82000 0.5173000 69.86000 0.6772000 69.78000 0.7821000 0.8083000E-01  1.035000  
1 1 1 5  6  5  o 120.4000 0.8835000 121.8000 1.171000  119.0000 1.323000  2.764000       1.767000  
1 1 1 5  6  7  o 34.71000 0.2614000 34.37000 0.3122000 35.05000 0.4194000 -0.6795000     0.5229000 
1 1 1 5  6  9  o 46.18000 0.3750000 46.03000 0.5294000 46.33000 0.5313000 -0.3008000     0.7500000 
1 1 1 5  6  11 f 42.98000 0.3072000 42.97000 0.4340000 42.99000 0.4349000 -0.2666000E-01 0.6144000 
1 1 1 5  6  13 o 35.62000 0.3028000 35.70000 0.4256000 35.54000 0.4309000 0.1636000      0.6057000 
1 1 1 5  6  15 o 27.10000 0.2391000 26.68000 0.3494000 27.52000 0.3265000 -0.8399000     0.4782000 
1 1 1 5  6  17 o 101.8000 0.7520000 100.9000 1.127000  102.7000 0.9965000 -1.775000      1.504000  
1 1 1 5  6  19 o 80.17000 0.5724000 79.62000 0.8985000 80.72000 0.7094000 -1.094000      1.145000  
1 1 1 5  6  21 f 101.6000 0.7200000 101.4000 1.135000  101.8000 0.8861000 -0.4262000     1.440000  
1 1 1 5  6  23 o 42.78000 0.3516000 42.83000 0.5252000 42.73000 0.4676000 0.9751000E-01  0.7032000 
1 1 1 5  6  25 o 58.20000 0.4840000 57.82000 0.6776000 58.59000 0.6914000 -0.7677000     0.9681000 
1 1 1 5  6  27 o 70.25000 0.4990000 70.69000 0.7103000 69.81000 0.7010000 0.8838000      0.9980000 
1 1 1 5  6  29 o 73.40000 0.6399000 72.45000 0.7277000 74.35000 1.053000  -1.909000      1.280000  
1 1 1 5  6  31 o 9.119000 0.5925000 10.13000 0.6761000 8.106000 0.9731000 2.026000       1.185000  
1 1 1 5  6  33 o 36.67000 0.3173000 36.70000 0.4464000 36.64000 0.4510000 0.5846000E-01  0.6346000 
1 1 1 5  6  35 f 36.65000 0.3176000 37.20000 0.4533000 36.09000 0.4451000 1.113000       0.6353000 
1 1 1 5  6  37 o 44.28000 0.3538000 44.58000 0.5026000 43.97000 0.4982000 0.6133000      0.7076000 
1 1 1 5  6  39 o 45.01000 0.3611000 44.94000 0.5090000 45.08000 0.5122000 -0.1432000     0.7222000 
1 1 1 5  6  41 o 18.81000 0.3817000 19.30000 0.5593000 18.32000 0.5196000 0.9738000      0.7634000 
1 1 1 5  6  43 o 20.50000 0.4177000 19.86000 0.5003000 21.14000 0.6691000 -1.280000      0.8355000 
1 1 1 5  6  45 o 32.81000 0.3633000 32.40000 0.4741000 33.23000 0.5506000 -0.8290000     0.7266000 
1 1 1 5  6  47 o 7.178000 1.023000  7.462000 1.677000  6.893000 1.170000  0.5691000      2.045000  
1 1 1 5  6  49 o 14.78000 0.4339000 14.98000 0.6062000 14.59000 0.6208000 0.3976000      0.8677000 
1 1 1 5  6  51 o 36.88000 0.3483000 37.24000 0.4994000 36.51000 0.4857000 0.7391000      0.6966000 
1 1 1 5  6  53 f 11.25000 0.5146000 10.86000 0.7561000 11.64000 0.6984000 -0.7766000     1.029000  
1 1 1 5  6  55 o 7.113000 0.7663000 7.026000 1.116000  7.200000 1.051000  -0.1739000     1.533000  
1 1 1 5  6  57 o 6.519000 0.8008000 6.569000 1.116000  6.468000 1.149000  0.1002000      1.602000  
1 1 1 5  6  59 o 4.894000 1.053000  4.734000 1.550000  5.054000 1.425000  -0.3193000     2.105000  
1 1 1 5  6  61 o 18.41000 0.3868000 18.38000 0.5553000 18.45000 0.5386000 -0.7727000E-01 0.7736000 
1 1 1 5  6  63 o 6.276000 0.9173000 5.029000 1.491000  7.523000 1.070000  -2.494000      1.835000  
1 1 1 5  6  65 o 7.414000 0.8372000 7.663000 1.190000  7.166000 1.178000  0.4976000      1.674000  
1 1 1 5  6  67 f 5.220000 1.018000  5.193000 1.474000  5.247000 1.404000  -0.5419000E-01 2.036000  
1 1 1 5  7  0  o 109.4000 1.053000  109.4000 1.053000  109.4000 1.053000  0.000000       0.000000  
1 1 1 5  7  2  o 162.0000 1.188000  162.0000 1.556000  162.0000 1.796000  0.3954000E-01  2.376000  
1 1 1 5  7  4  o 58.01000 0.4643000 58.15000 0.6583000 57.86000 0.6550000 0.2923000      0.9286000 
1 1 1 5  7  6  o 5.095000 0.4587000 5.815000 0.2230000 4.375000 0.8900000 1.440000       0.9175000 
1 1 1 5  7  8  o 6.175000 0.2051000 6.122000 0.2764000 6.227000 0.3030000 -0.1049000     0.4101000 
1 1 1 5  7  10 o 31.00000 0.2516000 31.05000 0.3293000 30.95000 0.3804000 0.9495000E-01  0.5032000 
1 1 1 5  7  12 o 71.05000 0.5288000 70.89000 0.7963000 71.20000 0.6962000 -0.3143000     1.058000  
1 1 1 5  7  14 o 45.77000 0.3791000 45.67000 0.5343000 45.86000 0.5378000 -0.1890000     0.7581000 
1 1 1 5  7  16 o 33.00000 0.2617000 32.81000 0.4081000 33.19000 0.3278000 -0.3815000     0.5234000 
1 1 1 5  7  18 o 35.85000 0.2840000 36.01000 0.4454000 35.70000 0.3523000 0.3026000      0.5679000 
1 1 1 5  7  20 f 36.54000 0.3505000 36.43000 0.5678000 36.65000 0.4112000 -0.2247000     0.7011000 
1 1 1 5  7  22 o 54.64000 0.4057000 54.31000 0.6348000 54.97000 0.5055000 -0.6575000     0.8114000 
1 1 1 5  7  24 o 80.01000 0.6019000 79.63000 0.9036000 80.39000 0.7955000 -0.7630000     1.204000  
1 1 1 5  7  26 o 38.41000 0.3599000 37.90000 0.5975000 38.91000 0.4013000 -1.011000      0.7198000 
1 1 1 5  7  28 o 43.29000 0.3677000 42.84000 0.5501000 43.74000 0.4882000 -0.8976000     0.7354000 
1 1 1 5  7  30 o 55.39000 0.4436000 54.58000 0.5744000 56.21000 0.6762000 -1.632000      0.8872000 
1 1 1 5  7  32 o 33.56000 0.3293000 33.91000 0.4969000 33.21000 0.4323000 0.7010000      0.6586000 
1 1 1 5  7  34 o 14.46000 0.3943000 14.46000 0.5996000 14.45000 0.5123000 0.9745000E-02  0.7886000 
1 1 1 5  7  36 o 20.00000 0.3101000 20.14000 0.4450000 19.86000 0.4320000 0.2818000      0.6202000 
1 1 1 5  7  38 o 10.94000 0.4958000 10.72000 0.6441000 11.16000 0.7539000 -0.4368000     0.9916000 
1 1 1 5  7  40 o 34.68000 0.3500000 34.29000 0.5302000 35.06000 0.4570000 -0.7659000     0.7000000 
1 1 1 5  7  42 o 7.844000 0.8007000 7.476000 1.043000  8.212000 1.215000  -0.7364000     1.601000  
1 1 1 5  7  44 f 22.15000 0.4380000 21.76000 0.5740000 22.55000 0.6618000 -0.7862000     0.8760000 
1 1 1 5  7  46 o 13.07000 0.4942000 12.77000 0.7308000 13.37000 0.6654000 -0.6055000     0.9883000 
1 1 1 5  7  48 o 24.44000 0.3837000 24.14000 0.4969000 24.75000 0.5847000 -0.6128000     0.7673000 
1 1 1 5  7  50 o 34.70000 0.3664000 34.51000 0.4813000 34.89000 0.5525000 -0.3831000     0.7327000 
1 1 1 5  7  52 o 29.59000 0.4120000 29.80000 0.6776000 29.38000 0.4688000 0.4272000      0.8240000 
1 1 1 5  7  54 o 9.257000 0.7310000 9.493000 0.8372000 9.021000 1.199000  0.4720000      1.462000  
1 1 1 5  7  56 o 11.67000 0.5068000 11.79000 0.6564000 11.55000 0.7724000 0.2377000      1.014000  
1 1 1 5  7  58 o 13.24000 0.4795000 13.38000 0.7316000 13.10000 0.6201000 0.2861000      0.9590000 
1 1 1 5  7  60 o 8.167000 0.7075000 7.670000 1.021000  8.664000 0.9794000 -0.9944000     1.415000  
1 1 1 5  7  62 o 4.427000 1.237000  5.151000 2.034000  3.703000 1.408000  1.448000       2.473000  
1 1 1 5  7  64 o 4.365000 1.114000  5.028000 1.527000  3.702000 1.622000  1.326000       2.227000  
1 1 1 5  7  66 o 6.310000 0.9728000 7.844000 1.064000  4.775000 1.629000  3.069000       1.946000  
1 1 1 5  8  1  o 99.79000 0.6799000 100.8000 0.9714000 98.76000 0.9517000 2.048000       1.360000  
1 1 1 5  8  3  o 24.45000 0.2217000 24.01000 0.3082000 24.90000 0.3187000 -0.8971000     0.4433000 
1 1 1 5  8  5  o 44.56000 0.4446000 43.98000 0.6208000 45.15000 0.6367000 -1.166000      0.8893000 
1 1 1 5  8  7  o 39.10000 0.3009000 38.83000 0.4518000 39.36000 0.3977000 -0.5356000     0.6019000 
1 1 1 5  8  9  o 49.42000 0.3756000 48.97000 0.4866000 49.88000 0.5723000 -0.9106000     0.7512000 
1 1 1 5  8  11 o 34.88000 0.2771000 35.24000 0.4190000 34.53000 0.3627000 0.7150000      0.5542000 
1 1 1 5  8  13 o 46.11000 0.3804000 46.16000 0.5373000 46.07000 0.5386000 0.9040000E-01  0.7608000 
1 1 1 5  8  15 o 34.52000 0.2624000 34.54000 0.3700000 34.51000 0.3720000 0.3004000E-01  0.5247000 
1 1 1 5  8  17 o 91.87000 0.7724000 91.46000 1.255000  92.29000 0.9006000 -0.8374000     1.545000  
1 1 1 5  8  19 o 64.40000 0.4661000 64.20000 0.7319000 64.60000 0.5774000 -0.4029000     0.9323000 
1 1 1 5  8  21 o 64.54000 0.5368000 64.01000 0.9016000 65.07000 0.5827000 -1.063000      1.074000  
1 1 1 5  8  23 o 33.67000 0.2918000 33.93000 0.4566000 33.40000 0.3633000 0.5334000      0.5835000 
1 1 1 5  8  25 o 96.40000 0.8129000 96.01000 1.322000  96.78000 0.9462000 -0.7667000     1.626000  
1 1 1 5  8  27 o 26.97000 0.4414000 27.22000 0.7837000 26.73000 0.4065000 0.4926000      0.8828000 
1 1 1 5  8  29 o 116.4000 0.8639000 116.0000 1.301000  116.8000 1.137000  -0.7377000     1.728000  
1 1 1 5  8  31 o 72.49000 0.5563000 73.16000 0.7356000 71.81000 0.8348000 1.349000       1.113000  
1 1 1 5  8  33 o 25.48000 0.3201000 25.95000 0.4119000 25.01000 0.4902000 0.9427000      0.6403000 
1 1 1 5  8  35 f 25.10000 0.3271000 25.00000 0.5027000 25.20000 0.4186000 -0.2056000     0.6542000 
1 1 1 5  8  37 o 40.79000 0.3648000 40.75000 0.4773000 40.82000 0.5517000 -0.6742000E-01 0.7295000 
1 1 1 5  8  39 o 28.36000 0.3247000 28.45000 0.4858000 28.27000 0.4309000 0.1783000      0.6494000 
1 1 1 5  8  41 o 27.24000 0.3436000 27.50000 0.4464000 26.97000 0.5225000 0.5351000      0.6872000 
1 1 1 5  8  43 o 25.58000 0.3798000 25.14000 0.5431000 26.01000 0.5312000 -0.8644000     0.7597000 
1 1 1 5  8  45 o 24.49000 0.3601000 24.94000 0.4802000 24.04000 0.5366000 0.9021000      0.7201000 
1 1 1 5  8  47 o 3.800000 1.087000  4.101000 1.630000  3.498000 1.440000  0.6031000      2.175000  
1 1 1 5  8  49 o 22.34000 0.3792000 22.28000 0.5073000 22.39000 0.5638000 -0.1103000     0.7584000 
1 1 1 5  8  51 o 8.190000 0.7883000 7.283000 1.294000  9.097000 0.9008000 -1.814000      1.577000  
1 1 1 5  8  53 o 3.966000 0.9907000 4.083000 1.434000  3.848000 1.367000  0.2354000      1.981000  
1 1 1 5  8  55 o 27.36000 0.3270000 27.76000 0.4568000 26.96000 0.4682000 0.8007000      0.6541000 
1 1 1 5  8  57 o 10.45000 0.5516000 10.58000 0.7782000 10.33000 0.7821000 0.2497000      1.103000  
1 1 1 5  8  59 o 5.869000 0.9167000 4.754000 1.481000  6.984000 1.081000  -2.230000      1.833000  
1 1 1 5  8  61 o 9.061000 0.6091000 9.432000 0.7603000 8.690000 0.9517000 0.7411000      1.218000  
1 1 1 5  8  63 o 12.07000 0.5923000 12.47000 0.7374000 11.67000 0.9270000 0.7979000      1.185000  
1 1 1 5  8  65 o 9.288000 0.6620000 10.68000 0.9246000 7.900000 0.9478000 2.776000       1.324000  
1 1 1 5  8  67 o 5.349000 1.045000  5.948000 1.639000  4.751000 1.296000  1.196000       2.090000  
1 1 1 5  9  0  o 105.5000 1.172000  105.5000 1.172000  105.5000 1.172000  0.000000       0.000000  
1 1 1 5  9  2  o 84.12000 0.8139000 84.31000 1.153000  83.93000 1.149000  0.3713000      1.628000  
1 1 1 5  9  4  o 79.90000 0.7744000 79.45000 1.089000  80.35000 1.101000  -0.8981000     1.549000  
1 1 1 5  9  6  o 50.47000 0.4573000 50.08000 0.7039000 50.86000 0.5841000 -0.7719000     0.9147000 
1 1 1 5  9  8  o 62.10000 0.4302000 62.62000 0.6128000 61.58000 0.6038000 1.037000       0.8603000 
1 1 1 5  9  10 o 42.53000 0.3273000 42.63000 0.4939000 42.43000 0.4298000 0.2013000      0.6547000 
1 1 1 5  9  12 o 67.51000 0.5055000 67.41000 0.6606000 67.60000 0.7652000 -0.1891000     1.011000  
1 1 1 5  9  14 o 42.40000 0.3087000 42.51000 0.4367000 42.29000 0.4363000 0.2233000      0.6174000 
1 1 1 5  9  16 o 24.73000 0.2856000 24.51000 0.4355000 24.96000 0.3695000 -0.4490000     0.5711000 
1 1 1 5  9  18 o 45.27000 0.3582000 45.14000 0.5339000 45.40000 0.4776000 -0.2616000     0.7163000 
1 1 1 5  9  20 o 25.03000 0.2455000 25.09000 0.3833000 24.97000 0.3069000 0.1210000      0.4910000 
1 1 1 5  9  22 o 41.62000 0.3276000 41.31000 0.5123000 41.92000 0.4084000 -0.6056000     0.6551000 
1 1 1 5  9  24 f 141.7000 1.117000  142.6000 1.588000  140.7000 1.573000  1.913000       2.235000  
1 1 1 5  9  26 o 31.51000 0.3449000 31.16000 0.5510000 31.85000 0.4150000 -0.6904000     0.6898000 
1 1 1 5  9  28 o 18.64000 0.3224000 18.56000 0.4646000 18.71000 0.4473000 -0.1423000     0.6449000 
1 1 1 5  9  30 o 17.82000 0.3391000 18.18000 0.5082000 17.46000 0.4492000 0.7259000      0.6783000 
1 1 1 5  9  32 o 26.96000 0.3138000 27.12000 0.4635000 26.80000 0.4231000 0.3288000      0.6276000 
1 1 1 5  9  34 f 31.92000 0.3199000 31.70000 0.4704000 32.13000 0.4337000 -0.4297000     0.6398000 
1 1 1 5  9  36 o 24.53000 0.3003000 24.58000 0.4186000 24.48000 0.4307000 0.9429000E-01  0.6006000 
1 1 1 5  9  38 o 46.71000 0.3952000 46.70000 0.5902000 46.73000 0.5256000 -0.3204000E-01 0.7903000 
1 1 1 5  9  40 o 9.696000 0.7642000 9.122000 1.303000  10.27000 0.7989000 -1.148000      1.528000  
1 1 1 5  9  42 o 46.47000 0.3763000 46.18000 0.5320000 46.75000 0.5324000 -0.5709000     0.7527000 
1 1 1 5  9  44 o 14.63000 0.4515000 14.48000 0.6414000 14.77000 0.6356000 -0.2909000     0.9030000 
1 1 1 5  9  46 o 27.02000 0.3374000 27.22000 0.4784000 26.83000 0.4758000 0.3876000      0.6747000 
1 1 1 5  9  48 o 28.34000 0.3660000 28.49000 0.5556000 28.19000 0.4765000 0.2926000      0.7320000 
1 1 1 5  9  50 o 17.72000 0.3776000 17.60000 0.5445000 17.85000 0.5233000 -0.2469000     0.7552000 
1 1 1 5  9  52 o 5.313000 1.054000  5.797000 1.361000  4.830000 1.611000  0.9664000      2.109000  
1 1 1 5  9  54 o 7.307000 0.7736000 8.686000 0.8842000 5.928000 1.270000  2.758000       1.547000  
1 1 1 5  9  56 o 4.280000 1.020000  4.904000 1.386000  3.656000 1.497000  1.248000       2.041000  
1 1 1 5  9  58 f 3.171000 0.9393000 3.121000 1.300000  3.221000 1.356000  -0.9973000E-01 1.879000  
1 1 1 5  9  60 o 3.103000 0.9272000 3.038000 1.298000  3.169000 1.325000  -0.1310000     1.854000  
1 1 1 5  9  62 o 6.633000 0.8926000 7.854000 1.220000  5.411000 1.303000  2.443000       1.785000  
1 1 1 5  9  64 o 8.952000 0.6714000 9.868000 0.9558000 8.035000 0.9432000 1.833000       1.343000  
1 1 1 5  9  66 o 4.478000 1.057000  3.716000 1.529000  5.241000 1.461000  -1.525000      2.115000  
1 1 1 5  10 1  o 15.48000 0.2097000 15.71000 0.3717000 15.26000 0.1940000 0.4529000      0.4193000 
1 1 1 5  10 3  o 65.18000 0.6370000 65.66000 0.9064000 64.70000 0.8951000 0.9584000      1.274000  
1 1 1 5  10 5  o 81.34000 0.7200000 80.70000 1.108000  81.97000 0.9201000 -1.262000      1.440000  
1 1 1 5  10 7  o 47.03000 0.3317000 47.27000 0.4713000 46.79000 0.4668000 0.4713000      0.6634000 
1 1 1 5  10 9  o 64.51000 0.5150000 64.47000 0.7261000 64.55000 0.7304000 -0.8319000E-01 1.030000  
1 1 1 5  10 11 o 69.35000 0.5181000 69.51000 0.6800000 69.19000 0.7819000 0.3176000      1.036000  
1 1 1 5  10 13 f 30.58000 0.3180000 30.50000 0.4940000 30.66000 0.4007000 -0.1570000     0.6361000 
1 1 1 5  10 15 o 44.75000 0.3252000 44.59000 0.4571000 44.91000 0.4628000 -0.3153000     0.6505000 
1 1 1 5  10 17 o 70.54000 0.5307000 69.66000 0.7891000 71.42000 0.7097000 -1.759000      1.061000  
1 1 1 5  10 19 o 65.72000 0.4759000 65.53000 0.7473000 65.91000 0.5893000 -0.3787000     0.9517000 
1 1 1 5  10 21 o 49.57000 0.4323000 49.90000 0.7306000 49.25000 0.4625000 0.6493000      0.8647000 
1 1 1 5  10 23 o 38.97000 0.3562000 39.22000 0.5004000 38.72000 0.5072000 0.5046000      0.7125000 
1 1 1 5  10 25 o 50.00000 0.4407000 50.67000 0.7446000 49.33000 0.4716000 1.338000       0.8814000 
1 1 1 5  10 27 o 24.32000 0.3408000 24.60000 0.5400000 24.03000 0.4158000 0.5747000      0.6816000 
1 1 1 5  10 29 o 44.19000 0.3746000 44.61000 0.5657000 43.77000 0.4913000 0.8421000      0.7493000 
1 1 1 5  10 31 o 37.96000 0.3918000 37.74000 0.6313000 38.19000 0.4640000 -0.4523000     0.7835000 
1 1 1 5  10 33 o 26.42000 0.3008000 26.46000 0.4697000 26.38000 0.3759000 0.8029000E-01  0.6016000 
1 1 1 5  10 35 o 48.36000 0.4399000 47.97000 0.7389000 48.75000 0.4776000 -0.7787000     0.8798000 
1 1 1 5  10 37 o 18.24000 0.3614000 18.28000 0.5169000 18.21000 0.5052000 0.7464000E-01  0.7228000 
1 1 1 5  10 39 o 35.13000 0.3898000 34.48000 0.6269000 35.79000 0.4633000 -1.312000      0.7795000 
1 1 1 5  10 41 o 45.25000 0.3986000 45.65000 0.5228000 44.86000 0.6017000 0.7833000      0.7971000 
1 1 1 5  10 43 o 30.30000 0.3415000 30.97000 0.4555000 29.63000 0.5090000 1.341000       0.6831000 
1 1 1 5  10 45 o 22.07000 0.3844000 21.79000 0.4888000 22.35000 0.5933000 -0.5605000     0.7688000 
1 1 1 5  10 47 o 26.33000 0.3330000 25.91000 0.4755000 26.75000 0.4663000 -0.8376000     0.6660000 
1 1 1 5  10 49 o 41.80000 0.3934000 41.60000 0.5130000 41.99000 0.5967000 -0.3876000     0.7869000 
1 1 1 5  10 51 o 24.32000 0.3611000 24.43000 0.5492000 24.21000 0.4689000 0.2218000      0.7221000 
1 1 1 5  10 53 o 11.50000 0.5297000 11.65000 0.6543000 11.34000 0.8333000 0.3140000      1.059000  
1 1 1 5  10 55 f 4.565000 1.075000  4.716000 1.537000  4.413000 1.504000  0.3031000      2.151000  
1 1 1 5  10 57 o 7.571000 0.7283000 7.299000 1.212000  7.844000 0.8074000 -0.5447000     1.457000  
1 1 1 5  10 59 o 5.598000 0.9929000 5.715000 1.574000  5.481000 1.211000  0.2348000      1.986000  
1 1 1 5  10 61 o 8.932000 0.8121000 9.845000 1.281000  8.018000 0.9987000 1.827000       1.624000  
1 1 1 5  10 63 o 15.48000 0.6833000 15.90000 1.225000  15.06000 0.6054000 0.8429000      1.367000  
1 1 1 5  10 65 o 7.707000 0.8015000 7.541000 1.289000  7.872000 0.9527000 -0.3316000     1.603000  
1 1 1 5  10 67 o 5.324000 1.153000  5.764000 1.706000  4.884000 1.550000  0.8807000      2.305000  
1 1 1 5  11 0  o 50.94000 0.5037000 50.94000 0.5037000 50.94000 0.5037000 0.000000       0.000000  
1 1 1 5  11 2  o 10.29000 0.1597000 10.20000 0.2708000 10.39000 0.1692000 -0.1897000     0.3193000 
1 1 1 5  11 4  o 53.23000 0.4318000 53.76000 0.6157000 52.70000 0.6055000 1.059000       0.8636000 
1 1 1 5  11 6  o 75.17000 0.5994000 76.39000 0.8610000 73.94000 0.8342000 2.450000       1.199000  
1 1 1 5  11 8  o 28.51000 0.2503000 28.85000 0.3531000 28.16000 0.3548000 0.6955000      0.5006000 
1 1 1 5  11 10 o 32.92000 0.2880000 33.43000 0.4181000 32.41000 0.3961000 1.024000       0.5759000 
1 1 1 5  11 12 o 52.48000 0.4816000 52.74000 0.6077000 52.23000 0.7473000 0.5140000      0.9632000 
1 1 1 5  11 14 o 88.21000 0.6070000 88.39000 0.8594000 88.02000 0.8575000 0.3711000      1.214000  
1 1 1 5  11 16 o 85.43000 0.5895000 85.14000 0.8304000 85.71000 0.8370000 -0.5675000     1.179000  
1 1 1 5  11 18 o 34.80000 0.3219000 34.00000 0.4319000 35.59000 0.4775000 -1.591000      0.6438000 
1 1 1 5  11 20 o 84.95000 0.6060000 84.26000 0.9496000 85.64000 0.7533000 -1.386000      1.212000  
1 1 1 5  11 22 o 109.0000 0.9144000 108.2000 1.485000  109.8000 1.068000  -1.618000      1.829000  
1 1 1 5  11 24 o 74.29000 0.5385000 74.20000 0.8478000 74.38000 0.6643000 -0.1795000     1.077000  
1 1 1 5  11 26 o 58.40000 0.6611000 58.19000 1.176000  58.61000 0.6046000 -0.4115000     1.322000  
1 1 1 5  11 28 o 47.54000 0.3722000 46.87000 0.5778000 48.21000 0.4693000 -1.332000      0.7444000 
1 1 1 5  11 30 o 49.76000 0.3909000 49.88000 0.6147000 49.63000 0.4830000 0.2482000      0.7817000 
1 1 1 5  11 32 f 28.01000 0.3179000 28.39000 0.4760000 27.64000 0.4214000 0.7530000      0.6358000 
1 1 1 5  11 34 o 29.48000 0.3187000 28.72000 0.4768000 30.23000 0.4231000 -1.513000      0.6374000 
1 1 1 5  11 36 o 9.103000 0.9279000 7.907000 1.710000  10.30000 0.7202000 -2.392000      1.856000  
1 1 1 5  11 38 o 52.41000 0.4114000 52.51000 0.6463000 52.30000 0.5093000 0.2150000      0.8228000 
1 1 1 5  11 40 o 11.70000 0.5343000 11.63000 0.8074000 11.77000 0.6999000 -0.1345000     1.069000  
1 1 1 5  11 42 o 37.29000 0.3435000 36.93000 0.5349000 37.65000 0.4312000 -0.7255000     0.6870000 
1 1 1 5  11 44 o 39.06000 0.3577000 39.45000 0.5654000 38.67000 0.4383000 0.7828000      0.7154000 
1 1 1 5  11 46 o 24.97000 0.3479000 25.16000 0.5464000 24.77000 0.4309000 0.3909000      0.6959000 
1 1 1 5  11 48 o 11.50000 0.6091000 12.42000 1.035000  10.59000 0.6419000 1.838000       1.218000  
1 1 1 5  11 50 o 24.13000 0.3623000 24.23000 0.5532000 24.03000 0.4679000 0.2056000      0.7245000 
1 1 1 5  11 52 f 9.296000 0.7047000 9.763000 1.167000  8.829000 0.7904000 0.9342000      1.409000  
1 1 1 5  11 54 o 8.229000 0.6640000 8.808000 1.025000  7.650000 0.8448000 1.158000       1.328000  
1 1 1 5  11 56 f 4.041000 1.019000  4.951000 1.546000  3.131000 1.327000  1.820000       2.037000  
1 1 1 5  11 58 o 4.500000 0.9482000 3.568000 1.468000  5.432000 1.201000  -1.863000      1.896000  
1 1 1 5  11 60 o 5.717000 1.040000  6.549000 1.482000  4.884000 1.460000  1.666000       2.080000  
1 1 1 5  11 62 o 3.895000 1.030000  5.140000 1.662000  2.651000 1.216000  2.489000       2.059000  
1 1 1 5  11 64 o 3.657000 1.019000  4.165000 1.548000  3.149000 1.326000  1.016000       2.038000  
1 1 1 5  11 66 o 4.701000 1.066000  5.326000 1.678000  4.075000 1.317000  1.251000       2.133000  
1 1 1 5  12 1  o 105.3000 0.7190000 104.4000 1.008000  106.1000 1.025000  -1.704000      1.438000  
1 1 1 5  12 3  o 8.944000 0.1525000 9.050000 0.2136000 8.839000 0.2177000 0.2112000      0.3050000 
1 1 1 5  12 5  o 13.23000 0.1525000 13.00000 0.2125000 13.47000 0.2189000 -0.4630000     0.3051000 
1 1 1 5  12 7  f 43.23000 0.3324000 43.31000 0.5014000 43.15000 0.4364000 0.1659000      0.6647000 
1 1 1 5  12 9  o 83.33000 0.7419000 83.62000 0.9413000 83.04000 1.147000  0.5811000      1.484000  
1 1 1 5  12 11 o 108.0000 0.7972000 108.8000 1.051000  107.2000 1.199000  1.565000       1.594000  
1 1 1 5  12 13 o 66.71000 0.4652000 66.57000 0.6554000 66.84000 0.6603000 -0.2736000     0.9303000 
1 1 1 5  12 15 o 80.40000 0.5563000 80.92000 0.7906000 79.87000 0.7827000 1.046000       1.113000  
1 1 1 5  12 17 o 75.16000 0.5228000 75.29000 0.7399000 75.03000 0.7389000 0.2585000      1.046000  
1 1 1 5  12 19 o 111.8000 0.7905000 111.5000 1.245000  112.2000 0.9746000 -0.6645000     1.581000  
1 1 1 5  12 21 o 7.553000 0.4443000 7.156000 0.6412000 7.950000 0.6151000 -0.7939000     0.8885000 
1 1 1 5  12 23 o 47.02000 0.3828000 47.67000 0.5780000 46.38000 0.5022000 1.285000       0.7657000 
1 1 1 5  12 25 o 109.9000 0.9286000 110.9000 1.523000  108.9000 1.062000  2.070000       1.857000  
1 1 1 5  12 27 o 98.64000 0.7054000 99.15000 1.117000  98.13000 0.8624000 1.018000       1.411000  
1 1 1 5  12 29 f 38.60000 0.4175000 39.05000 0.6399000 38.14000 0.5363000 0.9187000      0.8349000 
1 1 1 5  12 31 o 47.45000 0.3770000 47.10000 0.5903000 47.80000 0.4692000 -0.6958000     0.7541000 
1 1 1 5  12 33 o 10.67000 0.4828000 11.06000 0.7385000 10.28000 0.6221000 0.7813000      0.9656000 
1 1 1 5  12 35 o 29.08000 0.3404000 28.29000 0.5616000 29.86000 0.3848000 -1.576000      0.6807000 
1 1 1 5  12 37 o 6.005000 0.8808000 6.200000 1.285000  5.809000 1.205000  0.3909000      1.762000  
1 1 1 5  12 39 o 35.83000 0.3815000 36.11000 0.6423000 35.55000 0.4119000 0.5617000      0.7630000 
1 1 1 5  12 41 o 7.186000 0.7957000 7.647000 1.192000  6.726000 1.054000  0.9212000      1.591000  
1 1 1 5  12 43 o 44.98000 0.3964000 44.26000 0.5886000 45.70000 0.5311000 -1.442000      0.7928000 
1 1 1 5  12 45 o 41.53000 0.3893000 42.19000 0.5836000 40.88000 0.5154000 1.305000       0.7786000 
1 1 1 5  12 47 o 20.54000 0.3787000 20.20000 0.5970000 20.89000 0.4660000 -0.6914000     0.7574000 
1 1 1 5  12 49 o 22.42000 0.3814000 22.12000 0.5801000 22.72000 0.4954000 -0.5966000     0.7629000 
1 1 1 5  12 51 o 10.65000 0.6018000 11.36000 0.9915000 9.942000 0.6823000 1.420000       1.204000  
1 1 1 5  12 53 o 18.09000 0.3800000 17.40000 0.6108000 18.78000 0.4521000 -1.376000      0.7600000 
1 1 1 5  12 55 f 3.438000 0.9778000 3.951000 1.512000  2.925000 1.240000  1.026000       1.956000  
1 1 1 5  12 57 o 7.039000 0.9991000 6.024000 1.351000  8.053000 1.472000  -2.028000      1.998000  
1 1 1 5  12 59 o 3.892000 1.090000  4.165000 1.685000  3.619000 1.383000  0.5452000      2.180000  
1 1 1 5  12 61 o 3.681000 1.025000  3.530000 1.506000  3.832000 1.391000  -0.3025000     2.050000  
1 1 1 5  12 63 o 8.051000 0.8306000 8.975000 1.240000  7.127000 1.105000  1.848000       1.661000  
1 1 1 5  12 65 o 3.252000 0.9880000 3.472000 1.493000  3.032000 1.294000  0.4395000      1.976000  
1 1 1 5  13 0  o 20.06000 0.3872000 20.06000 0.3872000 20.06000 0.3872000 0.000000       0.000000  
1 1 1 5  13 2  o 19.11000 0.1770000 18.78000 0.2108000 19.43000 0.2844000 -0.6492000     0.3540000 
1 1 1 5  13 4  o 75.60000 0.6011000 76.30000 0.8570000 74.89000 0.8431000 1.404000       1.202000  
1 1 1 5  13 6  o 55.78000 0.5078000 56.40000 0.7911000 55.16000 0.6370000 1.243000       1.016000  
1 1 1 5  13 8  o 41.21000 0.3823000 41.08000 0.4848000 41.34000 0.5913000 -0.2601000     0.7646000 
1 1 1 5  13 10 o 96.10000 0.7102000 97.32000 0.9431000 94.88000 1.062000  2.436000       1.420000  
1 1 1 5  13 12 o 24.43000 0.2116000 24.50000 0.2981000 24.36000 0.3005000 0.1426000      0.4233000 
1 1 1 5  13 14 f 66.26000 0.4634000 66.33000 0.6549000 66.19000 0.6558000 0.1471000      0.9268000 
1 1 1 5  13 16 o 88.93000 0.6139000 88.93000 0.8665000 88.94000 0.8699000 -0.1144000E-01 1.228000  
1 1 1 5  13 18 o 51.12000 0.4779000 51.20000 0.7309000 51.03000 0.6159000 0.1679000      0.9558000 
1 1 1 5  13 20 o 23.70000 0.3223000 23.75000 0.5094000 23.66000 0.3951000 0.8401000E-01  0.6447000 
1 1 1 5  13 22 o 50.21000 0.4559000 50.02000 0.7401000 50.40000 0.5324000 -0.3800000     0.9117000 
1 1 1 5  13 24 o 10.47000 0.4324000 10.15000 0.6921000 10.79000 0.5186000 -0.6406000     0.8649000 
1 1 1 5  13 26 o 53.28000 0.4657000 53.69000 0.7849000 52.86000 0.5014000 0.8360000      0.9314000 
1 1 1 5  13 28 o 26.75000 0.2974000 27.26000 0.4651000 26.24000 0.3709000 1.019000       0.5949000 
1 1 1 5  13 30 o 34.46000 0.3162000 35.02000 0.4970000 33.91000 0.3910000 1.112000       0.6324000 
1 1 1 5  13 32 o 32.84000 0.3893000 32.00000 0.5826000 33.67000 0.5166000 -1.670000      0.7787000 
1 1 1 5  13 34 o 44.27000 0.3642000 44.19000 0.5706000 44.35000 0.4527000 -0.1539000     0.7284000 
1 1 1 5  13 36 o 17.87000 0.4262000 17.27000 0.6736000 18.48000 0.5223000 -1.210000      0.8523000 
1 1 1 5  13 38 o 32.54000 0.3236000 32.71000 0.5065000 32.38000 0.4028000 0.3261000      0.6471000 
1 1 1 5  13 40 o 11.32000 0.5718000 10.88000 0.9894000 11.76000 0.5736000 -0.8875000     1.144000  
1 1 1 5  13 42 f 34.54000 0.3417000 34.76000 0.5343000 34.31000 0.4259000 0.4483000      0.6833000 
1 1 1 5  13 44 o 11.91000 0.5353000 10.95000 0.8721000 12.86000 0.6208000 -1.915000      1.071000  
1 1 1 5  13 46 o 23.52000 0.4041000 23.41000 0.5738000 23.62000 0.5692000 -0.2079000     0.8082000 
1 1 1 5  13 48 o 22.34000 0.4417000 22.80000 0.6714000 21.89000 0.5743000 0.9085000      0.8835000 
1 1 1 5  13 50 o 5.900000 1.049000  5.768000 1.758000  6.032000 1.144000  -0.2641000     2.097000  
1 1 1 5  13 52 o 16.42000 0.4525000 17.30000 0.7546000 15.55000 0.4998000 1.749000       0.9050000 
1 1 1 5  13 54 o 12.59000 0.4618000 13.14000 0.7137000 12.04000 0.5863000 1.098000       0.9236000 
1 1 1 5  13 56 o 5.681000 0.9062000 4.924000 1.480000  6.438000 1.046000  -1.514000      1.812000  
1 1 1 5  13 58 o 7.475000 0.7891000 7.952000 1.158000  6.998000 1.073000  0.9547000      1.578000  
1 1 1 5  13 60 o 5.020000 1.045000  4.083000 1.739000  5.957000 1.159000  -1.874000      2.090000  
1 1 1 5  13 62 o 4.241000 1.047000  4.340000 1.583000  4.141000 1.371000  0.1996000      2.094000  
1 1 1 5  13 64 o 14.02000 0.4860000 14.11000 0.7405000 13.94000 0.6297000 0.1756000      0.9720000 
1 1 1 5  13 66 f 8.265000 0.7675000 8.914000 1.224000  7.615000 0.9262000 1.299000       1.535000  
1 1 1 5  14 1  o 84.69000 0.6271000 85.44000 0.8280000 83.93000 0.9420000 1.513000       1.254000  
1 1 1 5  14 3  o 82.86000 0.6572000 83.13000 0.9322000 82.60000 0.9266000 0.5303000      1.314000  
1 1 1 5  14 5  o 103.0000 0.8341000 102.9000 0.8896000 103.2000 1.411000  -0.3741000     1.668000  
1 1 1 5  14 7  o 32.83000 0.2999000 32.91000 0.3516000 32.75000 0.4860000 0.1601000      0.5999000 
1 1 1 5  14 9  o 6.043000 0.2489000 5.719000 0.3583000 6.367000 0.3457000 -0.6480000     0.4979000 
1 1 1 5  14 11 o 33.98000 0.2804000 34.07000 0.4236000 33.88000 0.3674000 0.1906000      0.5607000 
1 1 1 5  14 13 o 80.36000 0.5559000 80.21000 0.7842000 80.51000 0.7880000 -0.3072000     1.112000  
1 1 1 5  14 15 o 107.8000 0.7389000 107.7000 1.043000  107.9000 1.047000  -0.2763000     1.478000  
1 1 1 5  14 17 o 57.75000 0.4122000 57.90000 0.5822000 57.60000 0.5836000 0.3006000      0.8244000 
1 1 1 5  14 19 o 59.54000 0.4387000 59.04000 0.6848000 60.04000 0.5484000 -0.9956000     0.8774000 
1 1 1 5  14 21 o 61.98000 0.5429000 61.40000 0.8768000 62.56000 0.6404000 -1.164000      1.086000  
1 1 1 5  14 23 f 80.97000 0.5832000 80.77000 0.9177000 81.16000 0.7201000 -0.3931000     1.166000  
1 1 1 5  14 25 f 87.65000 0.9634000 88.39000 1.724000  86.90000 0.8598000 1.490000       1.927000  
1 1 1 5  14 27 o 45.52000 0.4612000 45.80000 0.7079000 45.23000 0.5913000 0.5626000      0.9223000 
1 1 1 5  14 29 o 63.46000 0.4968000 64.49000 0.7539000 62.42000 0.6474000 2.076000       0.9937000 
1 1 1 5  14 31 o 33.05000 0.3547000 33.36000 0.5914000 32.74000 0.3918000 0.6204000      0.7094000 
1 1 1 5  14 33 o 14.42000 0.4052000 14.38000 0.6012000 14.45000 0.5434000 -0.7436000E-01 0.8104000 
1 1 1 5  14 35 o 33.09000 0.3502000 33.09000 0.4958000 33.09000 0.4947000 -0.1495000E-02 0.7004000 
1 1 1 5  14 37 o 31.03000 0.3171000 30.86000 0.5001000 31.20000 0.3902000 -0.3403000     0.6343000 
1 1 1 5  14 39 o 38.79000 0.5274000 39.54000 0.9421000 38.04000 0.4744000 1.494000       1.055000  
1 1 1 5  14 41 o 10.92000 0.5378000 10.37000 0.8740000 11.48000 0.6267000 -1.107000      1.076000  
1 1 1 5  14 43 o 30.80000 0.3521000 30.39000 0.5278000 31.22000 0.4662000 -0.8321000     0.7042000 
1 1 1 5  14 45 o 32.01000 0.3422000 31.87000 0.5314000 32.16000 0.4314000 -0.2931000     0.6845000 
1 1 1 5  14 47 o 11.09000 0.5350000 11.28000 0.8430000 10.91000 0.6591000 0.3707000      1.070000  
1 1 1 5  14 49 o 14.74000 0.4850000 14.31000 0.8278000 15.17000 0.5058000 -0.8553000     0.9701000 
1 1 1 5  14 51 o 3.608000 1.020000  3.724000 1.522000  3.492000 1.357000  0.2322000      2.039000  
1 1 1 5  14 53 o 12.51000 0.4847000 11.77000 0.8104000 13.25000 0.5319000 -1.473000      0.9694000 
1 1 1 5  14 55 o 12.78000 0.4577000 13.47000 0.6720000 12.08000 0.6217000 1.391000       0.9155000 
1 1 1 5  14 57 o 3.962000 1.020000  4.634000 1.541000  3.291000 1.336000  1.343000       2.039000  
1 1 1 5  14 59 o 9.034000 0.6849000 8.820000 1.103000  9.249000 0.8127000 -0.4285000     1.370000  
1 1 1 5  14 61 o 7.395000 0.9559000 8.368000 1.136000  6.421000 1.538000  1.947000       1.912000  
1 1 1 5  14 63 o 6.952000 0.9794000 6.843000 1.678000  7.061000 1.010000  -0.2177000     1.959000  
1 1 1 5  14 65 o 6.393000 0.9321000 7.024000 1.478000  5.763000 1.136000  1.261000       1.864000  
1 1 1 5  15 0  o 108.3000 1.480000  108.3000 1.480000  108.3000 1.480000  0.000000       0.000000  
1 1 1 5  15 2  o 94.27000 1.009000  93.53000 0.8106000 95.01000 1.848000  -1.474000      2.018000  
1 1 1 5  15 4  o 60.22000 0.4989000 59.71000 0.5281000 60.72000 0.8465000 -1.013000      0.9977000 
1 1 1 5  15 6  o 61.24000 0.5234000 60.84000 0.6011000 61.64000 0.8569000 -0.7967000     1.047000  
1 1 1 5  15 8  o 87.06000 0.5991000 87.44000 0.8509000 86.67000 0.8436000 0.7700000      1.198000  
1 1 1 5  15 10 o 73.56000 0.5518000 73.89000 0.8361000 73.22000 0.7203000 0.6714000      1.104000  
1 1 1 5  15 12 o 15.09000 0.2372000 15.30000 0.3520000 14.88000 0.3180000 0.4221000      0.4744000 
1 1 1 5  15 14 o 70.06000 0.4897000 69.68000 0.6877000 70.44000 0.6974000 -0.7668000     0.9795000 
1 1 1 5  15 16 o 40.33000 0.3312000 40.05000 0.4963000 40.62000 0.4387000 -0.5731000     0.6625000 
1 1 1 5  15 18 o 65.63000 0.5048000 64.97000 0.6484000 66.29000 0.7739000 -1.325000      1.010000  
1 1 1 5  15 20 o 61.52000 0.4732000 61.25000 0.7088000 61.79000 0.6272000 -0.5408000     0.9465000 
1 1 1 5  15 22 o 84.38000 0.7216000 84.94000 1.181000  83.82000 0.8289000 1.122000       1.443000  
1 1 1 5  15 24 o 63.62000 0.5551000 62.97000 0.8975000 64.26000 0.6535000 -1.292000      1.110000  
1 1 1 5  15 26 o 47.16000 0.3714000 46.76000 0.5777000 47.56000 0.4670000 -0.7991000     0.7428000 
1 1 1 5  15 28 o 44.97000 0.4261000 44.69000 0.6849000 45.25000 0.5073000 -0.5621000     0.8523000 
1 1 1 5  15 30 f 45.84000 0.3862000 45.04000 0.5681000 46.63000 0.5232000 -1.591000      0.7724000 
1 1 1 5  15 32 o 72.02000 0.5295000 72.33000 0.8359000 71.72000 0.6501000 0.6060000      1.059000  
1 1 1 5  15 34 o 17.00000 0.3430000 17.09000 0.5449000 16.92000 0.4168000 0.1657000      0.6861000 
1 1 1 5  15 36 o 15.10000 0.4312000 15.53000 0.7287000 14.68000 0.4611000 0.8439000      0.8623000 
1 1 1 5  15 38 o 37.03000 0.4027000 37.42000 0.6567000 36.64000 0.4663000 0.7799000      0.8054000 
1 1 1 5  15 40 f 20.72000 0.3846000 20.97000 0.6331000 20.48000 0.4369000 0.4834000      0.7692000 
1 1 1 5  15 42 o 41.06000 0.3611000 41.68000 0.5667000 40.43000 0.4478000 1.244000       0.7223000 
1 1 1 5  15 44 o 33.87000 0.3422000 33.83000 0.5370000 33.91000 0.4243000 -0.7724000E-01 0.6844000 
1 1 1 5  15 46 o 17.25000 0.4238000 16.90000 0.6426000 17.59000 0.5527000 -0.6839000     0.8476000 
1 1 1 5  15 48 o 25.32000 0.3585000 25.34000 0.5394000 25.30000 0.4725000 0.4131000E-01  0.7171000 
1 1 1 5  15 50 o 16.12000 0.4651000 16.28000 0.7590000 15.96000 0.5376000 0.3209000      0.9301000 
1 1 1 5  15 52 o 16.53000 0.4597000 16.10000 0.7845000 16.96000 0.4792000 -0.8552000     0.9193000 
1 1 1 5  15 54 o 14.02000 0.4123000 14.40000 0.6249000 13.65000 0.5381000 0.7576000      0.8247000 
1 1 1 5  15 56 o 5.115000 0.9732000 6.055000 1.446000  4.175000 1.303000  1.879000       1.946000  
1 1 1 5  15 58 o 3.990000 1.026000  4.707000 1.577000  3.272000 1.312000  1.435000       2.052000  
1 1 1 5  15 60 o 11.85000 0.5972000 11.26000 1.045000  12.43000 0.5777000 -1.172000      1.194000  
1 1 1 5  15 62 o 7.158000 1.015000  7.630000 1.267000  6.686000 1.585000  0.9445000      2.029000  
1 1 1 5  15 64 o 6.086000 0.9716000 7.460000 1.361000  4.713000 1.387000  2.747000       1.943000  
1 1 1 5  15 66 o 5.272000 1.363000  4.657000 1.827000  5.887000 2.024000  -1.230000      2.727000  
1 1 1 5  16 1  o 24.95000 0.2427000 24.93000 0.3435000 24.96000 0.3429000 -0.3070000E-01 0.4853000 
1 1 1 5  16 3  o 63.38000 0.5232000 62.91000 0.5552000 63.84000 0.8869000 -0.9335000     1.046000  
1 1 1 5  16 5  o 45.50000 0.3537000 45.17000 0.4605000 45.82000 0.5370000 -0.6530000     0.7074000 
1 1 1 5  16 7  o 85.05000 0.6060000 84.70000 0.7384000 85.40000 0.9612000 -0.7073000     1.212000  
1 1 1 5  16 9  o 100.7000 0.6912000 100.1000 0.9719000 101.3000 0.9831000 -1.194000      1.382000  
1 1 1 5  16 11 o 39.85000 0.2979000 39.49000 0.4170000 40.21000 0.4256000 -0.7193000     0.5958000 
1 1 1 5  16 13 o 30.42000 0.2494000 30.53000 0.3506000 30.31000 0.3549000 0.2177000      0.4989000 
1 1 1 5  16 15 o 49.41000 0.3601000 49.44000 0.5082000 49.38000 0.5102000 0.6210000E-01  0.7201000 
1 1 1 5  16 17 o 78.86000 0.5496000 78.57000 0.7737000 79.14000 0.7809000 -0.5718000     1.099000  
1 1 1 5  16 19 o 90.81000 0.6785000 90.86000 0.8890000 90.77000 1.025000  0.8807000E-01  1.357000  
1 1 1 5  16 21 o 85.99000 0.6452000 85.60000 0.9686000 86.39000 0.8524000 -0.7871000     1.290000  
1 1 1 5  16 23 o 86.00000 0.6453000 85.27000 0.9663000 86.73000 0.8556000 -1.461000      1.291000  
1 1 1 5  16 25 o 85.49000 0.9500000 87.42000 1.708000  83.55000 0.8321000 3.866000       1.900000  
1 1 1 5  16 27 o 64.24000 0.4761000 64.03000 0.7460000 64.45000 0.5919000 -0.4158000     0.9523000 
1 1 1 5  16 29 o 27.16000 0.2922000 27.28000 0.4600000 27.04000 0.3603000 0.2484000      0.5844000 
1 1 1 5  16 31 o 41.81000 0.3467000 42.41000 0.5447000 41.20000 0.4291000 1.215000       0.6934000 
1 1 1 5  16 33 o 33.75000 0.3293000 33.70000 0.4879000 33.80000 0.4423000 -0.1005000     0.6585000 
1 1 1 5  16 35 o 17.81000 0.3518000 17.64000 0.5411000 17.98000 0.4496000 -0.3390000     0.7035000 
1 1 1 5  16 37 o 46.63000 0.4352000 46.49000 0.7307000 46.77000 0.4729000 -0.2749000     0.8704000 
1 1 1 5  16 39 o 27.10000 0.3623000 26.94000 0.6079000 27.26000 0.3941000 -0.3248000     0.7245000 
1 1 1 5  16 41 o 11.50000 0.5197000 11.90000 0.7864000 11.09000 0.6795000 0.8109000      1.039000  
1 1 1 5  16 43 o 34.61000 0.3538000 34.36000 0.5265000 34.86000 0.4726000 -0.4963000     0.7075000 
1 1 1 5  16 45 o 33.55000 0.3453000 33.84000 0.5426000 33.27000 0.4271000 0.5730000      0.6906000 
1 1 1 5  16 47 f 12.63000 0.5468000 12.92000 0.7475000 12.33000 0.7983000 0.5966000      1.094000  
1 1 1 5  16 49 o 16.45000 0.6323000 16.90000 1.167000  16.00000 0.4874000 0.9000000      1.265000  
1 1 1 5  16 51 o 13.22000 0.4532000 12.99000 0.7297000 13.45000 0.5377000 -0.4577000     0.9064000 
1 1 1 5  16 53 o 15.10000 0.4091000 15.31000 0.6402000 14.88000 0.5094000 0.4246000      0.8182000 
1 1 1 5  16 55 o 15.92000 0.4155000 16.97000 0.6129000 14.87000 0.5613000 2.096000       0.8311000 
1 1 1 5  16 57 o 2.428000 0.8206000 2.708000 1.267000  2.149000 1.044000  0.5587000      1.641000  
1 1 1 5  16 59 o 8.819000 0.8831000 8.127000 1.595000  9.512000 0.7579000 -1.385000      1.766000  
1 1 1 5  16 61 o 7.401000 0.7957000 7.978000 1.197000  6.824000 1.048000  1.153000       1.591000  
1 1 1 5  16 63 o 6.779000 1.004000  6.444000 1.742000  7.114000 0.9980000 -0.6696000     2.008000  
1 1 1 5  16 65 o 3.803000 1.034000  4.094000 1.632000  3.513000 1.271000  0.5807000      2.069000  
1 1 1 5  17 0  o 7.215000 0.3487000 7.215000 0.3487000 7.215000 0.3487000 0.000000       0.000000  
1 1 1 5  17 2  o 29.77000 0.2427000 29.55000 0.2945000 29.99000 0.3859000 -0.4381000     0.4854000 
1 1 1 5  17 4  o 8.265000 0.2561000 8.109000 0.3733000 8.422000 0.3507000 -0.3127000     0.5122000 
1 1 1 5  17 6  o 40.43000 0.3066000 40.69000 0.3792000 40.18000 0.4820000 0.5083000      0.6133000 
1 1 1 5  17 8  o 65.84000 0.4756000 65.68000 0.5821000 66.00000 0.7523000 -0.3218000     0.9512000 
1 1 1 5  17 10 o 53.04000 0.3904000 53.40000 0.4821000 52.69000 0.6141000 0.7028000      0.7807000 
1 1 1 5  17 12 o 32.92000 0.3001000 32.90000 0.4247000 32.94000 0.4241000 -0.3252000E-01 0.6002000 
1 1 1 5  17 14 o 80.70000 0.5604000 80.75000 0.7921000 80.66000 0.7929000 0.9177000E-01  1.121000  
1 1 1 5  17 16 o 115.2000 0.7912000 115.2000 1.117000  115.2000 1.120000  -0.4096000E-01 1.582000  
1 1 1 5  17 18 o 84.78000 0.7252000 84.46000 0.8302000 85.09000 1.189000  -0.6276000     1.450000  
1 1 1 5  17 20 o 56.83000 0.4441000 56.33000 0.6618000 57.33000 0.5925000 -1.004000      0.8883000 
1 1 1 5  17 22 o 60.25000 0.5623000 60.15000 0.8668000 60.34000 0.7165000 -0.1863000     1.125000  
1 1 1 5  17 24 o 26.98000 0.4383000 26.07000 0.7136000 27.88000 0.5090000 -1.804000      0.8766000 
1 1 1 5  17 26 o 31.01000 0.3018000 30.94000 0.4691000 31.08000 0.3799000 -0.1409000     0.6036000 
1 1 1 5  17 28 o 15.07000 0.3802000 14.71000 0.5736000 15.43000 0.4992000 -0.7233000     0.7603000 
1 1 1 5  17 30 o 29.08000 0.3009000 29.62000 0.4686000 28.53000 0.3776000 1.092000       0.6018000 
1 1 1 5  17 32 o 12.63000 0.4034000 13.07000 0.6061000 12.19000 0.5325000 0.8812000      0.8067000 
1 1 1 5  17 34 f 15.17000 0.4030000 14.97000 0.5861000 15.38000 0.5534000 -0.4103000     0.8060000 
1 1 1 5  17 36 o 11.76000 0.5228000 12.15000 0.8730000 11.38000 0.5756000 0.7767000      1.046000  
1 1 1 5  17 38 o 32.05000 0.3312000 32.13000 0.5214000 31.98000 0.4087000 0.1517000      0.6625000 
1 1 1 5  17 40 o 12.61000 0.4771000 12.00000 0.7713000 13.22000 0.5619000 -1.220000      0.9543000 
1 1 1 5  17 42 o 8.491000 0.7078000 8.673000 1.113000  8.309000 0.8748000 0.3643000      1.416000  
1 1 1 5  17 44 o 27.62000 0.3376000 27.97000 0.5294000 27.28000 0.4190000 0.6960000      0.6752000 
1 1 1 5  17 46 o 9.398000 0.7503000 9.153000 1.091000  9.644000 1.030000  -0.4907000     1.501000  
1 1 1 5  17 48 o 2.520000 0.8405000 3.028000 1.367000  2.012000 0.9786000 1.017000       1.681000  
1 1 1 5  17 50 o 9.938000 0.5984000 9.667000 1.023000  10.21000 0.6205000 -0.5421000     1.197000  
1 1 1 5  17 52 o 11.40000 0.5490000 10.70000 0.9622000 12.10000 0.5288000 -1.401000      1.098000  
1 1 1 5  17 54 o 6.954000 0.7615000 7.577000 1.132000  6.331000 1.019000  1.246000       1.523000  
1 1 1 5  17 56 o 5.587000 0.9349000 4.782000 1.578000  6.392000 1.003000  -1.610000      1.870000  
1 1 1 5  17 58 o 14.05000 0.5043000 14.83000 0.7183000 13.26000 0.7080000 1.572000       1.009000  
1 1 1 5  17 60 o 9.880000 0.7299000 10.37000 1.136000  9.388000 0.9172000 0.9839000      1.460000  
1 1 1 5  17 62 o 5.404000 0.9973000 5.461000 1.558000  5.346000 1.245000  0.1145000      1.995000  
1 1 1 5  17 64 o 8.108000 0.7846000 9.424000 1.165000  6.792000 1.051000  2.632000       1.569000  
1 1 1 5  18 1  o 109.5000 0.7493000 109.4000 1.060000  109.6000 1.060000  -0.2379000     1.499000  
1 1 1 5  18 3  o 120.4000 0.8491000 120.7000 1.044000  120.1000 1.340000  0.6201000      1.698000  
1 1 1 5  18 5  o 82.21000 0.6973000 82.52000 0.8074000 81.91000 1.137000  0.6112000      1.395000  
1 1 1 5  18 7  o 57.38000 0.4382000 57.17000 0.5727000 57.58000 0.6634000 -0.4109000     0.8764000 
1 1 1 5  18 9  o 100.1000 0.7423000 100.5000 0.9763000 99.77000 1.118000  0.7249000      1.485000  
1 1 1 5  18 11 o 103.0000 0.7308000 102.8000 0.8935000 103.1000 1.157000  -0.3132000     1.462000  
1 1 1 5  18 13 o 119.9000 0.8211000 120.4000 1.166000  119.4000 1.156000  1.018000       1.642000  
1 1 1 5  18 15 o 97.58000 0.6733000 97.43000 0.9501000 97.72000 0.9541000 -0.2953000     1.347000  
1 1 1 5  18 17 o 46.30000 0.4317000 46.55000 0.4927000 46.06000 0.7090000 0.4953000      0.8634000 
1 1 1 5  18 19 o 60.89000 0.4382000 60.78000 0.6158000 61.00000 0.6235000 -0.2164000     0.8763000 
1 1 1 5  18 21 o 76.71000 0.8885000 77.88000 1.548000  75.55000 0.8725000 2.335000       1.777000  
1 1 1 5  18 23 f 68.58000 0.7414000 67.83000 1.343000  69.33000 0.6287000 -1.499000      1.483000  
1 1 1 5  18 25 o 57.06000 0.4522000 57.58000 0.6814000 56.54000 0.5947000 1.036000       0.9044000 
1 1 1 5  18 27 o 56.05000 0.4462000 55.11000 0.6599000 56.98000 0.6007000 -1.874000      0.8924000 
1 1 1 5  18 29 o 13.94000 0.3689000 14.18000 0.5761000 13.71000 0.4609000 0.4628000      0.7378000 
1 1 1 5  18 31 o 53.92000 0.4146000 53.86000 0.6481000 53.97000 0.5172000 -0.1030000     0.8291000 
1 1 1 5  18 33 o 10.42000 0.5607000 10.67000 0.7461000 10.17000 0.8372000 0.4980000      1.121000  
1 1 1 5  18 35 o 18.36000 0.3424000 17.91000 0.5362000 18.82000 0.4259000 -0.9130000     0.6848000 
1 1 1 5  18 37 o 23.32000 0.5115000 23.06000 0.9432000 23.57000 0.3960000 -0.5081000     1.023000  
1 1 1 5  18 39 o 34.53000 0.3833000 34.83000 0.6416000 34.23000 0.4196000 0.5978000      0.7666000 
1 1 1 5  18 41 o 20.80000 0.3570000 21.47000 0.5564000 20.12000 0.4475000 1.348000       0.7140000 
1 1 1 5  18 43 o 20.63000 0.3823000 20.05000 0.5696000 21.22000 0.5101000 -1.170000      0.7646000 
1 1 1 5  18 45 o 31.30000 0.3408000 31.27000 0.5328000 31.34000 0.4251000 -0.6851000E-01 0.6816000 
1 1 1 5  18 47 o 23.42000 0.3370000 23.67000 0.5297000 23.16000 0.4169000 0.5049000      0.6740000 
1 1 1 5  18 49 o 3.858000 1.040000  3.750000 1.540000  3.967000 1.400000  -0.2172000     2.081000  
1 1 1 5  18 51 o 6.761000 0.7860000 6.803000 1.257000  6.720000 0.9439000 0.8204000E-01  1.572000  
1 1 1 5  18 53 o 3.419000 0.9148000 4.374000 1.452000  2.464000 1.113000  1.911000       1.830000  
1 1 1 5  18 55 o 7.414000 0.7780000 7.152000 1.234000  7.676000 0.9474000 -0.5235000     1.556000  
1 1 1 5  18 57 o 7.311000 0.8919000 7.920000 1.240000  6.703000 1.282000  1.217000       1.784000  
1 1 1 5  18 59 o 3.321000 0.9606000 2.887000 1.332000  3.754000 1.384000  -0.8670000     1.921000  
1 1 1 5  18 61 o 5.369000 0.9707000 4.970000 1.573000  5.768000 1.138000  -0.7977000     1.941000  
1 1 1 5  18 63 o 4.409000 1.128000  4.274000 1.838000  4.545000 1.308000  -0.2710000     2.256000  
1 1 1 5  18 65 o 3.693000 1.092000  4.299000 1.691000  3.086000 1.382000  1.212000       2.184000  
1 1 1 5  19 0  o 68.58000 0.6766000 68.58000 0.6766000 68.58000 0.6766000 0.000000       0.000000  
1 1 1 5  19 2  o 79.26000 0.5935000 79.86000 0.7813000 78.66000 0.8935000 1.196000       1.187000  
1 1 1 5  19 4  o 36.43000 0.2994000 36.29000 0.3909000 36.58000 0.4537000 -0.2883000     0.5989000 
1 1 1 5  19 6  o 11.58000 0.2180000 11.24000 0.2869000 11.93000 0.3283000 -0.6863000     0.4360000 
1 1 1 5  19 8  o 35.43000 0.3160000 35.66000 0.4498000 35.20000 0.4440000 0.4612000      0.6320000 
1 1 1 5  19 10 o 30.35000 0.2591000 30.31000 0.3210000 30.39000 0.4069000 -0.8325000E-01 0.5183000 
1 1 1 5  19 12 o 30.17000 0.2757000 30.34000 0.3656000 29.99000 0.4128000 0.3485000      0.5514000 
1 1 1 5  19 14 o 106.1000 0.7544000 105.8000 0.9216000 106.5000 1.195000  -0.6994000     1.509000  
1 1 1 5  19 16 o 143.3000 1.057000  144.0000 1.393000  142.5000 1.589000  1.500000       2.114000  
1 1 1 5  19 18 o 23.55000 0.3566000 23.89000 0.4106000 23.21000 0.5832000 0.6840000      0.7133000 
1 1 1 5  19 20 f 37.56000 0.3515000 37.08000 0.4879000 38.04000 0.5061000 -0.9513000     0.7030000 
1 1 1 5  19 22 o 25.49000 0.4344000 25.81000 0.7895000 25.17000 0.3624000 0.6450000      0.8687000 
1 1 1 5  19 24 o 22.52000 0.2919000 22.60000 0.4489000 22.43000 0.3732000 0.1751000      0.5838000 
1 1 1 5  19 26 o 75.67000 0.5505000 75.16000 0.8613000 76.19000 0.6859000 -1.021000      1.101000  
1 1 1 5  19 28 o 65.32000 0.5082000 65.58000 0.7636000 65.06000 0.6707000 0.5235000      1.016000  
1 1 1 5  19 30 o 15.70000 0.3481000 15.65000 0.5464000 15.75000 0.4316000 -0.1005000     0.6963000 
1 1 1 5  19 32 o 40.99000 0.3620000 41.40000 0.5423000 40.57000 0.4795000 0.8325000      0.7239000 
1 1 1 5  19 34 o 36.25000 0.3435000 35.58000 0.5100000 36.92000 0.4603000 -1.342000      0.6870000 
1 1 1 5  19 36 o 16.05000 0.6380000 15.43000 1.172000  16.67000 0.5042000 -1.241000      1.276000  
1 1 1 5  19 38 o 7.874000 0.7109000 8.046000 1.091000  7.702000 0.9115000 0.3433000      1.422000  
1 1 1 5  19 40 o 40.23000 0.3584000 40.68000 0.5631000 39.78000 0.4434000 0.8956000      0.7167000 
1 1 1 5  19 42 o 8.765000 0.7617000 9.502000 1.045000  8.028000 1.109000  1.474000       1.523000  
1 1 1 5  19 44 o 10.05000 0.6824000 8.441000 1.205000  11.65000 0.6415000 -3.208000      1.365000  
1 1 1 5  19 46 o 19.07000 0.4461000 19.38000 0.5729000 18.77000 0.6841000 0.6110000      0.8923000 
1 1 1 5  19 48 o 14.84000 0.5072000 15.42000 0.8285000 14.26000 0.5852000 1.159000       1.014000  
1 1 1 5  19 50 o 3.720000 0.9793000 4.045000 1.487000  3.395000 1.275000  0.6502000      1.959000  
1 1 1 5  19 52 o 6.418000 0.8803000 7.353000 1.319000  5.482000 1.166000  1.872000       1.761000  
1 1 1 5  19 54 o 7.019000 0.7771000 6.569000 1.291000  7.469000 0.8656000 -0.8998000     1.554000  
1 1 1 5  19 56 o 9.631000 0.6375000 10.54000 0.9184000 8.725000 0.8844000 1.812000       1.275000  
1 1 1 5  19 58 o 5.722000 1.105000  6.710000 1.675000  4.733000 1.442000  1.978000       2.211000  
1 1 1 5  19 60 o 5.010000 1.050000  4.883000 1.710000  5.136000 1.219000  -0.2533000     2.100000  
1 1 1 5  19 62 o 8.234000 0.8331000 7.814000 1.391000  8.655000 0.9178000 -0.8404000     1.666000  
1 1 1 5  19 64 o 4.394000 1.019000  5.891000 1.634000  2.897000 1.217000  2.994000       2.037000  
1 1 1 5  20 1  o 44.95000 0.3290000 44.71000 0.4633000 45.20000 0.4673000 -0.4866000     0.6580000 
1 1 1 5  20 3  o 144.6000 1.064000  144.8000 1.395000  144.4000 1.607000  0.3694000      2.128000  
1 1 1 5  20 5  o 122.0000 0.8614000 122.0000 1.056000  122.0000 1.362000  0.1380000E-01  1.723000  
1 1 1 5  20 7  o 69.28000 0.5233000 69.54000 0.6890000 69.02000 0.7878000 0.5224000      1.047000  
1 1 1 5  20 9  o 18.55000 0.2223000 18.34000 0.2850000 18.77000 0.3413000 -0.4273000     0.4447000 
1 1 1 5  20 11 o 23.16000 0.2610000 23.06000 0.3684000 23.26000 0.3697000 -0.1983000     0.5219000 
1 1 1 5  20 13 o 69.30000 0.5041000 69.29000 0.6187000 69.30000 0.7962000 -0.9537000E-02 1.008000  
1 1 1 5  20 15 o 110.0000 1.168000  109.4000 0.9522000 110.7000 2.133000  -1.242000      2.336000  
1 1 1 5  20 17 o 59.22000 0.4980000 59.68000 0.7029000 58.77000 0.7058000 0.9053000      0.9961000 
1 1 1 5  20 19 o 62.17000 0.5135000 63.03000 0.7324000 61.31000 0.7199000 1.723000       1.027000  
1 1 1 5  20 21 o 71.65000 0.8140000 73.07000 1.466000  70.23000 0.7086000 2.844000       1.628000  
1 1 1 5  20 23 o 46.03000 0.4151000 46.20000 0.6936000 45.85000 0.4561000 0.3544000      0.8301000 
1 1 1 5  20 25 o 58.54000 0.4424000 59.20000 0.6971000 57.89000 0.5449000 1.306000       0.8847000 
1 1 1 5  20 27 o 27.02000 0.3434000 27.13000 0.5473000 26.91000 0.4151000 0.2163000      0.6869000 
1 1 1 5  20 29 o 29.04000 0.2973000 29.32000 0.4611000 28.75000 0.3753000 0.5758000      0.5945000 
1 1 1 5  20 31 o 13.89000 0.3664000 13.92000 0.5874000 13.86000 0.4381000 0.5700000E-01  0.7328000 
1 1 1 5  20 33 o 35.37000 0.3696000 35.19000 0.5053000 35.54000 0.5394000 -0.3551000     0.7391000 
1 1 1 5  20 35 o 28.25000 0.3269000 28.44000 0.4819000 28.06000 0.4419000 0.3756000      0.6538000 
1 1 1 5  20 37 o 14.43000 0.4651000 14.74000 0.7713000 14.11000 0.5199000 0.6324000      0.9302000 
1 1 1 5  20 39 o 19.03000 0.4166000 19.46000 0.6966000 18.60000 0.4570000 0.8657000      0.8332000 
1 1 1 5  20 41 o 37.32000 0.3543000 37.73000 0.5528000 36.91000 0.4433000 0.8247000      0.7086000 
1 1 1 5  20 43 o 36.25000 0.3505000 36.62000 0.5508000 35.88000 0.4336000 0.7485000      0.7011000 
1 1 1 5  20 45 o 14.35000 0.4966000 13.73000 0.7399000 14.97000 0.6625000 -1.247000      0.9932000 
1 1 1 5  20 47 o 11.79000 0.5186000 12.15000 0.7661000 11.43000 0.6991000 0.7176000      1.037000  
1 1 1 5  20 49 o 10.01000 0.6082000 10.06000 1.016000  9.957000 0.6692000 0.9858000E-01  1.216000  
1 1 1 5  20 51 o 17.68000 0.3678000 18.01000 0.5747000 17.34000 0.4592000 0.6731000      0.7357000 
1 1 1 5  20 53 o 7.637000 0.6888000 8.002000 1.092000  7.272000 0.8392000 0.7302000      1.378000  
1 1 1 5  20 55 o 6.650000 0.8329000 7.422000 1.236000  5.877000 1.117000  1.544000       1.666000  
1 1 1 5  20 57 o 6.194000 0.9156000 5.952000 1.532000  6.435000 1.003000  -0.4824000     1.831000  
1 1 1 5  20 59 o 4.505000 1.038000  5.410000 1.625000  3.599000 1.292000  1.811000       2.076000  
1 1 1 5  20 61 o 6.555000 0.8714000 6.920000 1.320000  6.191000 1.138000  0.7284000      1.743000  
1 1 1 5  20 63 f 3.405000 1.014000  3.544000 1.591000  3.265000 1.257000  0.2791000      2.028000  
1 1 1 5  21 0  o 102.7000 0.9969000 102.7000 0.9969000 102.7000 0.9969000 0.000000       0.000000  
1 1 1 5  21 2  o 71.14000 0.5368000 71.05000 0.8111000 71.22000 0.7034000 -0.1663000     1.074000  
1 1 1 5  21 4  o 47.58000 0.3758000 47.49000 0.4922000 47.67000 0.5681000 -0.1738000     0.7516000 
1 1 1 5  21 6  o 97.97000 0.7284000 97.74000 0.9514000 98.20000 1.103000  -0.4575000     1.457000  
1 1 1 5  21 8  o 66.45000 0.4841000 66.29000 0.5926000 66.61000 0.7656000 -0.3146000     0.9682000 
1 1 1 5  21 10 o 43.12000 0.4110000 43.72000 0.5307000 42.53000 0.6277000 1.188000       0.8220000 
1 1 1 5  21 12 o 62.47000 0.4590000 62.72000 0.5666000 62.22000 0.7223000 0.4956000      0.9180000 
1 1 1 5  21 14 o 44.84000 0.5634000 45.25000 0.6791000 44.43000 0.8993000 0.8150000      1.127000  
1 1 1 5  21 16 o 84.45000 0.7021000 83.78000 0.7401000 85.11000 1.193000  -1.333000      1.404000  
1 1 1 5  21 18 o 46.85000 0.5824000 47.37000 1.014000  46.33000 0.5732000 1.039000       1.165000  
1 1 1 5  21 20 o 77.59000 0.5461000 77.87000 0.7732000 77.31000 0.7714000 0.5605000      1.092000  
1 1 1 5  21 22 o 60.68000 0.5626000 ?        ?         60.68000 0.5626000 ?              ?         
1 1 1 5  21 24 o 53.27000 0.4080000 53.21000 0.6381000 53.34000 0.5085000 -0.1260000     0.8159000 
1 1 1 5  21 26 o 39.39000 0.3494000 39.93000 0.5202000 38.84000 0.4667000 1.084000       0.6988000 
1 1 1 5  21 28 f 18.24000 0.3100000 17.94000 0.4761000 18.55000 0.3970000 -0.6146000     0.6199000 
1 1 1 5  21 30 o 32.20000 0.3080000 32.12000 0.4747000 32.29000 0.3925000 -0.1749000     0.6160000 
1 1 1 5  21 32 o 21.35000 0.3245000 21.67000 0.4798000 21.03000 0.4371000 0.6463000      0.6490000 
1 1 1 5  21 34 o 33.36000 0.3396000 33.62000 0.5072000 33.09000 0.4519000 0.5250000      0.6793000 
1 1 1 5  21 36 o 7.071000 0.8994000 6.450000 1.576000  7.692000 0.8676000 -1.242000      1.799000  
1 1 1 5  21 38 o 55.49000 0.5150000 55.49000 0.8344000 55.48000 0.6039000 0.1200000E-01  1.030000  
1 1 1 5  21 40 o 32.68000 0.3540000 32.65000 0.5330000 32.71000 0.4659000 -0.5999000E-01 0.7080000 
1 1 1 5  21 42 o 12.55000 0.5287000 13.08000 0.7986000 12.03000 0.6931000 1.046000       1.057000  
1 1 1 5  21 44 o 31.80000 0.3581000 31.93000 0.5388000 31.67000 0.4718000 0.2600000      0.7162000 
1 1 1 5  21 46 o 10.81000 0.5401000 11.03000 0.8532000 10.60000 0.6625000 0.4281000      1.080000  
1 1 1 5  21 48 o 7.063000 0.7954000 7.123000 1.311000  7.003000 0.9013000 0.1205000      1.591000  
1 1 1 5  21 50 o 8.700000 0.6233000 8.728000 1.032000  8.672000 0.6989000 0.5684000E-01  1.247000  
1 1 1 5  21 52 o 8.421000 0.7137000 8.409000 1.186000  8.433000 0.7945000 -0.2427000E-01 1.427000  
1 1 1 5  21 54 o 4.244000 1.038000  4.504000 1.526000  3.984000 1.407000  0.5202000      2.076000  
1 1 1 5  21 56 o 6.221000 0.9563000 6.154000 1.429000  6.288000 1.272000  -0.1347000     1.913000  
1 1 1 5  21 58 o 7.428000 0.9214000 7.002000 1.439000  7.855000 1.151000  -0.8528000     1.843000  
1 1 1 5  21 60 o 13.09000 0.5527000 13.08000 0.8150000 13.10000 0.7467000 -0.1682000E-01 1.105000  
1 1 1 5  21 62 o 7.300000 0.7688000 7.236000 1.215000  7.365000 0.9425000 -0.1291000     1.538000  
1 1 1 5  21 64 f 5.801000 1.159000  6.237000 1.741000  5.364000 1.531000  0.8728000      2.318000  
1 1 1 5  22 1  o 31.43000 0.3037000 31.62000 0.4293000 31.25000 0.4298000 0.3653000      0.6075000 
1 1 1 5  22 3  o 30.21000 0.2791000 30.38000 0.3619000 30.03000 0.4249000 0.3515000      0.5581000 
1 1 1 5  22 5  o 69.38000 0.5258000 69.13000 0.6863000 69.64000 0.7966000 -0.5088000     1.052000  
1 1 1 5  22 7  o 56.87000 0.4201000 57.25000 0.5200000 56.49000 0.6600000 0.7523000      0.8402000 
1 1 1 5  22 9  o 60.73000 0.4476000 60.28000 0.5453000 61.18000 0.7099000 -0.9042000     0.8951000 
1 1 1 5  22 11 o 61.65000 0.6860000 60.78000 0.6164000 62.52000 1.226000  -1.734000      1.372000  
1 1 1 5  22 13 o 52.01000 0.4471000 52.06000 0.4870000 51.96000 0.7500000 0.1012000      0.8943000 
1 1 1 5  22 15 o 75.62000 0.6331000 75.35000 0.6721000 75.88000 1.073000  -0.5273000     1.266000  
1 1 1 5  22 17 o 96.33000 0.9436000 96.87000 1.335000  95.79000 1.334000  1.074000       1.887000  
1 1 1 5  22 19 o 43.01000 0.3464000 43.19000 0.4277000 42.83000 0.5451000 0.3618000      0.6929000 
1 1 1 5  22 21 o 72.03000 0.6650000 72.61000 1.041000  71.44000 0.8274000 1.179000       1.330000  
1 1 1 5  22 23 o 30.75000 0.2939000 31.04000 0.4534000 30.46000 0.3741000 0.5866000      0.5878000 
1 1 1 5  22 25 o 15.75000 0.3225000 15.99000 0.4860000 15.51000 0.4241000 0.4807000      0.6451000 
1 1 1 5  22 27 o 29.47000 0.3158000 29.14000 0.4560000 29.79000 0.4370000 -0.6502000     0.6316000 
1 1 1 5  22 29 o 23.83000 0.2941000 23.55000 0.4535000 24.11000 0.3746000 -0.5606000     0.5882000 
1 1 1 5  22 31 o 19.49000 0.3148000 19.69000 0.4830000 19.30000 0.4038000 0.3879000      0.6296000 
1 1 1 5  22 33 o 37.44000 0.3549000 37.61000 0.5247000 37.26000 0.4780000 0.3508000      0.7098000 
1 1 1 5  22 35 o 37.69000 0.3854000 37.65000 0.6437000 37.73000 0.4240000 -0.8605000E-01 0.7708000 
1 1 1 5  22 37 f 5.216000 1.081000  5.575000 1.733000  4.857000 1.292000  0.7181000      2.162000  
1 1 1 5  22 39 o 15.43000 0.4766000 16.44000 0.7240000 14.42000 0.6201000 2.024000       0.9532000 
1 1 1 5  22 41 o 27.98000 0.3383000 27.61000 0.5268000 28.34000 0.4246000 -0.7335000     0.6766000 
1 1 1 5  22 43 o 11.02000 0.5798000 10.94000 0.9189000 11.09000 0.7075000 -0.1540000     1.160000  
1 1 1 5  22 45 o 18.88000 0.3722000 18.95000 0.5804000 18.82000 0.4660000 0.1263000      0.7443000 
1 1 1 5  22 47 o 11.75000 0.5909000 11.70000 0.9090000 11.80000 0.7553000 -0.1083000     1.182000  
1 1 1 5  22 49 o 11.70000 0.4603000 11.34000 0.7164000 12.07000 0.5783000 -0.7310000     0.9207000 
1 1 1 5  22 51 f 12.42000 0.4557000 12.95000 0.6984000 11.89000 0.5855000 1.064000       0.9114000 
1 1 1 5  22 53 f 6.665000 0.8196000 7.626000 1.157000  5.705000 1.161000  1.922000       1.639000  
1 1 1 5  22 55 o 12.95000 0.5331000 12.80000 0.7567000 13.10000 0.7510000 -0.3010000     1.066000  
1 1 1 5  22 57 o 9.747000 0.8618000 9.347000 1.488000  10.15000 0.8695000 -0.8002000     1.724000  
1 1 1 5  22 59 o 3.378000 0.9421000 2.809000 1.316000  3.947000 1.348000  -1.138000      1.884000  
1 1 1 5  22 61 o 4.121000 1.025000  4.079000 1.531000  4.164000 1.362000  -0.8455000E-01 2.049000  
1 1 1 5  22 63 o 11.59000 0.5547000 12.47000 0.8611000 10.71000 0.6996000 1.765000       1.109000  
1 1 1 5  23 0  o 65.94000 0.7623000 65.94000 0.7623000 65.94000 0.7623000 0.000000       0.000000  
1 1 1 5  23 2  o 80.90000 0.6090000 80.59000 0.7932000 81.20000 0.9244000 -0.6150000     1.218000  
1 1 1 5  23 4  o 29.83000 0.3014000 29.79000 0.4323000 29.86000 0.4200000 -0.6529000E-01 0.6028000 
1 1 1 5  23 6  o 54.64000 0.4074000 54.90000 0.5023000 54.38000 0.6415000 0.5171000      0.8148000 
1 1 1 5  23 8  o 101.8000 0.8327000 100.7000 0.8792000 102.9000 1.414000  -2.285000      1.665000  
1 1 1 5  23 10 o 46.75000 0.4116000 46.25000 0.4419000 47.25000 0.6945000 -1.000000      0.8232000 
1 1 1 5  23 12 o 61.18000 0.4533000 61.00000 0.5552000 61.36000 0.7168000 -0.3557000     0.9066000 
1 1 1 5  23 14 o 70.89000 0.5967000 71.27000 0.6393000 70.52000 1.008000  0.7476000      1.193000  
1 1 1 5  23 16 o 27.20000 0.3421000 27.47000 0.3734000 26.93000 0.5732000 0.5403000      0.6841000 
1 1 1 5  23 18 o 67.05000 0.4930000 67.44000 0.6104000 66.67000 0.7744000 0.7703000      0.9860000 
1 1 1 5  23 20 o 63.50000 0.5884000 63.36000 0.9090000 63.63000 0.7474000 -0.2705000     1.177000  
1 1 1 5  23 22 f 41.77000 0.3335000 41.40000 0.4630000 42.14000 0.4802000 -0.7325000     0.6670000 
1 1 1 5  23 24 o 46.89000 0.3607000 47.11000 0.5073000 46.66000 0.5130000 0.4556000      0.7215000 
1 1 1 5  23 26 o 31.44000 0.3151000 31.50000 0.4626000 31.38000 0.4280000 0.1173000      0.6302000 
1 1 1 5  23 28 o 38.72000 0.3330000 39.38000 0.5187000 38.06000 0.4177000 1.316000       0.6660000 
1 1 1 5  23 30 o 30.54000 0.3013000 30.62000 0.4657000 30.46000 0.3824000 0.1568000      0.6026000 
1 1 1 5  23 32 o 23.33000 0.3027000 23.64000 0.4712000 23.02000 0.3803000 0.6200000      0.6055000 
1 1 1 5  23 34 o 38.73000 0.3914000 39.00000 0.6554000 38.46000 0.4280000 0.5447000      0.7827000 
1 1 1 5  23 36 o 27.12000 0.3248000 27.20000 0.5069000 27.04000 0.4063000 0.1626000      0.6497000 
1 1 1 5  23 38 o 40.65000 0.4108000 41.25000 0.6890000 40.04000 0.4477000 1.214000       0.8216000 
1 1 1 5  23 40 o 11.18000 0.5419000 10.88000 0.8966000 11.48000 0.6089000 -0.5981000     1.084000  
1 1 1 5  23 42 o 16.95000 0.4187000 16.71000 0.6228000 17.19000 0.5598000 -0.4791000     0.8374000 
1 1 1 5  23 44 o 22.17000 0.3521000 21.60000 0.5362000 22.74000 0.4565000 -1.141000      0.7042000 
1 1 1 5  23 46 o 5.122000 1.076000  4.492000 1.717000  5.752000 1.298000  -1.260000      2.152000  
1 1 1 5  23 48 o 13.04000 0.4299000 12.93000 0.6669000 13.15000 0.5428000 -0.2261000     0.8599000 
1 1 1 5  23 50 o 4.324000 1.023000  4.279000 1.559000  4.369000 1.325000  -0.9040000E-01 2.046000  
1 1 1 5  23 52 o 7.115000 0.7527000 5.867000 1.295000  8.364000 0.7672000 -2.497000      1.505000  
1 1 1 5  23 54 o 3.518000 0.9758000 3.733000 1.473000  3.304000 1.280000  0.4283000      1.952000  
1 1 1 5  23 56 o 13.62000 0.5254000 13.78000 0.8741000 13.45000 0.5833000 0.3307000      1.051000  
1 1 1 5  23 58 o 9.879000 0.6506000 10.31000 1.001000  9.447000 0.8312000 0.8653000      1.301000  
1 1 1 5  23 60 o 2.761000 0.8821000 2.799000 1.299000  2.724000 1.194000  0.7438000E-01  1.764000  
1 1 1 5  23 62 o 3.424000 0.9998000 3.581000 1.573000  3.267000 1.235000  0.3148000      2.000000  
1 1 1 5  24 1  o 33.22000 0.2755000 33.16000 0.3872000 33.27000 0.3921000 -0.1118000     0.5510000 
1 1 1 5  24 3  o 26.12000 0.3267000 25.62000 0.3569000 26.63000 0.5474000 -1.012000      0.6535000 
1 1 1 5  24 5  o 88.87000 0.7266000 89.12000 0.7811000 88.63000 1.226000  0.4862000      1.453000  
1 1 1 5  24 7  f 30.98000 0.2908000 31.42000 0.3851000 30.54000 0.4358000 0.8723000      0.5816000 
1 1 1 5  24 9  o 89.91000 0.7368000 89.66000 0.7875000 90.16000 1.246000  -0.5030000     1.474000  
1 1 1 5  24 11 o 98.56000 0.7054000 97.29000 0.8521000 99.83000 1.125000  -2.539000      1.411000  
1 1 1 5  24 13 o 65.93000 0.5596000 65.68000 0.5931000 66.17000 0.9491000 -0.4872000     1.119000  
1 1 1 5  24 15 o 2.981000 0.8866000 2.270000 1.012000  3.691000 1.456000  -1.421000      1.773000  
1 1 1 5  24 17 o 41.40000 0.3508000 41.34000 0.4593000 41.46000 0.5305000 -0.1228000     0.7017000 
1 1 1 5  24 19 o 13.62000 0.3425000 13.64000 0.4394000 13.60000 0.5256000 0.4597000E-01  0.6850000 
1 1 1 5  24 21 o 44.68000 0.3758000 44.85000 0.5001000 44.50000 0.5611000 0.3448000      0.7516000 
1 1 1 5  24 23 o 5.284000 0.8619000 5.551000 1.242000  5.017000 1.196000  0.5345000      1.724000  
1 1 1 5  24 25 o 25.64000 0.3051000 26.28000 0.3889000 25.00000 0.4701000 1.277000       0.6101000 
1 1 1 5  24 27 o 18.16000 0.3000000 18.90000 0.4005000 17.41000 0.4467000 1.492000       0.5999000 
1 1 1 5  24 29 o 19.12000 0.3160000 19.18000 0.4694000 19.05000 0.4231000 0.1296000      0.6320000 
1 1 1 5  24 31 o 16.65000 0.3511000 16.06000 0.5443000 17.25000 0.4438000 -1.193000      0.7023000 
1 1 1 5  24 33 o 50.50000 0.4247000 50.64000 0.6312000 50.36000 0.5685000 0.2770000      0.8494000 
1 1 1 5  24 35 o 24.19000 0.3298000 24.33000 0.5163000 24.04000 0.4105000 0.2937000      0.6597000 
1 1 1 5  24 37 o 15.15000 0.5152000 14.50000 0.8983000 15.80000 0.5049000 -1.305000      1.030000  
1 1 1 5  24 39 o 10.66000 0.5383000 11.23000 0.8100000 10.09000 0.7092000 1.141000       1.077000  
1 1 1 5  24 41 o 16.84000 0.4169000 16.24000 0.6090000 17.44000 0.5694000 -1.202000      0.8337000 
1 1 1 5  24 43 o 15.46000 0.4422000 15.80000 0.6287000 15.11000 0.6220000 0.6935000      0.8844000 
1 1 1 5  24 45 o 12.57000 0.4824000 13.21000 0.6717000 11.92000 0.6926000 1.293000       0.9648000 
1 1 1 5  24 47 o 16.28000 0.4109000 16.54000 0.5960000 16.02000 0.5659000 0.5236000      0.8219000 
1 1 1 5  24 49 o 11.82000 0.4497000 12.08000 0.6909000 11.56000 0.5759000 0.5225000      0.8994000 
1 1 1 5  24 51 f 12.29000 0.5099000 12.44000 0.8264000 12.13000 0.5975000 0.3074000      1.020000  
1 1 1 5  24 53 f 9.543000 0.6003000 8.624000 0.9697000 10.46000 0.7081000 -1.838000      1.201000  
1 1 1 5  24 55 o 7.752000 0.8488000 6.180000 1.481000  9.324000 0.8303000 -3.144000      1.698000  
1 1 1 5  24 57 o 4.345000 1.055000  4.353000 1.587000  4.337000 1.392000  0.1677000E-01  2.111000  
1 1 1 5  24 59 o 3.969000 1.018000  5.013000 1.585000  2.926000 1.278000  2.087000       2.036000  
1 1 1 5  24 61 o 6.195000 1.044000  6.442000 1.668000  5.948000 1.255000  0.4940000      2.087000  
1 1 1 5  25 0  o 42.38000 0.4590000 42.38000 0.4590000 42.38000 0.4590000 0.000000       0.000000  
1 1 1 5  25 2  o 46.01000 0.3736000 45.86000 0.4866000 46.16000 0.5670000 -0.3015000     0.7472000 
1 1 1 5  25 4  o 42.63000 0.4256000 42.26000 0.5306000 42.99000 0.6657000 -0.7304000     0.8513000 
1 1 1 5  25 6  o 40.50000 0.3803000 41.34000 0.4076000 39.65000 0.6421000 1.689000       0.7606000 
1 1 1 5  25 8  o 30.49000 0.4271000 30.55000 0.3445000 30.42000 0.7815000 0.1328000      0.8541000 
1 1 1 5  25 10 o 48.47000 0.5734000 48.01000 0.4609000 48.93000 1.050000  -0.9182000     1.147000  
1 1 1 5  25 12 o 75.26000 0.6322000 74.36000 0.6629000 76.15000 1.077000  -1.789000      1.264000  
1 1 1 5  25 14 o 44.09000 0.4191000 44.53000 0.4809000 43.66000 0.6865000 0.8752000      0.8382000 
1 1 1 5  25 16 o 41.24000 0.3507000 41.55000 0.4630000 40.92000 0.5269000 0.6305000      0.7014000 
1 1 1 5  25 18 o 44.51000 0.3715000 44.55000 0.4904000 44.47000 0.5582000 0.7933000E-01  0.7431000 
1 1 1 5  25 20 o 10.73000 0.4501000 11.07000 0.6450000 10.39000 0.6279000 0.6832000      0.9001000 
1 1 1 5  25 22 o 29.04000 0.2870000 28.86000 0.3527000 29.23000 0.4528000 -0.3610000     0.5740000 
1 1 1 5  25 24 o 18.12000 0.3183000 17.95000 0.4016000 18.28000 0.4938000 -0.3277000     0.6365000 
1 1 1 5  25 26 o 37.01000 0.3778000 36.61000 0.6007000 37.41000 0.4585000 -0.8034000     0.7557000 
1 1 1 5  25 28 f 45.89000 0.3887000 45.93000 0.5075000 45.85000 0.5888000 0.7957000E-01  0.7773000 
1 1 1 5  25 30 o 5.705000 0.8500000 5.505000 1.247000  5.905000 1.156000  -0.3997000     1.700000  
1 1 1 5  25 32 o 6.725000 0.7440000 7.974000 0.8659000 5.476000 1.210000  2.498000       1.488000  
1 1 1 5  25 34 o 9.439000 0.6806000 9.061000 1.181000  9.817000 0.6765000 -0.7562000     1.361000  
1 1 1 5  25 36 o 19.20000 0.3469000 19.50000 0.5458000 18.90000 0.4282000 0.5925000      0.6937000 
1 1 1 5  25 38 o 7.224000 0.9263000 7.217000 1.550000  7.231000 1.015000  -0.1382000E-01 1.853000  
1 1 1 5  25 40 o 10.69000 0.5701000 10.64000 0.9044000 10.74000 0.6942000 -0.9957000E-01 1.140000  
1 1 1 5  25 42 o 9.354000 0.6927000 8.305000 1.118000  10.40000 0.8175000 -2.099000      1.385000  
1 1 1 5  25 44 o 3.399000 0.9755000 3.774000 1.477000  3.024000 1.274000  0.7495000      1.951000  
1 1 1 5  25 46 o 3.557000 0.9551000 3.144000 1.343000  3.971000 1.358000  -0.8273000     1.910000  
1 1 1 5  25 48 o 4.675000 0.9190000 5.788000 1.369000  3.563000 1.226000  2.225000       1.838000  
1 1 1 5  25 50 o 5.370000 0.9606000 6.579000 1.375000  4.162000 1.342000  2.417000       1.921000  
1 1 1 5  25 52 o 13.16000 0.4599000 13.06000 0.6928000 13.25000 0.6051000 -0.1851000     0.9199000 
1 1 1 5  25 54 o 13.93000 0.4912000 14.47000 0.6511000 13.39000 0.7357000 1.079000       0.9824000 
1 1 1 5  25 56 o 6.025000 1.005000  4.799000 1.791000  7.251000 0.9122000 -2.453000      2.010000  
1 1 1 5  25 58 o 3.418000 0.9666000 3.243000 1.425000  3.593000 1.306000  -0.3499000     1.933000  
1 1 1 5  25 60 o 11.06000 0.5719000 11.72000 0.9038000 10.40000 0.7010000 1.328000       1.144000  
1 1 1 5  25 62 o 4.726000 1.122000  5.007000 1.774000  4.446000 1.375000  0.5617000      2.245000  
1 1 1 5  26 1  o 79.96000 0.7202000 79.94000 0.9103000 79.98000 1.116000  -0.3309000E-01 1.440000  
1 1 1 5  26 3  o 45.28000 0.3726000 45.46000 0.5664000 45.10000 0.4842000 0.3636000      0.7452000 
1 1 1 5  26 5  o 13.14000 0.5173000 13.67000 0.4204000 12.62000 0.9453000 1.046000       1.035000  
1 1 1 5  26 7  f 37.20000 0.4730000 37.88000 0.3877000 36.53000 0.8628000 1.353000       0.9459000 
1 1 1 5  26 9  o 64.46000 0.5462000 65.05000 0.5888000 63.87000 0.9202000 1.183000       1.092000  
1 1 1 5  26 11 o 27.36000 0.3235000 27.46000 0.3433000 27.27000 0.5483000 0.1871000      0.6469000 
1 1 1 5  26 13 o 51.91000 0.4758000 51.52000 0.5388000 52.29000 0.7845000 -0.7659000     0.9517000 
1 1 1 5  26 15 o 116.4000 0.9254000 116.1000 1.307000  116.8000 1.311000  -0.6969000     1.851000  
1 1 1 5  26 17 o 124.7000 0.9267000 123.8000 1.205000  125.7000 1.408000  -1.886000      1.853000  
1 1 1 5  26 19 o 31.12000 0.3703000 31.07000 0.5814000 31.17000 0.4587000 -0.9596000E-01 0.7406000 
1 1 1 5  26 21 f 34.65000 0.3075000 34.51000 0.3800000 34.79000 0.4836000 -0.2828000     0.6150000 
1 1 1 5  26 23 f 8.809000 0.4845000 8.515000 0.6392000 9.104000 0.7281000 -0.5895000     0.9689000 
1 1 1 5  26 25 o 17.75000 0.3006000 17.77000 0.4102000 17.72000 0.4393000 0.5391000E-01  0.6011000 
1 1 1 5  26 27 o 16.23000 0.3396000 16.05000 0.4415000 16.40000 0.5161000 -0.3588000     0.6792000 
1 1 1 5  26 29 o 15.50000 0.3996000 15.40000 0.6213000 15.60000 0.5027000 -0.2026000     0.7992000 
1 1 1 5  26 31 o 30.01000 0.3207000 30.59000 0.4261000 29.43000 0.4794000 1.155000       0.6414000 
1 1 1 5  26 33 o 32.11000 0.3682000 31.65000 0.5179000 32.56000 0.5234000 -0.9070000     0.7363000 
1 1 1 5  26 35 o 27.22000 0.3118000 27.12000 0.4417000 27.31000 0.4402000 -0.1893000     0.6236000 
1 1 1 5  26 37 o 19.06000 0.4443000 17.78000 0.7347000 20.34000 0.4998000 -2.564000      0.8886000 
1 1 1 5  26 39 o 28.84000 0.3488000 29.08000 0.5276000 28.60000 0.4563000 0.4798000      0.6975000 
1 1 1 5  26 41 o 24.58000 0.3867000 24.40000 0.5342000 24.76000 0.5592000 -0.3638000     0.7734000 
1 1 1 5  26 43 o 28.57000 0.3462000 28.30000 0.5076000 28.84000 0.4709000 -0.5354000     0.6924000 
1 1 1 5  26 45 o 5.687000 1.009000  5.850000 1.661000  5.525000 1.146000  0.3253000      2.018000  
1 1 1 5  26 47 o 11.45000 0.4953000 11.10000 0.8174000 11.79000 0.5596000 -0.6931000     0.9906000 
1 1 1 5  26 49 o 4.766000 0.9596000 4.607000 1.493000  4.924000 1.206000  -0.3176000     1.919000  
1 1 1 5  26 51 o 17.58000 0.4837000 17.56000 0.8432000 17.60000 0.4740000 -0.4666000E-01 0.9673000 
1 1 1 5  26 53 o 4.035000 1.034000  3.558000 1.403000  4.512000 1.519000  -0.9544000     2.067000  
1 1 1 5  26 55 o 11.50000 0.6627000 11.15000 1.061000  11.86000 0.7947000 -0.7107000     1.325000  
1 1 1 5  26 57 o 7.334000 0.7783000 7.423000 1.141000  7.244000 1.059000  0.1785000      1.557000  
1 1 1 5  26 59 o 6.276000 0.8403000 6.600000 1.145000  5.952000 1.231000  0.6478000      1.681000  
1 1 1 5  26 61 o 5.875000 0.9279000 6.075000 1.350000  5.674000 1.274000  0.4017000      1.856000  
1 1 1 5  27 0  o 30.46000 0.4542000 30.46000 0.4542000 30.46000 0.4542000 0.000000       0.000000  
1 1 1 5  27 2  o 98.89000 0.7881000 99.10000 1.117000  98.68000 1.112000  0.4190000      1.576000  
1 1 1 5  27 4  o 24.07000 0.2728000 24.40000 0.3671000 23.73000 0.4038000 0.6703000      0.5457000 
1 1 1 5  27 6  o 20.00000 0.2662000 20.14000 0.3352000 19.85000 0.4135000 0.2862000      0.5323000 
1 1 1 5  27 8  o 48.47000 0.3748000 48.37000 0.4595000 48.58000 0.5923000 -0.2066000     0.7497000 
1 1 1 5  27 10 o 87.57000 0.6585000 87.72000 0.8634000 87.42000 0.9944000 0.2977000      1.317000  
1 1 1 5  27 12 o 35.05000 0.3575000 34.16000 0.4117000 35.93000 0.5846000 -1.770000      0.7150000 
1 1 1 5  27 14 o 50.95000 0.4382000 50.48000 0.6175000 51.42000 0.6220000 -0.9427000     0.8765000 
1 1 1 5  27 16 o 36.87000 0.3300000 36.30000 0.4305000 37.43000 0.5002000 -1.133000      0.6599000 
1 1 1 5  27 18 o 12.34000 0.3985000 12.65000 0.5883000 12.03000 0.5376000 0.6131000      0.7970000 
1 1 1 5  27 20 o 24.38000 0.2941000 24.84000 0.4009000 23.93000 0.4303000 0.9130000      0.5881000 
1 1 1 5  27 22 o 24.09000 0.3315000 24.21000 0.3856000 23.96000 0.5392000 0.2466000      0.6629000 
1 1 1 5  27 24 o 27.89000 0.2839000 27.97000 0.3934000 27.82000 0.4093000 0.1515000      0.5678000 
1 1 1 5  27 26 o 16.85000 0.3437000 17.04000 0.4670000 16.67000 0.5043000 0.3670000      0.6873000 
1 1 1 5  27 28 o 35.11000 0.3121000 35.38000 0.4375000 34.83000 0.4451000 0.5464000      0.6241000 
1 1 1 5  27 30 o 18.31000 0.3426000 18.69000 0.4503000 17.92000 0.5166000 0.7723000      0.6853000 
1 1 1 5  27 32 o 30.60000 0.4011000 30.66000 0.6081000 30.54000 0.5231000 0.1177000      0.8021000 
1 1 1 5  27 34 f 23.55000 0.3206000 23.64000 0.4548000 23.45000 0.4519000 0.1876000      0.6412000 
1 1 1 5  27 36 o 3.070000 0.9448000 3.732000 1.511000  2.408000 1.134000  1.324000       1.890000  
1 1 1 5  27 38 o 4.029000 1.002000  3.302000 1.398000  4.756000 1.435000  -1.454000      2.003000  
1 1 1 5  27 40 o 9.003000 0.6836000 9.224000 0.8815000 8.782000 1.045000  0.4419000      1.367000  
1 1 1 5  27 42 o 21.04000 0.3511000 21.19000 0.5253000 20.89000 0.4662000 0.2964000      0.7023000 
1 1 1 5  27 44 o 12.95000 0.4234000 11.94000 0.5932000 13.97000 0.6042000 -2.024000      0.8467000 
1 1 1 5  27 46 o 8.345000 0.5754000 8.128000 0.8519000 8.562000 0.7738000 -0.4340000     1.151000  
1 1 1 5  27 48 o 3.640000 0.9184000 3.084000 1.249000  4.197000 1.346000  -1.114000      1.837000  
1 1 1 5  27 50 o 13.90000 0.4614000 13.35000 0.6666000 14.45000 0.6381000 -1.105000      0.9228000 
1 1 1 5  27 52 o 10.33000 0.5456000 9.782000 0.7284000 10.88000 0.8124000 -1.095000      1.091000  
1 1 1 5  27 54 o 13.60000 0.5614000 13.50000 0.6018000 13.70000 0.9479000 -0.2003000     1.123000  
1 1 1 5  27 56 o 5.787000 0.9664000 5.389000 1.405000  6.184000 1.327000  -0.7951000     1.933000  
1 1 1 5  27 58 o 6.286000 0.9136000 6.214000 1.318000  6.358000 1.266000  -0.1440000     1.827000  
1 1 1 5  27 60 o 9.807000 0.6328000 8.946000 0.9674000 10.67000 0.8161000 -1.722000      1.266000  
1 1 1 5  28 1  o 28.52000 0.3755000 28.11000 0.5327000 28.93000 0.5293000 -0.8131000     0.7510000 
1 1 1 5  28 3  o 55.75000 0.4679000 54.87000 0.6540000 56.63000 0.6693000 -1.758000      0.9357000 
1 1 1 5  28 5  o 24.16000 0.2719000 24.23000 0.4086000 24.10000 0.3589000 0.1261000      0.5438000 
1 1 1 5  28 7  o 7.841000 0.4854000 6.981000 0.6735000 8.701000 0.6990000 -1.721000      0.9707000 
1 1 1 5  28 9  o 41.25000 0.3481000 40.80000 0.4501000 41.70000 0.5310000 -0.8979000     0.6962000 
1 1 1 5  28 11 o 23.15000 0.2867000 22.84000 0.3802000 23.46000 0.4293000 -0.6179000     0.5735000 
1 1 1 5  28 13 o 46.76000 0.4112000 46.89000 0.5865000 46.64000 0.5765000 0.2487000      0.8224000 
1 1 1 5  28 15 o 17.32000 0.3096000 17.77000 0.4351000 16.88000 0.4407000 0.8944000      0.6193000 
1 1 1 5  28 17 o 58.03000 0.4911000 58.02000 0.6997000 58.04000 0.6894000 -0.1736000E-01 0.9822000 
1 1 1 5  28 19 o 34.74000 0.3241000 34.98000 0.4351000 34.50000 0.4806000 0.4859000      0.6483000 
1 1 1 5  28 21 o 46.28000 0.4170000 46.56000 0.4550000 46.00000 0.6990000 0.5660000      0.8340000 
1 1 1 5  28 23 o 21.32000 0.2947000 21.49000 0.3803000 21.15000 0.4503000 0.3355000      0.5894000 
1 1 1 5  28 25 o 46.69000 0.3915000 46.50000 0.5077000 46.89000 0.5961000 -0.3884000     0.7830000 
1 1 1 5  28 27 o 19.43000 0.2989000 19.24000 0.4102000 19.62000 0.4349000 -0.3783000     0.5978000 
1 1 1 5  28 29 o 9.914000 0.5393000 9.392000 0.7803000 10.43000 0.7447000 -1.042000      1.079000  
1 1 1 5  28 31 o 15.53000 0.3813000 16.08000 0.5208000 14.98000 0.5571000 1.103000       0.7627000 
1 1 1 5  28 33 o 17.84000 0.3953000 18.22000 0.4926000 17.46000 0.6185000 0.7537000      0.7907000 
1 1 1 5  28 35 o 20.06000 0.4129000 19.66000 0.6782000 20.47000 0.4714000 -0.8144000     0.8259000 
1 1 1 5  28 37 f 6.342000 1.008000  4.994000 1.743000  7.690000 1.014000  -2.695000      2.016000  
1 1 1 5  28 39 o 19.39000 0.3684000 18.60000 0.5292000 20.17000 0.5128000 -1.576000      0.7369000 
1 1 1 5  28 41 o 8.261000 0.7601000 8.892000 1.031000  7.629000 1.118000  1.263000       1.520000  
1 1 1 5  28 43 o 26.36000 0.3406000 26.22000 0.4477000 26.51000 0.5135000 -0.2900000     0.6813000 
1 1 1 5  28 45 o 13.78000 0.4118000 13.77000 0.5823000 13.78000 0.5826000 -0.7303000E-02 0.8237000 
1 1 1 5  28 47 o 9.754000 0.5557000 9.136000 0.8018000 10.37000 0.7696000 -1.236000      1.111000  
1 1 1 5  28 49 o 4.670000 0.9800000 4.818000 1.380000  4.523000 1.392000  0.2950000      1.960000  
1 1 1 5  28 51 o 14.26000 0.4374000 15.11000 0.6492000 13.42000 0.5864000 1.692000       0.8748000 
1 1 1 5  28 53 o 3.657000 0.9990000 3.160000 1.291000  4.154000 1.525000  -0.9942000     1.998000  
1 1 1 5  28 55 o 5.583000 0.8744000 6.850000 0.9601000 4.317000 1.462000  2.533000       1.749000  
1 1 1 5  28 57 o 3.455000 0.9505000 3.884000 1.398000  3.026000 1.289000  0.8584000      1.901000  
1 1 1 5  28 59 o 7.019000 0.8571000 7.559000 1.085000  6.478000 1.327000  1.081000       1.714000  
1 1 1 5  29 0  o 12.12000 0.4892000 12.12000 0.4892000 12.12000 0.4892000 0.000000       0.000000  
1 1 1 5  29 2  o 52.96000 0.4776000 52.37000 0.7758000 53.54000 0.5573000 -1.170000      0.9552000 
1 1 1 5  29 4  o 43.57000 0.4176000 43.32000 0.6845000 43.81000 0.4784000 -0.4929000     0.8351000 
1 1 1 5  29 6  o 24.39000 0.3362000 23.79000 0.4436000 24.99000 0.5054000 -1.200000      0.6724000 
1 1 1 5  29 8  f 17.28000 0.3099000 17.55000 0.4334000 17.01000 0.4432000 0.5375000      0.6198000 
1 1 1 5  29 10 o 45.83000 0.3789000 46.50000 0.5057000 45.16000 0.5644000 1.340000       0.7578000 
1 1 1 5  29 12 o 37.87000 0.4138000 37.93000 0.6567000 37.82000 0.5036000 0.1005000      0.8276000 
1 1 1 5  29 14 o 82.11000 0.5948000 82.10000 0.7304000 82.13000 0.9391000 -0.3489000E-01 1.190000  
1 1 1 5  29 16 o 70.72000 0.5451000 70.43000 0.7151000 71.02000 0.8229000 -0.5926000     1.090000  
1 1 1 5  29 18 o 22.45000 0.2942000 22.75000 0.4007000 22.14000 0.4310000 0.6115000      0.5885000 
1 1 1 5  29 20 o 43.71000 0.4045000 43.62000 0.4362000 43.80000 0.6814000 -0.1817000     0.8090000 
1 1 1 5  29 22 o 7.603000 0.5439000 8.278000 0.6017000 6.927000 0.9062000 1.351000       1.088000  
1 1 1 5  29 24 o 14.88000 0.3475000 14.17000 0.4490000 15.58000 0.5305000 -1.410000      0.6950000 
1 1 1 5  29 26 o 18.04000 0.3033000 17.87000 0.4163000 18.21000 0.4413000 -0.3431000     0.6067000 
1 1 1 5  29 28 o 26.62000 0.3299000 26.36000 0.4593000 26.89000 0.4735000 -0.5361000     0.6597000 
1 1 1 5  29 30 o 15.55000 0.3614000 16.12000 0.4927000 14.99000 0.5287000 1.127000       0.7227000 
1 1 1 5  29 32 o 12.93000 0.4708000 13.47000 0.5702000 12.39000 0.7493000 1.084000       0.9416000 
1 1 1 5  29 34 o 12.32000 0.4451000 12.52000 0.6395000 12.13000 0.6193000 0.3834000      0.8902000 
1 1 1 5  29 36 o 13.04000 0.5526000 14.14000 0.8784000 11.93000 0.6707000 2.216000       1.105000  
1 1 1 5  29 38 o 11.16000 0.6443000 12.13000 1.011000  10.18000 0.7994000 1.944000       1.289000  
1 1 1 5  29 40 o 4.006000 1.045000  3.627000 1.421000  4.386000 1.532000  -0.7591000     2.090000  
1 1 1 5  29 42 o 18.70000 0.3678000 18.72000 0.4997000 18.67000 0.5399000 0.5175000E-01  0.7357000 
1 1 1 5  29 44 o 4.122000 0.9834000 4.113000 1.378000  4.131000 1.403000  -0.1714000E-01 1.967000  
1 1 1 5  29 46 o 18.18000 0.3580000 17.62000 0.5291000 18.75000 0.4824000 -1.128000      0.7160000 
1 1 1 5  29 48 o 12.97000 0.4384000 13.63000 0.6031000 12.31000 0.6365000 1.322000       0.8768000 
1 1 1 5  29 50 o 8.226000 0.7813000 8.852000 1.259000  7.600000 0.9256000 1.252000       1.563000  
1 1 1 5  29 52 o 8.372000 0.6808000 8.771000 1.025000  7.973000 0.8964000 0.7985000      1.362000  
1 1 1 5  29 54 o 3.941000 1.055000  4.495000 1.618000  3.387000 1.355000  1.108000       2.111000  
1 1 1 5  29 56 o 3.363000 0.9480000 2.966000 1.274000  3.759000 1.404000  -0.7934000     1.896000  
1 1 1 5  29 58 o 5.778000 0.8616000 6.083000 1.140000  5.472000 1.292000  0.6113000      1.723000  
1 1 1 5  29 60 o 4.002000 1.003000  3.161000 1.303000  4.842000 1.524000  -1.681000      2.005000  
1 1 1 5  30 1  o 13.92000 0.3136000 13.71000 0.4526000 14.14000 0.4341000 -0.4251000     0.6271000 
1 1 1 5  30 3  o 39.22000 0.3148000 38.95000 0.4453000 39.48000 0.4450000 -0.5284000     0.6295000 
1 1 1 5  30 5  o 9.863000 0.4579000 10.46000 0.7131000 9.266000 0.5746000 1.193000       0.9159000 
1 1 1 5  30 7  o 53.97000 0.4610000 54.58000 0.6600000 53.37000 0.6439000 1.202000       0.9220000 
1 1 1 5  30 9  f 49.89000 0.4564000 49.33000 0.5228000 50.45000 0.7483000 -1.119000      0.9129000 
1 1 1 5  30 11 o 41.45000 0.3404000 40.72000 0.4137000 42.18000 0.5407000 -1.467000      0.6808000 
1 1 1 5  30 13 o 36.58000 0.3325000 36.82000 0.4501000 36.33000 0.4895000 0.4896000      0.6650000 
1 1 1 5  30 15 o 36.42000 0.3340000 36.10000 0.4461000 36.74000 0.4973000 -0.6349000     0.6680000 
1 1 1 5  30 17 o 19.58000 0.3033000 20.19000 0.4189000 18.98000 0.4386000 1.201000       0.6066000 
1 1 1 5  30 19 o 17.51000 0.3243000 17.56000 0.3706000 17.47000 0.5323000 0.8623000E-01  0.6486000 
1 1 1 5  30 21 o 34.45000 0.3092000 34.67000 0.3847000 34.23000 0.4843000 0.4407000      0.6185000 
1 1 1 5  30 23 o 23.76000 0.3197000 24.17000 0.3510000 23.36000 0.5343000 0.8130000      0.6393000 
1 1 1 5  30 25 o 21.17000 0.2881000 21.11000 0.3939000 21.22000 0.4205000 -0.1109000     0.5761000 
1 1 1 5  30 27 o 23.54000 0.3293000 23.53000 0.4546000 23.55000 0.4764000 -0.2312000E-01 0.6585000 
1 1 1 5  30 29 o 23.52000 0.3025000 23.38000 0.4220000 23.65000 0.4336000 -0.2690000     0.6051000 
1 1 1 5  30 31 o 32.91000 0.3425000 32.49000 0.5062000 33.32000 0.4614000 -0.8289000     0.6849000 
1 1 1 5  30 33 o 14.05000 0.4016000 14.02000 0.5588000 14.07000 0.5771000 -0.4337000E-01 0.8033000 
1 1 1 5  30 35 o 21.83000 0.3611000 22.06000 0.5465000 21.59000 0.4722000 0.4720000      0.7222000 
1 1 1 5  30 37 o 21.01000 0.3733000 21.37000 0.5714000 20.64000 0.4806000 0.7211000      0.7466000 
1 1 1 5  30 39 o 17.21000 0.3637000 17.95000 0.5252000 16.47000 0.5032000 1.472000       0.7274000 
1 1 1 5  30 41 o 8.763000 0.7785000 9.008000 1.188000  8.519000 1.007000  0.4897000      1.557000  
1 1 1 5  30 43 o 17.19000 0.3929000 17.24000 0.5894000 17.15000 0.5197000 0.8964000E-01  0.7858000 
1 1 1 5  30 45 o 3.445000 0.9697000 3.931000 1.489000  2.960000 1.242000  0.9714000      1.939000  
1 1 1 5  30 47 o 20.81000 0.3660000 21.00000 0.4739000 20.61000 0.5580000 0.3922000      0.7321000 
1 1 1 5  30 49 o 18.25000 0.3685000 17.99000 0.5383000 18.52000 0.5034000 -0.5264000     0.7370000 
1 1 1 5  30 51 o 3.504000 0.9797000 3.184000 1.401000  3.823000 1.369000  -0.6390000     1.959000  
1 1 1 5  30 53 o 12.05000 0.5790000 12.15000 0.8435000 11.96000 0.7934000 0.1908000      1.158000  
1 1 1 5  30 55 o 3.254000 0.9493000 2.485000 1.176000  4.024000 1.490000  -1.539000      1.899000  
1 1 1 5  30 57 o 3.395000 0.9648000 3.516000 1.421000  3.274000 1.306000  0.2426000      1.930000  
1 1 1 5  30 59 o 8.721000 0.6935000 9.303000 0.8480000 8.139000 1.098000  1.164000       1.387000  
1 1 1 5  31 0  o 67.22000 0.6772000 67.22000 0.6772000 67.22000 0.6772000 0.000000       0.000000  
1 1 1 5  31 2  o 34.33000 0.3371000 34.28000 0.4699000 34.39000 0.4834000 -0.1040000     0.6741000 
1 1 1 5  31 4  o 28.72000 0.2886000 28.53000 0.4313000 28.92000 0.3836000 -0.3876000     0.5772000 
1 1 1 5  31 6  o 13.33000 0.3442000 12.66000 0.5535000 13.99000 0.4093000 -1.325000      0.6884000 
1 1 1 5  31 8  o 41.07000 0.3573000 40.36000 0.4642000 41.79000 0.5433000 -1.429000      0.7146000 
1 1 1 5  31 10 o 60.60000 0.4767000 60.55000 0.6291000 60.65000 0.7165000 -0.9876000E-01 0.9535000 
1 1 1 5  31 12 f 65.20000 0.6031000 65.66000 0.7753000 64.74000 0.9240000 0.9289000      1.206000  
1 1 1 5  31 14 o 50.24000 0.4097000 51.02000 0.5502000 49.47000 0.6071000 1.552000       0.8193000 
1 1 1 5  31 16 o 43.23000 0.3991000 42.70000 0.4282000 43.76000 0.6736000 -1.060000      0.7982000 
1 1 1 5  31 18 o 39.72000 0.3778000 39.89000 0.4148000 39.55000 0.6315000 0.3396000      0.7556000 
1 1 1 5  31 20 o 47.86000 0.3816000 47.73000 0.4704000 47.99000 0.6009000 -0.2622000     0.7632000 
1 1 1 5  31 22 o 46.29000 0.4197000 46.21000 0.4588000 46.37000 0.7030000 -0.1501000     0.8394000 
1 1 1 5  31 24 o 19.85000 0.2921000 19.98000 0.4025000 19.71000 0.4234000 0.2684000      0.5842000 
1 1 1 5  31 26 o 19.86000 0.3381000 20.12000 0.4553000 19.60000 0.4999000 0.5203000      0.6762000 
1 1 1 5  31 28 o 3.277000 0.8972000 3.023000 1.228000  3.530000 1.308000  -0.5061000     1.794000  
1 1 1 5  31 30 o 11.87000 0.4519000 11.83000 0.6701000 11.91000 0.6065000 -0.8685000E-01 0.9039000 
1 1 1 5  31 32 f 33.53000 0.3578000 34.14000 0.4621000 32.93000 0.5466000 1.202000       0.7157000 
1 1 1 5  31 34 o 23.46000 0.3303000 23.46000 0.4712000 23.46000 0.4630000 0.1055000E-02  0.6607000 
1 1 1 5  31 36 o 14.35000 0.4388000 14.30000 0.6642000 14.40000 0.5736000 -0.1023000     0.8776000 
1 1 1 5  31 38 o 18.70000 0.3549000 18.49000 0.5144000 18.90000 0.4891000 -0.4163000     0.7098000 
1 1 1 5  31 40 o 10.73000 0.5583000 11.09000 0.8083000 10.37000 0.7705000 0.7156000      1.117000  
1 1 1 5  31 42 o 6.139000 0.9036000 6.586000 1.299000  5.692000 1.257000  0.8937000      1.807000  
1 1 1 5  31 44 o 9.466000 0.6261000 8.594000 1.013000  10.34000 0.7354000 -1.744000      1.252000  
1 1 1 5  31 46 o 11.59000 0.5151000 11.47000 0.7932000 11.71000 0.6573000 -0.2385000     1.030000  
1 1 1 5  31 48 o 17.25000 0.3596000 17.04000 0.5298000 17.45000 0.4865000 -0.4079000     0.7193000 
1 1 1 5  31 50 o 5.393000 1.103000  5.890000 1.643000  4.896000 1.473000  0.9944000      2.206000  
1 1 1 5  31 52 o 10.57000 0.6018000 10.65000 0.7775000 10.49000 0.9187000 0.1545000      1.204000  
1 1 1 5  31 54 o 6.230000 0.9118000 6.198000 1.336000  6.262000 1.241000  -0.6410000E-01 1.824000  
1 1 1 5  31 56 o 3.583000 0.9561000 3.252000 1.384000  3.914000 1.319000  -0.6622000     1.912000  
1 1 1 5  31 58 o 3.788000 1.024000  3.754000 1.466000  3.823000 1.431000  -0.6886000E-01 2.049000  
1 1 1 5  32 1  o 66.38000 0.5466000 66.25000 0.7720000 66.51000 0.7739000 -0.2660000     1.093000  
1 1 1 5  32 3  o 13.41000 0.3332000 12.86000 0.5022000 13.97000 0.4380000 -1.110000      0.6664000 
1 1 1 5  32 5  o 38.04000 0.3112000 38.03000 0.4402000 38.05000 0.4401000 -0.1375000E-01 0.6224000 
1 1 1 5  32 7  o 46.70000 0.3693000 46.33000 0.4491000 47.08000 0.5864000 -0.7531000     0.7386000 
1 1 1 5  32 9  o 49.54000 0.3875000 49.13000 0.4717000 49.96000 0.6149000 -0.8359000     0.7750000 
1 1 1 5  32 11 o 35.55000 0.3300000 35.49000 0.4386000 35.60000 0.4932000 -0.1030000     0.6600000 
1 1 1 5  32 13 o 36.07000 0.3555000 36.29000 0.3942000 35.85000 0.5918000 0.4414000      0.7111000 
1 1 1 5  32 15 o 16.34000 0.3981000 16.03000 0.4706000 16.65000 0.6422000 -0.6292000     0.7961000 
1 1 1 5  32 17 o 40.24000 0.3814000 40.42000 0.4190000 40.06000 0.6375000 0.3601000      0.7629000 
1 1 1 5  32 19 o 20.72000 0.2859000 21.10000 0.3657000 20.34000 0.4396000 0.7627000      0.5718000 
1 1 1 5  32 21 o 54.71000 0.4768000 55.25000 0.5239000 54.17000 0.7969000 1.081000       0.9536000 
1 1 1 5  32 23 o 31.81000 0.3089000 31.59000 0.3821000 32.03000 0.4856000 -0.4440000     0.6179000 
1 1 1 5  32 25 o 7.407000 0.6413000 7.962000 0.7605000 6.852000 1.033000  1.110000       1.283000  
1 1 1 5  32 27 o 13.72000 0.3767000 13.56000 0.5062000 13.88000 0.5579000 -0.3213000     0.7534000 
1 1 1 5  32 29 o 15.99000 0.3808000 15.81000 0.5603000 16.17000 0.5158000 -0.3650000     0.7616000 
1 1 1 5  32 31 o 29.04000 0.3492000 29.41000 0.4485000 28.66000 0.5354000 0.7525000      0.6984000 
1 1 1 5  32 33 o 19.76000 0.3389000 19.76000 0.4724000 19.76000 0.4861000 -0.1173000E-02 0.6778000 
1 1 1 5  32 35 o 42.90000 0.3932000 43.59000 0.6015000 42.21000 0.5067000 1.388000       0.7865000 
1 1 1 5  32 37 o 23.49000 0.3535000 23.51000 0.4661000 23.46000 0.5317000 0.5244000E-01  0.7071000 
1 1 1 5  32 39 o 5.235000 0.9556000 6.555000 1.233000  3.915000 1.461000  2.640000       1.911000  
1 1 1 5  32 41 o 20.65000 0.3595000 20.56000 0.5456000 20.74000 0.4683000 -0.1801000     0.7190000 
1 1 1 5  32 43 o 7.821000 0.6772000 8.647000 0.8965000 6.995000 1.015000  1.652000       1.354000  
1 1 1 5  32 45 f 6.585000 0.7897000 6.501000 1.134000  6.670000 1.099000  -0.1682000     1.579000  
1 1 1 5  32 47 o 3.684000 0.9985000 3.933000 1.478000  3.436000 1.343000  0.4963000      1.997000  
1 1 1 5  32 49 o 7.528000 0.8200000 6.386000 1.319000  8.670000 0.9750000 -2.283000      1.640000  
1 1 1 5  32 51 o 5.373000 0.9485000 6.421000 1.113000  4.325000 1.536000  2.097000       1.897000  
1 1 1 5  32 53 o 3.546000 0.9529000 2.917000 1.266000  4.175000 1.424000  -1.258000      1.906000  
1 1 1 5  32 55 o 9.281000 0.5857000 9.373000 0.8452000 9.188000 0.8110000 0.1854000      1.171000  
1 1 1 5  32 57 o 8.714000 0.6973000 8.695000 0.8999000 8.733000 1.065000  -0.3843000E-01 1.395000  
1 1 1 5  33 0  o 7.353000 0.8178000 7.353000 0.8178000 7.353000 0.8178000 0.000000       0.000000  
1 1 1 5  33 2  o 21.23000 0.2876000 21.16000 0.3921000 21.31000 0.4209000 -0.1491000     0.5753000 
1 1 1 5  33 4  o 21.89000 0.2825000 21.73000 0.3778000 22.05000 0.4200000 -0.3115000     0.5649000 
1 1 1 5  33 6  o 65.60000 0.5069000 65.89000 0.6691000 65.30000 0.7615000 0.5956000      1.014000  
1 1 1 5  33 8  o 58.86000 0.5067000 59.12000 0.5474000 58.60000 0.8527000 0.5145000      1.013000  
1 1 1 5  33 10 o 45.84000 0.4153000 46.02000 0.4509000 45.65000 0.6975000 0.3744000      0.8306000 
1 1 1 5  33 12 o 28.43000 0.3235000 28.98000 0.3626000 27.88000 0.5358000 1.097000       0.6470000 
1 1 1 5  33 14 o 21.20000 0.3499000 21.15000 0.4834000 21.24000 0.5059000 -0.9100000E-01 0.6997000 
1 1 1 5  33 16 o 68.06000 0.5052000 68.27000 0.6224000 67.86000 0.7960000 0.4046000      1.010000  
1 1 1 5  33 18 o 36.61000 0.3735000 36.81000 0.4402000 36.40000 0.6034000 0.4116000      0.7469000 
1 1 1 5  33 20 o 23.94000 0.3207000 23.93000 0.3673000 23.95000 0.5259000 -0.1407000E-01 0.6414000 
1 1 1 5  33 22 o 8.237000 0.5558000 8.329000 0.6678000 8.145000 0.8886000 0.1845000      1.112000  
1 1 1 5  33 24 o 31.58000 0.3259000 31.56000 0.4244000 31.60000 0.4948000 -0.3655000E-01 0.6518000 
1 1 1 5  33 26 o 11.85000 0.4063000 11.69000 0.5474000 12.01000 0.6004000 -0.3247000     0.8125000 
1 1 1 5  33 28 o 28.65000 0.3055000 28.54000 0.4234000 28.76000 0.4404000 -0.2264000     0.6109000 
1 1 1 5  33 30 f 28.22000 0.3129000 28.43000 0.4361000 28.01000 0.4487000 0.4219000      0.6257000 
1 1 1 5  33 32 o 17.47000 0.3929000 17.87000 0.4905000 17.08000 0.6139000 0.7974000      0.7858000 
1 1 1 5  33 34 o 27.83000 0.3404000 28.17000 0.5195000 27.48000 0.4400000 0.6890000      0.6808000 
1 1 1 5  33 36 o 3.425000 0.9900000 2.972000 1.299000  3.878000 1.495000  -0.9059000     1.980000  
1 1 1 5  33 38 o 14.14000 0.4604000 13.42000 0.6685000 14.86000 0.6333000 -1.447000      0.9209000 
1 1 1 5  33 40 o 11.54000 0.5084000 11.49000 0.6554000 11.58000 0.7773000 -0.8812000E-01 1.017000  
1 1 1 5  33 42 o 16.11000 0.3718000 15.85000 0.5287000 16.37000 0.5229000 -0.5211000     0.7436000 
1 1 1 5  33 44 o 7.296000 0.7036000 7.287000 0.9917000 7.304000 0.9985000 -0.1708000E-01 1.407000  
1 1 1 5  33 46 f 8.686000 0.5481000 9.477000 0.7602000 7.895000 0.7897000 1.581000       1.096000  
1 1 1 5  33 48 o 9.317000 0.6303000 9.714000 0.7503000 8.920000 1.013000  0.7939000      1.261000  
1 1 1 5  33 50 f 5.440000 1.107000  6.350000 1.550000  4.529000 1.581000  1.821000       2.214000  
1 1 1 5  33 52 o 4.435000 1.015000  4.257000 1.474000  4.613000 1.395000  -0.3569000     2.029000  
1 1 1 5  33 54 o 3.586000 0.9418000 2.785000 1.243000  4.387000 1.415000  -1.602000      1.884000  
1 1 1 5  33 56 o 4.928000 1.008000  3.799000 1.492000  6.057000 1.357000  -2.258000      2.016000  
1 1 1 5  34 1  o 56.81000 0.4177000 56.66000 0.5902000 56.96000 0.5913000 -0.3023000     0.8355000 
1 1 1 5  34 3  o 52.49000 0.3919000 52.77000 0.5576000 52.20000 0.5509000 0.5662000      0.7838000 
1 1 1 5  34 5  o 41.18000 0.3540000 41.42000 0.4700000 40.94000 0.5295000 0.4786000      0.7080000 
1 1 1 5  34 7  o 49.05000 0.4369000 49.05000 0.4734000 49.06000 0.7345000 -0.1409000E-01 0.8739000 
1 1 1 5  34 9  o 21.40000 0.3068000 21.36000 0.3487000 21.43000 0.5050000 -0.6966000E-01 0.6137000 
1 1 1 5  34 11 o 29.97000 0.3299000 29.58000 0.3628000 30.36000 0.5511000 -0.7867000     0.6598000 
1 1 1 5  34 13 o 34.86000 0.3263000 34.39000 0.4252000 35.33000 0.4950000 -0.9342000     0.6526000 
1 1 1 5  34 15 f 29.03000 0.2950000 29.45000 0.3725000 28.60000 0.4575000 0.8563000      0.5899000 
1 1 1 5  34 17 o 20.66000 0.2929000 20.86000 0.3658000 20.45000 0.4577000 0.4121000      0.5859000 
1 1 1 5  34 19 o 22.64000 0.3246000 22.52000 0.3714000 22.76000 0.5325000 -0.2425000     0.6492000 
1 1 1 5  34 21 o 57.68000 0.5186000 58.25000 0.6109000 57.12000 0.8382000 1.124000       1.037000  
1 1 1 5  34 23 o 42.85000 0.3779000 42.68000 0.4936000 43.03000 0.5723000 -0.3484000     0.7557000 
1 1 1 5  34 25 o 39.76000 0.3629000 39.58000 0.5372000 39.95000 0.4879000 -0.3632000     0.7257000 
1 1 1 5  34 27 o 32.23000 0.3147000 32.39000 0.4407000 32.07000 0.4494000 0.3191000      0.6295000 
1 1 1 5  34 29 o 19.66000 0.3366000 19.49000 0.4550000 19.83000 0.4962000 -0.3419000     0.6732000 
1 1 1 5  34 31 o 13.48000 0.4517000 13.27000 0.5730000 13.69000 0.6984000 -0.4169000     0.9034000 
1 1 1 5  34 33 o 13.94000 0.4222000 13.87000 0.6150000 14.01000 0.5785000 -0.1388000     0.8443000 
1 1 1 5  34 35 o 34.48000 0.3777000 34.59000 0.5372000 34.37000 0.5311000 0.2206000      0.7555000 
1 1 1 5  34 37 o 17.95000 0.3435000 17.55000 0.5045000 18.34000 0.4663000 -0.7880000     0.6870000 
1 1 1 5  34 39 o 4.898000 0.9403000 4.959000 1.317000  4.837000 1.342000  0.1225000      1.881000  
1 1 1 5  34 41 o 7.436000 0.7385000 7.851000 1.081000  7.020000 1.006000  0.8304000      1.477000  
1 1 1 5  34 43 o 6.003000 0.8151000 5.631000 1.219000  6.374000 1.082000  -0.7426000     1.630000  
1 1 1 5  34 45 o 4.224000 0.9167000 4.639000 1.315000  3.809000 1.277000  0.8296000      1.833000  
1 1 1 5  34 47 f 3.638000 1.024000  3.170000 1.271000  4.106000 1.607000  -0.9354000     2.049000  
1 1 1 5  34 49 o 6.907000 0.8218000 6.970000 1.288000  6.843000 1.021000  0.1264000      1.644000  
1 1 1 5  34 51 f 7.877000 0.7391000 7.684000 1.157000  8.071000 0.9203000 -0.3873000     1.478000  
1 1 1 5  34 53 o 8.812000 0.6158000 8.991000 0.8504000 8.632000 0.8908000 0.3595000      1.232000  
1 1 1 5  34 55 o 3.986000 1.007000  3.831000 1.450000  4.140000 1.399000  -0.3097000     2.014000  
1 1 1 5  34 57 o 9.421000 1.166000  8.889000 2.077000  9.954000 1.062000  -1.066000      2.332000  
1 1 1 5  35 0  f 25.32000 0.3836000 25.32000 0.3836000 25.32000 0.3836000 0.000000       0.000000  
1 1 1 5  35 2  f 20.30000 0.2778000 20.16000 0.3977000 20.45000 0.3880000 -0.2997000     0.5556000 
1 1 1 5  35 4  o 78.40000 0.5992000 78.48000 0.9079000 78.32000 0.7822000 0.1648000      1.198000  
1 1 1 5  35 6  o 78.77000 0.5574000 79.29000 0.7945000 78.25000 0.7819000 1.040000       1.115000  
1 1 1 5  35 8  o 26.11000 0.2843000 25.66000 0.3499000 26.57000 0.4482000 -0.9126000     0.5686000 
1 1 1 5  35 10 o 39.78000 0.3357000 39.74000 0.4157000 39.82000 0.5272000 -0.7767000E-01 0.6713000 
1 1 1 5  35 12 o 39.73000 0.3514000 39.48000 0.4596000 39.99000 0.5317000 -0.5055000     0.7028000 
1 1 1 5  35 14 o 34.36000 0.3142000 34.08000 0.3859000 34.64000 0.4959000 -0.5590000     0.6284000 
1 1 1 5  35 16 o 59.31000 0.4511000 59.28000 0.5558000 59.34000 0.7107000 -0.5969000E-01 0.9022000 
1 1 1 5  35 18 f 43.91000 0.4079000 44.18000 0.4485000 43.64000 0.6814000 0.5342000      0.8158000 
1 1 1 5  35 20 o 22.18000 0.3036000 22.70000 0.3833000 21.66000 0.4710000 1.045000       0.6073000 
1 1 1 5  35 22 o 19.28000 0.3340000 20.20000 0.4353000 18.36000 0.5067000 1.848000       0.6680000 
1 1 1 5  35 24 o 22.70000 0.3449000 23.40000 0.4797000 22.00000 0.4957000 1.396000       0.6898000 
1 1 1 5  35 26 o 5.682000 0.8509000 6.531000 1.021000  4.832000 1.361000  1.699000       1.702000  
1 1 1 5  35 28 o 26.58000 0.3062000 26.17000 0.4295000 26.99000 0.4365000 -0.8117000     0.6124000 
1 1 1 5  35 30 o 37.76000 0.3704000 37.95000 0.4730000 37.58000 0.5702000 0.3666000      0.7408000 
1 1 1 5  35 32 o 14.41000 0.4233000 14.13000 0.6307000 14.68000 0.5649000 -0.5520000     0.8467000 
1 1 1 5  35 34 o 4.757000 0.9752000 4.757000 1.333000  4.757000 1.424000  -0.4172000E-03 1.950000  
1 1 1 5  35 36 o 26.87000 0.3620000 27.51000 0.5055000 26.22000 0.5182000 1.293000       0.7239000 
1 1 1 5  35 38 o 9.948000 0.5548000 10.71000 0.6801000 9.186000 0.8766000 1.523000       1.110000  
1 1 1 5  35 40 o 8.639000 0.6214000 8.930000 0.9047000 8.347000 0.8520000 0.5836000      1.243000  
1 1 1 5  35 42 o 8.887000 0.5544000 8.471000 0.8458000 9.304000 0.7168000 -0.8336000     1.109000  
1 1 1 5  35 44 o 4.712000 0.9229000 4.714000 1.323000  4.711000 1.287000  0.3777000E-02  1.846000  
1 1 1 5  35 46 o 9.196000 0.5995000 8.998000 0.8319000 9.394000 0.8635000 -0.3956000     1.199000  
1 1 1 5  35 48 o 6.253000 0.8123000 5.223000 1.350000  7.282000 0.9043000 -2.059000      1.625000  
1 1 1 5  35 50 o 5.098000 1.050000  4.915000 1.602000  5.281000 1.359000  -0.3657000     2.100000  
1 1 1 5  35 52 o 8.384000 0.7463000 8.454000 0.9928000 8.314000 1.115000  0.1402000      1.493000  
1 1 1 5  35 54 o 6.031000 0.8396000 6.418000 1.220000  5.645000 1.154000  0.7722000      1.679000  
1 1 1 5  35 56 o 4.642000 0.9480000 4.101000 1.423000  5.183000 1.253000  -1.082000      1.896000  
1 1 1 5  36 1  f 3.524000 0.8323000 4.110000 1.180000  2.939000 1.174000  1.171000       1.665000  
1 1 1 5  36 3  o 27.23000 0.2824000 27.15000 0.4051000 27.32000 0.3936000 -0.1710000     0.5649000 
1 1 1 5  36 5  o 51.85000 0.4240000 51.89000 0.6447000 51.82000 0.5508000 0.6911000E-01  0.8480000 
1 1 1 5  36 7  o 26.83000 0.3183000 27.31000 0.4501000 26.35000 0.4502000 0.9632000      0.6366000 
1 1 1 5  36 9  o 8.119000 0.4994000 8.079000 0.6258000 8.158000 0.7786000 -0.7896000E-01 0.9989000 
1 1 1 5  36 11 o 27.19000 0.3068000 26.87000 0.4020000 27.50000 0.4636000 -0.6338000     0.6137000 
1 1 1 5  36 13 o 44.80000 0.3839000 44.51000 0.5036000 45.09000 0.5796000 -0.5834000     0.7678000 
1 1 1 5  36 15 o 18.09000 0.3047000 17.72000 0.3907000 18.45000 0.4675000 -0.7385000     0.6093000 
1 1 1 5  36 17 o 21.19000 0.2962000 21.07000 0.3725000 21.32000 0.4606000 -0.2505000     0.5924000 
1 1 1 5  36 19 o 20.77000 0.3078000 20.83000 0.3874000 20.72000 0.4784000 0.1073000      0.6156000 
1 1 1 5  36 21 o 33.49000 0.3381000 33.74000 0.4439000 33.23000 0.5102000 0.5183000      0.6763000 
1 1 1 5  36 23 o 30.93000 0.3330000 30.83000 0.4383000 31.03000 0.5015000 -0.2023000     0.6661000 
1 1 1 5  36 25 o 6.515000 0.7959000 6.776000 1.056000  6.253000 1.191000  0.5228000      1.592000  
1 1 1 5  36 27 o 15.23000 0.4025000 15.95000 0.5435000 14.51000 0.5937000 1.440000       0.8049000 
1 1 1 5  36 29 o 31.86000 0.3460000 31.92000 0.4439000 31.80000 0.5308000 0.1212000      0.6920000 
1 1 1 5  36 31 o 12.92000 0.4178000 12.62000 0.5348000 13.22000 0.6421000 -0.5968000     0.8356000 
1 1 1 5  36 33 o 5.140000 0.8955000 5.569000 1.050000  4.711000 1.451000  0.8574000      1.791000  
1 1 1 5  36 35 o 19.52000 0.3807000 19.48000 0.5248000 19.56000 0.5518000 -0.7945000E-01 0.7614000 
1 1 1 5  36 37 o 10.53000 0.5048000 10.68000 0.6779000 10.39000 0.7481000 0.2876000      1.010000  
1 1 1 5  36 39 o 9.953000 0.5521000 9.445000 0.8624000 10.46000 0.6896000 -1.017000      1.104000  
1 1 1 5  36 41 o 5.644000 0.8283000 5.670000 1.221000  5.617000 1.119000  0.5254000E-01  1.657000  
1 1 1 5  36 43 o 6.849000 0.7121000 7.049000 1.015000  6.650000 0.9995000 0.3992000      1.424000  
1 1 1 5  36 45 o 4.774000 0.9742000 4.669000 1.393000  4.880000 1.362000  -0.2113000     1.948000  
1 1 1 5  36 47 o 7.436000 0.7187000 8.251000 0.9957000 6.620000 1.037000  1.630000       1.437000  
1 1 1 5  36 49 o 6.385000 0.8752000 6.214000 1.274000  6.557000 1.200000  -0.3435000     1.750000  
1 1 1 5  36 51 o 9.731000 0.6463000 9.478000 0.8973000 9.984000 0.9305000 -0.5068000     1.293000  
1 1 1 5  36 53 o 9.996000 0.5345000 9.523000 0.7949000 10.47000 0.7148000 -0.9459000     1.069000  
1 1 1 5  36 55 o 4.486000 0.9628000 4.933000 1.345000  4.039000 1.378000  0.8940000      1.926000  
1 1 1 5  37 0  f 42.87000 0.4836000 42.87000 0.4836000 42.87000 0.4836000 0.000000       0.000000  
1 1 1 5  37 2  o 56.72000 0.4198000 56.74000 0.5939000 56.70000 0.5935000 0.4364000E-01  0.8396000 
1 1 1 5  37 4  o 37.92000 0.3483000 37.85000 0.5324000 37.98000 0.4493000 -0.1295000     0.6966000 
1 1 1 5  37 6  o 55.65000 0.5095000 56.67000 0.8407000 54.63000 0.5759000 2.038000       1.019000  
1 1 1 5  37 8  o 17.28000 0.3040000 17.59000 0.3799000 16.96000 0.4748000 0.6317000      0.6081000 
1 1 1 5  37 10 f 16.63000 0.3264000 16.68000 0.4292000 16.58000 0.4918000 0.1028000      0.6528000 
1 1 1 5  37 12 o 45.21000 0.3689000 45.27000 0.4558000 45.15000 0.5801000 0.1259000      0.7377000 
1 1 1 5  37 14 f 19.98000 0.3252000 20.52000 0.3789000 19.44000 0.5287000 1.082000       0.6504000 
1 1 1 5  37 16 o 14.28000 0.3458000 14.05000 0.4439000 14.51000 0.5303000 -0.4678000     0.6916000 
1 1 1 5  37 18 o 21.43000 0.3030000 21.80000 0.3822000 21.07000 0.4704000 0.7367000      0.6061000 
1 1 1 5  37 20 o 40.28000 0.3620000 40.60000 0.4793000 39.96000 0.5427000 0.6395000      0.7240000 
1 1 1 5  37 22 o 23.13000 0.3349000 23.88000 0.4384000 22.37000 0.5063000 1.514000       0.6698000 
1 1 1 5  37 24 o 30.68000 0.3363000 30.78000 0.4435000 30.58000 0.5057000 0.2005000      0.6726000 
1 1 1 5  37 26 f 19.56000 0.3551000 19.65000 0.5213000 19.47000 0.4824000 0.1859000      0.7103000 
1 1 1 5  37 28 o 30.81000 0.3138000 31.27000 0.4392000 30.34000 0.4483000 0.9264000      0.6276000 
1 1 1 5  37 30 o 14.43000 0.4384000 14.36000 0.5160000 14.51000 0.7088000 -0.1475000     0.8767000 
1 1 1 5  37 32 o 15.80000 0.5165000 15.30000 0.7021000 16.29000 0.7578000 -0.9901000     1.033000  
1 1 1 5  37 34 o 21.22000 0.3434000 21.05000 0.5171000 21.39000 0.4520000 -0.3328000     0.6868000 
1 1 1 5  37 36 o 31.74000 0.3653000 31.88000 0.5100000 31.60000 0.5232000 0.2790000      0.7306000 
1 1 1 5  37 38 f 18.83000 0.3333000 18.59000 0.4738000 19.06000 0.4689000 -0.4708000     0.6667000 
1 1 1 5  37 40 o 4.480000 0.9057000 4.126000 1.374000  4.835000 1.180000  -0.7097000     1.811000  
1 1 1 5  37 42 o 4.714000 0.9079000 4.056000 1.368000  5.373000 1.194000  -1.317000      1.816000  
1 1 1 5  37 44 o 5.915000 0.8465000 6.226000 1.156000  5.604000 1.237000  0.6215000      1.693000  
1 1 1 5  37 46 o 7.339000 0.7590000 7.183000 1.123000  7.495000 1.021000  -0.3116000     1.518000  
1 1 1 5  37 48 o 6.620000 0.8786000 6.791000 1.360000  6.448000 1.113000  0.3428000      1.757000  
1 1 1 5  37 50 o 2.895000 0.8801000 2.656000 1.195000  3.135000 1.292000  -0.4789000     1.760000  
1 1 1 5  37 52 o 8.336000 0.6238000 9.297000 0.8453000 7.374000 0.9176000 1.923000       1.248000  
1 1 1 5  37 54 f 4.695000 0.9608000 4.749000 1.342000  4.640000 1.376000  0.1083000      1.922000  
1 1 1 5  38 1  o 29.33000 0.2904000 29.87000 0.4115000 28.78000 0.4099000 1.094000       0.5808000 
1 1 1 5  38 3  o 21.47000 0.3123000 21.80000 0.4706000 21.14000 0.4106000 0.6618000      0.6245000 
1 1 1 5  38 5  o 8.063000 0.5262000 7.678000 0.7746000 8.448000 0.7123000 -0.7693000     1.052000  
1 1 1 5  38 7  o 57.38000 0.4606000 57.36000 0.6042000 57.40000 0.6952000 -0.4120000E-01 0.9211000 
1 1 1 5  38 9  o 21.69000 0.3055000 21.54000 0.3975000 21.83000 0.4640000 -0.2872000     0.6110000 
1 1 1 5  38 11 o 12.33000 0.3982000 12.02000 0.5125000 12.64000 0.6097000 -0.6214000     0.7965000 
1 1 1 5  38 13 o 45.86000 0.4263000 45.53000 0.4600000 46.20000 0.7177000 -0.6649000     0.8525000 
1 1 1 5  38 15 o 23.62000 0.3003000 23.03000 0.3746000 24.21000 0.4694000 -1.178000      0.6006000 
1 1 1 5  38 17 o 42.32000 0.3608000 42.13000 0.4464000 42.52000 0.5670000 -0.3892000     0.7217000 
1 1 1 5  38 19 o 25.92000 0.3147000 26.15000 0.4186000 25.70000 0.4700000 0.4484000      0.6294000 
1 1 1 5  38 21 o 5.618000 0.8781000 6.625000 1.042000  4.610000 1.414000  2.015000       1.756000  
1 1 1 5  38 23 o 16.32000 0.3693000 16.32000 0.4646000 16.33000 0.5742000 -0.1084000E-01 0.7386000 
1 1 1 5  38 25 o 16.90000 0.3790000 16.71000 0.5575000 17.08000 0.5137000 -0.3703000     0.7581000 
1 1 1 5  38 27 o 12.27000 0.4377000 11.75000 0.6305000 12.78000 0.6073000 -1.029000      0.8754000 
1 1 1 5  38 29 o 16.39000 0.4057000 16.25000 0.5497000 16.52000 0.5969000 -0.2699000     0.8114000 
1 1 1 5  38 31 o 23.51000 0.3494000 23.57000 0.4792000 23.45000 0.5086000 0.1251000      0.6988000 
1 1 1 5  38 33 o 7.584000 0.6230000 7.575000 0.8096000 7.593000 0.9470000 -0.1850000E-01 1.246000  
1 1 1 5  38 35 o 9.720000 0.7194000 9.193000 1.074000  10.25000 0.9571000 -1.055000      1.439000  
1 1 1 5  38 37 o 18.66000 0.3340000 18.93000 0.4729000 18.39000 0.4717000 0.5429000      0.6680000 
1 1 1 5  38 39 o 10.11000 0.4606000 10.06000 0.6540000 10.16000 0.6487000 -0.1024000     0.9212000 
1 1 1 5  38 41 o 7.857000 0.6149000 7.122000 0.9509000 8.592000 0.7800000 -1.469000      1.230000  
1 1 1 5  38 43 o 12.53000 0.4160000 12.36000 0.5997000 12.71000 0.5767000 -0.3544000     0.8320000 
1 1 1 5  38 45 o 5.605000 0.8885000 5.418000 1.296000  5.791000 1.216000  -0.3727000     1.777000  
1 1 1 5  38 47 o 9.311000 0.8881000 9.746000 1.044000  8.875000 1.437000  0.8706000      1.776000  
1 1 1 5  38 49 o 7.987000 0.8040000 9.596000 1.163000  6.378000 1.110000  3.218000       1.608000  
1 1 1 5  38 51 o 3.053000 0.9113000 3.167000 1.287000  2.940000 1.291000  0.2271000      1.823000  
1 1 1 5  38 53 f 4.037000 0.9523000 4.330000 1.340000  3.744000 1.353000  0.5864000      1.905000  
1 1 1 5  39 0  f 12.79000 0.5405000 12.79000 0.5405000 12.79000 0.5405000 0.000000       0.000000  
1 1 1 5  39 2  o 6.827000 0.7020000 7.134000 1.050000  6.520000 0.9318000 0.6135000      1.404000  
1 1 1 5  39 4  o 3.413000 0.8871000 3.789000 1.279000  3.037000 1.229000  0.7519000      1.774000  
1 1 1 5  39 6  o 4.008000 0.8988000 4.257000 1.267000  3.758000 1.275000  0.4993000      1.798000  
1 1 1 5  39 8  o 41.35000 0.3670000 41.22000 0.4806000 41.47000 0.5547000 -0.2564000     0.7339000 
1 1 1 5  39 10 o 14.29000 0.3575000 14.51000 0.4578000 14.06000 0.5492000 0.4533000      0.7150000 
1 1 1 5  39 12 o 38.78000 0.3830000 38.71000 0.4178000 38.86000 0.6420000 -0.1453000     0.7660000 
1 1 1 5  39 14 o 44.45000 0.3699000 44.75000 0.4600000 44.14000 0.5793000 0.6114000      0.7397000 
1 1 1 5  39 16 o 42.49000 0.3619000 41.82000 0.4421000 43.16000 0.5730000 -1.340000      0.7237000 
1 1 1 5  39 18 o 19.61000 0.3347000 19.39000 0.4289000 19.83000 0.5140000 -0.4384000     0.6695000 
1 1 1 5  39 20 o 10.24000 0.5207000 10.14000 0.7106000 10.34000 0.7613000 -0.2022000     1.041000  
1 1 1 5  39 22 o 22.55000 0.3178000 22.80000 0.4056000 22.30000 0.4894000 0.5044000      0.6357000 
1 1 1 5  39 24 o 9.511000 0.5595000 9.851000 0.6932000 9.172000 0.8783000 0.6794000      1.119000  
1 1 1 5  39 26 o 12.84000 0.4212000 13.44000 0.5510000 12.25000 0.6372000 1.182000       0.8424000 
1 1 1 5  39 28 o 20.80000 0.3890000 20.79000 0.5450000 20.82000 0.5551000 -0.3468000E-01 0.7779000 
1 1 1 5  39 30 o 24.48000 0.3568000 24.13000 0.4982000 24.82000 0.5110000 -0.6838000     0.7137000 
1 1 1 5  39 32 o 20.90000 0.3158000 20.62000 0.4374000 21.18000 0.4555000 -0.5526000     0.6315000 
1 1 1 5  39 34 o 10.21000 0.6517000 10.31000 0.9343000 10.11000 0.9088000 0.1994000      1.303000  
1 1 1 5  39 36 o 7.875000 0.7217000 8.130000 0.7965000 7.619000 1.204000  0.5106000      1.443000  
1 1 1 5  39 38 o 4.233000 0.8822000 4.589000 1.247000  3.877000 1.248000  0.7121000      1.764000  
1 1 1 5  39 40 o 2.903000 0.8461000 2.796000 1.178000  3.011000 1.215000  -0.2150000     1.692000  
1 1 1 5  39 42 o 8.084000 0.5817000 7.741000 0.8335000 8.427000 0.8118000 -0.6858000     1.163000  
1 1 1 5  39 44 f 5.282000 0.9387000 4.796000 1.368000  5.767000 1.285000  -0.9712000     1.877000  
1 1 1 5  39 46 o 4.047000 1.113000  4.623000 1.679000  3.471000 1.462000  1.152000       2.227000  
1 1 1 5  39 48 o 3.444000 0.9582000 3.370000 1.387000  3.518000 1.322000  -0.1479000     1.916000  
1 1 1 5  39 50 o 2.978000 0.9049000 2.362000 1.105000  3.595000 1.434000  -1.233000      1.810000  
1 1 1 5  39 52 o 4.602000 0.9601000 5.078000 1.367000  4.126000 1.349000  0.9519000      1.920000  
1 1 1 5  40 1  o 18.25000 0.3547000 18.10000 0.5443000 18.40000 0.4549000 -0.3025000     0.7094000 
1 1 1 5  40 3  o 13.40000 0.3746000 13.56000 0.5210000 13.25000 0.5384000 0.3040000      0.7492000 
1 1 1 5  40 5  o 24.78000 0.3191000 24.08000 0.4829000 25.48000 0.4172000 -1.399000      0.6382000 
1 1 1 5  40 7  f 23.93000 0.3418000 24.02000 0.4910000 23.84000 0.4755000 0.1748000      0.6835000 
1 1 1 5  40 9  o 10.28000 0.4881000 10.02000 0.6124000 10.55000 0.7601000 -0.5246000     0.9761000 
1 1 1 5  40 11 o 15.46000 0.3673000 15.71000 0.4563000 15.21000 0.5757000 0.4947000      0.7346000 
1 1 1 5  40 13 o 4.600000 0.9092000 4.760000 1.178000  4.439000 1.386000  0.3208000      1.818000  
1 1 1 5  40 15 o 24.58000 0.3298000 24.82000 0.4338000 24.34000 0.4969000 0.4831000      0.6596000 
1 1 1 5  40 17 o 57.96000 0.4503000 57.61000 0.5521000 58.30000 0.7116000 -0.6829000     0.9007000 
1 1 1 5  40 19 o 9.475000 0.5327000 9.350000 0.6983000 9.600000 0.8046000 -0.2499000     1.065000  
1 1 1 5  40 21 o 8.275000 0.6117000 8.377000 0.7694000 8.173000 0.9510000 0.2034000      1.223000  
1 1 1 5  40 23 o 12.29000 0.4413000 13.00000 0.5618000 11.59000 0.6807000 1.405000       0.8826000 
1 1 1 5  40 25 o 28.47000 0.3403000 28.54000 0.5126000 28.41000 0.4476000 0.1249000      0.6805000 
1 1 1 5  40 27 o 4.559000 0.8502000 5.782000 0.9872000 3.335000 1.384000  2.446000       1.700000  
1 1 1 5  40 29 o 3.633000 0.9945000 3.504000 1.403000  3.762000 1.409000  -0.2586000     1.989000  
1 1 1 5  40 31 o 4.157000 0.9319000 3.919000 1.313000  4.395000 1.323000  -0.4767000     1.864000  
1 1 1 5  40 33 o 12.91000 0.4378000 13.27000 0.6244000 12.55000 0.6137000 0.7230000      0.8755000 
1 1 1 5  40 35 o 9.491000 0.4534000 9.090000 0.6448000 9.892000 0.6375000 -0.8017000     0.9067000 
1 1 1 5  40 37 o 3.051000 0.8974000 3.096000 1.301000  3.007000 1.237000  0.8903000E-01  1.795000  
1 1 1 5  40 39 o 6.825000 0.7952000 6.552000 0.9623000 7.098000 1.266000  -0.5465000     1.590000  
1 1 1 5  40 41 o 3.493000 0.9300000 3.171000 1.251000  3.815000 1.376000  -0.6436000     1.860000  
1 1 1 5  40 43 o 5.652000 1.027000  4.957000 1.347000  6.348000 1.551000  -1.391000      2.055000  
1 1 1 5  40 45 o 3.347000 0.9575000 3.444000 1.418000  3.250000 1.287000  0.1941000      1.915000  
1 1 1 5  40 47 o 5.687000 0.8944000 5.076000 1.395000  6.298000 1.120000  -1.222000      1.789000  
1 1 1 5  40 49 o 3.335000 0.9793000 3.394000 1.444000  3.277000 1.323000  0.1164000      1.959000  
1 1 1 5  40 51 o 4.016000 0.9794000 4.430000 1.456000  3.601000 1.311000  0.8285000      1.959000  
1 1 1 5  41 0  o 15.09000 0.5959000 15.09000 0.5959000 15.09000 0.5959000 0.000000       0.000000  
1 1 1 5  41 2  o 34.25000 0.3435000 34.66000 0.4512000 33.83000 0.5181000 0.8323000      0.6871000 
1 1 1 5  41 4  o 40.39000 0.3411000 40.22000 0.4800000 40.57000 0.4847000 -0.3463000     0.6822000 
1 1 1 5  41 6  o 10.88000 0.4665000 10.29000 0.6698000 11.47000 0.6495000 -1.179000      0.9330000 
1 1 1 5  41 8  o 18.41000 0.3667000 18.35000 0.4106000 18.46000 0.6078000 -0.1092000     0.7334000 
1 1 1 5  41 10 o 28.32000 0.3111000 28.47000 0.3898000 28.18000 0.4851000 0.2860000      0.6223000 
1 1 1 5  41 12 o 21.55000 0.3177000 21.78000 0.3906000 21.33000 0.5011000 0.4511000      0.6353000 
1 1 1 5  41 14 o 7.337000 0.6881000 7.684000 0.9172000 6.990000 1.026000  0.6941000      1.376000  
1 1 1 5  41 16 o 22.02000 0.3234000 22.89000 0.4133000 21.14000 0.4975000 1.748000       0.6468000 
1 1 1 5  41 18 o 11.56000 0.4447000 11.41000 0.5879000 11.72000 0.6675000 -0.3137000     0.8895000 
1 1 1 5  41 20 o 13.02000 0.4081000 13.17000 0.5325000 12.88000 0.6184000 0.2877000      0.8161000 
1 1 1 5  41 22 o 17.58000 0.3503000 17.82000 0.4652000 17.35000 0.5238000 0.4687000      0.7005000 
1 1 1 5  41 24 o 30.36000 0.3754000 30.77000 0.4004000 29.94000 0.6352000 0.8245000      0.7509000 
1 1 1 5  41 26 o 6.320000 0.8647000 7.054000 1.052000  5.585000 1.372000  1.469000       1.729000  
1 1 1 5  41 28 o 14.61000 0.4885000 14.27000 0.6112000 14.95000 0.7622000 -0.6811000     0.9770000 
1 1 1 5  41 30 o 26.58000 0.3142000 26.76000 0.4467000 26.40000 0.4419000 0.3650000      0.6284000 
1 1 1 5  41 32 o 9.469000 0.5372000 9.155000 0.7677000 9.783000 0.7517000 -0.6276000     1.074000  
1 1 1 5  41 34 o 4.115000 0.8696000 3.418000 1.240000  4.811000 1.220000  -1.394000      1.739000  
1 1 1 5  41 36 o 5.590000 0.8550000 5.444000 1.316000  5.735000 1.092000  -0.2914000     1.710000  
1 1 1 5  41 38 o 4.667000 0.8299000 5.707000 1.026000  3.626000 1.305000  2.081000       1.660000  
1 1 1 5  41 40 o 12.21000 0.4363000 11.77000 0.6180000 12.66000 0.6160000 -0.8887000     0.8726000 
1 1 1 5  41 42 o 12.70000 0.4706000 12.88000 0.6371000 12.52000 0.6928000 0.3612000      0.9412000 
1 1 1 5  41 44 o 8.159000 0.6779000 7.195000 1.056000  9.124000 0.8501000 -1.928000      1.356000  
1 1 1 5  41 46 o 5.364000 0.8993000 5.891000 1.262000  4.836000 1.281000  1.055000       1.799000  
1 1 1 5  41 48 o 3.674000 0.9419000 3.263000 1.346000  4.085000 1.318000  -0.8219000     1.884000  
1 1 1 5  41 50 o 3.443000 0.9373000 3.181000 1.332000  3.706000 1.319000  -0.5251000     1.875000  
1 1 1 5  42 1  o 12.97000 0.4107000 12.99000 0.5861000 12.95000 0.5756000 0.4004000E-01  0.8215000 
1 1 1 5  42 3  o 19.90000 0.4068000 20.05000 0.4514000 19.75000 0.6769000 0.3011000      0.8136000 
1 1 1 5  42 5  o 9.676000 0.5260000 9.655000 0.7203000 9.697000 0.7667000 -0.4217000E-01 1.052000  
1 1 1 5  42 7  o 23.13000 0.3937000 22.14000 0.5278000 24.11000 0.5844000 -1.967000      0.7875000 
1 1 1 5  42 9  o 34.50000 0.3717000 34.63000 0.4110000 34.38000 0.6195000 0.2464000      0.7434000 
1 1 1 5  42 11 o 19.08000 0.3307000 19.56000 0.4195000 18.60000 0.5115000 0.9545000      0.6615000 
1 1 1 5  42 13 o 20.81000 0.3432000 20.65000 0.4402000 20.97000 0.5266000 -0.3206000     0.6864000 
1 1 1 5  42 15 o 16.95000 0.3460000 17.08000 0.4461000 16.82000 0.5291000 0.2572000      0.6921000 
1 1 1 5  42 17 o 18.14000 0.3573000 18.11000 0.5006000 18.17000 0.5100000 -0.6315000E-01 0.7146000 
1 1 1 5  42 19 o 14.51000 0.3840000 15.12000 0.4788000 13.90000 0.6003000 1.217000       0.7679000 
1 1 1 5  42 21 o 11.41000 0.5197000 11.76000 0.5479000 11.06000 0.8833000 0.6982000      1.039000  
1 1 1 5  42 23 o 17.95000 0.3404000 18.25000 0.4197000 17.64000 0.5360000 0.6124000      0.6807000 
1 1 1 5  42 25 o 19.91000 0.3777000 19.94000 0.5213000 19.88000 0.5466000 0.5911000E-01  0.7553000 
1 1 1 5  42 27 o 15.16000 0.4689000 14.96000 0.4934000 15.36000 0.7974000 -0.3977000     0.9378000 
1 1 1 5  42 29 o 8.954000 0.5261000 9.337000 0.6934000 8.572000 0.7915000 0.7651000      1.052000  
1 1 1 5  42 31 o 7.165000 0.6860000 7.474000 0.8719000 6.855000 1.059000  0.6190000      1.372000  
1 1 1 5  42 33 o 11.26000 0.4982000 11.34000 0.7347000 11.19000 0.6731000 0.1464000      0.9964000 
1 1 1 5  42 35 o 8.055000 0.6122000 8.471000 0.8693000 7.638000 0.8622000 0.8324000      1.224000  
1 1 1 5  42 37 o 13.66000 0.3876000 13.87000 0.5518000 13.46000 0.5445000 0.4130000      0.7752000 
1 1 1 5  42 39 o 4.119000 0.9655000 4.552000 1.295000  3.686000 1.432000  0.8654000      1.931000  
1 1 1 5  42 41 o 15.40000 0.3876000 15.45000 0.5048000 15.35000 0.5882000 0.1015000      0.7751000 
1 1 1 5  42 43 o 3.118000 0.9043000 2.846000 1.213000  3.391000 1.342000  -0.5452000     1.809000  
1 1 1 5  42 45 o 6.111000 0.9748000 5.985000 1.099000  6.236000 1.610000  -0.2511000     1.950000  
1 1 1 5  42 47 o 6.621000 0.8201000 5.270000 1.241000  7.973000 1.073000  -2.703000      1.640000  
1 1 1 5  42 49 o 4.579000 1.060000  4.172000 1.502000  4.985000 1.495000  -0.8132000     2.119000  
1 1 1 5  43 0  o 93.33000 0.9292000 93.33000 0.9292000 93.33000 0.9292000 0.000000       0.000000  
1 1 1 5  43 2  o 48.71000 0.4711000 48.94000 0.5503000 48.49000 0.7648000 0.4517000      0.9422000 
1 1 1 5  43 4  o 7.959000 0.8524000 8.901000 0.7529000 7.018000 1.529000  1.884000       1.705000  
1 1 1 5  43 6  o 11.33000 0.4198000 11.84000 0.6269000 10.82000 0.5585000 1.018000       0.8396000 
1 1 1 5  43 8  o 29.18000 0.3386000 29.49000 0.4530000 28.87000 0.5034000 0.6261000      0.6772000 
1 1 1 5  43 10 o 27.85000 0.3247000 27.85000 0.4329000 27.85000 0.4841000 0.1661000E-02  0.6494000 
1 1 1 5  43 12 o 14.24000 0.3817000 13.99000 0.4888000 14.48000 0.5864000 -0.4819000     0.7634000 
1 1 1 5  43 14 o 22.54000 0.3203000 22.76000 0.3985000 22.32000 0.5015000 0.4486000      0.6405000 
1 1 1 5  43 16 o 29.94000 0.3178000 30.23000 0.4020000 29.66000 0.4923000 0.5685000      0.6356000 
1 1 1 5  43 18 o 11.65000 0.4482000 12.06000 0.5938000 11.24000 0.6716000 0.8137000      0.8964000 
1 1 1 5  43 20 o 15.37000 0.3613000 15.30000 0.4530000 15.44000 0.5629000 -0.1426000     0.7226000 
1 1 1 5  43 22 o 8.720000 0.5082000 8.536000 0.6747000 8.903000 0.7601000 -0.3668000     1.016000  
1 1 1 5  43 24 o 14.61000 0.4618000 14.93000 0.5649000 14.29000 0.7308000 0.6409000      0.9236000 
1 1 1 5  43 26 o 29.56000 0.3926000 29.36000 0.4308000 29.77000 0.6565000 -0.4067000     0.7852000 
1 1 1 5  43 28 o 25.75000 0.3498000 26.02000 0.4902000 25.48000 0.4991000 0.5435000      0.6996000 
1 1 1 5  43 30 o 4.612000 0.9635000 5.059000 1.182000  4.165000 1.522000  0.8938000      1.927000  
1 1 1 5  43 32 o 9.973000 0.5095000 10.80000 0.7536000 9.142000 0.6859000 1.662000       1.019000  
1 1 1 5  43 34 o 15.84000 0.4058000 15.66000 0.6417000 16.03000 0.4969000 -0.3671000     0.8116000 
1 1 1 5  43 36 o 10.85000 0.4464000 10.96000 0.6090000 10.73000 0.6528000 0.2289000      0.8928000 
1 1 1 5  43 38 o 13.95000 0.4178000 14.13000 0.6041000 13.77000 0.5773000 0.3641000      0.8356000 
1 1 1 5  43 40 o 7.493000 0.7035000 7.123000 0.9572000 7.863000 1.031000  -0.7400000     1.407000  
1 1 1 5  43 42 o 4.342000 0.9540000 4.236000 1.378000  4.448000 1.320000  -0.2117000     1.908000  
1 1 1 5  43 44 o 9.447000 0.5323000 8.733000 0.8032000 10.16000 0.6986000 -1.427000      1.065000  
1 1 1 5  43 46 o 3.039000 0.8931000 3.016000 1.267000  3.063000 1.259000  -0.4670000E-01 1.786000  
1 1 1 5  43 48 o 4.350000 1.078000  3.848000 1.355000  4.851000 1.678000  -1.003000      2.157000  
1 1 1 5  44 1  o 11.75000 0.5301000 11.56000 0.6481000 11.94000 0.8392000 -0.3866000     1.060000  
1 1 1 5  44 3  o 23.43000 0.3126000 23.78000 0.4362000 23.07000 0.4479000 0.7077000      0.6252000 
1 1 1 5  44 5  o 24.21000 0.3423000 24.69000 0.4496000 23.73000 0.5164000 0.9610000      0.6847000 
1 1 1 5  44 7  o 16.73000 0.4265000 16.35000 0.4652000 17.10000 0.7149000 -0.7512000     0.8529000 
1 1 1 5  44 9  o 4.772000 0.9215000 4.845000 1.257000  4.700000 1.348000  0.1447000      1.843000  
1 1 1 5  44 11 o 16.47000 0.3516000 17.35000 0.4425000 15.58000 0.5464000 1.776000       0.7031000 
1 1 1 5  44 13 o 33.41000 0.3293000 33.84000 0.4089000 32.98000 0.5164000 0.8604000      0.6587000 
1 1 1 5  44 15 o 31.07000 0.3341000 31.14000 0.4476000 31.00000 0.4962000 0.1394000      0.6683000 
1 1 1 5  44 17 o 12.65000 0.3971000 12.85000 0.4952000 12.46000 0.6210000 0.3842000      0.7943000 
1 1 1 5  44 19 f 13.99000 0.3673000 13.41000 0.4849000 14.57000 0.5518000 -1.156000      0.7346000 
1 1 1 5  44 21 o 5.806000 0.7758000 6.104000 1.085000  5.509000 1.109000  0.5949000      1.552000  
1 1 1 5  44 23 o 5.107000 0.9412000 5.419000 1.105000  4.796000 1.524000  0.6229000      1.882000  
1 1 1 5  44 25 f 19.77000 0.4005000 19.85000 0.4200000 19.70000 0.6820000 0.1490000      0.8009000 
1 1 1 5  44 27 o 13.33000 0.3652000 13.52000 0.5010000 13.14000 0.5316000 0.3802000      0.7305000 
1 1 1 5  44 29 o 10.45000 0.5558000 10.92000 0.5863000 9.986000 0.9443000 0.9380000      1.112000  
1 1 1 5  44 31 o 6.009000 0.8887000 5.767000 1.411000  6.251000 1.081000  -0.4838000     1.777000  
1 1 1 5  44 33 o 7.190000 0.6014000 6.841000 0.8769000 7.538000 0.8234000 -0.6976000     1.203000  
1 1 1 5  44 35 o 10.23000 0.5514000 10.81000 0.6951000 9.651000 0.8561000 1.156000       1.103000  
1 1 1 5  44 37 o 21.81000 0.3529000 21.74000 0.4809000 21.89000 0.5167000 -0.1571000     0.7059000 
1 1 1 5  44 39 o 8.385000 0.6430000 8.050000 0.8354000 8.721000 0.9777000 -0.6705000     1.286000  
1 1 1 5  44 41 o 9.328000 0.5419000 9.248000 0.7817000 9.407000 0.7507000 -0.1595000     1.084000  
1 1 1 5  44 43 o 4.977000 0.9271000 3.863000 1.461000  6.092000 1.142000  -2.229000      1.854000  
1 1 1 5  44 45 o 4.497000 0.9653000 3.414000 1.388000  5.580000 1.342000  -2.166000      1.931000  
1 1 1 5  44 47 o 3.189000 0.9096000 3.120000 1.305000  3.259000 1.268000  -0.1396000     1.819000  
1 1 1 5  45 0  o 7.590000 1.042000  7.590000 1.042000  7.590000 1.042000  0.000000       0.000000  
1 1 1 5  45 2  o 8.789000 0.6181000 8.398000 0.9487000 9.179000 0.7927000 -0.7809000     1.236000  
1 1 1 5  45 4  o 5.303000 0.9134000 5.444000 1.353000  5.163000 1.228000  0.2808000      1.827000  
1 1 1 5  45 6  o 16.13000 0.3754000 15.51000 0.5810000 16.75000 0.4754000 -1.232000      0.7507000 
1 1 1 5  45 8  o 27.82000 0.3922000 28.00000 0.4412000 27.63000 0.6486000 0.3701000      0.7844000 
1 1 1 5  45 10 f 15.02000 0.4431000 14.49000 0.4840000 15.55000 0.7422000 -1.060000      0.8861000 
1 1 1 5  45 12 o 16.99000 0.4179000 17.51000 0.4250000 16.47000 0.7196000 1.040000       0.8357000 
1 1 1 5  45 14 o 19.98000 0.3958000 20.17000 0.4119000 19.80000 0.6760000 0.3641000      0.7916000 
1 1 1 5  45 16 o 9.643000 0.4492000 9.352000 0.5970000 9.935000 0.6714000 -0.5829000     0.8985000 
1 1 1 5  45 18 o 16.93000 0.4250000 17.36000 0.4687000 16.50000 0.7092000 0.8639000      0.8501000 
1 1 1 5  45 20 o 20.24000 0.3863000 19.65000 0.4549000 20.82000 0.6245000 -1.167000      0.7726000 
1 1 1 5  45 22 o 16.27000 0.4207000 16.04000 0.4211000 16.49000 0.7284000 -0.4468000     0.8414000 
1 1 1 5  45 24 o 14.77000 0.4122000 14.83000 0.4549000 14.72000 0.6876000 0.1125000      0.8245000 
1 1 1 5  45 26 o 14.15000 0.3566000 14.49000 0.4832000 13.81000 0.5246000 0.6859000      0.7132000 
1 1 1 5  45 28 o 16.96000 0.3558000 17.80000 0.4525000 16.12000 0.5491000 1.679000       0.7115000 
1 1 1 5  45 30 o 5.084000 0.9607000 5.942000 1.358000  4.227000 1.359000  1.715000       1.921000  
1 1 1 5  45 32 o 5.554000 0.8379000 5.395000 1.184000  5.713000 1.186000  -0.3177000     1.676000  
1 1 1 5  45 34 o 16.56000 0.4256000 17.34000 0.6418000 15.79000 0.5590000 1.544000       0.8512000 
1 1 1 5  45 36 o 6.686000 0.7770000 5.691000 1.271000  7.681000 0.8942000 -1.990000      1.554000  
1 1 1 5  45 38 o 6.043000 0.8462000 6.199000 1.042000  5.887000 1.334000  0.3120000      1.692000  
1 1 1 5  45 40 o 7.527000 0.6492000 7.384000 0.9557000 7.670000 0.8787000 -0.2861000     1.298000  
1 1 1 5  45 42 o 4.847000 0.9279000 4.381000 1.381000  5.313000 1.240000  -0.9318000     1.856000  
1 1 1 5  45 44 o 3.736000 1.021000  4.176000 1.552000  3.296000 1.326000  0.8806000      2.042000  
1 1 1 5  45 46 o 3.474000 0.9154000 3.504000 1.302000  3.445000 1.287000  0.5832000E-01  1.831000  
1 1 1 5  46 1  o 16.69000 0.3841000 17.15000 0.5840000 16.22000 0.4990000 0.9224000      0.7682000 
1 1 1 5  46 3  o 11.91000 0.4378000 11.55000 0.6460000 12.28000 0.5910000 -0.7321000     0.8756000 
1 1 1 5  46 5  o 19.49000 0.3807000 19.51000 0.6148000 19.46000 0.4491000 0.4696000E-01  0.7614000 
1 1 1 5  46 7  o 15.67000 0.3779000 15.42000 0.5299000 15.93000 0.5389000 -0.5125000     0.7557000 
1 1 1 5  46 9  o 10.98000 0.4738000 10.58000 0.6792000 11.37000 0.6607000 -0.7912000     0.9475000 
1 1 1 5  46 11 o 11.96000 0.5183000 12.21000 0.6197000 11.72000 0.8309000 0.4852000      1.037000  
1 1 1 5  46 13 f 29.58000 0.3868000 29.69000 0.4458000 29.48000 0.6322000 0.2121000      0.7736000 
1 1 1 5  46 15 o 26.89000 0.3898000 26.94000 0.4448000 26.84000 0.6403000 0.1029000      0.7797000 
1 1 1 5  46 17 o 11.73000 0.5373000 11.90000 0.5875000 11.55000 0.8997000 0.3508000      1.075000  
1 1 1 5  46 19 o 12.88000 0.4759000 12.93000 0.4840000 12.83000 0.8196000 0.9878000E-01  0.9518000 
1 1 1 5  46 21 o 10.09000 0.5423000 10.01000 0.5623000 10.18000 0.9274000 -0.1698000     1.085000  
1 1 1 5  46 23 o 3.114000 0.9047000 2.769000 1.131000  3.460000 1.412000  -0.6910000     1.809000  
1 1 1 5  46 25 o 15.59000 0.3443000 16.31000 0.4561000 14.86000 0.5159000 1.442000       0.6886000 
1 1 1 5  46 27 o 17.37000 0.3544000 17.69000 0.4474000 17.05000 0.5498000 0.6378000      0.7088000 
1 1 1 5  46 29 o 3.636000 0.9792000 3.669000 1.462000  3.604000 1.303000  0.6498000E-01  1.958000  
1 1 1 5  46 31 o 9.671000 0.5214000 9.550000 0.6662000 9.793000 0.8021000 -0.2435000     1.043000  
1 1 1 5  46 33 o 11.40000 0.4640000 12.11000 0.5998000 10.69000 0.7082000 1.425000       0.9281000 
1 1 1 5  46 35 o 2.741000 0.8408000 2.530000 1.108000  2.951000 1.265000  -0.4213000     1.682000  
1 1 1 5  46 37 o 15.25000 0.4194000 15.79000 0.5469000 14.71000 0.6360000 1.073000       0.8388000 
1 1 1 5  46 39 o 13.25000 0.4278000 12.82000 0.6230000 13.68000 0.5863000 -0.8611000     0.8555000 
1 1 1 5  46 41 o 11.26000 0.5340000 10.33000 0.8597000 12.20000 0.6338000 -1.873000      1.068000  
1 1 1 5  46 43 o 2.901000 0.8907000 3.020000 1.331000  2.782000 1.184000  0.2378000      1.781000  
1 1 1 5  46 45 o 3.964000 0.9568000 4.362000 1.370000  3.565000 1.336000  0.7965000      1.914000  
1 1 1 5  47 0  o 7.049000 0.9557000 7.049000 0.9557000 7.049000 0.9557000 0.000000       0.000000  
1 1 1 5  47 2  o 7.685000 0.6952000 6.821000 1.093000  8.550000 0.8595000 -1.729000      1.390000  
1 1 1 5  47 4  o 23.16000 0.3607000 23.16000 0.5706000 23.15000 0.4416000 0.1200000E-01  0.7215000 
1 1 1 5  47 6  o 8.743000 0.5219000 7.844000 0.8240000 9.643000 0.6406000 -1.799000      1.044000  
1 1 1 5  47 8  o 18.60000 0.4114000 18.63000 0.4669000 18.57000 0.6775000 0.5806000E-01  0.8228000 
1 1 1 5  47 10 o 25.11000 0.3187000 24.63000 0.4287000 25.59000 0.4718000 -0.9575000     0.6375000 
1 1 1 5  47 12 o 11.63000 0.4052000 11.10000 0.5489000 12.16000 0.5963000 -1.060000      0.8104000 
1 1 1 5  47 14 o 6.983000 0.6408000 7.439000 0.7943000 6.528000 1.006000  0.9110000      1.282000  
1 1 1 5  47 16 o 20.89000 0.3254000 21.06000 0.3954000 20.71000 0.5169000 0.3539000      0.6508000 
1 1 1 5  47 18 o 4.501000 0.8719000 4.051000 1.203000  4.951000 1.263000  -0.9002000     1.744000  
1 1 1 5  47 20 o 14.07000 0.3803000 14.70000 0.4938000 13.45000 0.5784000 1.255000       0.7605000 
1 1 1 5  47 22 o 9.117000 0.4771000 8.703000 0.6044000 9.530000 0.7384000 -0.8270000     0.9542000 
1 1 1 5  47 24 o 25.25000 0.3259000 24.81000 0.4348000 25.68000 0.4857000 -0.8687000     0.6519000 
1 1 1 5  47 26 f 19.15000 0.3393000 19.00000 0.4406000 19.30000 0.5162000 -0.2992000     0.6787000 
1 1 1 5  47 28 o 3.920000 0.9993000 4.138000 1.527000  3.703000 1.289000  0.4350000      1.999000  
1 1 1 5  47 30 o 3.107000 0.8727000 2.640000 1.142000  3.574000 1.320000  -0.9334000     1.745000  
1 1 1 5  47 32 o 5.957000 0.7909000 7.197000 0.8277000 4.717000 1.348000  2.480000       1.582000  
1 1 1 5  47 34 o 7.316000 0.6617000 8.038000 0.7720000 6.594000 1.075000  1.444000       1.323000  
1 1 1 5  47 36 o 4.276000 0.9795000 3.777000 1.311000  4.775000 1.456000  -0.9973000     1.959000  
1 1 1 5  47 38 o 4.253000 0.9552000 3.779000 1.370000  4.727000 1.331000  -0.9479000     1.910000  
1 1 1 5  47 40 o 5.855000 0.8918000 5.252000 1.453000  6.457000 1.035000  -1.205000      1.784000  
1 1 1 5  47 42 o 5.236000 0.8679000 3.741000 1.389000  6.731000 1.041000  -2.990000      1.736000  
1 1 1 5  47 44 o 6.864000 0.8124000 6.021000 1.172000  7.706000 1.126000  -1.685000      1.625000  
1 1 1 5  48 1  o 10.25000 0.5391000 10.31000 0.7467000 10.18000 0.7778000 0.1255000      1.078000  
1 1 1 5  48 3  o 20.20000 0.3433000 20.21000 0.5127000 20.19000 0.4568000 0.1760000E-01  0.6867000 
1 1 1 5  48 5  o 9.822000 0.5501000 8.902000 0.7876000 10.74000 0.7684000 -1.840000      1.100000  
1 1 1 5  48 7  o 17.06000 0.3500000 17.45000 0.4644000 16.67000 0.5237000 0.7809000      0.7000000 
1 1 1 5  48 9  o 9.347000 0.4801000 9.053000 0.6512000 9.641000 0.7057000 -0.5881000     0.9603000 
1 1 1 5  48 11 o 11.71000 0.3997000 10.86000 0.5068000 12.55000 0.6182000 -1.689000      0.7994000 
1 1 1 5  48 13 o 16.32000 0.3332000 16.90000 0.4251000 15.74000 0.5133000 1.161000       0.6665000 
1 1 1 5  48 15 o 17.73000 0.3253000 17.86000 0.4036000 17.59000 0.5104000 0.2687000      0.6507000 
1 1 1 5  48 17 o 17.77000 0.3403000 17.91000 0.4034000 17.63000 0.5480000 0.2799000      0.6805000 
1 1 1 5  48 19 o 22.85000 0.3491000 22.16000 0.3890000 23.54000 0.5799000 -1.382000      0.6983000 
1 1 1 5  48 21 f 9.703000 0.4643000 10.52000 0.5473000 8.887000 0.7501000 1.630000       0.9286000 
1 1 1 5  48 23 o 10.98000 0.4590000 10.89000 0.4958000 11.06000 0.7726000 -0.1677000     0.9180000 
1 1 1 5  48 25 o 4.502000 0.8584000 4.942000 1.190000  4.061000 1.237000  0.8813000      1.717000  
1 1 1 5  48 27 o 5.210000 1.074000  5.207000 1.797000  5.212000 1.177000  -0.5829000E-02 2.148000  
1 1 1 5  48 29 o 9.448000 0.4730000 8.946000 0.6718000 9.950000 0.6659000 -1.004000      0.9459000 
1 1 1 5  48 31 o 7.863000 0.6071000 8.176000 0.8382000 7.550000 0.8785000 0.6266000      1.214000  
1 1 1 5  48 33 o 4.509000 0.8722000 5.526000 1.154000  3.492000 1.308000  2.034000       1.744000  
1 1 1 5  48 35 o 6.682000 0.8224000 7.014000 0.9516000 6.349000 1.341000  0.6645000      1.645000  
1 1 1 5  48 37 o 17.78000 0.3556000 18.02000 0.4833000 17.53000 0.5218000 0.4940000      0.7112000 
1 1 1 5  48 39 o 8.944000 0.6027000 8.481000 0.9046000 9.408000 0.7967000 -0.9273000     1.205000  
1 1 1 5  48 41 o 7.372000 0.6873000 7.563000 0.9505000 7.180000 0.9930000 0.3831000      1.375000  
1 1 1 5  48 43 o 4.698000 0.9245000 4.087000 1.288000  5.309000 1.326000  -1.221000      1.849000  
1 1 1 5  49 0  o 19.72000 0.5291000 19.72000 0.5291000 19.72000 0.5291000 0.000000       0.000000  
1 1 1 5  49 2  o 3.839000 0.9927000 3.773000 1.270000  3.905000 1.526000  -0.1315000     1.985000  
1 1 1 5  49 4  o 13.16000 0.4042000 13.24000 0.5638000 13.09000 0.5794000 0.1489000      0.8085000 
1 1 1 5  49 6  o 14.01000 0.4144000 14.40000 0.5164000 13.62000 0.6482000 0.7807000      0.8287000 
1 1 1 5  49 8  o 10.48000 0.4469000 10.62000 0.6003000 10.34000 0.6621000 0.2802000      0.8937000 
1 1 1 5  49 10 o 9.547000 0.5373000 9.007000 0.8324000 10.09000 0.6795000 -1.081000      1.075000  
1 1 1 5  49 12 o 4.041000 0.8734000 3.437000 1.195000  4.644000 1.275000  -1.207000      1.747000  
1 1 1 5  49 14 o 8.979000 0.4764000 8.920000 0.6345000 9.037000 0.7109000 -0.1166000     0.9528000 
1 1 1 5  49 16 o 12.52000 0.3862000 12.35000 0.4852000 12.68000 0.6011000 -0.3280000     0.7725000 
1 1 1 5  49 18 o 5.766000 0.8695000 5.517000 1.002000  6.014000 1.421000  -0.4965000     1.739000  
1 1 1 5  49 20 o 10.59000 0.4880000 10.89000 0.5459000 10.30000 0.8090000 0.5858000      0.9759000 
1 1 1 5  49 22 o 9.264000 0.5537000 9.594000 0.6566000 8.934000 0.8917000 0.6604000      1.107000  
1 1 1 5  49 24 o 13.62000 0.4182000 13.96000 0.5792000 13.28000 0.6034000 0.6828000      0.8364000 
1 1 1 5  49 26 o 3.349000 0.9383000 4.043000 1.485000  2.655000 1.148000  1.389000       1.877000  
1 1 1 5  49 28 o 4.632000 0.8625000 5.021000 1.150000  4.242000 1.286000  0.7793000      1.725000  
1 1 1 5  49 30 o 6.773000 0.7279000 7.090000 1.014000  6.456000 1.044000  0.6334000      1.456000  
1 1 1 5  49 32 o 3.936000 0.8810000 4.701000 1.207000  3.171000 1.284000  1.530000       1.762000  
1 1 1 5  49 34 o 5.238000 0.8906000 5.244000 1.117000  5.233000 1.387000  0.1049000E-01  1.781000  
1 1 1 5  49 36 o 3.973000 0.9410000 3.556000 1.290000  4.389000 1.370000  -0.8324000     1.882000  
1 1 1 5  49 38 o 2.702000 0.8352000 3.019000 1.250000  2.384000 1.108000  0.6343000      1.670000  
1 1 1 5  49 40 f 6.426000 0.7857000 5.713000 1.195000  7.138000 1.020000  -1.425000      1.571000  
1 1 1 5  49 42 o 5.098000 0.9588000 5.135000 1.324000  5.061000 1.387000  0.7354000E-01  1.918000  
1 1 1 5  50 1  o 22.32000 0.3490000 21.52000 0.5245000 23.12000 0.4605000 -1.594000      0.6980000 
1 1 1 5  50 3  o 7.728000 0.6265000 7.719000 0.8263000 7.737000 0.9420000 -0.1779000E-01 1.253000  
1 1 1 5  50 5  o 16.02000 0.3349000 16.25000 0.4796000 15.80000 0.4676000 0.4428000      0.6698000 
1 1 1 5  50 7  o 8.643000 0.5356000 8.452000 0.6542000 8.835000 0.8482000 -0.3834000     1.071000  
1 1 1 5  50 9  o 3.469000 0.8677000 2.492000 1.097000  4.446000 1.344000  -1.954000      1.735000  
1 1 1 5  50 11 o 10.28000 0.4847000 10.36000 0.6055000 10.21000 0.7570000 0.1530000      0.9694000 
1 1 1 5  50 13 o 7.438000 0.6448000 7.958000 0.7362000 6.918000 1.059000  1.039000       1.290000  
1 1 1 5  50 15 o 9.036000 0.5554000 8.917000 0.7085000 9.155000 0.8554000 -0.2381000     1.111000  
1 1 1 5  50 17 o 3.440000 0.9431000 2.957000 1.146000  3.923000 1.498000  -0.9660000     1.886000  
1 1 1 5  50 19 o 14.37000 0.3731000 14.78000 0.4388000 13.97000 0.6035000 0.8114000      0.7461000 
1 1 1 5  50 21 o 10.14000 0.5469000 10.58000 0.6754000 9.706000 0.8605000 0.8720000      1.094000  
1 1 1 5  50 23 o 11.66000 0.4490000 12.02000 0.6417000 11.29000 0.6281000 0.7236000      0.8980000 
1 1 1 5  50 25 o 8.911000 0.6169000 8.910000 1.013000  8.913000 0.7049000 -0.2897000E-02 1.234000  
1 1 1 5  50 27 o 12.66000 0.3989000 12.87000 0.5640000 12.44000 0.5641000 0.4249000      0.7977000 
1 1 1 5  50 29 o 12.94000 0.4264000 13.38000 0.6210000 12.51000 0.5844000 0.8743000      0.8527000 
1 1 1 5  50 31 o 11.75000 0.4230000 12.01000 0.5542000 11.49000 0.6393000 0.5138000      0.8461000 
1 1 1 5  50 33 o 5.004000 0.9025000 4.082000 1.249000  5.927000 1.303000  -1.844000      1.805000  
1 1 1 5  50 35 o 6.135000 0.7964000 6.682000 0.9677000 5.589000 1.265000  1.094000       1.593000  
1 1 1 5  50 37 o 5.900000 0.8168000 5.327000 1.240000  6.474000 1.063000  -1.148000      1.634000  
1 1 1 5  50 39 o 3.348000 0.9293000 3.446000 1.306000  3.250000 1.323000  0.1967000      1.859000  
1 1 1 5  50 41 o 3.720000 1.031000  2.827000 1.266000  4.613000 1.627000  -1.786000      2.061000  
1 1 1 5  51 0  o 4.567000 1.335000  4.567000 1.335000  4.567000 1.335000  0.000000       0.000000  
1 1 1 5  51 2  o 9.650000 0.4865000 9.614000 0.6595000 9.686000 0.7153000 -0.7248000E-01 0.9729000 
1 1 1 5  51 4  o 22.17000 0.3083000 21.17000 0.4433000 23.17000 0.4286000 -1.994000      0.6166000 
1 1 1 5  51 6  o 4.480000 0.8593000 4.092000 1.194000  4.867000 1.236000  -0.7755000     1.719000  
1 1 1 5  51 8  o 4.766000 0.8283000 3.759000 1.263000  5.772000 1.072000  -2.013000      1.657000  
1 1 1 5  51 10 o 3.383000 0.8404000 3.952000 1.173000  2.814000 1.204000  1.138000       1.681000  
1 1 1 5  51 12 o 12.65000 0.4328000 11.60000 0.6472000 13.70000 0.5748000 -2.092000      0.8656000 
1 1 1 5  51 14 o 9.162000 0.5188000 8.815000 0.7260000 9.509000 0.7413000 -0.6944000     1.038000  
1 1 1 5  51 16 o 12.52000 0.4595000 13.01000 0.5530000 12.04000 0.7339000 0.9771000      0.9189000 
1 1 1 5  51 18 o 8.711000 0.5503000 9.278000 0.6429000 8.145000 0.8932000 1.133000       1.101000  
1 1 1 5  51 20 o 8.921000 0.6388000 9.128000 0.9314000 8.715000 0.8744000 0.4125000      1.278000  
1 1 1 5  51 22 o 7.483000 0.6414000 8.224000 0.7763000 6.742000 1.021000  1.482000       1.283000  
1 1 1 5  51 24 o 5.331000 0.8307000 4.868000 1.313000  5.794000 1.017000  -0.9258000     1.661000  
1 1 1 5  51 26 o 11.41000 0.4288000 11.22000 0.5872000 11.59000 0.6249000 -0.3730000     0.8575000 
1 1 1 5  51 28 o 6.152000 0.8187000 5.402000 1.330000  6.902000 0.9553000 -1.500000      1.637000  
1 1 1 5  51 30 o 6.109000 0.7560000 5.948000 1.062000  6.271000 1.076000  -0.3238000     1.512000  
1 1 1 5  51 32 o 9.068000 0.5863000 8.982000 0.7244000 9.155000 0.9222000 -0.1734000     1.173000  
1 1 1 5  51 34 f 4.685000 0.9161000 4.755000 1.233000  4.615000 1.355000  0.1405000      1.832000  
1 1 1 5  51 36 f 3.815000 0.8482000 4.959000 1.196000  2.672000 1.203000  2.287000       1.696000  
1 1 1 5  51 38 o 4.550000 0.9551000 4.439000 1.298000  4.660000 1.402000  -0.2212000     1.910000  
1 1 1 5  52 1  o 5.798000 0.7279000 5.016000 1.112000  6.580000 0.9396000 -1.565000      1.456000  
1 1 1 5  52 3  o 6.499000 0.6998000 5.730000 1.105000  7.269000 0.8597000 -1.540000      1.400000  
1 1 1 5  52 5  o 11.02000 0.4281000 10.53000 0.6298000 11.51000 0.5801000 -0.9806000     0.8562000 
1 1 1 5  52 7  o 18.58000 0.3421000 18.13000 0.4672000 19.02000 0.5000000 -0.8941000     0.6843000 
1 1 1 5  52 9  o 9.592000 0.5111000 8.977000 0.7597000 10.21000 0.6839000 -1.231000      1.022000  
1 1 1 5  52 11 o 22.19000 0.3556000 22.74000 0.5049000 21.65000 0.5008000 1.092000       0.7112000 
1 1 1 5  52 13 o 23.10000 0.3698000 22.72000 0.4399000 23.47000 0.5945000 -0.7567000     0.7396000 
1 1 1 5  52 15 o 3.786000 0.8772000 4.244000 1.202000  3.329000 1.278000  0.9152000      1.754000  
1 1 1 5  52 17 o 6.520000 0.6984000 7.269000 0.8466000 5.771000 1.111000  1.498000       1.397000  
1 1 1 5  52 19 o 18.59000 0.3482000 18.37000 0.4479000 18.80000 0.5334000 -0.4345000     0.6965000 
1 1 1 5  52 21 o 11.22000 0.4596000 11.84000 0.5148000 10.59000 0.7615000 1.252000       0.9192000 
1 1 1 5  52 23 o 3.073000 0.8983000 3.094000 1.279000  3.053000 1.261000  0.4124000E-01  1.797000  
1 1 1 5  52 25 o 3.534000 0.8880000 4.109000 1.291000  2.958000 1.220000  1.151000       1.776000  
1 1 1 5  52 27 o 13.15000 0.4368000 13.10000 0.6404000 13.20000 0.5942000 -0.9346000E-01 0.8736000 
1 1 1 5  52 29 o 5.011000 0.8826000 4.471000 1.279000  5.551000 1.217000  -1.080000      1.765000  
1 1 1 5  52 31 o 2.976000 0.8854000 3.079000 1.210000  2.873000 1.293000  0.2059000      1.771000  
1 1 1 5  52 33 o 8.412000 0.5661000 9.001000 0.7291000 7.822000 0.8663000 1.178000       1.132000  
1 1 1 5  52 35 o 8.038000 0.6197000 8.106000 0.7896000 7.971000 0.9553000 0.1346000      1.239000  
1 1 1 5  52 37 o 10.12000 0.4904000 10.23000 0.6638000 10.02000 0.7221000 0.2124000      0.9808000 
1 1 1 5  53 0  o 7.971000 0.7566000 7.971000 0.7566000 7.971000 0.7566000 0.000000       0.000000  
1 1 1 5  53 2  o 9.590000 0.4710000 9.577000 0.6575000 9.603000 0.6745000 -0.2646000E-01 0.9420000 
1 1 1 5  53 4  o 7.674000 0.5623000 7.724000 0.8092000 7.624000 0.7810000 0.1001000      1.125000  
1 1 1 5  53 6  o 10.62000 0.4468000 10.23000 0.6410000 11.02000 0.6225000 -0.7832000     0.8936000 
1 1 1 5  53 8  o 8.171000 0.5161000 7.857000 0.7030000 8.485000 0.7559000 -0.6271000     1.032000  
1 1 1 5  53 10 o 11.48000 0.4275000 10.76000 0.6053000 12.20000 0.6039000 -1.438000      0.8551000 
1 1 1 5  53 12 f 3.004000 0.8889000 2.651000 1.140000  3.357000 1.364000  -0.7056000     1.778000  
1 1 1 5  53 14 o 13.39000 0.3991000 12.29000 0.5221000 14.49000 0.6038000 -2.206000      0.7982000 
1 1 1 5  53 16 o 13.31000 0.3997000 13.01000 0.5657000 13.61000 0.5647000 -0.5975000     0.7993000 
1 1 1 5  53 18 o 14.52000 0.3637000 14.94000 0.4591000 14.09000 0.5642000 0.8443000      0.7274000 
1 1 1 5  53 20 o 8.415000 0.5455000 8.466000 0.6817000 8.364000 0.8517000 0.1021000      1.091000  
1 1 1 5  53 22 o 2.759000 0.8382000 3.135000 1.232000  2.383000 1.137000  0.7518000      1.676000  
1 1 1 5  53 24 o 3.466000 0.8936000 3.029000 1.221000  3.904000 1.305000  -0.8754000     1.787000  
1 1 1 5  53 26 o 4.387000 0.9518000 4.754000 1.368000  4.019000 1.323000  0.7351000      1.904000  
1 1 1 5  53 28 o 7.226000 0.6686000 7.029000 0.9251000 7.423000 0.9655000 -0.3935000     1.337000  
1 1 1 5  53 30 o 4.385000 0.9800000 3.960000 1.330000  4.809000 1.439000  -0.8484000     1.960000  
1 1 1 5  53 32 o 3.708000 0.9350000 4.359000 1.327000  3.057000 1.318000  1.302000       1.870000  
1 1 1 5  53 34 o 2.933000 0.8291000 3.671000 1.294000  2.196000 1.038000  1.474000       1.658000  
1 1 1 5  53 36 o 3.595000 0.9083000 3.718000 1.207000  3.471000 1.358000  0.2474000      1.817000  
1 1 1 5  54 1  o 11.01000 0.4459000 11.46000 0.6018000 10.56000 0.6582000 0.8966000      0.8919000 
1 1 1 5  54 3  o 5.577000 0.7931000 5.775000 1.086000  5.380000 1.156000  0.3953000      1.586000  
1 1 1 5  54 5  o 4.469000 0.9137000 4.293000 1.295000  4.646000 1.290000  -0.3528000     1.827000  
1 1 1 5  54 7  o 3.319000 0.8678000 3.157000 1.165000  3.482000 1.287000  -0.3249000     1.736000  
1 1 1 5  54 9  o 5.789000 0.7040000 5.922000 0.9488000 5.655000 1.040000  0.2673000      1.408000  
1 1 1 5  54 11 o 4.345000 0.9952000 4.131000 1.223000  4.559000 1.570000  -0.4281000     1.990000  
1 1 1 5  54 13 o 5.244000 0.7945000 4.927000 1.109000  5.561000 1.138000  -0.6343000     1.589000  
1 1 1 5  54 15 o 8.260000 0.5479000 7.937000 0.7677000 8.583000 0.7820000 -0.6456000     1.096000  
1 1 1 5  54 17 o 10.42000 0.4711000 10.08000 0.6668000 10.76000 0.6657000 -0.6816000     0.9423000 
1 1 1 5  54 19 o 11.69000 0.4421000 11.72000 0.5897000 11.66000 0.6588000 0.6143000E-01  0.8842000 
1 1 1 5  54 21 o 19.03000 0.3667000 19.14000 0.4729000 18.92000 0.5607000 0.2195000      0.7335000 
1 1 1 5  54 23 o 9.998000 0.4732000 9.465000 0.6728000 10.53000 0.6656000 -1.066000      0.9464000 
1 1 1 5  54 25 o 4.328000 0.9431000 4.043000 1.390000  4.613000 1.275000  -0.5703000     1.886000  
1 1 1 5  54 27 o 4.923000 0.9145000 4.872000 1.287000  4.975000 1.299000  -0.1025000     1.829000  
1 1 1 5  54 29 o 4.564000 0.9078000 5.463000 1.109000  3.666000 1.437000  1.797000       1.816000  
1 1 1 5  54 31 o 5.112000 0.9264000 4.536000 1.254000  5.688000 1.364000  -1.151000      1.853000  
1 1 1 5  54 33 o 3.226000 0.9205000 2.827000 1.245000  3.626000 1.356000  -0.7988000     1.841000  
1 1 1 5  55 0  o 3.194000 1.256000  3.194000 1.256000  3.194000 1.256000  0.000000       0.000000  
1 1 1 5  55 2  o 8.106000 0.6218000 7.738000 0.9603000 8.475000 0.7902000 -0.7366000     1.244000  
1 1 1 5  55 4  o 12.40000 0.4135000 12.43000 0.5771000 12.36000 0.5922000 0.7236000E-01  0.8269000 
1 1 1 5  55 6  o 8.557000 0.5463000 8.902000 0.6314000 8.213000 0.8918000 0.6888000      1.093000  
1 1 1 5  55 8  o 4.633000 0.9963000 4.743000 1.147000  4.524000 1.629000  0.2189000      1.993000  
1 1 1 5  55 10 o 5.837000 0.7595000 5.240000 1.038000  6.433000 1.109000  -1.193000      1.519000  
1 1 1 5  55 12 o 6.388000 0.6446000 5.203000 0.9777000 7.573000 0.8403000 -2.370000      1.289000  
1 1 1 5  55 14 o 7.142000 0.6441000 6.566000 0.9501000 7.718000 0.8697000 -1.152000      1.288000  
1 1 1 5  55 16 o 8.598000 0.5589000 8.927000 0.6885000 8.269000 0.8806000 0.6582000      1.118000  
1 1 1 5  55 18 o 3.425000 0.8940000 3.348000 1.210000  3.501000 1.317000  -0.1531000     1.788000  
1 1 1 5  55 20 o 3.195000 0.8891000 2.641000 1.164000  3.750000 1.344000  -1.109000      1.778000  
1 1 1 5  55 22 o 6.650000 0.7446000 6.601000 0.9941000 6.700000 1.109000  -0.9946000E-01 1.489000  
1 1 1 5  55 24 o 14.00000 0.4215000 13.99000 0.6011000 14.00000 0.5909000 -0.1122000E-01 0.8429000 
1 1 1 5  55 26 o 11.73000 0.4471000 11.33000 0.6118000 12.14000 0.6521000 -0.8122000     0.8942000 
1 1 1 5  55 28 o 7.398000 0.6681000 7.919000 0.8579000 6.878000 1.024000  1.042000       1.336000  
1 1 1 5  55 30 o 7.863000 0.6847000 7.754000 0.8317000 7.971000 1.088000  -0.2164000     1.369000  
1 1 1 5  55 32 o 9.994000 0.5251000 9.836000 0.7483000 10.15000 0.7368000 -0.3156000     1.050000  
1 1 1 5  56 1  o 3.175000 0.9102000 3.387000 1.379000  2.963000 1.188000  0.4242000      1.820000  
1 1 1 5  56 3  o 12.58000 0.4250000 12.43000 0.6128000 12.74000 0.5889000 -0.3056000     0.8500000 
1 1 1 5  56 5  o 9.372000 0.6778000 8.195000 0.7233000 10.55000 1.146000  -2.354000      1.356000  
1 1 1 5  56 7  o 10.85000 0.5097000 10.38000 0.6272000 11.31000 0.8035000 -0.9353000     1.019000  
1 1 1 5  56 9  o 6.506000 0.6751000 5.553000 0.9776000 7.458000 0.9312000 -1.905000      1.350000  
1 1 1 5  56 11 o 5.551000 0.7899000 4.889000 1.120000  6.213000 1.114000  -1.325000      1.580000  
1 1 1 5  56 13 o 3.016000 0.8742000 2.630000 1.139000  3.403000 1.326000  -0.7733000     1.748000  
1 1 1 5  56 15 o 11.57000 0.4206000 11.79000 0.5432000 11.35000 0.6422000 0.4448000      0.8411000 
1 1 1 5  56 17 o 8.295000 0.5529000 8.371000 0.7271000 8.220000 0.8330000 0.1510000      1.106000  
1 1 1 5  56 19 o 6.864000 0.6829000 6.624000 0.9677000 7.104000 0.9640000 -0.4804000     1.366000  
1 1 1 5  56 21 o 8.460000 0.5508000 8.098000 0.7070000 8.822000 0.8449000 -0.7244000     1.102000  
1 1 1 5  56 23 o 3.379000 0.9479000 3.616000 1.378000  3.141000 1.302000  0.4741000      1.896000  
1 1 1 5  56 25 o 8.878000 0.5889000 9.418000 0.7286000 8.338000 0.9255000 1.080000       1.178000  
1 1 1 5  56 27 o 3.438000 0.9289000 4.144000 1.409000  2.732000 1.211000  1.412000       1.858000  
1 1 1 5  56 29 o 5.990000 0.8621000 4.147000 1.344000  7.833000 1.080000  -3.686000      1.724000  
1 1 1 5  57 0  o 4.249000 1.453000  4.249000 1.453000  4.249000 1.453000  0.000000       0.000000  
1 1 1 5  57 2  o 9.523000 0.6024000 8.658000 0.9364000 10.39000 0.7582000 -1.729000      1.205000  
1 1 1 5  57 4  o 19.01000 0.3846000 18.87000 0.4315000 19.14000 0.6367000 -0.2747000     0.7692000 
1 1 1 5  57 6  o 9.435000 0.5351000 9.108000 0.7124000 9.762000 0.7987000 -0.6549000     1.070000  
1 1 1 5  57 8  o 6.338000 0.6703000 5.352000 0.9969000 7.324000 0.8963000 -1.972000      1.341000  
1 1 1 5  57 10 o 7.660000 0.5886000 7.077000 0.8337000 8.243000 0.8311000 -1.166000      1.177000  
1 1 1 5  57 12 o 5.464000 0.7997000 5.469000 1.058000  5.459000 1.199000  0.1019000E-01  1.599000  
1 1 1 5  57 14 o 4.181000 0.8119000 5.438000 1.055000  2.923000 1.234000  2.515000       1.624000  
1 1 1 5  57 16 o 3.976000 0.9138000 3.896000 1.220000  4.056000 1.361000  -0.1599000     1.828000  
1 1 1 5  57 18 o 2.637000 0.8320000 2.365000 1.084000  2.910000 1.262000  -0.5456000     1.664000  
1 1 1 5  57 20 o 5.931000 0.8211000 5.370000 1.101000  6.492000 1.219000  -1.122000      1.642000  
1 1 1 5  57 22 o 5.412000 0.8503000 5.182000 1.272000  5.642000 1.128000  -0.4600000     1.701000  
1 1 1 5  57 24 o 6.635000 0.7846000 6.589000 0.9975000 6.681000 1.211000  -0.9192000E-01 1.569000  
1 1 1 5  57 26 o 3.491000 0.8991000 4.084000 1.264000  2.898000 1.279000  1.185000       1.798000  
1 1 1 5  57 28 o 6.314000 0.8583000 6.062000 1.098000  6.567000 1.320000  -0.5056000     1.717000  
1 1 1 5  58 1  o 4.391000 0.9801000 5.042000 1.225000  3.740000 1.530000  1.301000       1.960000  
1 1 1 5  58 3  o 7.568000 0.5969000 8.492000 0.7820000 6.645000 0.9019000 1.847000       1.194000  
1 1 1 5  58 5  o 5.274000 0.8284000 5.054000 1.085000  5.494000 1.252000  -0.4404000     1.657000  
1 1 1 5  58 7  o 11.35000 0.4869000 10.90000 0.7015000 11.81000 0.6754000 -0.9062000     0.9738000 
1 1 1 5  58 9  o 8.952000 0.5232000 9.614000 0.6099000 8.290000 0.8503000 1.324000       1.046000  
1 1 1 5  58 11 o 4.442000 0.9003000 4.119000 1.227000  4.766000 1.317000  -0.6475000     1.801000  
1 1 1 5  58 13 o 5.042000 0.8408000 5.508000 1.040000  4.576000 1.322000  0.9320000      1.682000  
1 1 1 5  58 15 o 7.444000 0.5937000 6.745000 0.8530000 8.143000 0.8261000 -1.398000      1.187000  
1 1 1 5  58 17 o 7.668000 0.6330000 6.601000 0.8963000 8.736000 0.8941000 -2.135000      1.266000  
1 1 1 5  58 19 f 14.27000 0.4060000 14.25000 0.4891000 14.29000 0.6482000 -0.3942000E-01 0.8120000 
1 1 1 5  58 21 o 7.683000 0.6719000 7.806000 0.8331000 7.560000 1.054000  0.2460000      1.344000  
1 1 1 5  58 23 o 3.351000 0.9191000 3.059000 1.222000  3.642000 1.374000  -0.5825000     1.838000  
1 1 1 5  58 25 o 3.701000 0.9479000 3.745000 1.318000  3.656000 1.362000  0.8900000E-01  1.896000  
1 1 1 5  59 0  o 4.392000 1.340000  4.392000 1.340000  4.392000 1.340000  0.000000       0.000000  
1 1 1 5  59 2  o 5.455000 0.9405000 5.861000 1.297000  5.048000 1.363000  0.8131000      1.881000  
1 1 1 5  59 4  o 8.672000 0.9344000 10.34000 0.6813000 7.001000 1.740000  3.342000       1.869000  
1 1 1 5  59 6  o 9.374000 0.5503000 9.775000 0.6876000 8.974000 0.8594000 0.8019000      1.101000  
1 1 1 5  59 8  o 5.519000 0.7950000 5.439000 1.010000  5.599000 1.228000  -0.1600000     1.590000  
1 1 1 5  59 10 o 4.168000 0.9400000 4.103000 1.223000  4.234000 1.428000  -0.1312000     1.880000  
1 1 1 5  59 12 o 5.102000 0.8759000 5.256000 1.071000  4.947000 1.386000  0.3092000      1.752000  
1 1 1 5  59 14 o 3.269000 0.8568000 3.482000 1.162000  3.055000 1.260000  0.4271000      1.714000  
1 1 1 5  59 16 o 4.192000 0.9286000 4.626000 1.221000  3.758000 1.399000  0.8677000      1.857000  
1 1 1 5  59 18 o 4.423000 0.9118000 4.358000 1.148000  4.489000 1.417000  -0.1315000     1.824000  
1 1 1 5  59 20 o 4.873000 0.9623000 4.831000 1.268000  4.914000 1.448000  -0.8312000E-01 1.925000  
1 1 1 5  59 22 o 3.223000 0.9034000 2.691000 1.159000  3.755000 1.386000  -1.063000      1.807000  
1 1 1 5  60 1  o 4.020000 0.9355000 4.067000 1.293000  3.973000 1.352000  0.9476000E-01  1.871000  
1 1 1 5  60 3  o 3.729000 0.9237000 4.071000 1.283000  3.387000 1.329000  0.6837000      1.847000  
1 1 1 5  60 5  o 4.324000 0.9793000 4.398000 1.248000  4.250000 1.510000  0.1481000      1.959000  
1 1 1 5  60 7  o 3.685000 0.9295000 3.895000 1.329000  3.474000 1.300000  0.4209000      1.859000  
1 1 1 5  60 9  o 3.605000 0.9835000 3.525000 1.317000  3.685000 1.461000  -0.1603000     1.967000  
1 1 1 5  60 11 o 3.946000 0.9293000 3.108000 1.236000  4.785000 1.388000  -1.676000      1.859000  
1 1 1 5  60 13 o 9.718000 0.5412000 9.997000 0.6331000 9.438000 0.8779000 0.5599000      1.082000  
1 1 1 5  60 15 o 3.394000 0.9205000 2.791000 1.174000  3.998000 1.418000  -1.206000      1.841000  
1 1 1 5  60 17 o 4.282000 0.8984000 4.523000 1.104000  4.041000 1.417000  0.4816000      1.797000  
1 1 1 5  60 19 o 2.641000 0.8208000 2.829000 1.162000  2.452000 1.160000  0.3765000      1.642000  
1 1 1 5  61 0  o 4.281000 1.458000  4.281000 1.458000  4.281000 1.458000  0.000000       0.000000  
1 1 1 5  61 2  o 2.794000 0.8297000 2.255000 1.041000  3.333000 1.292000  -1.078000      1.659000  
1 1 1 5  61 4  o 5.483000 0.7945000 5.920000 0.9343000 5.045000 1.285000  0.8747000      1.589000  
1 1 1 5  61 6  o 3.831000 0.9477000 3.759000 1.277000  3.903000 1.400000  -0.1442000     1.895000  
1 1 1 5  61 8  o 4.612000 0.9452000 3.045000 1.166000  6.179000 1.488000  -3.134000      1.890000  
1 1 1 5  61 10 o 7.656000 0.6898000 6.618000 0.9637000 8.694000 0.9873000 -2.076000      1.380000  
1 1 1 5  61 12 f 12.13000 0.5042000 11.42000 0.5978000 12.83000 0.8120000 -1.416000      1.008000  
1 1 1 5  61 14 o 3.097000 0.9485000 3.143000 1.351000  3.051000 1.332000  0.9227000E-01  1.897000  
1 1 1 5  61 16 o 3.654000 1.458000  ?        ?         3.654000 1.458000  ?              ?         
1 1 1 5  62 1  o 2.951000 0.8709000 2.844000 1.199000  3.058000 1.263000  -0.2141000     1.742000  
1 1 1 5  62 3  o 4.385000 0.9715000 4.487000 1.208000  4.284000 1.522000  0.2023000      1.943000  
1 1 1 5  62 5  o 2.729000 0.8177000 2.508000 1.077000  2.950000 1.230000  -0.4415000     1.635000  
1 1 1 5  62 7  o 4.496000 0.9186000 4.224000 1.169000  4.768000 1.417000  -0.5441000     1.837000  
1 1 1 5  62 9  o 3.200000 0.9574000 2.031000 0.9561000 4.369000 1.659000  -2.338000      1.915000  
1 1 1 6  0  0  o 149.7000 2.033000  149.7000 2.033000  149.7000 2.033000  0.000000       0.000000  
1 1 1 6  0  2  o 145.5000 1.396000  145.5000 1.396000  145.5000 1.396000  0.000000       0.000000  
1 1 1 6  0  4  o 5.075000 0.2771000 5.075000 0.2771000 5.075000 0.2771000 0.000000       0.000000  
1 1 1 6  0  6  o 93.02000 0.8971000 93.02000 0.8971000 93.02000 0.8971000 0.000000       0.000000  
1 1 1 6  0  8  o 11.68000 0.2278000 11.68000 0.2278000 11.68000 0.2278000 0.000000       0.000000  
1 1 1 6  0  10 o 47.87000 0.5511000 47.87000 0.5511000 47.87000 0.5511000 0.000000       0.000000  
1 1 1 6  0  12 o 17.03000 0.2544000 17.03000 0.2544000 17.03000 0.2544000 0.000000       0.000000  
1 1 1 6  0  14 o 9.991000 0.4260000 9.991000 0.4260000 9.991000 0.4260000 0.000000       0.000000  
1 1 1 6  0  16 o 14.20000 0.2855000 14.20000 0.2855000 14.20000 0.2855000 0.000000       0.000000  
1 1 1 6  0  18 o 80.06000 0.9081000 80.06000 0.9081000 80.06000 0.9081000 0.000000       0.000000  
1 1 1 6  0  20 o 130.7000 1.262000  130.7000 1.262000  130.7000 1.262000  0.000000       0.000000  
1 1 1 6  0  22 o 47.29000 0.4953000 47.29000 0.4953000 47.29000 0.4953000 0.000000       0.000000  
1 1 1 6  0  24 o 126.2000 1.222000  126.2000 1.222000  126.2000 1.222000  0.000000       0.000000  
1 1 1 6  0  26 o 111.5000 1.085000  111.5000 1.085000  111.5000 1.085000  0.000000       0.000000  
1 1 1 6  0  28 o 18.67000 0.4950000 18.67000 0.4950000 18.67000 0.4950000 0.000000       0.000000  
1 1 1 6  0  30 o 7.109000 0.9781000 7.109000 0.9781000 7.109000 0.9781000 0.000000       0.000000  
1 1 1 6  0  32 o 66.76000 0.7844000 66.76000 0.7844000 66.76000 0.7844000 0.000000       0.000000  
1 1 1 6  0  34 o 40.35000 0.5493000 40.35000 0.5493000 40.35000 0.5493000 0.000000       0.000000  
1 1 1 6  0  36 o 8.143000 0.8692000 8.143000 0.8692000 8.143000 0.8692000 0.000000       0.000000  
1 1 1 6  0  38 o 24.96000 0.4973000 24.96000 0.4973000 24.96000 0.4973000 0.000000       0.000000  
1 1 1 6  0  40 o 52.47000 0.5707000 52.47000 0.5707000 52.47000 0.5707000 0.000000       0.000000  
1 1 1 6  0  42 o 21.58000 0.6459000 21.58000 0.6459000 21.58000 0.6459000 0.000000       0.000000  
1 1 1 6  0  44 o 28.25000 0.4562000 28.25000 0.4562000 28.25000 0.4562000 0.000000       0.000000  
1 1 1 6  0  46 o 22.57000 0.4965000 22.57000 0.4965000 22.57000 0.4965000 0.000000       0.000000  
1 1 1 6  0  48 o 12.86000 0.7074000 12.86000 0.7074000 12.86000 0.7074000 0.000000       0.000000  
1 1 1 6  0  50 o 3.625000 1.448000  3.625000 1.448000  3.625000 1.448000  0.000000       0.000000  
1 1 1 6  0  52 o 2.649000 1.191000  2.649000 1.191000  2.649000 1.191000  0.000000       0.000000  
1 1 1 6  0  54 o 3.635000 1.454000  3.635000 1.454000  3.635000 1.454000  0.000000       0.000000  
1 1 1 6  0  56 o 3.084000 1.299000  3.084000 1.299000  3.084000 1.299000  0.000000       0.000000  
1 1 1 6  0  58 o 9.181000 0.7921000 9.181000 0.7921000 9.181000 0.7921000 0.000000       0.000000  
1 1 1 6  0  60 o 3.268000 1.443000  3.268000 1.443000  3.268000 1.443000  0.000000       0.000000  
1 1 1 6  0  62 o 3.236000 1.378000  3.236000 1.378000  3.236000 1.378000  0.000000       0.000000  
1 1 1 6  0  64 o 13.27000 0.7719000 13.27000 0.7719000 13.27000 0.7719000 0.000000       0.000000  
1 1 1 6  0  66 f 4.721000 1.664000  4.721000 1.664000  4.721000 1.664000  0.000000       0.000000  
1 1 1 6  1  1  o 80.12000 0.5472000 80.30000 0.7754000 79.94000 0.7721000 0.3609000      1.094000  
1 1 1 6  1  3  o 86.00000 0.5866000 86.03000 0.8298000 85.97000 0.8293000 0.5947000E-01  1.173000  
1 1 1 6  1  5  o 45.57000 0.3184000 45.62000 0.4509000 45.52000 0.4498000 0.1015000      0.6369000 
1 1 1 6  1  7  o 70.97000 0.4872000 70.60000 0.6854000 71.34000 0.6925000 -0.7351000     0.9743000 
1 1 1 6  1  9  o 10.17000 0.1930000 10.25000 0.2703000 10.08000 0.2757000 0.1767000      0.3861000 
1 1 1 6  1  11 o 27.95000 0.2269000 27.43000 0.2731000 28.48000 0.3626000 -1.049000      0.4539000 
1 1 1 6  1  13 o 54.95000 0.4982000 55.80000 0.6388000 54.09000 0.7647000 1.707000       0.9964000 
1 1 1 6  1  15 o 45.93000 0.3301000 46.35000 0.4700000 45.51000 0.4635000 0.8388000      0.6601000 
1 1 1 6  1  17 o 84.14000 0.6269000 84.36000 0.9490000 83.92000 0.8194000 0.4395000      1.254000  
1 1 1 6  1  19 o 21.22000 0.2254000 21.17000 0.3540000 21.28000 0.2791000 -0.1074000     0.4508000 
1 1 1 6  1  21 o 191.9000 1.304000  190.9000 1.836000  192.8000 1.854000  -1.928000      2.609000  
1 1 1 6  1  23 o 59.40000 0.4254000 59.67000 0.6038000 59.12000 0.5995000 0.5567000      0.8508000 
1 1 1 6  1  25 o 80.89000 0.6535000 80.37000 0.9188000 81.41000 0.9296000 -1.034000      1.307000  
1 1 1 6  1  27 o 61.88000 0.4467000 61.47000 0.6279000 62.29000 0.6355000 -0.8189000     0.8933000 
1 1 1 6  1  29 o 100.4000 0.8994000 99.40000 1.126000  101.4000 1.403000  -2.032000      1.799000  
1 1 1 6  1  31 o 67.04000 0.5194000 66.75000 0.6786000 67.33000 0.7865000 -0.5768000     1.039000  
1 1 1 6  1  33 o 57.99000 0.4637000 57.93000 0.7000000 58.04000 0.6085000 -0.1113000     0.9275000 
1 1 1 6  1  35 o 25.86000 0.3167000 26.24000 0.4688000 25.48000 0.4259000 0.7655000      0.6333000 
1 1 1 6  1  37 o 57.02000 0.4247000 57.16000 0.6020000 56.87000 0.5993000 0.2908000      0.8494000 
1 1 1 6  1  39 o 59.20000 0.5097000 59.73000 0.7263000 58.67000 0.7154000 1.060000       1.019000  
1 1 1 6  1  41 o 21.43000 0.3573000 21.38000 0.5416000 21.48000 0.4663000 -0.9199000E-01 0.7147000 
1 1 1 6  1  43 o 12.23000 0.5222000 12.01000 0.7036000 12.45000 0.7717000 -0.4408000     1.044000  
1 1 1 6  1  45 o 39.51000 0.4096000 39.36000 0.5754000 39.66000 0.5831000 -0.3042000     0.8192000 
1 1 1 6  1  47 o 14.89000 0.4524000 15.49000 0.6106000 14.29000 0.6676000 1.194000       0.9047000 
1 1 1 6  1  49 o 15.71000 0.4253000 15.52000 0.6037000 15.91000 0.5993000 -0.3910000     0.8506000 
1 1 1 6  1  51 o 18.71000 0.3876000 19.50000 0.5792000 17.93000 0.5151000 1.566000       0.7751000 
1 1 1 6  1  53 o 2.514000 0.8444000 2.504000 1.193000  2.524000 1.196000  -0.2036000E-01 1.689000  
1 1 1 6  1  55 o 3.628000 0.9262000 4.430000 1.368000  2.826000 1.249000  1.604000       1.852000  
1 1 1 6  1  57 o 4.735000 0.9387000 2.914000 1.327000  6.555000 1.328000  -3.641000      1.877000  
1 1 1 6  1  59 o 10.60000 0.5546000 9.935000 0.8662000 11.27000 0.6928000 -1.333000      1.109000  
1 1 1 6  1  61 o 6.057000 1.139000  6.176000 1.753000  5.939000 1.454000  0.2377000      2.277000  
1 1 1 6  1  63 o 3.709000 1.078000  4.045000 1.572000  3.372000 1.475000  0.6734000      2.156000  
1 1 1 6  1  65 o 7.873000 0.7595000 8.750000 0.9453000 6.996000 1.189000  1.754000       1.519000  
1 1 1 6  1  67 o 3.167000 0.9611000 3.217000 1.348000  3.117000 1.370000  0.1004000      1.922000  
1 1 1 6  2  0  o 27.62000 0.2871000 27.62000 0.2871000 27.62000 0.2871000 0.000000       0.000000  
1 1 1 6  2  2  o 75.07000 0.5134000 74.54000 0.7208000 75.60000 0.7311000 -1.051000      1.027000  
1 1 1 6  2  4  o 133.0000 0.9033000 133.2000 1.279000  132.8000 1.276000  0.4106000      1.807000  
1 1 1 6  2  6  o 84.55000 0.5780000 84.06000 0.8131000 85.04000 0.8216000 -0.9829000     1.156000  
1 1 1 6  2  8  o 96.52000 0.7110000 95.94000 1.069000  97.10000 0.9372000 -1.164000      1.422000  
1 1 1 6  2  10 o 39.23000 0.3348000 39.82000 0.3630000 38.64000 0.5628000 1.174000       0.6697000 
1 1 1 6  2  12 o 12.25000 0.2203000 12.03000 0.2253000 12.47000 0.3787000 -0.4365000     0.4406000 
1 1 1 6  2  14 o 49.54000 0.4549000 49.39000 0.7010000 49.68000 0.5798000 -0.2905000     0.9098000 
1 1 1 6  2  16 o 42.98000 0.3382000 43.27000 0.5126000 42.69000 0.4412000 0.5832000      0.6763000 
1 1 1 6  2  18 o 13.83000 0.2720000 14.04000 0.4659000 13.63000 0.2809000 0.4103000      0.5440000 
1 1 1 6  2  20 f 140.9000 0.9918000 140.9000 1.567000  141.0000 1.217000  -0.1680000     1.984000  
1 1 1 6  2  22 o 128.5000 0.8783000 128.9000 1.247000  128.1000 1.238000  0.8325000      1.757000  
1 1 1 6  2  24 o 99.47000 0.6865000 99.31000 0.9691000 99.64000 0.9727000 -0.3296000     1.373000  
1 1 1 6  2  26 o 46.87000 0.3581000 47.26000 0.5094000 46.48000 0.5036000 0.7775000      0.7163000 
1 1 1 6  2  28 o 34.66000 0.5175000 34.56000 0.8359000 34.76000 0.6104000 -0.2048000     1.035000  
1 1 1 6  2  30 o 60.78000 0.4770000 60.64000 0.6261000 60.92000 0.7198000 -0.2751000     0.9540000 
1 1 1 6  2  32 o 96.60000 0.7262000 96.12000 0.9449000 97.08000 1.103000  -0.9614000     1.452000  
1 1 1 6  2  34 o 6.468000 0.7829000 7.130000 0.9786000 5.806000 1.222000  1.324000       1.566000  
1 1 1 6  2  36 o 49.37000 0.4147000 48.75000 0.5358000 49.99000 0.6332000 -1.241000      0.8295000 
1 1 1 6  2  38 o 53.67000 0.4394000 52.73000 0.5653000 54.61000 0.6730000 -1.872000      0.8789000 
1 1 1 6  2  40 o 46.42000 0.3707000 46.29000 0.5236000 46.54000 0.5248000 -0.2533000     0.7413000 
1 1 1 6  2  42 o 3.475000 0.9906000 3.141000 1.328000  3.810000 1.470000  -0.6692000     1.981000  
1 1 1 6  2  44 o 29.44000 0.3605000 29.18000 0.4650000 29.70000 0.5510000 -0.5116000     0.7210000 
1 1 1 6  2  46 o 46.60000 0.4158000 46.71000 0.6313000 46.48000 0.5413000 0.2253000      0.8316000 
1 1 1 6  2  48 o 17.02000 0.3906000 16.44000 0.5675000 17.61000 0.5368000 -1.171000      0.7811000 
1 1 1 6  2  50 o 41.76000 0.3925000 41.37000 0.5131000 42.16000 0.5941000 -0.7892000     0.7850000 
1 1 1 6  2  52 o 7.465000 0.7421000 7.453000 1.063000  7.476000 1.036000  -0.2275000E-01 1.484000  
1 1 1 6  2  54 o 2.695000 0.8727000 2.756000 1.255000  2.634000 1.213000  0.1214000      1.745000  
1 1 1 6  2  56 o 3.916000 1.105000  3.867000 1.488000  3.965000 1.633000  -0.9739000E-01 2.209000  
1 1 1 6  2  58 o 12.32000 0.4927000 12.58000 0.6906000 12.06000 0.7029000 0.5181000      0.9854000 
1 1 1 6  2  60 o 3.474000 0.9799000 3.690000 1.428000  3.257000 1.342000  0.4326000      1.960000  
1 1 1 6  2  62 o 6.117000 0.9450000 7.238000 1.189000  4.996000 1.469000  2.242000       1.890000  
1 1 1 6  2  64 o 7.808000 0.8831000 8.531000 1.171000  7.086000 1.322000  1.446000       1.766000  
1 1 1 6  2  66 o 3.264000 0.9892000 3.559000 1.451000  2.968000 1.345000  0.5910000      1.978000  
1 1 1 6  3  1  o 146.9000 0.9978000 146.7000 1.409000  147.2000 1.413000  -0.4530000     1.996000  
1 1 1 6  3  3  o 51.66000 0.3576000 51.92000 0.5083000 51.41000 0.5033000 0.5144000      0.7153000 
1 1 1 6  3  5  o 125.4000 0.8518000 124.4000 1.195000  126.3000 1.214000  -1.871000      1.704000  
1 1 1 6  3  7  o 50.05000 0.3492000 50.16000 0.4946000 49.95000 0.4930000 0.2080000      0.6983000 
1 1 1 6  3  9  o 52.94000 0.4789000 53.15000 0.6067000 52.74000 0.7411000 0.4062000      0.9578000 
1 1 1 6  3  11 o 24.03000 0.2344000 24.35000 0.2518000 23.71000 0.3955000 0.6433000      0.4689000 
1 1 1 6  3  13 o 40.79000 0.3634000 40.91000 0.4194000 40.68000 0.5937000 0.2346000      0.7269000 
1 1 1 6  3  15 o 113.2000 0.8923000 113.5000 1.265000  112.9000 1.259000  0.6692000      1.785000  
1 1 1 6  3  17 o 79.89000 0.5693000 79.65000 0.8967000 80.13000 0.7016000 -0.4809000     1.139000  
1 1 1 6  3  19 o 30.41000 0.2972000 30.56000 0.5020000 30.25000 0.3185000 0.3087000      0.5945000 
1 1 1 6  3  21 o 66.50000 0.4835000 66.82000 0.7655000 66.18000 0.5907000 0.6459000      0.9669000 
1 1 1 6  3  23 o 82.29000 0.5908000 82.35000 0.9327000 82.23000 0.7254000 0.1142000      1.182000  
1 1 1 6  3  25 o 102.8000 0.8197000 102.9000 1.161000  102.7000 1.157000  0.1989000      1.639000  
1 1 1 6  3  27 o 36.08000 0.3474000 35.95000 0.4884000 36.21000 0.4942000 -0.2597000     0.6948000 
1 1 1 6  3  29 o 24.11000 0.3183000 23.77000 0.4068000 24.46000 0.4898000 -0.6917000     0.6367000 
1 1 1 6  3  31 o 11.93000 0.4721000 11.58000 0.6167000 12.29000 0.7151000 -0.7040000     0.9442000 
1 1 1 6  3  33 o 64.71000 0.5069000 64.75000 0.7676000 64.67000 0.6622000 0.7795000E-01  1.014000  
1 1 1 6  3  35 o 47.86000 0.3731000 47.97000 0.5300000 47.75000 0.5253000 0.2186000      0.7462000 
1 1 1 6  3  37 o 31.00000 0.3050000 30.83000 0.4320000 31.17000 0.4308000 -0.3461000     0.6101000 
1 1 1 6  3  39 o 7.454000 0.8056000 6.757000 1.365000  8.152000 0.8555000 -1.395000      1.611000  
1 1 1 6  3  41 o 33.01000 0.4038000 32.14000 0.6169000 33.87000 0.5213000 -1.728000      0.8076000 
1 1 1 6  3  43 o 24.35000 0.3548000 24.63000 0.4697000 24.07000 0.5319000 0.5680000      0.7096000 
1 1 1 6  3  45 o 25.23000 0.3393000 25.59000 0.4730000 24.86000 0.4866000 0.7252000      0.6786000 
1 1 1 6  3  47 o 12.21000 0.5152000 12.10000 0.7601000 12.32000 0.6956000 -0.2214000     1.030000  
1 1 1 6  3  49 o 10.62000 0.5877000 11.04000 0.7989000 10.20000 0.8621000 0.8385000      1.175000  
1 1 1 6  3  51 o 7.098000 0.8654000 7.804000 1.174000  6.392000 1.272000  1.412000       1.731000  
1 1 1 6  3  53 o 4.149000 1.050000  4.083000 1.492000  4.215000 1.479000  -0.1318000     2.101000  
1 1 1 6  3  55 o 3.943000 1.023000  3.757000 1.421000  4.128000 1.472000  -0.3710000     2.046000  
1 1 1 6  3  57 o 16.97000 0.4353000 16.95000 0.6707000 16.99000 0.5550000 -0.4806000E-01 0.8705000 
1 1 1 6  3  59 o 6.426000 0.8767000 5.004000 1.399000  7.847000 1.057000  -2.843000      1.753000  
1 1 1 6  3  61 o 8.908000 0.6551000 7.730000 1.049000  10.09000 0.7854000 -2.357000      1.310000  
1 1 1 6  3  63 o 4.876000 1.107000  4.713000 1.582000  5.038000 1.549000  -0.3256000     2.214000  
1 1 1 6  3  65 f 4.492000 1.343000  3.273000 1.393000  5.710000 2.296000  -2.437000      2.686000  
1 1 1 6  3  67 o 3.359000 0.9844000 3.780000 1.470000  2.938000 1.310000  0.8422000      1.969000  
1 1 1 6  4  0  o 55.87000 0.5449000 55.87000 0.5449000 55.87000 0.5449000 0.000000       0.000000  
1 1 1 6  4  2  o 23.71000 0.1801000 23.64000 0.2541000 23.77000 0.2553000 -0.1328000     0.3602000 
1 1 1 6  4  4  o 45.97000 0.3210000 46.13000 0.4552000 45.81000 0.4527000 0.3204000      0.6420000 
1 1 1 6  4  6  o 108.6000 0.7393000 108.9000 1.049000  108.2000 1.042000  0.6961000      1.479000  
1 1 1 6  4  8  o 59.98000 0.4490000 60.27000 0.6815000 59.69000 0.5847000 0.5777000      0.8979000 
1 1 1 6  4  10 o 61.83000 0.6610000 62.43000 0.5468000 61.22000 1.204000  1.217000       1.322000  
1 1 1 6  4  12 o 24.87000 0.2136000 25.09000 0.2590000 24.65000 0.3398000 0.4449000      0.4272000 
1 1 1 6  4  14 o 10.65000 0.3554000 11.33000 0.6441000 9.974000 0.3005000 1.352000       0.7107000 
1 1 1 6  4  16 o 66.46000 0.4997000 66.42000 0.7523000 66.51000 0.6579000 -0.9259000E-01 0.9994000 
1 1 1 6  4  18 o 102.7000 0.7284000 103.6000 1.158000  101.8000 0.8844000 1.832000       1.457000  
1 1 1 6  4  20 o 36.94000 0.3397000 37.12000 0.5730000 36.76000 0.3649000 0.3671000      0.6794000 
1 1 1 6  4  22 o 94.72000 0.6739000 94.53000 1.062000  94.92000 0.8293000 -0.3936000     1.348000  
1 1 1 6  4  24 o 83.65000 0.7523000 83.79000 1.165000  83.51000 0.9519000 0.2797000      1.505000  
1 1 1 6  4  26 o 62.73000 0.4857000 63.45000 0.7386000 62.00000 0.6308000 1.449000       0.9713000 
1 1 1 6  4  28 o 26.91000 0.3097000 26.95000 0.4622000 26.87000 0.4123000 0.7792000E-01  0.6193000 
1 1 1 6  4  30 o 18.44000 0.3966000 18.72000 0.4325000 18.17000 0.6649000 0.5570000      0.7932000 
1 1 1 6  4  32 o 64.65000 0.4678000 64.65000 0.6607000 64.65000 0.6623000 0.6302000E-02  0.9355000 
1 1 1 6  4  34 o 41.58000 0.3690000 41.79000 0.5590000 41.37000 0.4818000 0.4157000      0.7380000 
1 1 1 6  4  36 o 32.33000 0.3086000 32.08000 0.4395000 32.59000 0.4332000 -0.5127000     0.6171000 
1 1 1 6  4  38 o 29.70000 0.3276000 29.95000 0.4312000 29.46000 0.4932000 0.4915000      0.6551000 
1 1 1 6  4  40 o 64.35000 0.5430000 64.20000 0.7613000 64.51000 0.7744000 -0.3085000     1.086000  
1 1 1 6  4  42 o 35.63000 0.3612000 35.33000 0.4678000 35.94000 0.5504000 -0.6056000     0.7223000 
1 1 1 6  4  44 o 21.95000 0.4254000 22.18000 0.4913000 21.73000 0.6947000 0.4429000      0.8509000 
1 1 1 6  4  46 o 20.49000 0.4103000 20.39000 0.5765000 20.59000 0.5839000 -0.2045000     0.8205000 
1 1 1 6  4  48 o 17.00000 0.4014000 17.04000 0.5601000 16.97000 0.5752000 0.6834000E-01  0.8028000 
1 1 1 6  4  50 o 13.87000 0.4749000 14.02000 0.6173000 13.71000 0.7220000 0.3138000      0.9499000 
1 1 1 6  4  52 o 5.259000 1.134000  5.231000 1.716000  5.288000 1.482000  -0.5718000E-01 2.267000  
1 1 1 6  4  54 o 20.13000 0.3729000 20.04000 0.4949000 20.21000 0.5580000 -0.1725000     0.7459000 
1 1 1 6  4  56 o 10.43000 0.5299000 10.60000 0.7333000 10.27000 0.7651000 0.3322000      1.060000  
1 1 1 6  4  58 o 9.693000 0.6497000 9.298000 1.009000  10.09000 0.8183000 -0.7917000     1.299000  
1 1 1 6  4  60 o 3.812000 1.042000  3.696000 1.441000  3.929000 1.505000  -0.2333000     2.084000  
1 1 1 6  4  62 o 5.259000 1.092000  5.985000 1.616000  4.533000 1.470000  1.451000       2.184000  
1 1 1 6  4  64 o 5.401000 0.9951000 6.495000 1.326000  4.307000 1.484000  2.189000       1.990000  
1 1 1 6  4  66 o 8.291000 0.7784000 7.516000 1.178000  9.066000 1.018000  -1.550000      1.557000  
1 1 1 6  5  1  o 95.98000 0.6538000 95.67000 0.9217000 96.29000 0.9274000 -0.6247000     1.308000  
1 1 1 6  5  3  o 111.9000 0.7615000 111.4000 1.073000  112.4000 1.081000  -0.9470000     1.523000  
1 1 1 6  5  5  o 54.48000 0.3773000 54.21000 0.5311000 54.76000 0.5361000 -0.5537000     0.7547000 
1 1 1 6  5  7  o 54.05000 0.4058000 54.19000 0.6143000 53.92000 0.5304000 0.2698000      0.8116000 
1 1 1 6  5  9  o 34.21000 0.3949000 33.81000 0.3131000 34.60000 0.7250000 -0.7963000     0.7897000 
1 1 1 6  5  11 o 19.33000 0.1888000 18.99000 0.2194000 19.67000 0.3072000 -0.6730000     0.3776000 
1 1 1 6  5  13 f 39.61000 0.3709000 39.76000 0.5717000 39.47000 0.4726000 0.2929000      0.7417000 
1 1 1 6  5  15 f 111.4000 0.7614000 112.2000 1.084000  110.6000 1.069000  1.649000       1.523000  
1 1 1 6  5  17 o 89.43000 0.6344000 89.15000 0.9990000 89.71000 0.7821000 -0.5590000     1.269000  
1 1 1 6  5  19 f 60.61000 0.4415000 60.71000 0.6958000 60.51000 0.5435000 0.2021000      0.8829000 
1 1 1 6  5  21 o 70.50000 0.5818000 70.09000 0.9786000 70.91000 0.6294000 -0.8288000     1.164000  
1 1 1 6  5  23 o 94.90000 0.6760000 94.70000 1.066000  95.10000 0.8322000 -0.4051000     1.352000  
1 1 1 6  5  25 o 20.96000 0.3194000 21.59000 0.5288000 20.33000 0.3583000 1.256000       0.6388000 
1 1 1 6  5  27 o 25.06000 0.2874000 24.90000 0.4530000 25.22000 0.3538000 -0.3184000     0.5747000 
1 1 1 6  5  29 o 40.36000 0.3565000 40.04000 0.4614000 40.69000 0.5436000 -0.6537000     0.7130000 
1 1 1 6  5  31 o 63.93000 0.4987000 63.80000 0.6537000 64.06000 0.7534000 -0.2586000     0.9975000 
1 1 1 6  5  33 o 14.59000 0.3564000 14.53000 0.4900000 14.65000 0.5175000 -0.1243000     0.7127000 
1 1 1 6  5  35 o 31.52000 0.3081000 31.43000 0.4324000 31.61000 0.4390000 -0.1710000     0.6162000 
1 1 1 6  5  37 o 39.44000 0.3332000 38.97000 0.4656000 39.90000 0.4768000 -0.9336000     0.6665000 
1 1 1 6  5  39 o 13.48000 0.4397000 12.48000 0.6937000 14.47000 0.5405000 -1.988000      0.8794000 
1 1 1 6  5  41 o 8.176000 0.7258000 7.900000 1.116000  8.452000 0.9283000 -0.5517000     1.452000  
1 1 1 6  5  43 o 32.97000 0.3764000 32.93000 0.5224000 33.02000 0.5422000 -0.8473000E-01 0.7529000 
1 1 1 6  5  45 o 33.39000 0.3338000 33.83000 0.4773000 32.96000 0.4667000 0.8699000      0.6676000 
1 1 1 6  5  47 o 26.81000 0.3761000 26.67000 0.5718000 26.96000 0.4886000 -0.2891000     0.7521000 
1 1 1 6  5  49 o 13.67000 0.4558000 13.23000 0.6472000 14.11000 0.6421000 -0.8798000     0.9117000 
1 1 1 6  5  51 o 11.30000 0.5553000 11.80000 0.8255000 10.81000 0.7429000 0.9893000      1.111000  
1 1 1 6  5  53 o 16.97000 0.3802000 17.29000 0.5329000 16.66000 0.5425000 0.6234000      0.7604000 
1 1 1 6  5  55 o 16.26000 0.4421000 16.18000 0.5614000 16.34000 0.6831000 -0.1634000     0.8842000 
1 1 1 6  5  57 o 6.461000 0.8159000 7.051000 1.093000  5.871000 1.212000  1.180000       1.632000  
1 1 1 6  5  59 o 2.939000 0.9114000 2.801000 1.262000  3.077000 1.315000  -0.2763000     1.823000  
1 1 1 6  5  61 o 13.55000 0.4504000 14.06000 0.6009000 13.03000 0.6711000 1.036000       0.9008000 
1 1 1 6  5  63 o 4.318000 1.082000  4.187000 1.576000  4.450000 1.483000  -0.2633000     2.164000  
1 1 1 6  5  65 o 4.133000 0.9930000 3.609000 1.380000  4.658000 1.428000  -1.049000      1.986000  
1 1 1 6  5  67 o 6.786000 1.068000  7.764000 1.586000  5.809000 1.431000  1.955000       2.136000  
1 1 1 6  6  0  o 17.01000 0.2061000 17.01000 0.2061000 17.01000 0.2061000 0.000000       0.000000  
1 1 1 6  6  2  o 55.77000 0.3850000 55.81000 0.5445000 55.72000 0.5446000 0.8414000E-01  0.7701000 
1 1 1 6  6  4  o 81.06000 0.6001000 80.53000 0.7790000 81.59000 0.9129000 -1.056000      1.200000  
1 1 1 6  6  6  o 50.86000 0.4082000 51.13000 0.5802000 50.59000 0.5744000 0.5379000      0.8164000 
1 1 1 6  6  8  o 62.37000 0.5096000 62.64000 0.5469000 62.10000 0.8601000 0.5437000      1.019000  
1 1 1 6  6  10 o 84.02000 0.6819000 84.49000 0.7321000 83.56000 1.151000  0.9272000      1.364000  
1 1 1 6  6  12 o 20.45000 0.2444000 20.80000 0.3820000 20.09000 0.3049000 0.7083000      0.4888000 
1 1 1 6  6  14 o 23.86000 0.2066000 23.74000 0.2899000 23.97000 0.2944000 -0.2330000     0.4132000 
1 1 1 6  6  16 o 63.37000 0.4789000 63.77000 0.7247000 62.97000 0.6264000 0.8054000      0.9579000 
1 1 1 6  6  18 o 79.27000 0.5661000 79.06000 0.8909000 79.48000 0.6988000 -0.4104000     1.132000  
1 1 1 6  6  20 o 20.79000 0.2909000 21.03000 0.4821000 20.55000 0.3256000 0.4835000      0.5817000 
1 1 1 6  6  22 o 32.86000 0.3415000 33.59000 0.5595000 32.14000 0.3919000 1.449000       0.6831000 
1 1 1 6  6  24 o 41.75000 0.4608000 41.81000 0.6425000 41.68000 0.6607000 0.1368000      0.9216000 
1 1 1 6  6  26 o 82.51000 0.6210000 82.68000 0.9386000 82.33000 0.8133000 0.3563000      1.242000  
1 1 1 6  6  28 o 56.31000 0.5046000 57.19000 0.8254000 55.43000 0.5806000 1.759000       1.009000  
1 1 1 6  6  30 o 41.55000 0.3429000 41.88000 0.5403000 41.21000 0.4225000 0.6747000      0.6859000 
1 1 1 6  6  32 o 56.77000 0.4196000 56.12000 0.5858000 57.42000 0.6010000 -1.303000      0.8393000 
1 1 1 6  6  34 o 32.11000 0.3815000 32.42000 0.6287000 31.80000 0.4323000 0.6201000      0.7630000 
1 1 1 6  6  36 o 19.53000 0.3159000 19.37000 0.4461000 19.69000 0.4474000 -0.3140000     0.6318000 
1 1 1 6  6  38 o 17.62000 0.3592000 17.42000 0.4733000 17.83000 0.5404000 -0.4086000     0.7183000 
1 1 1 6  6  40 o 29.88000 0.4879000 29.82000 0.8303000 29.94000 0.5125000 -0.1229000     0.9757000 
1 1 1 6  6  42 o 40.01000 0.3790000 39.28000 0.4895000 40.74000 0.5787000 -1.464000      0.7580000 
1 1 1 6  6  44 o 22.54000 0.4200000 22.43000 0.4823000 22.65000 0.6879000 -0.2174000     0.8401000 
1 1 1 6  6  46 o 23.69000 0.3999000 23.82000 0.5770000 23.55000 0.5538000 0.2740000      0.7997000 
1 1 1 6  6  48 o 27.32000 0.3929000 26.89000 0.5678000 27.74000 0.5433000 -0.8436000     0.7858000 
1 1 1 6  6  50 o 23.42000 0.3467000 23.98000 0.4840000 22.87000 0.4964000 1.114000       0.6933000 
1 1 1 6  6  52 o 10.52000 0.6458000 10.80000 1.057000  10.24000 0.7421000 0.5633000      1.292000  
1 1 1 6  6  54 o 13.11000 0.5538000 13.26000 0.6207000 12.96000 0.9173000 0.2949000      1.108000  
1 1 1 6  6  56 o 6.933000 0.8476000 6.178000 1.251000  7.687000 1.144000  -1.508000      1.695000  
1 1 1 6  6  58 o 4.328000 1.064000  4.704000 1.592000  3.951000 1.411000  0.7527000      2.128000  
1 1 1 6  6  60 o 10.86000 0.5583000 10.15000 0.7693000 11.57000 0.8093000 -1.424000      1.117000  
1 1 1 6  6  62 o 3.695000 1.161000  4.360000 1.897000  3.031000 1.339000  1.329000       2.322000  
1 1 1 6  6  64 o 4.125000 1.063000  3.255000 1.393000  4.995000 1.606000  -1.741000      2.126000  
1 1 1 6  6  66 o 6.823000 0.9432000 5.584000 1.655000  8.061000 0.9048000 -2.478000      1.886000  
1 1 1 6  7  1  o 77.57000 0.5305000 78.09000 0.7550000 77.05000 0.7454000 1.045000       1.061000  
1 1 1 6  7  3  o 76.65000 0.6792000 75.62000 0.8447000 77.69000 1.064000  -2.065000      1.358000  
1 1 1 6  7  5  o 80.04000 0.7065000 80.67000 0.9011000 79.41000 1.088000  1.254000       1.413000  
1 1 1 6  7  7  o 27.18000 0.2187000 26.55000 0.2542000 27.82000 0.3560000 -1.273000      0.4374000 
1 1 1 6  7  9  o 80.40000 0.6519000 81.18000 0.7036000 79.63000 1.098000  1.544000       1.304000  
1 1 1 6  7  11 o 53.13000 0.4293000 53.41000 0.6079000 52.84000 0.6063000 0.5677000      0.8586000 
1 1 1 6  7  13 o 62.40000 0.4698000 62.44000 0.7102000 62.36000 0.6151000 0.8924000E-01  0.9396000 
1 1 1 6  7  15 o 38.99000 0.2884000 39.06000 0.4072000 38.91000 0.4083000 0.1518000      0.5767000 
1 1 1 6  7  17 o 83.71000 0.7072000 83.56000 1.151000  83.86000 0.8222000 -0.2983000     1.414000  
1 1 1 6  7  19 o 55.00000 0.4050000 54.91000 0.6356000 55.09000 0.5019000 -0.1870000     0.8099000 
1 1 1 6  7  21 f 14.01000 0.3401000 13.39000 0.5854000 14.64000 0.3462000 -1.254000      0.6801000 
1 1 1 6  7  23 o 28.82000 0.2721000 28.84000 0.4207000 28.80000 0.3453000 0.3572000E-01  0.5443000 
1 1 1 6  7  25 o 59.84000 0.5251000 59.85000 0.8534000 59.82000 0.6120000 0.2486000E-01  1.050000  
1 1 1 6  7  27 o 40.28000 0.3767000 40.70000 0.6326000 39.86000 0.4091000 0.8393000      0.7534000 
1 1 1 6  7  29 o 16.10000 0.3805000 15.78000 0.5098000 16.43000 0.5650000 -0.6506000     0.7610000 
1 1 1 6  7  31 o 15.51000 0.4322000 16.20000 0.6881000 14.82000 0.5231000 1.378000       0.8644000 
1 1 1 6  7  33 o 45.19000 0.3640000 44.93000 0.5696000 45.46000 0.4535000 -0.5352000     0.7281000 
1 1 1 6  7  35 o 38.86000 0.3994000 39.29000 0.6493000 38.44000 0.4652000 0.8480000      0.7988000 
1 1 1 6  7  37 o 19.38000 0.3345000 19.40000 0.4292000 19.36000 0.5131000 0.3896000E-01  0.6690000 
1 1 1 6  7  39 o 38.51000 0.4006000 38.40000 0.6451000 38.61000 0.4751000 -0.2157000     0.8012000 
1 1 1 6  7  41 o 10.21000 0.5786000 9.654000 0.8836000 10.77000 0.7474000 -1.120000      1.157000  
1 1 1 6  7  43 o 23.39000 0.3386000 22.94000 0.4744000 23.85000 0.4833000 -0.9083000     0.6772000 
1 1 1 6  7  45 o 20.28000 0.4135000 20.20000 0.5341000 20.36000 0.6312000 -0.1546000     0.8269000 
1 1 1 6  7  47 o 26.38000 0.5211000 27.07000 0.9286000 25.69000 0.4732000 1.379000       1.042000  
1 1 1 6  7  49 o 24.80000 0.3704000 24.32000 0.4901000 25.28000 0.5555000 -0.9611000     0.7408000 
1 1 1 6  7  51 o 40.91000 0.4378000 40.76000 0.7107000 41.06000 0.5114000 -0.3003000     0.8755000 
1 1 1 6  7  53 o 20.57000 0.3515000 21.16000 0.4967000 19.99000 0.4976000 1.172000       0.7030000 
1 1 1 6  7  55 o 7.275000 0.7327000 7.467000 0.9966000 7.083000 1.074000  0.3844000      1.465000  
1 1 1 6  7  57 f 4.364000 0.9719000 3.439000 1.359000  5.289000 1.390000  -1.849000      1.944000  
1 1 1 6  7  59 o 5.225000 0.9626000 4.899000 1.365000  5.551000 1.357000  -0.6520000     1.925000  
1 1 1 6  7  61 o 9.793000 0.6562000 8.332000 1.148000  11.25000 0.6364000 -2.921000      1.312000  
1 1 1 6  7  63 o 3.373000 0.9949000 3.234000 1.432000  3.511000 1.381000  -0.2766000     1.990000  
1 1 1 6  7  65 o 6.485000 0.9623000 6.492000 1.563000  6.478000 1.123000  0.1423000E-01  1.925000  
1 1 1 6  7  67 o 5.997000 1.007000  7.079000 1.494000  4.914000 1.350000  2.165000       2.014000  
1 1 1 6  8  0  o 98.01000 1.090000  98.01000 1.090000  98.01000 1.090000  0.000000       0.000000  
1 1 1 6  8  2  o 73.25000 0.6468000 74.14000 0.8284000 72.37000 0.9934000 1.769000       1.294000  
1 1 1 6  8  4  o 50.05000 0.4950000 50.06000 0.7001000 50.05000 0.7001000 0.1438000E-01  0.9901000 
1 1 1 6  8  6  o 35.81000 0.2815000 36.41000 0.3713000 35.22000 0.4231000 1.196000       0.5630000 
1 1 1 6  8  8  o 33.99000 0.2604000 33.94000 0.3118000 34.04000 0.4172000 -0.1021000     0.5208000 
1 1 1 6  8  10 o 6.561000 0.2227000 6.807000 0.3167000 6.314000 0.3132000 0.4933000      0.4454000 
1 1 1 6  8  12 o 37.50000 0.2974000 37.93000 0.3937000 37.06000 0.4460000 0.8622000      0.5949000 
1 1 1 6  8  14 o 17.41000 0.2007000 17.45000 0.3007000 17.36000 0.2660000 0.8807000E-01  0.4015000 
1 1 1 6  8  16 o 23.22000 0.2528000 23.11000 0.3563000 23.33000 0.3588000 -0.2226000     0.5057000 
1 1 1 6  8  18 o 72.30000 0.5442000 72.43000 0.8198000 72.17000 0.7158000 0.2640000      1.088000  
1 1 1 6  8  20 o 59.63000 0.4359000 59.47000 0.6840000 59.79000 0.5405000 -0.3140000     0.8718000 
1 1 1 6  8  22 o 56.01000 0.4162000 55.78000 0.6525000 56.24000 0.5169000 -0.4614000     0.8324000 
1 1 1 6  8  24 o 79.44000 0.6400000 78.61000 0.8935000 80.28000 0.9164000 -1.665000      1.280000  
1 1 1 6  8  26 o 60.12000 0.4486000 60.97000 0.7123000 59.27000 0.5454000 1.698000       0.8971000 
1 1 1 6  8  28 o 61.59000 0.5140000 60.51000 0.7113000 62.67000 0.7422000 -2.160000      1.028000  
1 1 1 6  8  30 o 83.92000 0.6062000 84.11000 0.9574000 83.72000 0.7438000 0.3842000      1.212000  
1 1 1 6  8  32 o 37.85000 0.3460000 37.99000 0.5176000 37.71000 0.4593000 0.2842000      0.6920000 
1 1 1 6  8  34 o 34.66000 0.3178000 34.73000 0.4981000 34.59000 0.3947000 0.1379000      0.6356000 
1 1 1 6  8  36 o 8.101000 0.6077000 7.923000 0.9650000 8.279000 0.7388000 -0.3563000     1.215000  
1 1 1 6  8  38 o 32.73000 0.3158000 31.81000 0.4929000 33.64000 0.3950000 -1.832000      0.6316000 
1 1 1 6  8  40 o 44.01000 0.4377000 43.97000 0.7090000 44.04000 0.5133000 -0.7479000E-01 0.8754000 
1 1 1 6  8  42 o 46.14000 0.4852000 45.65000 0.5992000 46.64000 0.7632000 -0.9934000     0.9704000 
1 1 1 6  8  44 o 15.62000 0.5002000 15.34000 0.5550000 15.90000 0.8324000 -0.5599000     1.000000  
1 1 1 6  8  46 o 24.25000 0.3504000 24.09000 0.4886000 24.41000 0.5023000 -0.3202000     0.7007000 
1 1 1 6  8  48 o 17.22000 0.5554000 17.74000 0.8401000 16.71000 0.7268000 1.037000       1.111000  
1 1 1 6  8  50 o 25.28000 0.3319000 25.95000 0.4800000 24.62000 0.4585000 1.331000       0.6638000 
1 1 1 6  8  52 o 7.984000 0.6750000 8.496000 0.8821000 7.472000 1.022000  1.024000       1.350000  
1 1 1 6  8  54 o 5.580000 1.010000  5.923000 1.422000  5.237000 1.435000  0.6866000      2.020000  
1 1 1 6  8  56 o 11.14000 0.5310000 11.48000 0.8087000 10.81000 0.6885000 0.6698000      1.062000  
1 1 1 6  8  58 o 3.726000 0.9723000 3.713000 1.460000  3.740000 1.285000  -0.2775000E-01 1.945000  
1 1 1 6  8  60 o 8.424000 0.6870000 8.956000 1.081000  7.891000 0.8478000 1.066000       1.374000  
1 1 1 6  8  62 o 6.845000 0.9577000 7.857000 1.475000  5.833000 1.222000  2.024000       1.915000  
1 1 1 6  8  64 o 6.947000 0.9400000 7.243000 1.365000  6.652000 1.292000  0.5903000      1.880000  
1 1 1 6  8  66 o 5.467000 1.046000  5.400000 1.688000  5.534000 1.238000  -0.1341000     2.093000  
1 1 1 6  9  1  o 50.19000 0.4020000 50.63000 0.5738000 49.74000 0.5632000 0.8886000      0.8040000 
1 1 1 6  9  3  o 54.94000 0.4918000 53.89000 0.7493000 55.99000 0.6371000 -2.101000      0.9835000 
1 1 1 6  9  5  o 32.17000 0.2779000 32.15000 0.3925000 32.19000 0.3934000 -0.3952000E-01 0.5557000 
1 1 1 6  9  7  o 14.17000 0.1945000 13.70000 0.2741000 14.63000 0.2760000 -0.9298000     0.3890000 
1 1 1 6  9  9  o 19.79000 0.2314000 19.81000 0.3191000 19.77000 0.3353000 0.4215000E-01  0.4628000 
1 1 1 6  9  11 o 45.02000 0.3469000 45.25000 0.4567000 44.78000 0.5223000 0.4690000      0.6938000 
1 1 1 6  9  13 o 14.27000 0.2624000 14.62000 0.4194000 13.92000 0.3154000 0.7064000      0.5248000 
1 1 1 6  9  15 o 47.85000 0.3438000 48.11000 0.4871000 47.60000 0.4853000 0.5090000      0.6876000 
1 1 1 6  9  17 o 50.46000 0.3626000 50.59000 0.5125000 50.32000 0.5131000 0.2748000      0.7252000 
1 1 1 6  9  19 o 84.34000 0.6010000 83.59000 0.9415000 85.08000 0.7472000 -1.494000      1.202000  
1 1 1 6  9  21 o 96.47000 0.7844000 95.82000 1.320000  97.12000 0.8485000 -1.300000      1.569000  
1 1 1 6  9  23 o 21.15000 0.2963000 21.84000 0.4065000 20.46000 0.4311000 1.386000       0.5925000 
1 1 1 6  9  25 o 91.43000 0.7510000 92.06000 1.271000  90.81000 0.8006000 1.249000       1.502000  
1 1 1 6  9  27 o 28.68000 0.3407000 28.71000 0.5435000 28.65000 0.4110000 0.6047000E-01  0.6815000 
1 1 1 6  9  29 o 31.34000 0.3187000 32.00000 0.4783000 30.68000 0.4214000 1.328000       0.6374000 
1 1 1 6  9  31 o 14.97000 0.3709000 14.61000 0.5900000 15.33000 0.4497000 -0.7233000     0.7419000 
1 1 1 6  9  33 o 44.47000 0.3624000 44.56000 0.5703000 44.39000 0.4473000 0.1743000      0.7248000 
1 1 1 6  9  35 o 37.67000 0.3782000 37.39000 0.6338000 37.96000 0.4129000 -0.5692000     0.7565000 
1 1 1 6  9  37 o 11.30000 0.4639000 11.16000 0.7078000 11.44000 0.5998000 -0.2836000     0.9278000 
1 1 1 6  9  39 o 16.55000 0.4178000 16.87000 0.6839000 16.23000 0.4803000 0.6352000      0.8357000 
1 1 1 6  9  41 o 64.30000 0.5086000 63.65000 0.7575000 64.96000 0.6789000 -1.312000      1.017000  
1 1 1 6  9  43 f 24.45000 0.3826000 24.64000 0.6327000 24.26000 0.4303000 0.3792000      0.7651000 
1 1 1 6  9  45 o 33.69000 0.3628000 33.38000 0.5495000 34.00000 0.4739000 -0.6253000     0.7256000 
1 1 1 6  9  47 o 38.00000 0.3604000 38.42000 0.5674000 37.57000 0.4445000 0.8485000      0.7208000 
1 1 1 6  9  49 o 24.03000 0.3947000 24.16000 0.5639000 23.91000 0.5526000 0.2594000      0.7895000 
1 1 1 6  9  51 o 11.77000 0.5789000 11.90000 0.9301000 11.64000 0.6896000 0.2650000      1.158000  
1 1 1 6  9  53 o 12.01000 0.5108000 11.95000 0.7796000 12.08000 0.6603000 -0.1297000     1.022000  
1 1 1 6  9  55 o 18.34000 0.3744000 18.53000 0.5919000 18.15000 0.4587000 0.3785000      0.7488000 
1 1 1 6  9  57 o 2.945000 0.9066000 3.171000 1.348000  2.719000 1.213000  0.4520000      1.813000  
1 1 1 6  9  59 o 5.051000 1.100000  5.242000 1.760000  4.859000 1.321000  0.3827000      2.201000  
1 1 1 6  9  61 o 5.395000 1.115000  4.923000 1.812000  5.868000 1.302000  -0.9451000     2.231000  
1 1 1 6  9  63 o 4.847000 1.098000  5.472000 1.626000  4.222000 1.477000  1.250000       2.197000  
1 1 1 6  9  65 o 4.081000 1.083000  4.949000 1.713000  3.212000 1.325000  1.737000       2.166000  
1 1 1 6  9  67 o 5.671000 1.061000  6.267000 1.585000  5.075000 1.412000  1.192000       2.123000  
1 1 1 6  10 0  o 106.0000 1.022000  106.0000 1.022000  106.0000 1.022000  0.000000       0.000000  
1 1 1 6  10 2  o 73.74000 0.5864000 73.32000 0.8242000 74.16000 0.8345000 -0.8481000     1.173000  
1 1 1 6  10 4  o 97.70000 0.7720000 97.90000 1.094000  97.50000 1.090000  0.4019000      1.544000  
1 1 1 6  10 6  o 73.52000 0.5861000 73.78000 0.8318000 73.25000 0.8260000 0.5353000      1.172000  
1 1 1 6  10 8  o 57.22000 0.4595000 57.64000 0.6527000 56.80000 0.6470000 0.8407000      0.9190000 
1 1 1 6  10 10 o 38.11000 0.3233000 38.50000 0.4663000 37.72000 0.4480000 0.7771000      0.6467000 
1 1 1 6  10 12 o 75.63000 0.5653000 76.66000 0.8637000 74.61000 0.7295000 2.044000       1.131000  
1 1 1 6  10 14 o 57.64000 0.4056000 57.77000 0.5738000 57.52000 0.5735000 0.2489000      0.8112000 
1 1 1 6  10 16 o 49.55000 0.3850000 49.44000 0.5792000 49.67000 0.5073000 -0.2318000     0.7699000 
1 1 1 6  10 18 o 28.04000 0.2653000 28.29000 0.3441000 27.79000 0.4040000 0.5028000      0.5307000 
1 1 1 6  10 20 o 111.2000 0.7850000 110.3000 1.232000  112.0000 0.9734000 -1.771000      1.570000  
1 1 1 6  10 22 o 10.43000 0.4593000 10.99000 0.7508000 9.867000 0.5292000 1.125000       0.9186000 
1 1 1 6  10 24 o 52.53000 0.4538000 51.96000 0.7577000 53.11000 0.4998000 -1.152000      0.9077000 
1 1 1 6  10 26 o 87.69000 0.7196000 87.51000 1.212000  87.87000 0.7763000 -0.3580000     1.439000  
1 1 1 6  10 28 o 12.86000 0.3832000 13.39000 0.5533000 12.33000 0.5304000 1.056000       0.7664000 
1 1 1 6  10 30 o 72.40000 0.5296000 72.43000 0.8344000 72.37000 0.6525000 0.5602000E-01  1.059000  
1 1 1 6  10 32 o 25.96000 0.3142000 25.47000 0.4606000 26.46000 0.4275000 -0.9968000     0.6284000 
1 1 1 6  10 34 o 35.93000 0.3239000 36.07000 0.5067000 35.78000 0.4037000 0.2887000      0.6478000 
1 1 1 6  10 36 o 20.74000 0.3737000 21.12000 0.5980000 20.36000 0.4483000 0.7624000      0.7474000 
1 1 1 6  10 38 o 51.50000 0.4248000 51.20000 0.6354000 51.79000 0.5641000 -0.5962000     0.8497000 
1 1 1 6  10 40 o 37.81000 0.3988000 37.88000 0.6390000 37.74000 0.4773000 0.1323000      0.7976000 
1 1 1 6  10 42 o 36.48000 0.3572000 35.73000 0.5320000 37.23000 0.4769000 -1.509000      0.7144000 
1 1 1 6  10 44 o 35.26000 0.3493000 35.15000 0.5509000 35.37000 0.4297000 -0.2276000     0.6987000 
1 1 1 6  10 46 o 40.61000 0.3684000 40.70000 0.5749000 40.52000 0.4609000 0.1802000      0.7368000 
1 1 1 6  10 48 o 45.18000 0.4603000 44.20000 0.7415000 46.15000 0.5458000 -1.943000      0.9207000 
1 1 1 6  10 50 o 3.311000 0.9548000 2.577000 1.223000  4.044000 1.467000  -1.466000      1.910000  
1 1 1 6  10 52 o 3.678000 1.025000  3.275000 1.479000  4.080000 1.421000  -0.8047000     2.051000  
1 1 1 6  10 54 o 12.14000 0.5094000 11.60000 0.8051000 12.68000 0.6243000 -1.081000      1.019000  
1 1 1 6  10 56 o 13.83000 0.4271000 13.20000 0.6699000 14.47000 0.5299000 -1.274000      0.8542000 
1 1 1 6  10 58 o 10.01000 0.5651000 9.766000 0.9525000 10.25000 0.6083000 -0.4882000     1.130000  
1 1 1 6  10 60 o 5.556000 1.009000  5.326000 1.638000  5.786000 1.178000  -0.4606000     2.018000  
1 1 1 6  10 62 o 4.301000 1.106000  5.119000 1.749000  3.483000 1.353000  1.636000       2.211000  
1 1 1 6  10 64 f 3.827000 1.050000  3.650000 1.548000  4.005000 1.420000  -0.3546000     2.101000  
1 1 1 6  10 66 o 4.246000 1.053000  4.834000 1.652000  3.659000 1.304000  1.174000       2.105000  
1 1 1 6  11 1  o 86.41000 0.6108000 86.15000 0.9644000 86.68000 0.7498000 -0.5360000     1.222000  
1 1 1 6  11 3  o 47.04000 0.3858000 46.89000 0.5432000 47.20000 0.5480000 -0.3129000     0.7716000 
1 1 1 6  11 5  o 52.94000 0.4790000 52.22000 0.7326000 53.67000 0.6172000 -1.443000      0.9579000 
1 1 1 6  11 7  o 63.42000 0.5691000 63.55000 0.8815000 63.29000 0.7201000 0.2555000      1.138000  
1 1 1 6  11 9  o 83.46000 0.7033000 83.64000 0.8128000 83.27000 1.148000  0.3638000      1.407000  
1 1 1 6  11 11 o 29.37000 0.2298000 29.97000 0.3289000 28.78000 0.3210000 1.186000       0.4596000 
1 1 1 6  11 13 o 23.08000 0.2055000 23.07000 0.2890000 23.09000 0.2922000 -0.1584000E-01 0.4109000 
1 1 1 6  11 15 o 29.36000 0.2390000 29.51000 0.3382000 29.21000 0.3379000 0.2957000      0.4781000 
1 1 1 6  11 17 o 92.15000 0.6348000 92.26000 0.8978000 92.04000 0.8978000 0.2240000      1.270000  
1 1 1 6  11 19 o 72.83000 0.5241000 72.40000 0.8218000 73.27000 0.6507000 -0.8700000     1.048000  
1 1 1 6  11 21 o 56.30000 0.4172000 55.70000 0.6501000 56.90000 0.5230000 -1.207000      0.8344000 
1 1 1 6  11 23 o 64.16000 0.4926000 63.61000 0.7345000 64.71000 0.6567000 -1.096000      0.9853000 
1 1 1 6  11 25 o 60.35000 0.5320000 60.28000 0.8615000 60.42000 0.6243000 -0.1353000     1.064000  
1 1 1 6  11 27 o 46.00000 0.3639000 45.67000 0.5682000 46.33000 0.4546000 -0.6587000     0.7277000 
1 1 1 6  11 29 o 18.26000 0.3128000 18.43000 0.4871000 18.08000 0.3927000 0.3427000      0.6257000 
1 1 1 6  11 31 o 33.52000 0.3110000 33.46000 0.4830000 33.59000 0.3919000 -0.1303000     0.6220000 
1 1 1 6  11 33 o 38.09000 0.3485000 38.02000 0.5172000 38.17000 0.4671000 -0.1525000     0.6970000 
1 1 1 6  11 35 o 27.06000 0.3009000 26.67000 0.4662000 27.45000 0.3805000 -0.7789000     0.6018000 
1 1 1 6  11 37 o 16.62000 0.3742000 16.88000 0.5441000 16.37000 0.5140000 0.5075000      0.7485000 
1 1 1 6  11 39 o 12.40000 0.6462000 12.37000 1.172000  12.44000 0.5459000 -0.7531000E-01 1.292000  
1 1 1 6  11 41 o 12.53000 0.4636000 12.74000 0.7257000 12.32000 0.5771000 0.4153000      0.9272000 
1 1 1 6  11 43 o 19.95000 0.3763000 19.91000 0.5985000 19.98000 0.4562000 -0.7836000E-01 0.7525000 
1 1 1 6  11 45 o 22.35000 0.3564000 22.82000 0.5539000 21.88000 0.4487000 0.9494000      0.7128000 
1 1 1 6  11 47 o 24.77000 0.3523000 24.50000 0.5546000 25.05000 0.4347000 -0.5455000     0.7047000 
1 1 1 6  11 49 o 15.54000 0.4568000 15.66000 0.6522000 15.43000 0.6397000 0.2373000      0.9135000 
1 1 1 6  11 51 o 21.63000 0.3902000 21.08000 0.6483000 22.18000 0.4344000 -1.095000      0.7804000 
1 1 1 6  11 53 o 3.699000 1.036000  3.964000 1.499000  3.434000 1.432000  0.5298000      2.073000  
1 1 1 6  11 55 o 10.29000 0.5304000 10.29000 0.8085000 10.29000 0.6868000 0.3633000E-02  1.061000  
1 1 1 6  11 57 o 3.398000 0.9617000 4.249000 1.515000  2.546000 1.185000  1.703000       1.923000  
1 1 1 6  11 59 o 7.634000 0.8969000 7.753000 1.503000  7.514000 0.9794000 0.2387000      1.794000  
1 1 1 6  11 61 o 6.842000 0.7978000 8.014000 1.085000  5.669000 1.170000  2.345000       1.596000  
1 1 1 6  11 63 o 6.411000 0.9688000 6.775000 1.521000  6.047000 1.200000  0.7284000      1.938000  
1 1 1 6  11 65 o 4.111000 1.051000  3.770000 1.564000  4.453000 1.403000  -0.6829000     2.101000  
1 1 1 6  12 0  o 149.2000 1.435000  149.2000 1.435000  149.2000 1.435000  0.000000       0.000000  
1 1 1 6  12 2  o 89.76000 0.6344000 89.47000 1.001000  90.05000 0.7793000 -0.5795000     1.269000  
1 1 1 6  12 4  o 89.03000 0.7869000 88.46000 1.212000  89.59000 1.004000  -1.122000      1.574000  
1 1 1 6  12 6  o 97.85000 0.8643000 98.67000 1.104000  97.03000 1.330000  1.647000       1.729000  
1 1 1 6  12 8  o 36.91000 0.3286000 36.97000 0.3834000 36.86000 0.5338000 0.1050000      0.6572000 
1 1 1 6  12 10 o 56.87000 0.3988000 56.80000 0.5629000 56.94000 0.5652000 -0.1445000     0.7976000 
1 1 1 6  12 12 o 58.78000 0.4466000 59.40000 0.6807000 58.16000 0.5783000 1.244000       0.8932000 
1 1 1 6  12 14 o 61.24000 0.4303000 61.54000 0.6106000 60.93000 0.6066000 0.6138000      0.8607000 
1 1 1 6  12 16 o 36.17000 0.2790000 36.13000 0.3915000 36.21000 0.3977000 -0.8441000E-01 0.5580000 
1 1 1 6  12 18 o 81.79000 0.6146000 81.49000 0.7988000 82.10000 0.9343000 -0.6180000     1.229000  
1 1 1 6  12 20 o 58.29000 0.4303000 58.43000 0.6769000 58.16000 0.5315000 0.2718000      0.8607000 
1 1 1 6  12 22 o 61.51000 0.5687000 61.60000 0.8805000 61.42000 0.7199000 0.1794000      1.137000  
1 1 1 6  12 24 o 81.04000 0.6660000 80.40000 1.117000  81.68000 0.7254000 -1.280000      1.332000  
1 1 1 6  12 26 o 87.00000 0.7402000 86.98000 1.204000  87.02000 0.8614000 -0.3590000E-01 1.480000  
1 1 1 6  12 28 o 27.66000 0.3106000 28.05000 0.4652000 27.27000 0.4116000 0.7784000      0.6211000 
1 1 1 6  12 30 o 36.77000 0.3247000 36.71000 0.5077000 36.83000 0.4049000 -0.1145000     0.6494000 
1 1 1 6  12 32 o 16.97000 0.3320000 17.27000 0.5158000 16.66000 0.4183000 0.6119000      0.6641000 
1 1 1 6  12 34 o 47.89000 0.3835000 47.96000 0.6029000 47.81000 0.4741000 0.1535000      0.7670000 
1 1 1 6  12 36 o 6.553000 1.105000  7.129000 1.883000  5.977000 1.158000  1.152000       2.211000  
1 1 1 6  12 38 o 19.26000 0.3529000 18.89000 0.5529000 19.64000 0.4386000 -0.7495000     0.7057000 
1 1 1 6  12 40 o 15.42000 0.4232000 14.68000 0.6604000 16.17000 0.5295000 -1.485000      0.8464000 
1 1 1 6  12 42 o 37.90000 0.3669000 38.19000 0.5500000 37.61000 0.4858000 0.5827000      0.7338000 
1 1 1 6  12 44 o 17.30000 0.4050000 17.62000 0.6342000 16.97000 0.5038000 0.6490000      0.8099000 
1 1 1 6  12 46 o 15.07000 0.4761000 15.13000 0.7175000 15.01000 0.6259000 0.1197000      0.9522000 
1 1 1 6  12 48 o 36.42000 0.3696000 35.64000 0.5535000 37.20000 0.4900000 -1.559000      0.7392000 
1 1 1 6  12 50 o 31.14000 0.3888000 31.27000 0.6528000 31.00000 0.4225000 0.2776000      0.7776000 
1 1 1 6  12 52 o 3.840000 1.070000  4.411000 1.690000  3.269000 1.313000  1.142000       2.140000  
1 1 1 6  12 54 o 10.70000 0.5320000 10.08000 0.8248000 11.32000 0.6721000 -1.244000      1.064000  
1 1 1 6  12 56 o 11.17000 0.5254000 11.94000 0.8120000 10.39000 0.6669000 1.551000       1.051000  
1 1 1 6  12 58 o 13.28000 0.4998000 13.41000 0.7553000 13.15000 0.6547000 0.2572000      0.9996000 
1 1 1 6  12 60 f 4.705000 1.062000  4.115000 1.691000  5.294000 1.286000  -1.178000      2.125000  
1 1 1 6  12 62 o 9.220000 0.8783000 10.70000 1.239000  7.741000 1.246000  2.959000       1.757000  
1 1 1 6  12 64 o 9.725000 0.6701000 10.82000 1.005000  8.632000 0.8864000 2.185000       1.340000  
1 1 1 6  12 66 o 4.016000 1.046000  4.272000 1.628000  3.760000 1.315000  0.5112000      2.093000  
1 1 1 6  13 1  o 39.58000 0.3263000 40.11000 0.4683000 39.05000 0.4545000 1.057000       0.6526000 
1 1 1 6  13 3  o 32.79000 0.3501000 32.69000 0.4904000 32.90000 0.4999000 -0.2101000     0.7002000 
1 1 1 6  13 5  o 28.64000 0.2947000 28.68000 0.3729000 28.60000 0.4564000 0.7909000E-01  0.5893000 
1 1 1 6  13 7  o 81.43000 0.9155000 82.18000 0.9253000 80.68000 1.580000  1.503000       1.831000  
1 1 1 6  13 9  o 70.28000 0.4872000 69.64000 0.6827000 70.92000 0.6952000 -1.273000      0.9744000 
1 1 1 6  13 11 o 23.86000 0.2468000 23.85000 0.3330000 23.87000 0.3644000 -0.2026000E-01 0.4936000 
1 1 1 6  13 13 o 19.57000 0.1992000 20.06000 0.2819000 19.07000 0.2816000 0.9902000      0.3984000 
1 1 1 6  13 15 o 27.75000 0.3172000 28.07000 0.3999000 27.43000 0.4924000 0.6430000      0.6343000 
1 1 1 6  13 17 o 152.4000 1.039000  152.0000 1.465000  152.7000 1.474000  -0.7098000     2.078000  
1 1 1 6  13 19 o 68.48000 0.5223000 68.73000 0.6831000 68.23000 0.7904000 0.5002000      1.045000  
1 1 1 6  13 21 o 35.86000 0.3435000 35.48000 0.4666000 36.23000 0.5043000 -0.7478000     0.6870000 
1 1 1 6  13 23 o 79.52000 0.6528000 78.48000 1.092000  80.56000 0.7156000 -2.077000      1.306000  
1 1 1 6  13 25 o 72.58000 0.6258000 72.94000 1.021000  72.23000 0.7240000 0.7102000      1.252000  
1 1 1 6  13 27 o 38.47000 0.3276000 38.87000 0.5127000 38.07000 0.4078000 0.7931000      0.6551000 
1 1 1 6  13 29 o 24.03000 0.2982000 24.30000 0.4646000 23.77000 0.3738000 0.5295000      0.5963000 
1 1 1 6  13 31 o 58.30000 0.4421000 58.29000 0.6942000 58.32000 0.5476000 -0.3170000E-01 0.8842000 
1 1 1 6  13 33 o 38.81000 0.4262000 39.37000 0.6524000 38.24000 0.5486000 1.128000       0.8524000 
1 1 1 6  13 35 o 16.73000 0.4017000 17.77000 0.6392000 15.69000 0.4867000 2.080000       0.8034000 
1 1 1 6  13 37 f 54.33000 0.4226000 54.13000 0.6621000 54.52000 0.5254000 -0.3943000     0.8453000 
1 1 1 6  13 39 f 10.40000 0.8975000 9.551000 1.656000  11.24000 0.6923000 -1.689000      1.795000  
1 1 1 6  13 41 o 38.45000 0.3491000 38.96000 0.5484000 37.95000 0.4320000 1.007000       0.6981000 
1 1 1 6  13 43 o 28.59000 0.3377000 28.74000 0.5235000 28.45000 0.4268000 0.2924000      0.6754000 
1 1 1 6  13 45 o 15.98000 0.4242000 16.06000 0.6844000 15.90000 0.5015000 0.1520000      0.8485000 
1 1 1 6  13 47 o 16.54000 0.4179000 16.75000 0.6531000 16.33000 0.5216000 0.4137000      0.8358000 
1 1 1 6  13 49 f 17.74000 0.4653000 17.00000 0.7763000 18.48000 0.5134000 -1.484000      0.9307000 
1 1 1 6  13 51 o 5.419000 1.022000  4.877000 1.610000  5.960000 1.259000  -1.084000      2.043000  
1 1 1 6  13 53 o 2.926000 0.9051000 3.097000 1.364000  2.756000 1.190000  0.3411000      1.810000  
1 1 1 6  13 55 o 20.33000 0.3673000 20.84000 0.5654000 19.82000 0.4691000 1.021000       0.7347000 
1 1 1 6  13 57 o 3.952000 1.055000  3.792000 1.523000  4.113000 1.460000  -0.3210000     2.110000  
1 1 1 6  13 59 o 12.02000 0.5281000 12.08000 0.7753000 11.96000 0.7173000 0.1154000      1.056000  
1 1 1 6  13 61 o 9.644000 0.6491000 10.29000 0.9689000 8.997000 0.8640000 1.294000       1.298000  
1 1 1 6  13 63 o 5.405000 1.048000  4.712000 1.692000  6.098000 1.237000  -1.386000      2.096000  
1 1 1 6  13 65 o 3.535000 0.9845000 4.707000 1.643000  2.363000 1.086000  2.344000       1.969000  
1 1 1 6  14 0  o 38.70000 0.5631000 38.70000 0.5631000 38.70000 0.5631000 0.000000       0.000000  
1 1 1 6  14 2  o 11.53000 0.1654000 11.97000 0.2404000 11.09000 0.2273000 0.8776000      0.3308000 
1 1 1 6  14 4  o 52.97000 0.3730000 53.07000 0.5269000 52.87000 0.5281000 0.1999000      0.7460000 
1 1 1 6  14 6  o 95.92000 0.6575000 96.27000 0.9331000 95.57000 0.9265000 0.6993000      1.315000  
1 1 1 6  14 8  o 30.96000 0.2385000 30.74000 0.3357000 31.18000 0.3388000 -0.4403000     0.4770000 
1 1 1 6  14 10 o 57.79000 0.4062000 57.81000 0.5745000 57.76000 0.5744000 0.4776000E-01  0.8124000 
1 1 1 6  14 12 o 9.471000 0.2165000 9.579000 0.3066000 9.363000 0.3057000 0.2157000      0.4330000 
1 1 1 6  14 14 o 16.64000 0.2432000 16.65000 0.2891000 16.62000 0.3912000 0.2510000E-01  0.4864000 
1 1 1 6  14 16 o 110.4000 0.7568000 110.0000 1.066000  110.7000 1.074000  -0.6804000     1.514000  
1 1 1 6  14 18 f 84.81000 0.6378000 84.43000 0.8275000 85.19000 0.9708000 -0.7522000     1.276000  
1 1 1 6  14 20 o 39.61000 0.3541000 39.39000 0.4945000 39.83000 0.5071000 -0.4350000     0.7083000 
1 1 1 6  14 22 o 34.76000 0.3628000 34.27000 0.5874000 35.25000 0.4259000 -0.9769000     0.7256000 
1 1 1 6  14 24 o 74.20000 0.6397000 74.60000 1.044000  73.80000 0.7396000 0.7925000      1.279000  
1 1 1 6  14 26 f 28.83000 0.2908000 28.78000 0.4484000 28.87000 0.3705000 -0.8933000E-01 0.5817000 
1 1 1 6  14 28 o 24.17000 0.3107000 24.09000 0.4568000 24.26000 0.4213000 -0.1770000     0.6214000 
1 1 1 6  14 30 o 25.43000 0.3181000 24.94000 0.4686000 25.92000 0.4305000 -0.9805000     0.6363000 
1 1 1 6  14 32 o 51.39000 0.4750000 51.95000 0.7726000 50.83000 0.5528000 1.118000       0.9500000 
1 1 1 6  14 34 o 66.44000 0.4952000 66.83000 0.7817000 66.04000 0.6083000 0.7886000      0.9905000 
1 1 1 6  14 36 o 25.83000 0.4559000 26.56000 0.8249000 25.10000 0.3884000 1.464000       0.9118000 
1 1 1 6  14 38 o 28.62000 0.3659000 28.76000 0.6212000 28.48000 0.3870000 0.2750000      0.7319000 
1 1 1 6  14 40 o 31.72000 0.3296000 31.81000 0.5163000 31.62000 0.4097000 0.1920000      0.6591000 
1 1 1 6  14 42 o 32.86000 0.3991000 32.43000 0.6474000 33.30000 0.4670000 -0.8664000     0.7982000 
1 1 1 6  14 44 o 14.28000 0.4650000 14.41000 0.7287000 14.16000 0.5780000 0.2493000      0.9301000 
1 1 1 6  14 46 o 9.971000 0.6530000 11.21000 0.9027000 8.734000 0.9439000 2.475000       1.306000  
1 1 1 6  14 48 o 16.84000 0.4263000 16.66000 0.6394000 17.02000 0.5640000 -0.3574000     0.8526000 
1 1 1 6  14 50 o 9.710000 0.7370000 8.787000 1.339000  10.63000 0.6165000 -1.847000      1.474000  
1 1 1 6  14 52 o 7.149000 0.8608000 7.798000 1.391000  6.499000 1.014000  1.299000       1.722000  
1 1 1 6  14 54 o 9.881000 0.5602000 10.54000 0.8147000 9.225000 0.7692000 1.313000       1.120000  
1 1 1 6  14 56 o 11.33000 0.5299000 11.49000 0.8300000 11.17000 0.6591000 0.3218000      1.060000  
1 1 1 6  14 58 o 9.502000 0.7149000 11.10000 0.8359000 7.906000 1.160000  3.192000       1.430000  
1 1 1 6  14 60 o 7.618000 0.7363000 7.665000 1.064000  7.571000 1.018000  0.9435000E-01  1.473000  
1 1 1 6  14 62 o 3.455000 1.070000  3.979000 1.721000  2.931000 1.270000  1.048000       2.139000  
1 1 1 6  14 64 o 6.170000 1.019000  6.769000 1.533000  5.572000 1.343000  1.197000       2.038000  
1 1 1 6  14 66 o 4.350000 1.144000  4.452000 1.655000  4.249000 1.580000  0.2037000      2.288000  
1 1 1 6  15 1  o 36.31000 0.3379000 36.54000 0.5606000 36.09000 0.3773000 0.4549000      0.6757000 
1 1 1 6  15 3  o 65.59000 0.5431000 65.44000 0.5742000 65.73000 0.9221000 -0.2936000     1.086000  
1 1 1 6  15 5  o 21.19000 0.2176000 20.98000 0.3066000 21.41000 0.3087000 -0.4281000     0.4351000 
1 1 1 6  15 7  o 59.01000 0.4473000 58.63000 0.5823000 59.39000 0.6791000 -0.7634000     0.8946000 
1 1 1 6  15 9  o 82.38000 0.5684000 82.87000 0.8084000 81.90000 0.7994000 0.9739000      1.137000  
1 1 1 6  15 11 o 44.16000 0.3222000 43.92000 0.4519000 44.41000 0.4593000 -0.4860000     0.6443000 
1 1 1 6  15 13 o 10.43000 0.2304000 10.13000 0.3182000 10.73000 0.3332000 -0.5990000     0.4607000 
1 1 1 6  15 15 o 135.0000 0.9213000 134.5000 1.299000  135.4000 1.307000  -0.8678000     1.843000  
1 1 1 6  15 17 o 53.58000 0.3878000 54.24000 0.5518000 52.93000 0.5451000 1.309000       0.7756000 
1 1 1 6  15 19 o 51.56000 0.4659000 51.62000 0.5351000 51.50000 0.7629000 0.1209000      0.9319000 
1 1 1 6  15 21 o 51.24000 0.4077000 51.45000 0.6126000 51.04000 0.5383000 0.4126000      0.8155000 
1 1 1 6  15 23 o 71.62000 0.7971000 70.97000 1.420000  72.26000 0.7240000 -1.289000      1.594000  
1 1 1 6  15 25 o 40.16000 0.3790000 39.73000 0.6293000 40.59000 0.4226000 -0.8611000     0.7580000 
1 1 1 6  15 27 o 27.88000 0.3054000 27.91000 0.4552000 27.85000 0.4072000 0.5825000E-01  0.6107000 
1 1 1 6  15 29 o 51.07000 0.4157000 51.24000 0.6250000 50.90000 0.5482000 0.3377000      0.8314000 
1 1 1 6  15 31 o 13.99000 0.4161000 13.33000 0.7025000 14.66000 0.4463000 -1.335000      0.8323000 
1 1 1 6  15 33 o 34.87000 0.3366000 34.57000 0.4935000 35.17000 0.4579000 -0.6029000     0.6732000 
1 1 1 6  15 35 o 16.88000 0.3803000 16.92000 0.5486000 16.84000 0.5268000 0.7710000E-01  0.7606000 
1 1 1 6  15 37 o 36.41000 0.3835000 36.11000 0.6418000 36.70000 0.4202000 -0.5982000     0.7671000 
1 1 1 6  15 39 o 39.29000 0.3979000 40.20000 0.6693000 38.39000 0.4306000 1.807000       0.7959000 
1 1 1 6  15 41 o 13.52000 0.4635000 13.12000 0.7574000 13.91000 0.5344000 -0.7860000     0.9269000 
1 1 1 6  15 43 o 30.01000 0.3373000 30.17000 0.5257000 29.85000 0.4226000 0.3211000      0.6745000 
1 1 1 6  15 45 o 27.71000 0.3398000 27.48000 0.5270000 27.95000 0.4291000 -0.4651000     0.6796000 
1 1 1 6  15 47 o 21.35000 0.3661000 22.49000 0.5457000 20.21000 0.4883000 2.282000       0.7323000 
1 1 1 6  15 49 o 43.38000 0.5591000 43.10000 1.017000  43.66000 0.4658000 -0.5566000     1.118000  
1 1 1 6  15 51 o 5.892000 0.8610000 5.060000 1.487000  6.725000 0.8678000 -1.665000      1.722000  
1 1 1 6  15 53 o 9.150000 0.5704000 9.598000 0.8972000 8.702000 0.7045000 0.8959000      1.141000  
1 1 1 6  15 55 o 11.90000 0.4815000 11.90000 0.7896000 11.90000 0.5512000 -0.1765000E-02 0.9629000 
1 1 1 6  15 57 o 10.05000 0.5708000 11.18000 0.8734000 8.921000 0.7352000 2.259000       1.142000  
1 1 1 6  15 59 o 3.260000 1.037000  4.143000 1.738000  2.377000 1.133000  1.766000       2.074000  
1 1 1 6  15 61 o 3.234000 1.008000  3.265000 1.457000  3.204000 1.393000  0.6063000E-01  2.015000  
1 1 1 6  15 63 o 5.144000 1.074000  5.185000 1.663000  5.104000 1.359000  0.8054000E-01  2.147000  
1 1 1 6  15 65 o 2.571000 0.8586000 2.859000 1.335000  2.283000 1.080000  0.5759000      1.717000  
1 1 1 6  16 0  o 89.73000 1.009000  89.73000 1.009000  89.73000 1.009000  0.000000       0.000000  
1 1 1 6  16 2  o 77.77000 0.5808000 77.24000 0.7549000 78.31000 0.8829000 -1.075000      1.162000  
1 1 1 6  16 4  o 24.93000 0.2413000 24.57000 0.3381000 25.28000 0.3443000 -0.7084000     0.4826000 
1 1 1 6  16 6  o 36.81000 0.2954000 36.93000 0.3890000 36.69000 0.4446000 0.2395000      0.5908000 
1 1 1 6  16 8  o 53.17000 0.3779000 53.14000 0.5340000 53.21000 0.5350000 -0.7224000E-01 0.7559000 
1 1 1 6  16 10 o 99.60000 0.7401000 100.8000 1.130000  98.40000 0.9565000 2.390000       1.480000  
1 1 1 6  16 12 f 92.88000 0.6400000 92.66000 0.9021000 93.11000 0.9082000 -0.4564000     1.280000  
1 1 1 6  16 14 o 61.64000 0.4353000 61.65000 0.6145000 61.63000 0.6167000 0.2088000E-01  0.8706000 
1 1 1 6  16 16 o 44.53000 0.3329000 44.21000 0.4655000 44.85000 0.4759000 -0.6386000     0.6657000 
1 1 1 6  16 18 o 141.6000 1.185000  141.7000 1.367000  141.5000 1.936000  0.1563000      2.370000  
1 1 1 6  16 20 o 133.1000 0.9844000 132.1000 1.278000  134.0000 1.497000  -1.899000      1.969000  
1 1 1 6  16 22 o 41.79000 0.5190000 41.49000 0.9270000 42.10000 0.4668000 -0.6098000     1.038000  
1 1 1 6  16 24 o 39.98000 0.3749000 39.59000 0.6195000 40.36000 0.4225000 -0.7719000     0.7499000 
1 1 1 6  16 26 o 37.13000 0.3217000 36.73000 0.4971000 37.53000 0.4085000 -0.7985000     0.6434000 
1 1 1 6  16 28 o 56.09000 0.5059000 56.64000 0.8229000 55.54000 0.5887000 1.097000       1.012000  
1 1 1 6  16 30 o 43.65000 0.3569000 44.01000 0.5601000 43.29000 0.4426000 0.7111000      0.7139000 
1 1 1 6  16 32 o 35.86000 0.3244000 35.75000 0.5048000 35.96000 0.4077000 -0.2126000     0.6489000 
1 1 1 6  16 34 o 12.27000 0.5437000 11.58000 0.6927000 12.96000 0.8382000 -1.380000      1.087000  
1 1 1 6  16 36 o 50.00000 0.3967000 50.37000 0.6235000 49.63000 0.4906000 0.7413000      0.7934000 
1 1 1 6  16 38 o 6.111000 0.9482000 5.270000 1.665000  6.952000 0.9085000 -1.683000      1.896000  
1 1 1 6  16 40 o 21.03000 0.3415000 20.60000 0.5444000 21.45000 0.4124000 -0.8540000     0.6830000 
1 1 1 6  16 42 o 4.524000 1.052000  4.159000 1.608000  4.890000 1.356000  -0.7312000     2.103000  
1 1 1 6  16 44 o 23.19000 0.3561000 23.64000 0.5570000 22.74000 0.4437000 0.9018000      0.7122000 
1 1 1 6  16 46 o 19.40000 0.3595000 19.18000 0.5766000 19.61000 0.4295000 -0.4254000     0.7190000 
1 1 1 6  16 48 o 16.42000 0.3983000 16.60000 0.6433000 16.25000 0.4697000 0.3510000      0.7965000 
1 1 1 6  16 50 o 19.81000 0.3826000 19.91000 0.5813000 19.71000 0.4976000 0.2012000      0.7652000 
1 1 1 6  16 52 o 9.393000 0.5625000 9.489000 0.8941000 9.297000 0.6827000 0.1924000      1.125000  
1 1 1 6  16 54 o 12.22000 0.4842000 12.53000 0.7297000 11.92000 0.6365000 0.6024000      0.9683000 
1 1 1 6  16 56 o 7.735000 0.7136000 8.100000 1.128000  7.371000 0.8750000 0.7289000      1.427000  
1 1 1 6  16 58 o 4.898000 1.077000  5.682000 1.484000  4.115000 1.562000  1.567000       2.154000  
1 1 1 6  16 60 o 12.90000 0.5777000 12.98000 0.9277000 12.81000 0.6887000 0.1683000      1.155000  
1 1 1 6  16 62 o 10.49000 0.8112000 10.90000 1.213000  10.08000 1.078000  0.8284000      1.622000  
1 1 1 6  16 64 o 4.591000 1.120000  5.324000 1.738000  3.859000 1.414000  1.466000       2.241000  
1 1 1 6  17 1  o 109.5000 0.7487000 110.0000 1.064000  108.9000 1.053000  1.040000       1.497000  
1 1 1 6  17 3  o 30.21000 0.2448000 30.38000 0.3003000 30.05000 0.3868000 0.3370000      0.4897000 
1 1 1 6  17 5  o 58.81000 0.4484000 58.24000 0.5797000 59.38000 0.6842000 -1.137000      0.8968000 
1 1 1 6  17 7  o 46.59000 0.3888000 46.53000 0.5489000 46.66000 0.5507000 -0.1295000     0.7775000 
1 1 1 6  17 9  o 57.34000 0.4393000 57.84000 0.6687000 56.83000 0.5699000 1.009000       0.8786000 
1 1 1 6  17 11 o 60.74000 0.4291000 60.41000 0.6026000 61.08000 0.6110000 -0.6730000     0.8582000 
1 1 1 6  17 13 o 28.06000 0.2762000 27.85000 0.3894000 28.28000 0.3918000 -0.4352000     0.5524000 
1 1 1 6  17 15 f 21.96000 0.2544000 21.72000 0.3774000 22.19000 0.3412000 -0.4779000     0.5088000 
1 1 1 6  17 17 o 92.03000 0.6866000 92.02000 0.8992000 92.04000 1.038000  -0.2371000E-01 1.373000  
1 1 1 6  17 19 o 118.4000 0.8788000 118.4000 1.148000  118.3000 1.330000  0.1472000      1.758000  
1 1 1 6  17 21 o 53.45000 0.4519000 53.69000 0.6381000 53.21000 0.6401000 0.4741000      0.9038000 
1 1 1 6  17 23 o 26.19000 0.4346000 26.80000 0.7899000 25.57000 0.3627000 1.236000       0.8692000 
1 1 1 6  17 25 o 91.45000 0.7792000 91.73000 1.271000  91.16000 0.9016000 0.5762000      1.558000  
1 1 1 6  17 27 o 55.06000 0.4386000 54.50000 0.6506000 55.62000 0.5885000 -1.123000      0.8772000 
1 1 1 6  17 29 o 28.05000 0.2951000 28.03000 0.4579000 28.07000 0.3722000 -0.3678000E-01 0.5901000 
1 1 1 6  17 31 o 21.99000 0.3042000 21.98000 0.4769000 22.00000 0.3778000 -0.1648000E-01 0.6084000 
1 1 1 6  17 33 o 30.03000 0.3453000 29.80000 0.4700000 30.26000 0.5061000 -0.4533000     0.6907000 
1 1 1 6  17 35 o 12.91000 0.4164000 12.45000 0.6535000 13.37000 0.5161000 -0.9243000     0.8327000 
1 1 1 6  17 37 o 32.50000 0.5018000 32.96000 0.8970000 32.04000 0.4503000 0.9139000      1.004000  
1 1 1 6  17 39 o 12.71000 0.5094000 12.89000 0.8748000 12.52000 0.5222000 0.3667000      1.019000  
1 1 1 6  17 41 f 8.534000 0.6976000 9.791000 0.9726000 7.277000 1.000000  2.514000       1.395000  
1 1 1 6  17 43 o 17.09000 0.4020000 17.27000 0.6369000 16.91000 0.4906000 0.3669000      0.8039000 
1 1 1 6  17 45 o 19.52000 0.3760000 19.31000 0.5997000 19.73000 0.4538000 -0.4204000     0.7520000 
1 1 1 6  17 47 o 16.44000 0.4420000 16.32000 0.6346000 16.56000 0.6156000 -0.2448000     0.8841000 
1 1 1 6  17 49 o 7.940000 0.8635000 7.169000 1.512000  8.711000 0.8348000 -1.541000      1.727000  
1 1 1 6  17 51 o 11.54000 0.5520000 12.25000 0.9063000 10.84000 0.6305000 1.403000       1.104000  
1 1 1 6  17 53 o 4.701000 0.9857000 4.499000 1.548000  4.903000 1.221000  -0.4039000     1.971000  
1 1 1 6  17 55 o 5.968000 0.9050000 4.915000 1.533000  7.020000 0.9622000 -2.105000      1.810000  
1 1 1 6  17 57 o 3.537000 0.9902000 4.356000 1.558000  2.718000 1.223000  1.639000       1.980000  
1 1 1 6  17 59 o 4.150000 1.138000  4.704000 1.828000  3.595000 1.357000  1.108000       2.276000  
1 1 1 6  17 61 o 5.019000 1.076000  4.670000 1.661000  5.368000 1.369000  -0.6982000     2.153000  
1 1 1 6  17 63 o 3.811000 1.096000  4.089000 1.700000  3.533000 1.385000  0.5564000      2.192000  
1 1 1 6  17 65 o 3.407000 1.009000  4.231000 1.634000  2.584000 1.185000  1.647000       2.018000  
1 1 1 6  18 0  o 34.97000 0.3778000 34.97000 0.3778000 34.97000 0.3778000 0.000000       0.000000  
1 1 1 6  18 2  o 58.42000 0.4240000 59.23000 0.5260000 57.62000 0.6651000 1.612000       0.8480000 
1 1 1 6  18 4  o 52.20000 0.4013000 52.46000 0.5283000 51.93000 0.6041000 0.5265000      0.8026000 
1 1 1 6  18 6  o 101.3000 0.7175000 101.8000 0.8830000 100.9000 1.131000  0.9125000      1.435000  
1 1 1 6  18 8  o 45.47000 0.3598000 45.03000 0.4705000 45.91000 0.5444000 -0.8806000     0.7195000 
1 1 1 6  18 10 o 104.9000 0.8311000 105.1000 1.179000  104.7000 1.172000  0.4194000      1.662000  
1 1 1 6  18 12 o 135.0000 0.9220000 134.5000 1.299000  135.5000 1.309000  -0.9182000     1.844000  
1 1 1 6  18 14 o 31.14000 0.2637000 31.54000 0.3745000 30.74000 0.3714000 0.8029000      0.5274000 
1 1 1 6  18 16 o 149.1000 1.099000  149.3000 1.441000  148.9000 1.661000  0.4390000      2.199000  
1 1 1 6  18 18 o 91.16000 0.6847000 91.26000 0.8935000 91.07000 1.038000  0.1897000      1.369000  
1 1 1 6  18 20 o 135.0000 1.066000  134.1000 1.496000  135.9000 1.519000  -1.828000      2.132000  
1 1 1 6  18 22 o 104.2000 0.8745000 101.9000 1.404000  106.5000 1.042000  -4.657000      1.749000  
1 1 1 6  18 24 o 60.58000 0.6651000 60.36000 1.205000  60.80000 0.5635000 -0.4387000     1.330000  
1 1 1 6  18 26 o 28.35000 0.3255000 28.34000 0.4515000 28.36000 0.4691000 -0.1988000E-01 0.6511000 
1 1 1 6  18 28 o 25.65000 0.2925000 25.10000 0.4553000 26.20000 0.3674000 -1.103000      0.5851000 
1 1 1 6  18 30 o 30.68000 0.3028000 30.40000 0.4693000 30.97000 0.3828000 -0.5687000     0.6056000 
1 1 1 6  18 32 o 7.940000 0.6555000 7.082000 1.129000  8.799000 0.6659000 -1.717000      1.311000  
1 1 1 6  18 34 o 11.42000 0.5141000 11.17000 0.7306000 11.68000 0.7236000 -0.5154000     1.028000  
1 1 1 6  18 36 o 28.58000 0.3299000 28.14000 0.4963000 29.02000 0.4349000 -0.8733000     0.6599000 
1 1 1 6  18 38 o 17.98000 0.4312000 17.67000 0.7454000 18.28000 0.4338000 -0.6135000     0.8624000 
1 1 1 6  18 40 f 17.42000 0.3914000 16.81000 0.6262000 18.03000 0.4696000 -1.218000      0.7827000 
1 1 1 6  18 42 o 34.95000 0.3598000 35.47000 0.5351000 34.43000 0.4812000 1.048000       0.7196000 
1 1 1 6  18 44 o 27.29000 0.3418000 27.45000 0.5314000 27.12000 0.4301000 0.3243000      0.6837000 
1 1 1 6  18 46 o 15.17000 0.4735000 15.32000 0.6721000 15.02000 0.6672000 0.3004000      0.9470000 
1 1 1 6  18 48 o 19.55000 0.4193000 19.47000 0.7111000 19.64000 0.4446000 -0.1721000     0.8387000 
1 1 1 6  18 50 o 15.59000 0.4375000 15.26000 0.7384000 15.92000 0.4693000 -0.6650000     0.8749000 
1 1 1 6  18 52 o 2.508000 0.8267000 3.016000 1.345000  2.001000 0.9619000 1.015000       1.653000  
1 1 1 6  18 54 o 6.676000 0.7908000 8.517000 1.039000  4.835000 1.192000  3.682000       1.582000  
1 1 1 6  18 56 o 9.632000 0.6159000 9.911000 0.9607000 9.354000 0.7710000 0.5572000      1.232000  
1 1 1 6  18 58 o 7.631000 0.9023000 9.508000 1.308000  5.753000 1.244000  3.754000       1.805000  
1 1 1 6  18 60 o 3.507000 0.9986000 4.099000 1.570000  2.915000 1.235000  1.184000       1.997000  
1 1 1 6  18 62 o 4.112000 1.215000  4.841000 2.012000  3.384000 1.363000  1.457000       2.431000  
1 1 1 6  18 64 o 6.112000 0.9714000 7.342000 1.455000  4.882000 1.287000  2.460000       1.943000  
1 1 1 6  19 1  o 35.10000 0.2789000 34.97000 0.3376000 35.22000 0.4441000 -0.2544000     0.5578000 
1 1 1 6  19 3  o 57.35000 0.4392000 57.29000 0.5747000 57.41000 0.6644000 -0.1207000     0.8784000 
1 1 1 6  19 5  o 16.29000 0.2356000 16.82000 0.3092000 15.75000 0.3555000 1.061000       0.4711000 
1 1 1 6  19 7  o 32.22000 0.2642000 32.02000 0.3238000 32.41000 0.4175000 -0.3904000     0.5284000 
1 1 1 6  19 9  o 56.39000 0.4141000 57.04000 0.5160000 55.74000 0.6478000 1.296000       0.8282000 
1 1 1 6  19 11 o 90.55000 0.6749000 90.86000 0.8876000 90.24000 1.017000  0.6254000      1.350000  
1 1 1 6  19 13 f 45.02000 0.4197000 45.53000 0.4808000 44.51000 0.6881000 1.018000       0.8394000 
1 1 1 6  19 15 o 38.94000 0.3965000 38.54000 0.5097000 39.34000 0.6076000 -0.8007000     0.7931000 
1 1 1 6  19 17 o 41.50000 0.3487000 42.05000 0.4612000 40.94000 0.5231000 1.111000       0.6974000 
1 1 1 6  19 19 o 38.02000 0.4472000 38.59000 0.6224000 37.45000 0.6424000 1.134000       0.8944000 
1 1 1 6  19 21 o 20.17000 0.3569000 20.41000 0.4320000 19.93000 0.5681000 0.4886000      0.7137000 
1 1 1 6  19 23 o 40.69000 0.5139000 41.74000 0.9397000 39.65000 0.4164000 2.089000       1.028000  
1 1 1 6  19 25 o 39.22000 0.3302000 39.30000 0.5126000 39.15000 0.4163000 0.1533000      0.6604000 
1 1 1 6  19 27 o 69.82000 0.5145000 70.16000 0.8104000 69.48000 0.6340000 0.6831000      1.029000  
1 1 1 6  19 29 o 30.79000 0.2999000 30.70000 0.4628000 30.88000 0.3817000 -0.1775000     0.5998000 
1 1 1 6  19 31 o 41.65000 0.3485000 42.36000 0.5474000 40.94000 0.4313000 1.417000       0.6969000 
1 1 1 6  19 33 o 29.91000 0.3217000 29.94000 0.4792000 29.87000 0.4295000 0.7241000E-01  0.6435000 
1 1 1 6  19 35 o 19.90000 0.3405000 19.92000 0.5219000 19.87000 0.4374000 0.4816000E-01  0.6810000 
1 1 1 6  19 37 o 47.76000 0.4495000 48.12000 0.7598000 47.41000 0.4804000 0.7076000      0.8989000 
1 1 1 6  19 39 o 40.34000 0.4039000 39.73000 0.6727000 40.95000 0.4473000 -1.222000      0.8079000 
1 1 1 6  19 41 o 45.48000 0.4037000 46.16000 0.6078000 44.79000 0.5316000 1.371000       0.8075000 
1 1 1 6  19 43 o 6.517000 0.9175000 7.196000 1.413000  5.837000 1.171000  1.359000       1.835000  
1 1 1 6  19 45 f 10.27000 0.6150000 11.46000 0.8675000 9.078000 0.8718000 2.381000       1.230000  
1 1 1 6  19 47 o 19.50000 0.3709000 19.86000 0.5681000 19.14000 0.4769000 0.7225000      0.7417000 
1 1 1 6  19 49 o 16.73000 0.3863000 16.89000 0.6132000 16.56000 0.4699000 0.3258000      0.7726000 
1 1 1 6  19 51 o 26.59000 0.3785000 26.91000 0.6335000 26.28000 0.4143000 0.6264000      0.7570000 
1 1 1 6  19 53 o 12.99000 0.4681000 13.12000 0.7477000 12.86000 0.5635000 0.2603000      0.9362000 
1 1 1 6  19 55 o 3.805000 0.9955000 4.729000 1.582000  2.882000 1.209000  1.847000       1.991000  
1 1 1 6  19 57 o 10.54000 0.5812000 11.33000 0.8214000 9.755000 0.8224000 1.573000       1.162000  
1 1 1 6  19 59 o 4.358000 1.033000  5.195000 1.565000  3.521000 1.348000  1.675000       2.065000  
1 1 1 6  19 61 o 3.049000 0.9652000 2.819000 1.363000  3.279000 1.367000  -0.4592000     1.930000  
1 1 1 6  19 63 o 11.71000 0.5703000 11.72000 0.9153000 11.71000 0.6807000 0.1145000E-01  1.141000  
1 1 1 6  20 0  o 76.47000 0.7513000 76.47000 0.7513000 76.47000 0.7513000 0.000000       0.000000  
1 1 1 6  20 2  o 39.86000 0.3086000 40.25000 0.3801000 39.47000 0.4864000 0.7875000      0.6172000 
1 1 1 6  20 4  o 46.93000 0.3532000 47.10000 0.4339000 46.76000 0.5574000 0.3432000      0.7064000 
1 1 1 6  20 6  o 108.4000 0.7672000 108.9000 0.9447000 107.8000 1.209000  1.120000       1.534000  
1 1 1 6  20 8  o 11.92000 0.2483000 11.67000 0.3462000 12.16000 0.3560000 -0.4965000     0.4966000 
1 1 1 6  20 10 o 95.49000 0.6779000 96.44000 0.8415000 94.53000 1.063000  1.912000       1.356000  
1 1 1 6  20 12 o 73.26000 0.5289000 74.02000 0.6572000 72.49000 0.8290000 1.531000       1.058000  
1 1 1 6  20 14 f 20.47000 0.2979000 20.78000 0.3896000 20.16000 0.4509000 0.6199000      0.5959000 
1 1 1 6  20 16 o 37.89000 0.3267000 38.22000 0.4340000 37.57000 0.4885000 0.6499000      0.6534000 
1 1 1 6  20 18 o 36.63000 0.4036000 36.51000 0.4762000 36.75000 0.6517000 -0.2493000     0.8072000 
1 1 1 6  20 20 o 84.84000 0.6410000 85.11000 0.9703000 84.56000 0.8379000 0.5555000      1.282000  
1 1 1 6  20 22 o 14.31000 0.3678000 13.28000 0.4594000 15.34000 0.5746000 -2.057000      0.7357000 
1 1 1 6  20 24 o 69.49000 0.5101000 69.37000 0.8002000 69.60000 0.6329000 -0.2332000     1.020000  
1 1 1 6  20 26 o 79.79000 0.6060000 79.41000 0.9069000 80.17000 0.8040000 -0.7587000     1.212000  
1 1 1 6  20 28 o 39.14000 0.3325000 39.17000 0.5168000 39.10000 0.4186000 0.7307000E-01  0.6651000 
1 1 1 6  20 30 o 72.22000 0.5540000 72.34000 0.8334000 72.10000 0.7301000 0.2388000      1.108000  
1 1 1 6  20 32 o 52.87000 0.4118000 53.55000 0.6482000 52.19000 0.5082000 1.359000       0.8237000 
1 1 1 6  20 34 f 34.49000 0.3439000 34.20000 0.5068000 34.79000 0.4649000 -0.5948000     0.6878000 
1 1 1 6  20 36 o 27.35000 0.3646000 27.80000 0.6124000 26.89000 0.3957000 0.9051000      0.7291000 
1 1 1 6  20 38 o 30.04000 0.4788000 30.11000 0.8654000 29.98000 0.4098000 0.1329000      0.9576000 
1 1 1 6  20 40 o 13.94000 0.4686000 13.69000 0.7539000 14.19000 0.5566000 -0.4945000     0.9371000 
1 1 1 6  20 42 o 25.44000 0.3447000 26.02000 0.5401000 24.85000 0.4285000 1.171000       0.6894000 
1 1 1 6  20 44 o 23.44000 0.3548000 24.31000 0.5479000 22.56000 0.4510000 1.745000       0.7096000 
1 1 1 6  20 46 o 14.91000 0.4099000 14.91000 0.6490000 14.92000 0.5010000 -0.2767000E-02 0.8199000 
1 1 1 6  20 48 o 16.30000 0.3921000 16.10000 0.5669000 16.49000 0.5419000 -0.3906000     0.7843000 
1 1 1 6  20 50 o 15.22000 0.4595000 16.11000 0.7556000 14.32000 0.5229000 1.789000       0.9189000 
1 1 1 6  20 52 o 12.01000 0.4746000 12.57000 0.7136000 11.45000 0.6259000 1.113000       0.9492000 
1 1 1 6  20 54 o 10.01000 0.5717000 9.832000 0.9188000 10.18000 0.6806000 -0.3486000     1.143000  
1 1 1 6  20 56 o 10.13000 0.6062000 10.50000 0.8507000 9.757000 0.8639000 0.7469000      1.212000  
1 1 1 6  20 58 o 4.637000 0.9286000 3.291000 1.367000  5.983000 1.257000  -2.691000      1.857000  
1 1 1 6  20 60 o 8.008000 0.7901000 9.724000 1.069000  6.291000 1.164000  3.434000       1.580000  
1 1 1 6  20 62 o 16.44000 0.5091000 17.09000 0.8634000 15.80000 0.5398000 1.287000       1.018000  
1 1 1 6  20 64 o 7.998000 0.8676000 7.930000 1.403000  8.066000 1.021000  -0.1365000     1.735000  
1 1 1 6  21 1  o 13.90000 0.2335000 14.14000 0.2800000 13.66000 0.3737000 0.4758000      0.4669000 
1 1 1 6  21 3  o 88.78000 0.6633000 87.96000 0.8598000 89.61000 1.010000  -1.645000      1.327000  
1 1 1 6  21 5  o 34.19000 0.2806000 34.01000 0.3425000 34.37000 0.4445000 -0.3615000     0.5612000 
1 1 1 6  21 7  o 87.84000 0.6560000 87.50000 0.8557000 88.17000 0.9946000 -0.6719000     1.312000  
1 1 1 6  21 9  f 22.82000 0.2372000 23.00000 0.3026000 22.64000 0.3655000 0.3589000      0.4745000 
1 1 1 6  21 11 o 77.72000 0.6389000 77.64000 0.6858000 77.81000 1.078000  -0.1741000     1.278000  
1 1 1 6  21 13 o 38.29000 0.3629000 38.51000 0.4306000 38.07000 0.5843000 0.4422000      0.7258000 
1 1 1 6  21 15 o 50.07000 0.4371000 49.68000 0.4681000 50.46000 0.7384000 -0.7722000     0.8743000 
1 1 1 6  21 17 o 40.86000 0.5000000 40.93000 0.8550000 40.78000 0.5186000 0.1453000      1.000000  
1 1 1 6  21 19 o 71.80000 0.6628000 70.59000 0.8173000 73.00000 1.044000  -2.405000      1.326000  
1 1 1 6  21 21 o 66.91000 0.4787000 67.25000 0.6779000 66.57000 0.6761000 0.6806000      0.9575000 
1 1 1 6  21 23 o 8.746000 0.5963000 8.056000 1.035000  9.436000 0.5921000 -1.380000      1.193000  
1 1 1 6  21 25 o 48.98000 0.4020000 49.32000 0.6010000 48.65000 0.5339000 0.6697000      0.8039000 
1 1 1 6  21 27 o 44.23000 0.3577000 44.27000 0.5569000 44.20000 0.4493000 0.7268000E-01  0.7155000 
1 1 1 6  21 29 o 34.81000 0.3156000 35.42000 0.4905000 34.21000 0.3975000 1.213000       0.6313000 
1 1 1 6  21 31 o 12.29000 0.4222000 12.39000 0.6279000 12.19000 0.5646000 0.2001000      0.8444000 
1 1 1 6  21 33 o 38.54000 0.3380000 38.92000 0.5269000 38.15000 0.4235000 0.7616000      0.6760000 
1 1 1 6  21 35 o 13.19000 0.5029000 13.60000 0.8390000 12.77000 0.5546000 0.8297000      1.006000  
1 1 1 6  21 37 o 37.12000 0.5180000 36.21000 0.9110000 38.02000 0.4935000 -1.810000      1.036000  
1 1 1 6  21 39 o 32.99000 0.3559000 32.99000 0.5247000 33.00000 0.4811000 -0.1577000E-01 0.7119000 
1 1 1 6  21 41 o 20.51000 0.3867000 20.80000 0.5694000 20.22000 0.5234000 0.5802000      0.7734000 
1 1 1 6  21 43 f 11.67000 0.5336000 10.66000 0.8828000 12.68000 0.5997000 -2.013000      1.067000  
1 1 1 6  21 45 o 8.092000 0.7877000 7.393000 1.313000  8.790000 0.8701000 -1.397000      1.575000  
1 1 1 6  21 47 o 11.80000 0.6553000 11.60000 1.021000  11.99000 0.8220000 -0.3924000     1.311000  
1 1 1 6  21 49 o 6.178000 0.8669000 5.475000 1.438000  6.882000 0.9692000 -1.408000      1.734000  
1 1 1 6  21 51 o 7.348000 0.8801000 6.400000 1.594000  8.295000 0.7461000 -1.895000      1.760000  
1 1 1 6  21 53 o 4.577000 0.9705000 5.513000 1.466000  3.641000 1.272000  1.873000       1.941000  
1 1 1 6  21 55 o 3.997000 0.9842000 3.491000 1.461000  4.504000 1.319000  -1.012000      1.968000  
1 1 1 6  21 57 o 3.487000 1.028000  3.306000 1.588000  3.668000 1.307000  -0.3626000     2.056000  
1 1 1 6  21 59 o 8.030000 0.8164000 7.521000 1.333000  8.539000 0.9435000 -1.018000      1.633000  
1 1 1 6  21 61 o 5.831000 1.045000  5.179000 1.785000  6.482000 1.086000  -1.303000      2.089000  
1 1 1 6  21 63 o 10.45000 0.6164000 10.89000 1.056000  10.01000 0.6368000 0.8834000      1.233000  
1 1 1 6  22 0  o 72.09000 0.7129000 72.09000 0.7129000 72.09000 0.7129000 0.000000       0.000000  
1 1 1 6  22 2  o 112.8000 0.8373000 111.9000 1.085000  113.8000 1.276000  -1.946000      1.675000  
1 1 1 6  22 4  o 49.55000 0.3731000 49.47000 0.4560000 49.62000 0.5906000 -0.1469000     0.7461000 
1 1 1 6  22 6  o 59.64000 0.4584000 59.99000 0.6044000 59.30000 0.6893000 0.6935000      0.9168000 
1 1 1 6  22 8  o 14.65000 0.2492000 14.51000 0.3235000 14.78000 0.3791000 -0.2706000     0.4984000 
1 1 1 6  22 10 f 62.94000 0.5282000 62.26000 0.5616000 63.63000 0.8949000 -1.370000      1.056000  
1 1 1 6  22 12 o 87.74000 0.6290000 87.63000 0.7701000 87.84000 0.9947000 -0.2097000     1.258000  
1 1 1 6  22 14 o 30.25000 0.3409000 30.11000 0.4393000 30.40000 0.5214000 -0.2888000     0.6818000 
1 1 1 6  22 16 o 49.83000 0.4009000 49.42000 0.5213000 50.25000 0.6092000 -0.8241000     0.8018000 
1 1 1 6  22 18 o 60.15000 0.5646000 60.30000 0.7104000 59.99000 0.8777000 0.3087000      1.129000  
1 1 1 6  22 20 o 115.3000 0.9160000 116.5000 1.308000  114.2000 1.283000  2.303000       1.832000  
1 1 1 6  22 22 o 51.87000 0.4815000 52.48000 0.7907000 51.26000 0.5496000 1.223000       0.9629000 
1 1 1 6  22 24 o 50.27000 0.4081000 49.35000 0.5985000 51.19000 0.5549000 -1.837000      0.8162000 
1 1 1 6  22 26 o 42.51000 0.3475000 42.31000 0.5390000 42.70000 0.4388000 -0.3877000     0.6950000 
1 1 1 6  22 28 o 42.89000 0.3532000 43.44000 0.5526000 42.34000 0.4402000 1.096000       0.7065000 
1 1 1 6  22 30 o 17.90000 0.3373000 17.48000 0.5060000 18.33000 0.4462000 -0.8480000     0.6747000 
1 1 1 6  22 32 o 48.45000 0.4044000 48.09000 0.6012000 48.81000 0.5409000 -0.7153000     0.8088000 
1 1 1 6  22 34 o 29.10000 0.3369000 29.03000 0.4959000 29.16000 0.4562000 -0.1327000     0.6738000 
1 1 1 6  22 36 o 14.34000 0.4116000 14.44000 0.6441000 14.25000 0.5127000 0.1932000      0.8232000 
1 1 1 6  22 38 o 20.76000 0.5095000 21.31000 0.9128000 20.20000 0.4528000 1.107000       1.019000  
1 1 1 6  22 40 o 29.40000 0.3358000 29.43000 0.5233000 29.37000 0.4209000 0.5323000E-01  0.6716000 
1 1 1 6  22 42 o 13.67000 0.4730000 14.46000 0.7216000 12.88000 0.6117000 1.574000       0.9460000 
1 1 1 6  22 44 o 6.707000 0.9788000 7.001000 1.351000  6.412000 1.417000  0.5890000      1.958000  
1 1 1 6  22 46 o 15.27000 0.4323000 14.78000 0.6342000 15.76000 0.5877000 -0.9823000     0.8646000 
1 1 1 6  22 48 o 10.89000 0.5216000 10.80000 0.8416000 10.97000 0.6166000 -0.1697000     1.043000  
1 1 1 6  22 50 o 16.64000 0.4402000 16.31000 0.7437000 16.97000 0.4712000 -0.6541000     0.8804000 
1 1 1 6  22 52 o 8.931000 0.6129000 9.045000 0.9764000 8.817000 0.7410000 0.2276000      1.226000  
1 1 1 6  22 54 o 7.177000 0.7992000 7.345000 1.270000  7.009000 0.9702000 0.3357000      1.598000  
1 1 1 6  22 56 o 5.843000 1.006000  4.490000 1.721000  7.196000 1.043000  -2.706000      2.013000  
1 1 1 6  22 58 o 3.858000 1.018000  3.567000 1.489000  4.149000 1.388000  -0.5816000     2.035000  
1 1 1 6  22 60 o 10.24000 0.5824000 11.21000 0.8866000 9.265000 0.7554000 1.941000       1.165000  
1 1 1 6  22 62 o 4.341000 1.104000  4.255000 1.776000  4.426000 1.312000  -0.1708000     2.208000  
1 1 1 6  23 1  o 61.07000 0.4700000 61.18000 0.7127000 60.96000 0.6129000 0.2125000      0.9400000 
1 1 1 6  23 3  o 121.9000 0.8623000 121.8000 1.054000  122.1000 1.365000  -0.3367000     1.725000  
1 1 1 6  23 5  o 54.11000 0.4233000 53.97000 0.5538000 54.24000 0.6403000 -0.2720000     0.8465000 
1 1 1 6  23 7  o 17.37000 0.2618000 17.31000 0.3553000 17.44000 0.3845000 -0.1265000     0.5235000 
1 1 1 6  23 9  o 38.38000 0.3548000 37.83000 0.3813000 38.93000 0.5983000 -1.104000      0.7095000 
1 1 1 6  23 11 o 111.4000 0.9374000 111.0000 1.079000  111.8000 1.533000  -0.7960000     1.875000  
1 1 1 6  23 13 o 36.60000 0.3213000 35.75000 0.4156000 37.45000 0.4900000 -1.703000      0.6425000 
1 1 1 6  23 15 o 92.22000 0.6912000 91.81000 0.8997000 92.62000 1.050000  -0.8097000     1.382000  
1 1 1 6  23 17 o 60.33000 0.5666000 61.17000 0.7211000 59.49000 0.8741000 1.675000       1.133000  
1 1 1 6  23 19 o 56.98000 0.4304000 56.35000 0.5222000 57.62000 0.6844000 -1.270000      0.8609000 
1 1 1 6  23 21 o 79.17000 0.7215000 79.02000 1.118000  79.32000 0.9123000 -0.3024000     1.443000  
1 1 1 6  23 23 o 15.52000 0.5581000 15.51000 0.5847000 15.54000 0.9508000 -0.3477000E-01 1.116000  
1 1 1 6  23 25 f 59.57000 0.4491000 59.89000 0.7049000 59.25000 0.5565000 0.6442000      0.8981000 
1 1 1 6  23 27 o 29.00000 0.2952000 29.09000 0.4554000 28.92000 0.3759000 0.1695000      0.5905000 
1 1 1 6  23 29 o 21.24000 0.3085000 21.36000 0.4537000 21.13000 0.4181000 0.2342000      0.6170000 
1 1 1 6  23 31 o 32.64000 0.3273000 32.45000 0.4857000 32.84000 0.4387000 -0.3891000     0.6545000 
1 1 1 6  23 33 o 41.54000 0.3729000 42.06000 0.5608000 41.01000 0.4917000 1.043000       0.7459000 
1 1 1 6  23 35 o 25.09000 0.3684000 25.79000 0.6099000 24.39000 0.4136000 1.394000       0.7369000 
1 1 1 6  23 37 o 33.01000 0.5085000 34.02000 0.9040000 32.00000 0.4657000 2.021000       1.017000  
1 1 1 6  23 39 f 22.03000 0.3420000 23.10000 0.5341000 20.96000 0.4271000 2.148000       0.6839000 
1 1 1 6  23 41 o 18.30000 0.3994000 18.18000 0.6041000 18.42000 0.5224000 -0.2420000     0.7987000 
1 1 1 6  23 43 o 28.40000 0.3864000 27.85000 0.5377000 28.95000 0.5551000 -1.099000      0.7728000 
1 1 1 6  23 45 o 20.82000 0.3508000 20.87000 0.5367000 20.77000 0.4518000 0.1075000      0.7015000 
1 1 1 6  23 47 o 5.213000 0.9051000 4.036000 1.488000  6.389000 1.031000  -2.353000      1.810000  
1 1 1 6  23 49 o 12.80000 0.4569000 13.24000 0.6844000 12.36000 0.6055000 0.8830000      0.9138000 
1 1 1 6  23 51 o 14.73000 0.4795000 14.59000 0.7950000 14.87000 0.5363000 -0.2811000     0.9590000 
1 1 1 6  23 53 o 7.101000 0.7577000 7.070000 1.199000  7.132000 0.9267000 -0.6195000E-01 1.515000  
1 1 1 6  23 55 f 13.14000 0.4876000 13.35000 0.7291000 12.93000 0.6476000 0.4237000      0.9752000 
1 1 1 6  23 57 o 4.370000 1.023000  5.216000 1.541000  3.524000 1.346000  1.692000       2.046000  
1 1 1 6  23 59 o 6.755000 0.8795000 7.418000 1.213000  6.093000 1.274000  1.325000       1.759000  
1 1 1 6  23 61 o 4.043000 1.053000  4.108000 1.679000  3.979000 1.272000  0.1287000      2.107000  
1 1 1 6  23 63 o 4.997000 1.203000  5.170000 1.873000  4.824000 1.510000  0.3461000      2.406000  
1 1 1 6  24 0  o 16.85000 0.5704000 16.85000 0.5704000 16.85000 0.5704000 0.000000       0.000000  
1 1 1 6  24 2  o 70.17000 0.6422000 69.69000 0.7983000 70.64000 1.006000  -0.9538000     1.284000  
1 1 1 6  24 4  o 101.6000 0.7573000 101.6000 0.9912000 101.6000 1.145000  0.8461000E-02  1.515000  
1 1 1 6  24 6  o 20.05000 0.2772000 19.84000 0.3138000 20.26000 0.4570000 -0.4254000     0.5544000 
1 1 1 6  24 8  o 43.39000 0.4926000 42.66000 0.4147000 44.13000 0.8937000 -1.472000      0.9852000 
1 1 1 6  24 10 f 83.50000 0.6280000 83.46000 0.8229000 83.53000 0.9490000 -0.7702000E-01 1.256000  
1 1 1 6  24 12 o 52.55000 0.3987000 52.90000 0.4943000 52.21000 0.6258000 0.6926000      0.7975000 
1 1 1 6  24 14 o 45.74000 0.3734000 45.36000 0.4848000 46.11000 0.5680000 -0.7561000     0.7467000 
1 1 1 6  24 16 o 33.39000 0.4284000 33.85000 0.6108000 32.93000 0.6009000 0.9208000      0.8568000 
1 1 1 6  24 18 o 59.17000 0.4422000 59.68000 0.5491000 58.66000 0.6933000 1.015000       0.8844000 
1 1 1 6  24 20 o 26.12000 0.2906000 25.74000 0.3808000 26.51000 0.4390000 -0.7737000     0.5811000 
1 1 1 6  24 22 o 30.17000 0.3109000 29.92000 0.4147000 30.42000 0.4633000 -0.4993000     0.6218000 
1 1 1 6  24 24 o 27.80000 0.3183000 27.84000 0.4354000 27.76000 0.4643000 0.7940000E-01  0.6365000 
1 1 1 6  24 26 o 56.51000 0.5076000 56.91000 0.8246000 56.12000 0.5923000 0.7862000      1.015000  
1 1 1 6  24 28 o 45.47000 0.3826000 45.45000 0.5699000 45.50000 0.5107000 -0.4807000E-01 0.7652000 
1 1 1 6  24 30 o 25.80000 0.2976000 26.23000 0.4565000 25.37000 0.3820000 0.8538000      0.5952000 
1 1 1 6  24 32 o 39.76000 0.3611000 40.37000 0.5454000 39.15000 0.4734000 1.225000       0.7222000 
1 1 1 6  24 34 o 40.93000 0.4241000 41.67000 0.6810000 40.19000 0.5056000 1.478000       0.8482000 
1 1 1 6  24 36 o 17.85000 0.3731000 17.62000 0.5860000 18.08000 0.4621000 -0.4589000     0.7463000 
1 1 1 6  24 38 o 31.15000 0.3844000 30.94000 0.6437000 31.37000 0.4202000 -0.4282000     0.7687000 
1 1 1 6  24 40 o 19.21000 0.3959000 19.62000 0.5904000 18.80000 0.5275000 0.8206000      0.7917000 
1 1 1 6  24 42 o 31.63000 0.3562000 32.01000 0.5354000 31.25000 0.4700000 0.7633000      0.7124000 
1 1 1 6  24 44 o 17.94000 0.3725000 18.26000 0.5686000 17.62000 0.4813000 0.6389000      0.7449000 
1 1 1 6  24 46 o 7.871000 0.7778000 9.292000 1.210000  6.450000 0.9780000 2.842000       1.556000  
1 1 1 6  24 48 o 3.387000 0.9673000 3.378000 1.382000  3.397000 1.354000  -0.1818000E-01 1.935000  
1 1 1 6  24 50 o 8.535000 0.6663000 7.832000 1.116000  9.237000 0.7275000 -1.406000      1.333000  
1 1 1 6  24 52 o 6.912000 0.7828000 6.534000 1.315000  7.289000 0.8503000 -0.7551000     1.566000  
1 1 1 6  24 54 o 7.485000 0.8756000 6.751000 1.319000  8.218000 1.151000  -1.467000      1.751000  
1 1 1 6  24 56 o 7.079000 0.9977000 6.794000 1.682000  7.364000 1.073000  -0.5706000     1.995000  
1 1 1 6  24 58 o 5.441000 0.9974000 4.920000 1.555000  5.961000 1.250000  -1.041000      1.995000  
1 1 1 6  24 60 o 6.895000 0.8590000 6.418000 1.431000  7.373000 0.9499000 -0.9548000     1.718000  
1 1 1 6  24 62 o 2.849000 0.9285000 3.123000 1.471000  2.576000 1.134000  0.5467000      1.857000  
1 1 1 6  25 1  o 53.29000 0.3885000 52.76000 0.5439000 53.82000 0.5547000 -1.057000      0.7769000 
1 1 1 6  25 3  o 52.19000 0.5017000 52.06000 0.6268000 52.33000 0.7835000 -0.2636000     1.003000  
1 1 1 6  25 5  o 78.16000 0.6433000 78.76000 0.6965000 77.56000 1.082000  1.201000       1.287000  
1 1 1 6  25 7  o 71.82000 0.5464000 72.86000 0.7254000 70.79000 0.8173000 2.071000       1.093000  
1 1 1 6  25 9  o 19.30000 0.3283000 19.34000 0.3263000 19.26000 0.5697000 0.8305000E-01  0.6566000 
1 1 1 6  25 11 o 57.50000 0.4308000 57.21000 0.5283000 57.79000 0.6807000 -0.5793000     0.8616000 
1 1 1 6  25 13 o 41.35000 0.3465000 41.32000 0.4537000 41.39000 0.5237000 -0.7359000E-01 0.6929000 
1 1 1 6  25 15 o 59.33000 0.5312000 59.60000 0.6108000 59.06000 0.8693000 0.5366000      1.062000  
1 1 1 6  25 17 o 54.79000 0.4818000 55.27000 0.5135000 54.30000 0.8155000 0.9710000      0.9637000 
1 1 1 6  25 19 o 26.75000 0.2790000 26.96000 0.3449000 26.54000 0.4386000 0.4242000      0.5580000 
1 1 1 6  25 21 o 19.53000 0.3045000 19.32000 0.4137000 19.74000 0.4468000 -0.4141000     0.6089000 
1 1 1 6  25 23 o 24.87000 0.3192000 24.69000 0.3438000 25.04000 0.5380000 -0.3519000     0.6385000 
1 1 1 6  25 25 o 53.42000 0.4010000 53.15000 0.5609000 53.68000 0.5733000 -0.5362000     0.8020000 
1 1 1 6  25 27 o 25.75000 0.3138000 25.76000 0.4367000 25.74000 0.4507000 0.1921000E-01  0.6276000 
1 1 1 6  25 29 o 18.62000 0.3581000 18.99000 0.5560000 18.25000 0.4516000 0.7442000      0.7163000 
1 1 1 6  25 31 o 16.75000 0.3604000 16.61000 0.5333000 16.89000 0.4849000 -0.2843000     0.7208000 
1 1 1 6  25 33 o 19.35000 0.3809000 19.51000 0.6341000 19.19000 0.4222000 0.3188000      0.7618000 
1 1 1 6  25 35 o 39.43000 0.3552000 40.31000 0.5586000 38.56000 0.4388000 1.750000       0.7103000 
1 1 1 6  25 37 o 23.88000 0.5011000 23.79000 0.9072000 23.96000 0.4257000 -0.1705000     1.002000  
1 1 1 6  25 39 f 27.71000 0.3328000 27.14000 0.5119000 28.28000 0.4255000 -1.140000      0.6657000 
1 1 1 6  25 41 o 27.65000 0.3514000 27.35000 0.5220000 27.95000 0.4707000 -0.6044000     0.7029000 
1 1 1 6  25 43 o 17.07000 0.3890000 17.21000 0.5704000 16.94000 0.5292000 0.2722000      0.7780000 
1 1 1 6  25 45 o 11.75000 0.5441000 12.20000 0.9038000 11.31000 0.6061000 0.8970000      1.088000  
1 1 1 6  25 47 o 16.99000 0.3549000 17.51000 0.5425000 16.48000 0.4577000 1.029000       0.7098000 
1 1 1 6  25 49 o 16.21000 0.3866000 16.22000 0.6056000 16.19000 0.4807000 0.2862000E-01  0.7732000 
1 1 1 6  25 51 o 8.943000 0.7231000 8.322000 1.283000  9.564000 0.6672000 -1.242000      1.446000  
1 1 1 6  25 53 o 3.899000 1.060000  3.626000 1.435000  4.171000 1.562000  -0.5449000     2.121000  
1 1 1 6  25 55 o 15.08000 0.4867000 14.04000 0.7358000 16.12000 0.6372000 -2.081000      0.9734000 
1 1 1 6  25 57 o 3.869000 1.018000  4.460000 1.557000  3.279000 1.312000  1.181000       2.036000  
1 1 1 6  25 59 o 5.389000 0.9415000 4.511000 1.513000  6.266000 1.121000  -1.754000      1.883000  
1 1 1 6  25 61 o 6.000000 1.083000  5.460000 1.918000  6.541000 1.006000  -1.081000      2.166000  
1 1 1 6  26 0  o 66.66000 0.6692000 66.66000 0.6692000 66.66000 0.6692000 0.000000       0.000000  
1 1 1 6  26 2  o 52.55000 0.4698000 52.82000 0.5472000 52.28000 0.7639000 0.5437000      0.9396000 
1 1 1 6  26 4  o 36.16000 0.4160000 36.16000 0.4160000 ?        ?         ?              ?         
1 1 1 6  26 6  o 75.83000 0.5505000 75.57000 0.6729000 76.10000 0.8716000 -0.5321000     1.101000  
1 1 1 6  26 8  o 94.80000 0.6776000 95.05000 0.8339000 94.54000 1.068000  0.5169000      1.355000  
1 1 1 6  26 10 o 72.85000 0.5551000 72.25000 0.7196000 73.44000 0.8455000 -1.186000      1.110000  
1 1 1 6  26 12 o 53.05000 0.4482000 53.52000 0.6382000 52.58000 0.6294000 0.9387000      0.8963000 
1 1 1 6  26 14 o 49.06000 0.4604000 48.70000 0.5219000 49.42000 0.7586000 -0.7252000     0.9208000 
1 1 1 6  26 16 o 30.69000 0.3801000 30.92000 0.4824000 30.47000 0.5876000 0.4520000      0.7603000 
1 1 1 6  26 18 o 35.39000 0.3079000 35.63000 0.3787000 35.15000 0.4856000 0.4765000      0.6159000 
1 1 1 6  26 20 f 28.57000 0.2832000 28.85000 0.3522000 28.29000 0.4436000 0.5545000      0.5664000 
1 1 1 6  26 22 o 38.98000 0.3908000 38.60000 0.4537000 39.36000 0.6364000 -0.7615000     0.7816000 
1 1 1 6  26 24 o 30.69000 0.3099000 30.64000 0.3994000 30.73000 0.4740000 -0.8602000E-01 0.6198000 
1 1 1 6  26 26 o 8.049000 0.5546000 7.800000 0.7288000 8.298000 0.8363000 -0.4979000     1.109000  
1 1 1 6  26 28 o 25.00000 0.2881000 25.02000 0.3995000 24.97000 0.4152000 0.5176000E-01  0.5762000 
1 1 1 6  26 30 o 50.03000 0.4404000 50.11000 0.6189000 49.95000 0.6267000 0.1598000      0.8808000 
1 1 1 6  26 32 o 15.42000 0.4306000 15.98000 0.6874000 14.86000 0.5188000 1.115000       0.8612000 
1 1 1 6  26 34 o 25.77000 0.3499000 26.18000 0.5142000 25.35000 0.4747000 0.8356000      0.6999000 
1 1 1 6  26 36 f 20.67000 0.3999000 21.27000 0.6630000 20.06000 0.4471000 1.216000       0.7997000 
1 1 1 6  26 38 o 18.83000 0.4299000 19.34000 0.7144000 18.33000 0.4783000 1.009000       0.8598000 
1 1 1 6  26 40 o 19.75000 0.3953000 18.99000 0.5854000 20.51000 0.5314000 -1.516000      0.7906000 
1 1 1 6  26 42 o 18.90000 0.3772000 19.06000 0.5691000 18.74000 0.4952000 0.3131000      0.7544000 
1 1 1 6  26 44 o 16.47000 0.3945000 16.54000 0.5844000 16.41000 0.5300000 0.1262000      0.7889000 
1 1 1 6  26 46 o 9.377000 0.5728000 9.028000 0.9478000 9.726000 0.6436000 -0.6980000     1.146000  
1 1 1 6  26 48 o 11.78000 0.4786000 11.05000 0.7581000 12.50000 0.5845000 -1.453000      0.9573000 
1 1 1 6  26 50 o 4.809000 1.141000  5.642000 1.859000  3.976000 1.325000  1.666000       2.282000  
1 1 1 6  26 52 o 19.81000 0.3733000 19.67000 0.5654000 19.96000 0.4876000 -0.2944000     0.7466000 
1 1 1 6  26 54 o 3.631000 1.010000  3.862000 1.521000  3.400000 1.329000  0.4613000      2.020000  
1 1 1 6  26 56 o 8.887000 0.6626000 9.331000 1.027000  8.443000 0.8372000 0.8887000      1.325000  
1 1 1 6  26 58 o 3.284000 0.9728000 3.547000 1.498000  3.022000 1.241000  0.5242000      1.946000  
1 1 1 6  26 60 o 6.473000 0.8607000 6.498000 1.389000  6.448000 1.017000  0.4951000E-01  1.721000  
1 1 1 6  27 1  o 98.60000 1.110000  98.15000 1.107000  99.06000 1.925000  -0.9078000     2.221000  
1 1 1 6  27 3  o 38.55000 0.3546000 38.59000 0.4975000 38.51000 0.5053000 0.8486000E-01  0.7091000 
1 1 1 6  27 5  o 101.2000 0.8533000 103.1000 1.006000  99.29000 1.379000  3.792000       1.707000  
1 1 1 6  27 7  o 87.81000 0.7518000 87.59000 0.8620000 88.04000 1.232000  -0.4494000     1.504000  
1 1 1 6  27 9  o 57.30000 0.5392000 58.06000 0.6829000 56.55000 0.8346000 1.510000       1.078000  
1 1 1 6  27 11 o 12.75000 0.4308000 12.30000 0.4518000 13.19000 0.7336000 -0.8904000     0.8615000 
1 1 1 6  27 13 o 55.04000 0.4807000 55.55000 0.5168000 54.52000 0.8107000 1.035000       0.9615000 
1 1 1 6  27 15 o 68.06000 0.5995000 67.56000 0.6810000 68.56000 0.9867000 -1.001000      1.199000  
1 1 1 6  27 17 o 12.83000 0.3193000 12.36000 0.4154000 13.30000 0.4851000 -0.9473000     0.6387000 
1 1 1 6  27 19 o 32.31000 0.3116000 32.66000 0.4103000 31.97000 0.4692000 0.6925000      0.6233000 
1 1 1 6  27 21 o 47.40000 0.4438000 47.57000 0.5201000 47.24000 0.7192000 0.3357000      0.8876000 
1 1 1 6  27 23 o 31.99000 0.3114000 32.36000 0.4108000 31.61000 0.4682000 0.7486000      0.6229000 
1 1 1 6  27 25 o 62.75000 0.4920000 62.73000 0.6415000 62.77000 0.7462000 -0.3737000E-01 0.9841000 
1 1 1 6  27 27 o 44.15000 0.3529000 44.24000 0.4929000 44.05000 0.5051000 0.1870000      0.7057000 
1 1 1 6  27 29 o 21.35000 0.3321000 21.57000 0.4533000 21.14000 0.4856000 0.4326000      0.6643000 
1 1 1 6  27 31 o 26.51000 0.3057000 26.99000 0.4291000 26.04000 0.4357000 0.9473000      0.6115000 
1 1 1 6  27 33 o 10.93000 0.4824000 10.66000 0.7064000 11.20000 0.6572000 -0.5377000     0.9649000 
1 1 1 6  27 35 o 16.71000 0.5401000 17.42000 0.9389000 15.99000 0.5340000 1.425000       1.080000  
1 1 1 6  27 37 o 25.64000 0.4129000 25.74000 0.6860000 25.54000 0.4599000 0.2015000      0.8259000 
1 1 1 6  27 39 o 7.141000 0.8754000 6.955000 1.358000  7.327000 1.105000  -0.3719000     1.751000  
1 1 1 6  27 41 o 26.34000 0.3314000 26.39000 0.5110000 26.29000 0.4220000 0.9721000E-01  0.6627000 
1 1 1 6  27 43 o 7.502000 0.7511000 7.786000 1.080000  7.219000 1.044000  0.5674000      1.502000  
1 1 1 6  27 45 o 6.376000 0.8255000 5.232000 1.449000  7.519000 0.7918000 -2.287000      1.651000  
1 1 1 6  27 47 o 6.426000 0.8209000 5.933000 1.385000  6.919000 0.8822000 -0.9859000     1.642000  
1 1 1 6  27 49 o 12.27000 0.4821000 12.16000 0.7566000 12.39000 0.5979000 -0.2356000     0.9643000 
1 1 1 6  27 51 o 13.54000 0.4928000 13.28000 0.8278000 13.79000 0.5348000 -0.5133000     0.9855000 
1 1 1 6  27 53 o 5.388000 1.002000  4.706000 1.495000  6.070000 1.334000  -1.364000      2.004000  
1 1 1 6  27 55 o 6.766000 0.9985000 6.082000 1.761000  7.449000 0.9419000 -1.367000      1.997000  
1 1 1 6  27 57 o 5.336000 1.014000  4.790000 1.600000  5.882000 1.246000  -1.092000      2.028000  
1 1 1 6  27 59 o 5.846000 1.012000  5.775000 1.371000  5.917000 1.489000  -0.1425000     2.024000  
1 1 1 6  27 61 o 10.78000 0.7266000 11.35000 0.9175000 10.21000 1.127000  1.145000       1.453000  
1 1 1 6  28 0  o 14.74000 0.4672000 14.74000 0.4672000 14.74000 0.4672000 0.000000       0.000000  
1 1 1 6  28 2  o 39.81000 0.3362000 39.58000 0.5037000 40.05000 0.4456000 -0.4685000     0.6725000 
1 1 1 6  28 4  o 29.75000 0.2935000 29.89000 0.3816000 29.61000 0.4461000 0.2795000      0.5871000 
1 1 1 6  28 6  o 30.11000 0.2962000 30.39000 0.3888000 29.84000 0.4469000 0.5564000      0.5923000 
1 1 1 6  28 8  f 84.04000 0.7593000 84.62000 0.9620000 83.46000 1.175000  1.163000       1.519000  
1 1 1 6  28 10 o 34.47000 0.3572000 35.08000 0.3782000 33.86000 0.6060000 1.228000       0.7143000 
1 1 1 6  28 12 o 37.67000 0.3743000 37.61000 0.3896000 37.73000 0.6391000 -0.1266000     0.7485000 
1 1 1 6  28 14 o 59.76000 0.5360000 59.64000 0.6129000 59.87000 0.8795000 -0.2380000     1.072000  
1 1 1 6  28 16 o 27.61000 0.2736000 27.85000 0.3415000 27.36000 0.4275000 0.4890000      0.5471000 
1 1 1 6  28 18 o 30.58000 0.3366000 30.35000 0.3947000 30.80000 0.5453000 -0.4491000     0.6732000 
1 1 1 6  28 20 o 50.21000 0.4647000 49.57000 0.5389000 50.85000 0.7571000 -1.282000      0.9294000 
1 1 1 6  28 22 o 22.72000 0.2809000 22.63000 0.3442000 22.82000 0.4441000 -0.1893000     0.5619000 
1 1 1 6  28 24 o 22.09000 0.3148000 22.14000 0.3468000 22.03000 0.5256000 0.1030000      0.6297000 
1 1 1 6  28 26 o 29.65000 0.2923000 29.38000 0.4010000 29.92000 0.4254000 -0.5336000     0.5846000 
1 1 1 6  28 28 o 14.83000 0.3561000 14.77000 0.4557000 14.89000 0.5472000 -0.1140000     0.7121000 
1 1 1 6  28 30 o 26.83000 0.3001000 26.94000 0.4202000 26.71000 0.4285000 0.2338000      0.6001000 
1 1 1 6  28 32 o 35.40000 0.3495000 35.76000 0.5326000 35.04000 0.4526000 0.7229000      0.6989000 
1 1 1 6  28 34 o 7.523000 0.7455000 8.075000 0.9193000 6.972000 1.174000  1.103000       1.491000  
1 1 1 6  28 36 o 5.596000 0.9764000 4.993000 1.484000  6.199000 1.269000  -1.206000      1.953000  
1 1 1 6  28 38 o 26.67000 0.5032000 26.43000 0.8916000 26.90000 0.4670000 -0.4628000     1.006000  
1 1 1 6  28 40 o 19.92000 0.3463000 19.83000 0.4840000 20.00000 0.4955000 -0.1715000     0.6927000 
1 1 1 6  28 42 f 12.14000 0.5031000 12.23000 0.6377000 12.05000 0.7782000 0.1716000      1.006000  
1 1 1 6  28 44 o 4.634000 0.8979000 3.707000 1.414000  5.562000 1.107000  -1.855000      1.796000  
1 1 1 6  28 46 o 11.91000 0.4927000 11.57000 0.7229000 12.25000 0.6695000 -0.6782000     0.9853000 
1 1 1 6  28 48 o 8.449000 0.5965000 8.962000 0.7535000 7.936000 0.9249000 1.026000       1.193000  
1 1 1 6  28 50 o 7.739000 0.6511000 6.690000 1.059000  8.787000 0.7575000 -2.098000      1.302000  
1 1 1 6  28 52 o 9.909000 0.5800000 10.36000 0.8254000 9.456000 0.8151000 0.9057000      1.160000  
1 1 1 6  28 54 f 11.93000 0.5289000 11.32000 0.8325000 12.55000 0.6527000 -1.233000      1.058000  
1 1 1 6  28 56 o 8.075000 0.6641000 8.808000 0.8931000 7.341000 0.9832000 1.467000       1.328000  
1 1 1 6  28 58 o 7.084000 0.8065000 6.423000 1.303000  7.746000 0.9506000 -1.323000      1.613000  
1 1 1 6  28 60 o 8.805000 0.6567000 8.666000 0.9904000 8.944000 0.8626000 -0.2788000     1.313000  
1 1 1 6  29 1  o 28.47000 0.2954000 28.37000 0.4510000 28.58000 0.3818000 -0.2131000     0.5909000 
1 1 1 6  29 3  f 53.66000 0.4241000 54.18000 0.5630000 53.14000 0.6344000 1.034000       0.8481000 
1 1 1 6  29 5  o 30.09000 0.2978000 29.58000 0.3848000 30.61000 0.4547000 -1.031000      0.5957000 
1 1 1 6  29 7  o 56.70000 0.4460000 56.71000 0.5821000 56.70000 0.6760000 0.5047000E-02  0.8921000 
1 1 1 6  29 9  o 32.62000 0.2955000 32.72000 0.3652000 32.52000 0.4647000 0.1960000      0.5911000 
1 1 1 6  29 11 o 37.62000 0.3185000 37.54000 0.3918000 37.71000 0.5023000 -0.1678000     0.6370000 
1 1 1 6  29 13 f 67.67000 0.5208000 68.47000 0.6937000 66.86000 0.7770000 1.607000       1.042000  
1 1 1 6  29 15 o 24.74000 0.2709000 25.06000 0.3417000 24.43000 0.4205000 0.6250000      0.5418000 
1 1 1 6  29 17 o 33.36000 0.3499000 33.15000 0.4152000 33.57000 0.5633000 -0.4221000     0.6998000 
1 1 1 6  29 19 o 21.17000 0.3261000 20.82000 0.4118000 21.52000 0.5058000 -0.7040000     0.6522000 
1 1 1 6  29 21 o 27.08000 0.3057000 26.36000 0.4136000 27.79000 0.4504000 -1.433000      0.6115000 
1 1 1 6  29 23 o 16.32000 0.3503000 16.92000 0.3810000 15.71000 0.5879000 1.214000       0.7006000 
1 1 1 6  29 25 f 24.49000 0.2806000 23.99000 0.3863000 24.98000 0.4070000 -0.9867000     0.5611000 
1 1 1 6  29 27 o 9.674000 0.4987000 9.220000 0.6587000 10.13000 0.7490000 -0.9084000     0.9974000 
1 1 1 6  29 29 o 12.86000 0.3968000 13.24000 0.5238000 12.48000 0.5963000 0.7611000      0.7937000 
1 1 1 6  29 31 o 37.90000 0.3885000 37.99000 0.5359000 37.82000 0.5628000 0.1712000      0.7771000 
1 1 1 6  29 33 o 25.57000 0.3536000 25.59000 0.4432000 25.55000 0.5512000 0.3429000E-01  0.7073000 
1 1 1 6  29 35 o 6.119000 0.9273000 5.016000 1.528000  7.223000 1.051000  -2.207000      1.855000  
1 1 1 6  29 37 o 15.97000 0.4445000 15.94000 0.6842000 16.00000 0.5675000 -0.5862000E-01 0.8889000 
1 1 1 6  29 39 o 26.07000 0.3946000 26.26000 0.4652000 25.88000 0.6376000 0.3767000      0.7893000 
1 1 1 6  29 41 o 12.64000 0.4853000 13.45000 0.7128000 11.82000 0.6587000 1.635000       0.9706000 
1 1 1 6  29 43 o 9.266000 0.6244000 9.274000 0.9569000 9.258000 0.8022000 0.1545000E-01  1.249000  
1 1 1 6  29 45 o 19.61000 0.4062000 19.58000 0.5773000 19.63000 0.5716000 -0.4584000E-01 0.8124000 
1 1 1 6  29 47 o 13.18000 0.4146000 13.03000 0.6143000 13.33000 0.5571000 -0.3003000     0.8293000 
1 1 1 6  29 49 o 12.31000 0.4741000 11.83000 0.7437000 12.79000 0.5880000 -0.9567000     0.9481000 
1 1 1 6  29 51 o 14.70000 0.4664000 14.78000 0.6360000 14.61000 0.6823000 0.1734000      0.9328000 
1 1 1 6  29 53 o 6.517000 0.8818000 6.335000 1.135000  6.699000 1.350000  -0.3640000     1.764000  
1 1 1 6  29 55 o 4.084000 0.9660000 3.449000 1.382000  4.720000 1.350000  -1.272000      1.932000  
1 1 1 6  29 57 o 6.913000 0.7748000 7.488000 1.019000  6.338000 1.167000  1.149000       1.550000  
1 1 1 6  29 59 o 3.327000 0.9713000 3.680000 1.403000  2.973000 1.344000  0.7075000      1.943000  
1 1 1 6  30 0  o 26.28000 0.3777000 26.28000 0.3777000 26.28000 0.3777000 0.000000       0.000000  
1 1 1 6  30 2  o 83.06000 0.7111000 83.13000 1.162000  83.00000 0.8202000 0.1329000      1.422000  
1 1 1 6  30 4  o 43.61000 0.3897000 43.85000 0.5500000 43.36000 0.5522000 0.4894000      0.7793000 
1 1 1 6  30 6  o 25.61000 0.3161000 25.60000 0.3703000 25.62000 0.5123000 -0.1436000E-01 0.6321000 
1 1 1 6  30 8  o 21.62000 0.2753000 21.07000 0.3438000 22.18000 0.4301000 -1.109000      0.5506000 
1 1 1 6  30 10 o 40.18000 0.3330000 40.17000 0.4111000 40.19000 0.5240000 -0.1152000E-01 0.6660000 
1 1 1 6  30 12 o 59.10000 0.4646000 58.96000 0.6080000 59.24000 0.7026000 -0.2852000     0.9292000 
1 1 1 6  30 14 f 40.80000 0.3800000 41.35000 0.4198000 40.26000 0.6334000 1.089000       0.7599000 
1 1 1 6  30 16 f 21.15000 0.3114000 20.98000 0.3788000 21.31000 0.4944000 -0.3311000     0.6228000 
1 1 1 6  30 18 o 49.04000 0.4031000 49.34000 0.5372000 48.74000 0.6010000 0.5973000      0.8061000 
1 1 1 6  30 20 o 40.97000 0.3587000 41.36000 0.4785000 40.58000 0.5346000 0.7889000      0.7174000 
1 1 1 6  30 22 f 62.02000 0.5311000 61.73000 0.5717000 62.32000 0.8951000 -0.5976000     1.062000  
1 1 1 6  30 24 o 22.64000 0.3557000 23.53000 0.3639000 21.75000 0.6114000 1.781000       0.7115000 
1 1 1 6  30 26 o 36.58000 0.3395000 36.30000 0.4400000 36.86000 0.5172000 -0.5598000     0.6791000 
1 1 1 6  30 28 o 38.41000 0.3298000 38.06000 0.4577000 38.77000 0.4749000 -0.7120000     0.6596000 
1 1 1 6  30 30 o 25.69000 0.3072000 25.12000 0.4307000 26.26000 0.4382000 -1.137000      0.6144000 
1 1 1 6  30 32 o 10.97000 0.5128000 11.09000 0.7183000 10.86000 0.7320000 0.2231000      1.026000  
1 1 1 6  30 34 o 22.70000 0.3847000 22.91000 0.5185000 22.49000 0.5684000 0.4188000      0.7693000 
1 1 1 6  30 36 f 22.03000 0.3323000 22.16000 0.4695000 21.90000 0.4704000 0.2585000      0.6646000 
1 1 1 6  30 38 o 4.233000 1.127000  4.789000 1.606000  3.677000 1.583000  1.111000       2.255000  
1 1 1 6  30 40 o 13.07000 0.4810000 12.81000 0.7377000 13.33000 0.6175000 -0.5205000     0.9621000 
1 1 1 6  30 42 o 3.867000 0.9308000 4.749000 1.364000  2.986000 1.267000  1.763000       1.862000  
1 1 1 6  30 44 o 10.43000 0.6003000 11.09000 0.8369000 9.765000 0.8607000 1.321000       1.201000  
1 1 1 6  30 46 o 5.246000 0.9259000 4.070000 1.527000  6.421000 1.047000  -2.352000      1.852000  
1 1 1 6  30 48 o 15.98000 0.4144000 15.48000 0.5615000 16.48000 0.6095000 -0.9934000     0.8287000 
1 1 1 6  30 50 o 17.21000 0.4184000 16.69000 0.5721000 17.72000 0.6106000 -1.030000      0.8367000 
1 1 1 6  30 52 o 6.398000 0.9739000 5.560000 1.349000  7.237000 1.405000  -1.677000      1.948000  
1 1 1 6  30 54 f 3.501000 0.9706000 3.236000 1.329000  3.766000 1.415000  -0.5303000     1.941000  
1 1 1 6  30 56 o 3.454000 0.9818000 3.249000 1.347000  3.659000 1.428000  -0.4092000     1.964000  
1 1 1 6  30 58 o 4.052000 1.020000  4.500000 1.461000  3.603000 1.425000  0.8971000      2.041000  
1 1 1 6  31 1  o 16.98000 0.3044000 16.89000 0.4362000 17.06000 0.4246000 -0.1747000     0.6087000 
1 1 1 6  31 3  o 7.183000 0.5202000 6.403000 0.7724000 7.963000 0.6971000 -1.560000      1.040000  
1 1 1 6  31 5  o 13.46000 0.3427000 13.41000 0.4584000 13.52000 0.5094000 -0.1127000     0.6853000 
1 1 1 6  31 7  o 20.67000 0.2771000 20.84000 0.3475000 20.51000 0.4316000 0.3314000      0.5541000 
1 1 1 6  31 9  o 24.38000 0.3168000 24.40000 0.3722000 24.37000 0.5126000 0.3101000E-01  0.6335000 
1 1 1 6  31 11 o 25.90000 0.3172000 25.52000 0.3850000 26.27000 0.5042000 -0.7523000     0.6344000 
1 1 1 6  31 13 f 36.04000 0.3674000 35.53000 0.4308000 36.56000 0.5953000 -1.030000      0.7348000 
1 1 1 6  31 15 o 26.24000 0.3191000 26.47000 0.3905000 26.02000 0.5048000 0.4496000      0.6382000 
1 1 1 6  31 17 o 14.48000 0.3411000 14.20000 0.4891000 14.77000 0.4757000 -0.5742000     0.6823000 
1 1 1 6  31 19 o 44.51000 0.3768000 44.89000 0.5023000 44.13000 0.5618000 0.7612000      0.7536000 
1 1 1 6  31 21 o 30.42000 0.3336000 30.56000 0.3706000 30.29000 0.5548000 0.2695000      0.6672000 
1 1 1 6  31 23 o 25.75000 0.2913000 25.87000 0.3621000 25.62000 0.4565000 0.2512000      0.5826000 
1 1 1 6  31 25 o 28.78000 0.3124000 28.64000 0.4059000 28.92000 0.4749000 -0.2823000     0.6248000 
1 1 1 6  31 27 o 27.67000 0.3164000 27.42000 0.4653000 27.92000 0.4287000 -0.5040000     0.6327000 
1 1 1 6  31 29 o 30.42000 0.3105000 31.24000 0.4347000 29.59000 0.4434000 1.650000       0.6209000 
1 1 1 6  31 31 o 33.39000 0.3233000 33.69000 0.4551000 33.08000 0.4593000 0.6174000      0.6466000 
1 1 1 6  31 33 o 15.09000 0.4617000 14.96000 0.6388000 15.22000 0.6667000 -0.2586000     0.9233000 
1 1 1 6  31 35 o 23.15000 0.3198000 23.37000 0.4563000 22.94000 0.4483000 0.4264000      0.6397000 
1 1 1 6  31 37 o 22.23000 0.3839000 22.31000 0.5604000 22.14000 0.5250000 0.1696000      0.7679000 
1 1 1 6  31 39 o 9.972000 0.5390000 9.982000 0.7799000 9.962000 0.7441000 0.1919000E-01  1.078000  
1 1 1 6  31 41 o 16.18000 0.4145000 16.20000 0.6243000 16.16000 0.5454000 0.4663000E-01  0.8289000 
1 1 1 6  31 43 o 10.54000 0.5090000 10.16000 0.7635000 10.93000 0.6733000 -0.7623000     1.018000  
1 1 1 6  31 45 o 13.30000 0.4172000 13.19000 0.6186000 13.42000 0.5598000 -0.2240000     0.8343000 
1 1 1 6  31 47 o 4.281000 1.009000  4.530000 1.511000  4.031000 1.339000  0.4994000      2.019000  
1 1 1 6  31 49 o 3.836000 1.080000  3.706000 1.592000  3.965000 1.461000  -0.2589000     2.161000  
1 1 1 6  31 51 o 7.726000 0.8948000 7.418000 1.582000  8.034000 0.8359000 -0.6157000     1.790000  
1 1 1 6  31 53 o 7.551000 0.8354000 7.398000 1.309000  7.705000 1.038000  -0.3073000     1.671000  
1 1 1 6  31 55 o 10.97000 0.5448000 10.65000 0.7841000 11.30000 0.7566000 -0.6445000     1.090000  
1 1 1 6  31 57 o 6.245000 0.8733000 6.700000 1.211000  5.789000 1.258000  0.9109000      1.747000  
1 1 1 6  32 0  f 29.00000 0.3891000 29.00000 0.3891000 29.00000 0.3891000 0.000000       0.000000  
1 1 1 6  32 2  o 41.73000 0.3540000 41.15000 0.4615000 42.30000 0.5368000 -1.147000      0.7079000 
1 1 1 6  32 4  o 58.38000 0.5198000 58.38000 0.6023000 58.37000 0.8474000 0.7599000E-02  1.040000  
1 1 1 6  32 6  o 18.17000 0.3263000 17.59000 0.4146000 18.75000 0.5039000 -1.161000      0.6525000 
1 1 1 6  32 8  o 19.94000 0.3391000 19.74000 0.4513000 20.14000 0.5061000 -0.3992000     0.6781000 
1 1 1 6  32 10 o 19.46000 0.3200000 19.20000 0.3941000 19.72000 0.5042000 -0.5192000     0.6399000 
1 1 1 6  32 12 o 27.69000 0.3875000 27.53000 0.3867000 27.84000 0.6717000 -0.3144000     0.7751000 
1 1 1 6  32 14 o 49.35000 0.4076000 49.19000 0.5389000 49.51000 0.6115000 -0.3170000     0.8151000 
1 1 1 6  32 16 o 24.80000 0.2992000 25.25000 0.4117000 24.35000 0.4342000 0.9074000      0.5984000 
1 1 1 6  32 18 o 13.69000 0.3795000 13.97000 0.5656000 13.41000 0.5060000 0.5613000      0.7589000 
1 1 1 6  32 20 o 23.73000 0.3133000 23.72000 0.3541000 23.73000 0.5170000 -0.1900000E-01 0.6266000 
1 1 1 6  32 22 f 33.87000 0.3138000 33.77000 0.3888000 33.97000 0.4927000 -0.1912000     0.6277000 
1 1 1 6  32 24 o 35.91000 0.3386000 35.73000 0.4408000 36.09000 0.5141000 -0.3593000     0.6772000 
1 1 1 6  32 26 f 22.61000 0.3189000 22.85000 0.4653000 22.38000 0.4363000 0.4681000      0.6378000 
1 1 1 6  32 28 o 26.46000 0.3039000 26.70000 0.4269000 26.22000 0.4327000 0.4782000      0.6078000 
1 1 1 6  32 30 o 9.657000 0.5766000 9.692000 0.8622000 9.621000 0.7659000 0.7141000E-01  1.153000  
1 1 1 6  32 32 o 9.337000 0.5382000 8.742000 0.7750000 9.933000 0.7469000 -1.191000      1.076000  
1 1 1 6  32 34 o 23.69000 0.3199000 23.66000 0.4534000 23.72000 0.4513000 -0.5793000E-01 0.6397000 
1 1 1 6  32 36 o 12.51000 0.4912000 12.53000 0.6513000 12.50000 0.7355000 0.2647000E-01  0.9825000 
1 1 1 6  32 38 o 10.85000 0.5521000 10.14000 0.7915000 11.55000 0.7698000 -1.413000      1.104000  
1 1 1 6  32 40 o 21.84000 0.3613000 22.04000 0.4576000 21.63000 0.5592000 0.4051000      0.7226000 
1 1 1 6  32 42 o 17.41000 0.3897000 17.98000 0.5814000 16.85000 0.5190000 1.138000       0.7794000 
1 1 1 6  32 44 o 6.619000 0.7439000 7.135000 0.9915000 6.104000 1.109000  1.031000       1.488000  
1 1 1 6  32 46 o 9.374000 0.5484000 9.159000 0.8083000 9.589000 0.7414000 -0.4307000     1.097000  
1 1 1 6  32 48 o 4.132000 1.038000  4.469000 1.522000  3.795000 1.412000  0.6740000      2.076000  
1 1 1 6  32 50 o 5.713000 0.9432000 6.084000 1.401000  5.342000 1.263000  0.7417000      1.886000  
1 1 1 6  32 52 o 4.913000 1.119000  5.138000 1.746000  4.688000 1.398000  0.4491000      2.237000  
1 1 1 6  32 54 o 3.983000 0.9319000 3.043000 1.313000  4.923000 1.323000  -1.880000      1.864000  
1 1 1 6  32 56 o 7.834000 0.6816000 7.912000 1.021000  7.757000 0.9031000 0.1555000      1.363000  
1 1 1 6  32 58 f 4.476000 1.028000  3.337000 1.370000  5.615000 1.533000  -2.277000      2.056000  
1 1 1 6  33 1  o 28.67000 0.2984000 28.83000 0.4538000 28.52000 0.3876000 0.3041000      0.5968000 
1 1 1 6  33 3  o 75.49000 0.5336000 75.59000 0.7558000 75.39000 0.7536000 0.2052000      1.067000  
1 1 1 6  33 5  o 29.09000 0.2860000 28.66000 0.3532000 29.52000 0.4500000 -0.8592000     0.5720000 
1 1 1 6  33 7  o 15.74000 0.3066000 15.57000 0.3981000 15.90000 0.4665000 -0.3296000     0.6132000 
1 1 1 6  33 9  o 19.21000 0.3058000 19.21000 0.4072000 19.20000 0.4563000 0.1505000E-01  0.6116000 
1 1 1 6  33 11 o 36.00000 0.3334000 35.84000 0.4416000 36.15000 0.4995000 -0.3060000     0.6667000 
1 1 1 6  33 13 o 48.67000 0.4040000 48.91000 0.5371000 48.43000 0.6035000 0.4856000      0.8080000 
1 1 1 6  33 15 o 37.29000 0.4025000 37.41000 0.5280000 37.16000 0.6077000 0.2413000      0.8050000 
1 1 1 6  33 17 o 33.23000 0.3261000 33.43000 0.4398000 33.04000 0.4815000 0.3919000      0.6522000 
1 1 1 6  33 19 o 21.21000 0.3214000 20.86000 0.3670000 21.56000 0.5278000 -0.6980000     0.6429000 
1 1 1 6  33 21 o 31.07000 0.3029000 31.05000 0.3763000 31.09000 0.4747000 -0.4808000E-01 0.6058000 
1 1 1 6  33 23 o 15.56000 0.3498000 15.20000 0.4632000 15.91000 0.5243000 -0.7090000     0.6995000 
1 1 1 6  33 25 o 26.23000 0.3243000 26.40000 0.4250000 26.06000 0.4900000 0.3410000      0.6486000 
1 1 1 6  33 27 o 27.40000 0.3038000 27.77000 0.4239000 27.04000 0.4353000 0.7359000      0.6075000 
1 1 1 6  33 29 o 19.65000 0.3487000 20.13000 0.5156000 19.17000 0.4695000 0.9609000      0.6974000 
1 1 1 6  33 31 o 8.372000 0.5883000 8.192000 0.8617000 8.553000 0.8012000 -0.3605000     1.177000  
1 1 1 6  33 33 o 4.788000 0.9954000 5.883000 1.361000  3.693000 1.453000  2.189000       1.991000  
1 1 1 6  33 35 o 15.85000 0.4075000 15.49000 0.5191000 16.21000 0.6283000 -0.7207000     0.8150000 
1 1 1 6  33 37 o 8.064000 0.7194000 8.209000 1.020000  7.919000 1.015000  0.2905000      1.439000  
1 1 1 6  33 39 o 10.45000 0.4802000 10.31000 0.7069000 10.59000 0.6500000 -0.2741000     0.9603000 
1 1 1 6  33 41 o 3.685000 0.9662000 3.185000 1.355000  4.185000 1.378000  -0.9999000     1.932000  
1 1 1 6  33 43 o 12.04000 0.4235000 11.84000 0.6105000 12.24000 0.5871000 -0.3970000     0.8469000 
1 1 1 6  33 45 o 9.793000 0.5279000 9.339000 0.7725000 10.25000 0.7198000 -0.9067000     1.056000  
1 1 1 6  33 47 f 2.989000 0.8826000 3.546000 1.357000  2.433000 1.129000  1.113000       1.765000  
1 1 1 6  33 49 o 6.236000 0.8141000 6.274000 1.159000  6.199000 1.144000  0.7499000E-01  1.628000  
1 1 1 6  33 51 o 6.167000 0.9863000 5.663000 1.445000  6.672000 1.343000  -1.009000      1.973000  
1 1 1 6  33 53 o 8.118000 0.6707000 7.648000 1.047000  8.588000 0.8382000 -0.9403000     1.341000  
1 1 1 6  33 55 o 3.470000 1.003000  3.756000 1.527000  3.184000 1.299000  0.5714000      2.005000  
1 1 1 6  33 57 o 3.436000 0.9854000 3.896000 1.507000  2.977000 1.271000  0.9192000      1.971000  
1 1 1 6  34 0  o 24.41000 0.3790000 24.41000 0.3790000 24.41000 0.3790000 0.000000       0.000000  
1 1 1 6  34 2  o 73.64000 0.5226000 73.16000 0.7363000 74.12000 0.7420000 -0.9578000     1.045000  
1 1 1 6  34 4  o 34.00000 0.2963000 33.65000 0.4210000 34.34000 0.4170000 -0.6894000     0.5926000 
1 1 1 6  34 6  o 30.27000 0.2926000 30.19000 0.3598000 30.36000 0.4615000 -0.1658000     0.5852000 
1 1 1 6  34 8  o 49.89000 0.3903000 49.83000 0.4789000 49.96000 0.6164000 -0.1273000     0.7806000 
1 1 1 6  34 10 o 27.59000 0.2884000 27.60000 0.3549000 27.58000 0.4547000 0.1339000E-01  0.5768000 
1 1 1 6  34 12 o 60.56000 0.4799000 60.84000 0.6356000 60.28000 0.7192000 0.5654000      0.9598000 
1 1 1 6  34 14 o 42.40000 0.3665000 41.49000 0.4737000 43.30000 0.5594000 -1.802000      0.7330000 
1 1 1 6  34 16 o 37.50000 0.3277000 37.94000 0.4110000 37.07000 0.5105000 0.8674000      0.6554000 
1 1 1 6  34 18 o 51.86000 0.4750000 52.06000 0.5560000 51.67000 0.7704000 0.3876000      0.9501000 
1 1 1 6  34 20 o 18.38000 0.3119000 18.72000 0.3814000 18.05000 0.4936000 0.6673000      0.6238000 
1 1 1 6  34 22 o 19.82000 0.3242000 20.13000 0.4188000 19.52000 0.4951000 0.6124000      0.6485000 
1 1 1 6  34 24 o 6.094000 0.8078000 7.043000 0.8277000 5.145000 1.388000  1.898000       1.616000  
1 1 1 6  34 26 o 9.166000 0.5606000 9.888000 0.6776000 8.445000 0.8932000 1.443000       1.121000  
1 1 1 6  34 28 o 23.71000 0.3281000 23.79000 0.4822000 23.63000 0.4449000 0.1565000      0.6561000 
1 1 1 6  34 30 o 4.847000 0.9403000 5.467000 1.259000  4.226000 1.397000  1.241000       1.881000  
1 1 1 6  34 32 o 6.437000 0.8760000 5.573000 1.298000  7.302000 1.176000  -1.729000      1.752000  
1 1 1 6  34 34 o 8.880000 0.6109000 8.706000 0.8130000 9.055000 0.9119000 -0.3495000     1.222000  
1 1 1 6  34 36 o 29.57000 0.4202000 28.96000 0.5087000 30.19000 0.6691000 -1.235000      0.8405000 
1 1 1 6  34 38 o 4.565000 0.9502000 3.236000 1.387000  5.893000 1.300000  -2.656000      1.900000  
1 1 1 6  34 40 o 6.238000 0.7556000 6.470000 1.025000  6.005000 1.110000  0.4649000      1.511000  
1 1 1 6  34 42 o 10.05000 0.5156000 9.952000 0.7500000 10.16000 0.7078000 -0.2052000     1.031000  
1 1 1 6  34 44 o 3.182000 0.8986000 2.867000 1.216000  3.497000 1.324000  -0.6300000     1.797000  
1 1 1 6  34 46 o 7.904000 0.6219000 8.132000 0.8037000 7.676000 0.9492000 0.4560000      1.244000  
1 1 1 6  34 48 o 5.633000 0.9513000 4.935000 1.410000  6.331000 1.278000  -1.397000      1.903000  
1 1 1 6  34 50 o 3.283000 0.9461000 2.943000 1.271000  3.622000 1.402000  -0.6799000     1.892000  
1 1 1 6  34 52 o 4.570000 0.9744000 5.477000 1.385000  3.664000 1.371000  1.813000       1.949000  
1 1 1 6  34 54 o 3.741000 0.9305000 2.820000 1.279000  4.662000 1.352000  -1.841000      1.861000  
1 1 1 6  34 56 o 2.696000 0.8736000 2.829000 1.305000  2.563000 1.162000  0.2661000      1.747000  
1 1 1 6  35 1  o 35.04000 0.3011000 35.08000 0.4264000 35.00000 0.4253000 0.7825000E-01  0.6022000 
1 1 1 6  35 3  o 32.55000 0.2893000 32.47000 0.4094000 32.64000 0.4088000 -0.1729000     0.5785000 
1 1 1 6  35 5  o 17.41000 0.2963000 17.59000 0.3643000 17.22000 0.4675000 0.3698000      0.5927000 
1 1 1 6  35 7  o 24.84000 0.3389000 24.71000 0.3461000 24.97000 0.5826000 -0.2621000     0.6777000 
1 1 1 6  35 9  o 24.26000 0.2852000 23.66000 0.3565000 24.85000 0.4454000 -1.183000      0.5705000 
1 1 1 6  35 11 o 39.28000 0.3345000 39.32000 0.4130000 39.24000 0.5263000 0.8341000E-01  0.6691000 
1 1 1 6  35 13 o 24.18000 0.2997000 24.25000 0.3960000 24.12000 0.4499000 0.1304000      0.5993000 
1 1 1 6  35 15 o 23.67000 0.3072000 23.66000 0.4168000 23.68000 0.4515000 -0.2268000E-01 0.6145000 
1 1 1 6  35 17 o 19.90000 0.3288000 20.18000 0.3724000 19.62000 0.5420000 0.5577000      0.6576000 
1 1 1 6  35 19 o 12.90000 0.3730000 13.21000 0.4704000 12.58000 0.5789000 0.6338000      0.7459000 
1 1 1 6  35 21 o 15.56000 0.3483000 15.44000 0.4543000 15.67000 0.5280000 -0.2260000     0.6966000 
1 1 1 6  35 23 o 4.114000 0.9208000 2.996000 1.210000  5.231000 1.389000  -2.236000      1.842000  
1 1 1 6  35 25 o 43.38000 0.3672000 43.77000 0.4552000 42.98000 0.5764000 0.7930000      0.7344000 
1 1 1 6  35 27 o 13.23000 0.4240000 13.72000 0.6004000 12.75000 0.5989000 0.9643000      0.8480000 
1 1 1 6  35 29 o 18.56000 0.3379000 18.50000 0.4715000 18.61000 0.4842000 -0.1069000     0.6759000 
1 1 1 6  35 31 o 23.14000 0.3412000 23.64000 0.5092000 22.65000 0.4544000 0.9873000      0.6825000 
1 1 1 6  35 33 o 22.31000 0.4042000 22.54000 0.4389000 22.09000 0.6789000 0.4501000      0.8084000 
1 1 1 6  35 35 o 23.10000 0.3409000 23.21000 0.4341000 22.99000 0.5258000 0.2252000      0.6819000 
1 1 1 6  35 37 o 5.103000 1.028000  5.841000 1.502000  4.364000 1.404000  1.477000       2.056000  
1 1 1 6  35 39 o 24.24000 0.3130000 24.45000 0.4373000 24.02000 0.4480000 0.4327000      0.6261000 
1 1 1 6  35 41 o 17.40000 0.3609000 17.24000 0.5248000 17.56000 0.4956000 -0.3257000     0.7218000 
1 1 1 6  35 43 o 4.648000 0.9210000 5.680000 1.267000  3.615000 1.337000  2.064000       1.842000  
1 1 1 6  35 45 o 5.678000 0.8425000 6.443000 1.069000  4.913000 1.303000  1.529000       1.685000  
1 1 1 6  35 47 o 4.674000 0.9695000 4.840000 1.351000  4.507000 1.391000  0.3338000      1.939000  
1 1 1 6  35 49 o 9.983000 0.5796000 9.905000 0.7319000 10.06000 0.8989000 -0.1546000     1.159000  
1 1 1 6  35 51 o 4.855000 0.9210000 5.848000 1.242000  3.863000 1.360000  1.985000       1.842000  
1 1 1 6  35 53 o 7.901000 0.7003000 7.169000 1.085000  8.632000 0.8857000 -1.462000      1.401000  
1 1 1 6  35 55 o 5.215000 0.9518000 4.868000 1.424000  5.561000 1.263000  -0.6938000     1.904000  
1 1 1 6  36 0  o 46.74000 0.5105000 46.74000 0.5105000 46.74000 0.5105000 0.000000       0.000000  
1 1 1 6  36 2  o 42.60000 0.3405000 42.76000 0.4843000 42.43000 0.4786000 0.3355000      0.6809000 
1 1 1 6  36 4  f 55.06000 0.4085000 54.79000 0.5752000 55.33000 0.5802000 -0.5426000     0.8170000 
1 1 1 6  36 6  o 59.39000 0.5206000 59.25000 0.5513000 59.52000 0.8833000 -0.2669000     1.041000  
1 1 1 6  36 8  o 16.53000 0.3104000 16.46000 0.3893000 16.60000 0.4837000 -0.1412000     0.6209000 
1 1 1 6  36 10 o 32.60000 0.3064000 32.33000 0.3777000 32.86000 0.4826000 -0.5279000     0.6128000 
1 1 1 6  36 12 f 47.43000 0.3979000 46.75000 0.5159000 48.10000 0.6058000 -1.354000      0.7957000 
1 1 1 6  36 14 o 17.92000 0.3286000 18.33000 0.3804000 17.51000 0.5359000 0.8193000      0.6572000 
1 1 1 6  36 16 o 8.753000 0.4963000 8.903000 0.6310000 8.603000 0.7661000 0.3003000      0.9925000 
1 1 1 6  36 18 o 18.75000 0.3196000 18.86000 0.3973000 18.65000 0.5007000 0.2110000      0.6392000 
1 1 1 6  36 20 o 17.06000 0.3401000 17.24000 0.4360000 16.88000 0.5221000 0.3612000      0.6802000 
1 1 1 6  36 22 o 36.98000 0.3768000 37.64000 0.4203000 36.33000 0.6256000 1.311000       0.7537000 
1 1 1 6  36 24 o 16.93000 0.3670000 17.25000 0.4941000 16.60000 0.5429000 0.6416000      0.7340000 
1 1 1 6  36 26 o 7.735000 0.6443000 7.544000 0.9081000 7.926000 0.9143000 -0.3820000     1.289000  
1 1 1 6  36 28 f 8.968000 0.5532000 9.203000 0.7202000 8.732000 0.8398000 0.4712000      1.106000  
1 1 1 6  36 30 o 17.35000 0.4158000 16.85000 0.6637000 17.84000 0.5011000 -0.9869000     0.8316000 
1 1 1 6  36 32 o 5.880000 1.048000  5.414000 1.354000  6.346000 1.599000  -0.9317000     2.096000  
1 1 1 6  36 34 o 4.522000 0.9190000 3.891000 1.331000  5.154000 1.268000  -1.263000      1.838000  
1 1 1 6  36 36 o 18.57000 0.3770000 18.23000 0.5409000 18.91000 0.5254000 -0.6777000     0.7541000 
1 1 1 6  36 38 o 14.55000 0.3757000 14.89000 0.5328000 14.21000 0.5298000 0.6779000      0.7514000 
1 1 1 6  36 40 o 7.472000 0.6443000 6.840000 1.054000  8.104000 0.7412000 -1.264000      1.289000  
1 1 1 6  36 42 o 4.136000 0.9675000 4.104000 1.389000  4.169000 1.347000  -0.6439000E-01 1.935000  
1 1 1 6  36 44 o 4.259000 0.9317000 3.649000 1.370000  4.870000 1.263000  -1.221000      1.863000  
1 1 1 6  36 46 o 6.564000 0.8741000 6.666000 1.156000  6.462000 1.311000  0.2038000      1.748000  
1 1 1 6  36 48 o 3.166000 0.9740000 3.398000 1.440000  2.934000 1.312000  0.4642000      1.948000  
1 1 1 6  36 50 o 3.544000 0.9698000 2.754000 1.253000  4.334000 1.480000  -1.580000      1.940000  
1 1 1 6  36 52 o 4.729000 0.9454000 5.516000 1.311000  3.942000 1.362000  1.574000       1.891000  
1 1 1 6  36 54 o 3.190000 0.9157000 2.941000 1.235000  3.438000 1.353000  -0.4973000     1.831000  
1 1 1 6  37 1  o 11.29000 0.3743000 11.54000 0.5147000 11.04000 0.5436000 0.4961000      0.7486000 
1 1 1 6  37 3  o 23.74000 0.2800000 23.84000 0.3944000 23.64000 0.3976000 0.1963000      0.5601000 
1 1 1 6  37 5  o 43.23000 0.3766000 42.86000 0.4907000 43.60000 0.5715000 -0.7358000     0.7532000 
1 1 1 6  37 7  o 32.45000 0.3438000 32.28000 0.4849000 32.62000 0.4875000 -0.3480000     0.6876000 
1 1 1 6  37 9  o 13.18000 0.3572000 13.00000 0.4471000 13.36000 0.5573000 -0.3559000     0.7145000 
1 1 1 6  37 11 o 58.64000 0.4689000 58.16000 0.6104000 59.13000 0.7121000 -0.9659000     0.9379000 
1 1 1 6  37 13 o 51.94000 0.4601000 52.47000 0.5041000 51.41000 0.7699000 1.057000       0.9203000 
1 1 1 6  37 15 o 42.05000 0.3734000 41.58000 0.4920000 42.53000 0.5617000 -0.9427000     0.7467000 
1 1 1 6  37 17 o 44.18000 0.3666000 44.66000 0.4590000 43.70000 0.5719000 0.9618000      0.7333000 
1 1 1 6  37 19 o 18.17000 0.3381000 18.19000 0.4438000 18.15000 0.5101000 0.3708000E-01  0.6761000 
1 1 1 6  37 21 o 28.99000 0.3128000 29.12000 0.3826000 28.86000 0.4950000 0.2591000      0.6256000 
1 1 1 6  37 23 o 18.15000 0.3510000 18.95000 0.4420000 17.35000 0.5453000 1.604000       0.7019000 
1 1 1 6  37 25 o 20.31000 0.3679000 20.30000 0.4143000 20.32000 0.6081000 -0.1308000E-01 0.7358000 
1 1 1 6  37 27 o 26.49000 0.3353000 27.00000 0.4467000 25.99000 0.5003000 1.011000       0.6707000 
1 1 1 6  37 29 o 18.00000 0.3580000 17.57000 0.5196000 18.44000 0.4927000 -0.8711000     0.7161000 
1 1 1 6  37 31 o 12.74000 0.5258000 12.79000 0.5682000 12.68000 0.8848000 0.1069000      1.052000  
1 1 1 6  37 33 o 12.82000 0.3856000 12.80000 0.5366000 12.83000 0.5539000 -0.3404000E-01 0.7712000 
1 1 1 6  37 35 o 19.50000 0.3936000 19.42000 0.4555000 19.58000 0.6419000 -0.1532000     0.7871000 
1 1 1 6  37 37 o 8.072000 0.5503000 7.756000 0.8147000 8.388000 0.7400000 -0.6326000     1.101000  
1 1 1 6  37 39 o 11.36000 0.4485000 11.49000 0.6988000 11.23000 0.5623000 0.2642000      0.8969000 
1 1 1 6  37 41 o 4.081000 0.9388000 4.785000 1.364000  3.376000 1.290000  1.409000       1.878000  
1 1 1 6  37 43 o 10.99000 0.4696000 11.31000 0.6502000 10.66000 0.6777000 0.6533000      0.9392000 
1 1 1 6  37 45 o 7.484000 0.7846000 8.463000 0.8650000 6.505000 1.309000  1.958000       1.569000  
1 1 1 6  37 47 o 8.300000 0.9021000 8.742000 1.241000  7.857000 1.310000  0.8851000      1.804000  
1 1 1 6  37 49 o 5.325000 0.9293000 5.967000 1.245000  4.683000 1.380000  1.284000       1.859000  
1 1 1 6  37 51 o 7.364000 0.8185000 8.089000 1.203000  6.640000 1.110000  1.449000       1.637000  
1 1 1 6  37 53 o 8.574000 0.5904000 8.990000 0.8166000 8.157000 0.8528000 0.8330000      1.181000  
1 1 1 6  38 0  o 51.57000 0.5522000 51.57000 0.5522000 51.57000 0.5522000 0.000000       0.000000  
1 1 1 6  38 2  f 33.13000 0.3019000 33.29000 0.4265000 32.97000 0.4275000 0.3208000      0.6038000 
1 1 1 6  38 4  o 51.53000 0.4239000 51.35000 0.6405000 51.71000 0.5555000 -0.3663000     0.8478000 
1 1 1 6  38 6  o 33.96000 0.3166000 34.10000 0.3915000 33.81000 0.4976000 0.2943000      0.6331000 
1 1 1 6  38 8  o 25.59000 0.3431000 25.51000 0.4190000 25.67000 0.5436000 -0.1606000     0.6863000 
1 1 1 6  38 10 o 21.00000 0.3092000 21.15000 0.4096000 20.86000 0.4632000 0.2900000      0.6183000 
1 1 1 6  38 12 o 40.04000 0.3880000 40.22000 0.4276000 39.86000 0.6475000 0.3575000      0.7759000 
1 1 1 6  38 14 o 32.75000 0.3169000 32.39000 0.3901000 33.11000 0.4996000 -0.7226000     0.6339000 
1 1 1 6  38 16 o 28.27000 0.3051000 28.91000 0.3868000 27.63000 0.4720000 1.275000       0.6102000 
1 1 1 6  38 18 o 38.80000 0.3832000 38.73000 0.5477000 38.87000 0.5360000 -0.1451000     0.7664000 
1 1 1 6  38 20 o 16.19000 0.3419000 16.77000 0.4233000 15.61000 0.5369000 1.153000       0.6837000 
1 1 1 6  38 22 o 11.56000 0.4653000 11.65000 0.5878000 11.47000 0.7214000 0.1757000      0.9305000 
1 1 1 6  38 24 o 20.93000 0.3297000 20.51000 0.4063000 21.35000 0.5194000 -0.8368000     0.6595000 
1 1 1 6  38 26 o 20.58000 0.3295000 20.78000 0.4709000 20.38000 0.4611000 0.4032000      0.6590000 
1 1 1 6  38 28 o 11.56000 0.5689000 12.51000 0.8164000 10.60000 0.7925000 1.912000       1.138000  
1 1 1 6  38 30 f 6.053000 0.7660000 7.933000 0.7374000 4.173000 1.343000  3.761000       1.532000  
1 1 1 6  38 32 f 8.716000 0.5698000 8.163000 0.7605000 9.269000 0.8488000 -1.106000      1.140000  
1 1 1 6  38 34 o 21.17000 0.3706000 21.27000 0.4441000 21.07000 0.5934000 0.2032000      0.7412000 
1 1 1 6  38 36 o 17.52000 0.3721000 17.29000 0.5776000 17.76000 0.4693000 -0.4713000     0.7443000 
1 1 1 6  38 38 f 18.32000 0.3579000 18.19000 0.5475000 18.45000 0.4612000 -0.2622000     0.7158000 
1 1 1 6  38 40 o 7.120000 0.6537000 7.434000 0.9070000 6.807000 0.9416000 0.6270000      1.307000  
1 1 1 6  38 42 o 9.900000 0.5103000 9.850000 0.7462000 9.949000 0.6962000 -0.9896000E-01 1.021000  
1 1 1 6  38 44 o 4.277000 1.013000  4.152000 1.371000  4.402000 1.491000  -0.2500000     2.026000  
1 1 1 6  38 46 o 15.09000 0.4703000 15.47000 0.6644000 14.70000 0.6658000 0.7632000      0.9406000 
1 1 1 6  38 48 o 7.505000 0.7734000 8.358000 0.9246000 6.651000 1.240000  1.708000       1.547000  
1 1 1 6  38 50 o 7.315000 0.7503000 7.825000 1.052000  6.806000 1.070000  1.020000       1.501000  
1 1 1 6  38 52 o 6.768000 0.7210000 7.234000 1.001000  6.302000 1.038000  0.9322000      1.442000  
1 1 1 6  39 1  o 28.68000 0.2940000 28.97000 0.4176000 28.38000 0.4140000 0.5897000      0.5880000 
1 1 1 6  39 3  o 25.65000 0.3393000 26.09000 0.4788000 25.20000 0.4809000 0.8899000      0.6786000 
1 1 1 6  39 5  o 27.07000 0.3187000 27.16000 0.4222000 26.98000 0.4776000 0.1820000      0.6374000 
1 1 1 6  39 7  o 26.18000 0.2998000 26.09000 0.3702000 26.27000 0.4716000 -0.1819000     0.5995000 
1 1 1 6  39 9  o 20.75000 0.3513000 20.63000 0.4223000 20.86000 0.5615000 -0.2272000     0.7026000 
1 1 1 6  39 11 o 31.21000 0.3547000 31.08000 0.3896000 31.34000 0.5928000 -0.2566000     0.7094000 
1 1 1 6  39 13 o 12.45000 0.3953000 12.41000 0.5131000 12.50000 0.6016000 -0.9305000E-01 0.7907000 
1 1 1 6  39 15 o 31.24000 0.3234000 31.58000 0.4247000 30.89000 0.4879000 0.6950000      0.6468000 
1 1 1 6  39 17 o 28.32000 0.3086000 27.93000 0.3869000 28.71000 0.4809000 -0.7853000     0.6172000 
1 1 1 6  39 19 o 15.21000 0.3798000 15.47000 0.5111000 14.95000 0.5618000 0.5214000      0.7595000 
1 1 1 6  39 21 o 14.32000 0.3893000 14.69000 0.5060000 13.95000 0.5918000 0.7401000      0.7786000 
1 1 1 6  39 23 o 9.889000 0.5322000 10.80000 0.5779000 8.978000 0.8939000 1.822000       1.064000  
1 1 1 6  39 25 o 3.759000 0.9836000 4.459000 1.444000  3.059000 1.336000  1.400000       1.967000  
1 1 1 6  39 27 o 14.74000 0.4094000 15.00000 0.6031000 14.48000 0.5539000 0.5130000      0.8189000 
1 1 1 6  39 29 o 14.95000 0.3946000 14.68000 0.5094000 15.23000 0.6028000 -0.5547000     0.7892000 
1 1 1 6  39 31 o 8.970000 0.5741000 9.374000 0.6684000 8.566000 0.9336000 0.8074000      1.148000  
1 1 1 6  39 33 o 7.950000 0.6762000 8.511000 0.7132000 7.389000 1.149000  1.122000       1.352000  
1 1 1 6  39 35 o 20.89000 0.3911000 20.94000 0.6365000 20.85000 0.4549000 0.8569000E-01  0.7823000 
1 1 1 6  39 37 o 6.651000 0.6617000 5.656000 1.015000  7.646000 0.8498000 -1.990000      1.323000  
1 1 1 6  39 39 o 9.283000 0.4881000 9.184000 0.6960000 9.382000 0.6845000 -0.1980000     0.9762000 
1 1 1 6  39 41 o 13.43000 0.3931000 13.15000 0.5648000 13.71000 0.5470000 -0.5595000     0.7863000 
1 1 1 6  39 43 o 13.77000 0.4127000 13.84000 0.5445000 13.70000 0.6204000 0.1445000      0.8254000 
1 1 1 6  39 45 o 5.711000 0.8347000 5.912000 1.168000  5.511000 1.192000  0.4006000      1.669000  
1 1 1 6  39 47 o 5.823000 0.9246000 5.489000 1.342000  6.156000 1.272000  -0.6666000     1.849000  
1 1 1 6  39 49 o 5.258000 0.9474000 5.523000 1.227000  4.994000 1.444000  0.5292000      1.895000  
1 1 1 6  39 51 o 4.376000 0.9344000 4.542000 1.344000  4.210000 1.299000  0.3326000      1.869000  
1 1 1 6  39 53 o 3.585000 1.158000  3.006000 1.378000  4.163000 1.861000  -1.157000      2.316000  
1 1 1 6  40 0  o 16.61000 0.4706000 16.61000 0.4706000 16.61000 0.4706000 0.000000       0.000000  
1 1 1 6  40 2  o 15.29000 0.3853000 14.94000 0.6088000 15.65000 0.4725000 -0.7058000     0.7706000 
1 1 1 6  40 4  o 22.50000 0.2996000 22.14000 0.4309000 22.87000 0.4164000 -0.7325000     0.5992000 
1 1 1 6  40 6  o 27.42000 0.3045000 27.17000 0.3756000 27.68000 0.4793000 -0.5074000     0.6090000 
1 1 1 6  40 8  o 12.00000 0.4805000 11.91000 0.5814000 12.10000 0.7652000 -0.1907000     0.9610000 
1 1 1 6  40 10 o 40.91000 0.3524000 41.14000 0.4397000 40.68000 0.5509000 0.4583000      0.7048000 
1 1 1 6  40 12 o 30.99000 0.3145000 30.94000 0.3902000 31.03000 0.4933000 -0.9075000E-01 0.6290000 
1 1 1 6  40 14 o 43.75000 0.3828000 43.78000 0.5008000 43.73000 0.5790000 0.5331000E-01  0.7656000 
1 1 1 6  40 16 o 44.04000 0.3699000 44.39000 0.4618000 43.68000 0.5781000 0.7128000      0.7399000 
1 1 1 6  40 18 f 26.97000 0.3110000 26.59000 0.3861000 27.36000 0.4876000 -0.7685000     0.6219000 
1 1 1 6  40 20 o 11.15000 0.5015000 12.09000 0.6602000 10.22000 0.7552000 1.868000       1.003000  
1 1 1 6  40 22 o 6.183000 0.7721000 5.810000 1.031000  6.555000 1.150000  -0.7450000     1.544000  
1 1 1 6  40 24 o 11.80000 0.5567000 12.59000 0.5410000 11.02000 0.9731000 1.567000       1.113000  
1 1 1 6  40 26 f 13.18000 0.4223000 13.32000 0.6296000 13.04000 0.5630000 0.2756000      0.8446000 
1 1 1 6  40 28 o 14.66000 0.3995000 15.77000 0.4796000 13.55000 0.6391000 2.214000       0.7990000 
1 1 1 6  40 30 o 13.41000 0.4382000 13.53000 0.5362000 13.29000 0.6933000 0.2394000      0.8764000 
1 1 1 6  40 32 o 3.581000 0.9820000 3.458000 1.270000  3.703000 1.498000  -0.2453000     1.964000  
1 1 1 6  40 34 o 9.727000 0.4956000 9.447000 0.7290000 10.01000 0.6718000 -0.5599000     0.9913000 
1 1 1 6  40 36 o 3.124000 0.9447000 3.228000 1.321000  3.020000 1.351000  0.2081000      1.889000  
1 1 1 6  40 38 o 3.164000 0.8611000 3.019000 1.185000  3.309000 1.250000  -0.2900000     1.722000  
1 1 1 6  40 40 o 7.097000 0.6461000 7.027000 0.9598000 7.166000 0.8653000 -0.1384000     1.292000  
1 1 1 6  40 42 o 6.530000 0.7225000 6.058000 1.028000  7.003000 1.016000  -0.9446000     1.445000  
1 1 1 6  40 44 o 4.958000 0.9181000 4.212000 1.402000  5.705000 1.186000  -1.493000      1.836000  
1 1 1 6  40 46 o 2.780000 0.8579000 2.359000 1.124000  3.200000 1.296000  -0.8407000     1.716000  
1 1 1 6  40 48 o 3.890000 1.042000  3.751000 1.456000  4.029000 1.491000  -0.2786000     2.084000  
1 1 1 6  40 50 o 3.964000 1.017000  4.556000 1.526000  3.373000 1.345000  1.183000       2.034000  
1 1 1 6  40 52 o 3.345000 0.9880000 2.887000 1.298000  3.803000 1.490000  -0.9157000     1.976000  
1 1 1 6  41 1  o 19.49000 0.3528000 19.16000 0.5440000 19.82000 0.4492000 -0.6580000     0.7055000 
1 1 1 6  41 3  o 36.41000 0.3469000 36.72000 0.4581000 36.09000 0.5212000 0.6220000      0.6939000 
1 1 1 6  41 5  o 4.794000 0.9498000 5.461000 1.096000  4.128000 1.551000  1.332000       1.900000  
1 1 1 6  41 7  f 35.15000 0.3855000 35.41000 0.4592000 34.89000 0.6194000 0.5167000      0.7710000 
1 1 1 6  41 9  o 16.01000 0.3473000 15.65000 0.4394000 16.36000 0.5380000 -0.7106000     0.6946000 
1 1 1 6  41 11 o 20.86000 0.3295000 20.82000 0.4102000 20.89000 0.5157000 -0.7090000E-01 0.6589000 
1 1 1 6  41 13 o 23.64000 0.3257000 23.62000 0.4277000 23.66000 0.4913000 -0.3848000E-01 0.6514000 
1 1 1 6  41 15 o 31.24000 0.3171000 31.63000 0.3960000 30.84000 0.4955000 0.7929000      0.6343000 
1 1 1 6  41 17 o 9.375000 0.5243000 9.146000 0.7075000 9.604000 0.7740000 -0.4577000     1.049000  
1 1 1 6  41 19 o 8.759000 0.5778000 9.082000 0.7829000 8.436000 0.8500000 0.6464000      1.156000  
1 1 1 6  41 21 o 20.58000 0.4128000 20.94000 0.4601000 20.23000 0.6854000 0.7096000      0.8255000 
1 1 1 6  41 23 o 14.05000 0.4212000 14.25000 0.5862000 13.85000 0.6050000 0.4023000      0.8424000 
1 1 1 6  41 25 o 15.51000 0.3749000 16.12000 0.4702000 14.91000 0.5842000 1.216000       0.7499000 
1 1 1 6  41 27 o 13.63000 0.4267000 13.81000 0.5323000 13.45000 0.6671000 0.3591000      0.8534000 
1 1 1 6  41 29 o 6.405000 0.7622000 6.347000 0.9438000 6.463000 1.197000  -0.1151000     1.524000  
1 1 1 6  41 31 o 21.74000 0.3847000 21.94000 0.4330000 21.54000 0.6360000 0.3989000      0.7694000 
1 1 1 6  41 33 o 14.05000 0.4043000 13.63000 0.6089000 14.47000 0.5319000 -0.8365000     0.8085000 
1 1 1 6  41 35 o 3.589000 0.9154000 3.832000 1.302000  3.347000 1.287000  0.4848000      1.831000  
1 1 1 6  41 37 o 5.928000 0.7562000 5.732000 1.117000  6.124000 1.020000  -0.3919000     1.512000  
1 1 1 6  41 39 o 9.707000 0.5808000 9.779000 0.7002000 9.635000 0.9268000 0.1437000      1.162000  
1 1 1 6  41 41 o 11.63000 0.4549000 11.98000 0.6000000 11.28000 0.6839000 0.6962000      0.9098000 
1 1 1 6  41 43 o 4.422000 1.005000  3.505000 1.358000  5.339000 1.482000  -1.834000      2.010000  
1 1 1 6  41 45 o 5.475000 0.9791000 5.279000 1.581000  5.671000 1.156000  -0.3915000     1.958000  
1 1 1 6  41 47 o 4.747000 0.9468000 3.541000 1.401000  5.953000 1.274000  -2.413000      1.894000  
1 1 1 6  41 49 o 3.534000 0.9329000 2.742000 1.236000  4.326000 1.398000  -1.584000      1.866000  
1 1 1 6  41 51 o 3.802000 1.030000  4.057000 1.454000  3.548000 1.458000  0.5086000      2.060000  
1 1 1 6  42 0  o 30.03000 0.5148000 30.03000 0.5148000 30.03000 0.5148000 0.000000       0.000000  
1 1 1 6  42 2  o 5.644000 0.9050000 5.567000 1.219000  5.721000 1.338000  -0.1543000     1.810000  
1 1 1 6  42 4  o 19.23000 0.3432000 19.96000 0.4561000 18.51000 0.5130000 1.453000       0.6864000 
1 1 1 6  42 6  o 17.99000 0.3476000 17.64000 0.4699000 18.33000 0.5123000 -0.6900000     0.6952000 
1 1 1 6  42 8  o 19.61000 0.3427000 20.03000 0.4598000 19.19000 0.5082000 0.8397000      0.6853000 
1 1 1 6  42 10 o 51.13000 0.4271000 50.81000 0.5554000 51.45000 0.6490000 -0.6393000     0.8542000 
1 1 1 6  42 12 o 39.73000 0.3668000 39.43000 0.4741000 40.03000 0.5598000 -0.5986000     0.7336000 
1 1 1 6  42 14 o 28.15000 0.3190000 28.34000 0.3979000 27.96000 0.4987000 0.3853000      0.6380000 
1 1 1 6  42 16 f 41.11000 0.3575000 41.17000 0.4449000 41.05000 0.5598000 0.1183000      0.7151000 
1 1 1 6  42 18 o 9.010000 0.5998000 9.091000 0.8691000 8.929000 0.8269000 0.1618000      1.200000  
1 1 1 6  42 20 f 4.266000 0.9239000 4.321000 1.225000  4.212000 1.384000  0.1093000      1.848000  
1 1 1 6  42 22 o 13.81000 0.4624000 14.13000 0.6904000 13.49000 0.6153000 0.6348000      0.9248000 
1 1 1 6  42 24 o 9.530000 0.4967000 9.178000 0.6176000 9.883000 0.7780000 -0.7047000     0.9934000 
1 1 1 6  42 26 o 15.88000 0.3714000 15.71000 0.4762000 16.04000 0.5701000 -0.3343000     0.7429000 
1 1 1 6  42 28 o 26.46000 0.3465000 26.97000 0.4247000 25.94000 0.5476000 1.031000       0.6929000 
1 1 1 6  42 30 o 12.14000 0.4790000 12.40000 0.5185000 11.88000 0.8055000 0.5132000      0.9580000 
1 1 1 6  42 32 o 22.81000 0.3385000 23.23000 0.5104000 22.38000 0.4447000 0.8433000      0.6769000 
1 1 1 6  42 34 o 7.378000 0.6999000 6.860000 1.127000  7.896000 0.8304000 -1.036000      1.400000  
1 1 1 6  42 36 o 4.697000 0.8831000 4.071000 1.304000  5.323000 1.191000  -1.252000      1.766000  
1 1 1 6  42 38 o 4.721000 0.8760000 4.232000 1.258000  5.210000 1.219000  -0.9780000     1.752000  
1 1 1 6  42 40 o 3.926000 0.9553000 3.031000 1.265000  4.820000 1.432000  -1.789000      1.911000  
1 1 1 6  42 42 o 4.736000 0.9862000 4.208000 1.394000  5.264000 1.396000  -1.056000      1.972000  
1 1 1 6  42 44 o 4.064000 1.040000  4.305000 1.549000  3.824000 1.388000  0.4813000      2.080000  
1 1 1 6  42 46 o 4.824000 0.9192000 5.770000 1.279000  3.878000 1.320000  1.892000       1.838000  
1 1 1 6  42 48 f 3.865000 1.021000  3.900000 1.392000  3.830000 1.494000  0.6950000E-01  2.042000  
1 1 1 6  42 50 o 5.252000 1.006000  5.643000 1.467000  4.860000 1.376000  0.7825000      2.012000  
1 1 1 6  43 1  o 20.98000 0.4225000 21.32000 0.5134000 20.63000 0.6711000 0.6885000      0.8449000 
1 1 1 6  43 3  o 14.08000 0.4417000 15.47000 0.5138000 12.69000 0.7187000 2.773000       0.8835000 
1 1 1 6  43 5  o 10.37000 0.5037000 10.15000 0.6987000 10.58000 0.7257000 -0.4257000     1.007000  
1 1 1 6  43 7  o 7.192000 0.7258000 8.176000 0.7400000 6.208000 1.249000  1.968000       1.452000  
1 1 1 6  43 9  o 8.640000 0.5810000 9.440000 0.7220000 7.841000 0.9105000 1.599000       1.162000  
1 1 1 6  43 11 o 24.19000 0.3169000 24.53000 0.4000000 23.85000 0.4916000 0.6812000      0.6338000 
1 1 1 6  43 13 o 35.34000 0.3407000 34.60000 0.4137000 36.09000 0.5414000 -1.492000      0.6814000 
1 1 1 6  43 15 o 3.400000 0.8883000 3.850000 1.241000  2.950000 1.272000  0.8999000      1.777000  
1 1 1 6  43 17 o 22.36000 0.3897000 21.74000 0.4350000 22.99000 0.6468000 -1.257000      0.7795000 
1 1 1 6  43 19 o 17.34000 0.3507000 17.43000 0.4797000 17.24000 0.5117000 0.1942000      0.7014000 
1 1 1 6  43 21 o 6.579000 0.7921000 7.177000 1.077000  5.982000 1.162000  1.195000       1.584000  
1 1 1 6  43 23 o 12.16000 0.3965000 11.47000 0.5166000 12.84000 0.6016000 -1.368000      0.7930000 
1 1 1 6  43 25 o 5.435000 0.9112000 4.515000 1.115000  6.355000 1.441000  -1.840000      1.822000  
1 1 1 6  43 27 o 11.85000 0.3782000 12.34000 0.5364000 11.37000 0.5333000 0.9706000      0.7564000 
1 1 1 6  43 29 o 21.36000 0.5075000 21.55000 0.4355000 21.17000 0.9167000 0.3717000      1.015000  
1 1 1 6  43 31 o 15.16000 0.3649000 14.83000 0.5030000 15.49000 0.5289000 -0.6607000     0.7299000 
1 1 1 6  43 33 o 6.690000 0.7147000 6.875000 1.012000  6.505000 1.009000  0.3703000      1.429000  
1 1 1 6  43 35 o 6.339000 0.7983000 6.264000 1.199000  6.414000 1.054000  -0.1508000     1.597000  
1 1 1 6  43 37 o 13.42000 0.3892000 13.26000 0.5563000 13.58000 0.5445000 -0.3253000     0.7784000 
1 1 1 6  43 39 o 3.220000 0.9152000 3.021000 1.216000  3.419000 1.368000  -0.3980000     1.830000  
1 1 1 6  43 41 o 3.132000 0.8848000 3.107000 1.219000  3.158000 1.282000  -0.5045000E-01 1.770000  
1 1 1 6  43 43 o 3.720000 0.9625000 3.618000 1.407000  3.823000 1.314000  -0.2049000     1.925000  
1 1 1 6  43 45 f 3.685000 0.9501000 3.914000 1.293000  3.457000 1.393000  0.4576000      1.900000  
1 1 1 6  43 47 o 3.612000 1.060000  3.861000 1.378000  3.362000 1.612000  0.4987000      2.121000  
1 1 1 6  43 49 o 4.482000 0.9828000 4.321000 1.327000  4.643000 1.450000  -0.3221000     1.966000  
1 1 1 6  44 0  o 30.00000 0.4524000 30.00000 0.4524000 30.00000 0.4524000 0.000000       0.000000  
1 1 1 6  44 2  o 10.56000 0.5743000 10.64000 0.7733000 10.48000 0.8493000 0.1661000      1.149000  
1 1 1 6  44 4  o 10.20000 0.5683000 10.71000 0.7423000 9.685000 0.8606000 1.022000       1.137000  
1 1 1 6  44 6  o 12.91000 0.4592000 12.78000 0.6474000 13.05000 0.6513000 -0.2699000     0.9183000 
1 1 1 6  44 8  o 7.916000 0.6067000 7.557000 0.8142000 8.276000 0.8997000 -0.7191000     1.213000  
1 1 1 6  44 10 o 7.087000 0.6467000 6.613000 0.8660000 7.561000 0.9607000 -0.9480000     1.293000  
1 1 1 6  44 12 o 9.834000 0.6543000 11.17000 0.6653000 8.494000 1.127000  2.680000       1.309000  
1 1 1 6  44 14 o 8.392000 0.7890000 7.913000 0.9209000 8.871000 1.281000  -0.9573000     1.578000  
1 1 1 6  44 16 o 13.81000 0.4124000 13.95000 0.6066000 13.67000 0.5589000 0.2789000      0.8249000 
1 1 1 6  44 18 o 11.63000 0.4371000 11.70000 0.5980000 11.57000 0.6376000 0.1332000      0.8742000 
1 1 1 6  44 20 o 21.71000 0.3188000 21.62000 0.4316000 21.80000 0.4694000 -0.1821000     0.6377000 
1 1 1 6  44 22 o 17.85000 0.3309000 18.40000 0.4123000 17.30000 0.5175000 1.107000       0.6617000 
1 1 1 6  44 24 o 5.680000 0.8748000 6.297000 0.8216000 5.062000 1.545000  1.235000       1.750000  
1 1 1 6  44 26 o 16.17000 0.4270000 15.78000 0.4770000 16.57000 0.7084000 -0.7862000     0.8540000 
1 1 1 6  44 28 o 6.391000 1.015000  6.629000 0.9048000 6.153000 1.818000  0.4759000      2.031000  
1 1 1 6  44 30 o 5.664000 0.8143000 5.995000 1.028000  5.333000 1.263000  0.6623000      1.629000  
1 1 1 6  44 32 o 10.45000 0.4655000 11.05000 0.5928000 9.854000 0.7178000 1.196000       0.9309000 
1 1 1 6  44 34 o 4.704000 1.026000  4.204000 1.598000  5.205000 1.288000  -1.001000      2.053000  
1 1 1 6  44 36 o 9.127000 0.5549000 9.033000 0.8302000 9.221000 0.7366000 -0.1876000     1.110000  
1 1 1 6  44 38 o 9.456000 0.5575000 10.03000 0.8022000 8.881000 0.7744000 1.149000       1.115000  
1 1 1 6  44 40 o 7.190000 0.6730000 7.139000 0.9598000 7.242000 0.9435000 -0.1028000     1.346000  
1 1 1 6  44 42 o 3.398000 0.8937000 2.838000 1.213000  3.958000 1.313000  -1.120000      1.787000  
1 1 1 6  44 44 o 4.790000 0.8984000 4.898000 1.280000  4.682000 1.260000  0.2158000      1.797000  
1 1 1 6  44 46 o 4.342000 1.063000  3.126000 1.315000  5.557000 1.672000  -2.431000      2.127000  
1 1 1 6  44 48 o 4.935000 0.9883000 3.957000 1.422000  5.913000 1.373000  -1.956000      1.977000  
1 1 1 6  45 1  f 28.19000 0.3428000 27.62000 0.4421000 28.77000 0.5239000 -1.147000      0.6856000 
1 1 1 6  45 3  o 4.179000 0.9253000 3.326000 1.307000  5.031000 1.310000  -1.705000      1.851000  
1 1 1 6  45 5  o 4.167000 1.041000  4.225000 1.282000  4.108000 1.640000  0.1164000      2.081000  
1 1 1 6  45 7  o 25.84000 0.3957000 25.82000 0.4435000 25.85000 0.6553000 -0.3739000E-01 0.7913000 
1 1 1 6  45 9  o 21.07000 0.3378000 20.51000 0.4596000 21.63000 0.4952000 -1.121000      0.6757000 
1 1 1 6  45 11 o 11.74000 0.5655000 12.85000 0.6859000 10.63000 0.8993000 2.216000       1.131000  
1 1 1 6  45 13 o 14.66000 0.3911000 14.62000 0.5317000 14.70000 0.5738000 -0.8218000E-01 0.7823000 
1 1 1 6  45 15 o 9.981000 0.4679000 9.520000 0.5713000 10.44000 0.7411000 -0.9231000     0.9357000 
1 1 1 6  45 17 o 8.574000 0.5035000 8.721000 0.6367000 8.428000 0.7801000 0.2927000      1.007000  
1 1 1 6  45 19 o 9.733000 0.4788000 9.701000 0.6509000 9.765000 0.7023000 -0.6363000E-01 0.9575000 
1 1 1 6  45 21 o 18.10000 0.3393000 18.33000 0.4492000 17.87000 0.5087000 0.4578000      0.6786000 
1 1 1 6  45 23 o 10.91000 0.4781000 10.97000 0.5177000 10.86000 0.8040000 0.1083000      0.9563000 
1 1 1 6  45 25 o 11.97000 0.5927000 11.63000 0.4753000 12.31000 1.086000  -0.6714000     1.185000  
1 1 1 6  45 27 o 10.09000 0.5959000 10.58000 0.5909000 9.605000 1.035000  0.9745000      1.192000  
1 1 1 6  45 29 o 18.49000 0.3281000 18.84000 0.4329000 18.14000 0.4932000 0.6939000      0.6563000 
1 1 1 6  45 31 o 7.001000 0.6481000 6.992000 0.8544000 7.010000 0.9748000 -0.1838000E-01 1.296000  
1 1 1 6  45 33 o 7.319000 0.8222000 6.997000 1.360000  7.640000 0.9244000 -0.6433000     1.644000  
1 1 1 6  45 35 o 15.05000 0.4275000 14.83000 0.5850000 15.27000 0.6235000 -0.4378000     0.8550000 
1 1 1 6  45 37 o 11.75000 0.4491000 11.50000 0.6622000 12.00000 0.6068000 -0.5047000     0.8981000 
1 1 1 6  45 39 o 7.287000 0.7167000 5.952000 1.165000  8.621000 0.8356000 -2.669000      1.433000  
1 1 1 6  45 41 o 3.588000 0.8675000 2.634000 1.178000  4.542000 1.274000  -1.908000      1.735000  
1 1 1 6  45 43 f 3.223000 0.8820000 3.784000 1.299000  2.661000 1.193000  1.123000       1.764000  
1 1 1 6  45 45 o 4.905000 0.9406000 5.289000 1.259000  4.520000 1.398000  0.7693000      1.881000  
1 1 1 6  45 47 o 4.184000 1.120000  3.689000 1.614000  4.680000 1.552000  -0.9908000     2.239000  
1 1 1 6  46 0  o 8.134000 0.9878000 8.134000 0.9878000 8.134000 0.9878000 0.000000       0.000000  
1 1 1 6  46 2  o 10.88000 0.4828000 11.20000 0.6948000 10.57000 0.6706000 0.6333000      0.9656000 
1 1 1 6  46 4  o 15.29000 0.3773000 15.12000 0.5571000 15.46000 0.5089000 -0.3357000     0.7545000 
1 1 1 6  46 6  o 32.96000 0.3877000 32.34000 0.4031000 33.58000 0.6623000 -1.238000      0.7753000 
1 1 1 6  46 8  o 19.59000 0.4044000 19.41000 0.4529000 19.76000 0.6701000 -0.3462000     0.8088000 
1 1 1 6  46 10 o 6.029000 0.7610000 7.411000 0.7657000 4.647000 1.315000  2.764000       1.522000  
1 1 1 6  46 12 o 5.505000 0.7705000 5.642000 0.9806000 5.369000 1.189000  0.2734000      1.541000  
1 1 1 6  46 14 o 24.59000 0.3563000 24.86000 0.4393000 24.31000 0.5611000 0.5529000      0.7126000 
1 1 1 6  46 16 f 8.099000 0.5445000 8.336000 0.6561000 7.862000 0.8692000 0.4735000      1.089000  
1 1 1 6  46 18 o 5.079000 0.7889000 4.003000 1.107000  6.154000 1.125000  -2.151000      1.578000  
1 1 1 6  46 20 o 6.660000 0.6447000 6.605000 0.8090000 6.715000 1.004000  -0.1092000     1.289000  
1 1 1 6  46 22 o 12.72000 0.4889000 13.19000 0.4671000 12.25000 0.8590000 0.9400000      0.9778000 
1 1 1 6  46 24 o 19.64000 0.4912000 19.32000 0.3966000 19.96000 0.8987000 -0.6415000     0.9824000 
1 1 1 6  46 26 o 13.19000 0.4156000 12.77000 0.5110000 13.61000 0.6556000 -0.8381000     0.8313000 
1 1 1 6  46 28 o 11.65000 0.4172000 11.91000 0.5671000 11.39000 0.6121000 0.5106000      0.8344000 
1 1 1 6  46 30 o 7.289000 0.6096000 7.424000 0.8460000 7.154000 0.8779000 0.2700000      1.219000  
1 1 1 6  46 32 o 10.11000 0.5892000 10.09000 0.9559000 10.13000 0.6891000 -0.4573000E-01 1.178000  
1 1 1 6  46 34 o 10.22000 0.5314000 10.17000 0.7623000 10.26000 0.7406000 -0.8160000E-01 1.063000  
1 1 1 6  46 36 o 9.282000 0.5168000 10.42000 0.6876000 8.145000 0.7717000 2.274000       1.034000  
1 1 1 6  46 38 o 7.261000 0.6554000 6.956000 0.9416000 7.565000 0.9120000 -0.6095000     1.311000  
1 1 1 6  46 40 o 11.62000 0.4691000 11.52000 0.7125000 11.71000 0.6103000 -0.1921000     0.9382000 
1 1 1 6  46 42 o 4.792000 0.8640000 4.789000 1.101000  4.794000 1.332000  -0.4908000E-02 1.728000  
1 1 1 6  46 44 o 4.535000 0.8431000 5.836000 1.061000  3.234000 1.311000  2.603000       1.686000  
1 1 1 6  46 46 o 4.443000 1.640000  4.443000 1.640000  ?        ?         ?              ?         
1 1 1 6  47 1  o 16.59000 0.4414000 16.30000 0.6785000 16.89000 0.5649000 -0.5819000     0.8829000 
1 1 1 6  47 3  o 16.55000 0.3681000 16.47000 0.4940000 16.64000 0.5458000 -0.1684000     0.7362000 
1 1 1 6  47 5  o 22.71000 0.3901000 23.30000 0.4374000 22.12000 0.6460000 1.174000       0.7801000 
1 1 1 6  47 7  o 8.141000 0.5825000 7.828000 0.7344000 8.455000 0.9044000 -0.6271000     1.165000  
1 1 1 6  47 9  o 4.998000 0.9736000 4.356000 1.216000  5.640000 1.521000  -1.285000      1.947000  
1 1 1 6  47 11 o 4.787000 0.9127000 5.474000 1.021000  4.101000 1.513000  1.373000       1.825000  
1 1 1 6  47 13 o 11.27000 0.5170000 11.59000 0.5258000 10.95000 0.8904000 0.6385000      1.034000  
1 1 1 6  47 15 o 17.38000 0.3214000 17.01000 0.4132000 17.75000 0.4924000 -0.7365000     0.6428000 
1 1 1 6  47 17 f 33.99000 0.3449000 34.17000 0.4522000 33.81000 0.5210000 0.3569000      0.6899000 
1 1 1 6  47 19 o 26.77000 0.4847000 27.56000 0.3796000 25.98000 0.8920000 1.571000       0.9695000 
1 1 1 6  47 21 o 7.154000 0.9992000 6.794000 0.7979000 7.514000 1.832000  -0.7197000     1.998000  
1 1 1 6  47 23 o 7.120000 0.7373000 8.091000 0.6495000 6.149000 1.324000  1.941000       1.475000  
1 1 1 6  47 25 o 13.78000 0.4446000 13.44000 0.4917000 14.11000 0.7408000 -0.6669000     0.8891000 
1 1 1 6  47 27 o 13.32000 0.3727000 13.53000 0.5151000 13.10000 0.5389000 0.4322000      0.7454000 
1 1 1 6  47 29 o 2.949000 0.8753000 2.952000 1.254000  2.946000 1.222000  0.5859000E-02  1.751000  
1 1 1 6  47 31 o 12.48000 0.6730000 11.53000 1.226000  13.43000 0.5550000 -1.902000      1.346000  
1 1 1 6  47 33 o 6.714000 0.6389000 6.226000 0.8577000 7.203000 0.9472000 -0.9763000     1.278000  
1 1 1 6  47 35 o 4.651000 0.8945000 5.011000 1.213000  4.291000 1.315000  0.7199000      1.789000  
1 1 1 6  47 37 o 6.162000 0.7890000 5.916000 1.167000  6.408000 1.062000  -0.4919000     1.578000  
1 1 1 6  47 39 o 9.898000 0.5360000 8.969000 0.8200000 10.83000 0.6906000 -1.858000      1.072000  
1 1 1 6  47 41 o 5.075000 0.8616000 3.525000 1.350000  6.625000 1.071000  -3.100000      1.723000  
1 1 1 6  47 43 o 6.344000 0.8023000 6.410000 1.227000  6.278000 1.034000  0.1327000      1.605000  
1 1 1 6  48 0  o 6.952000 0.9792000 6.952000 0.9792000 6.952000 0.9792000 0.000000       0.000000  
1 1 1 6  48 2  o 13.85000 0.4331000 14.22000 0.5795000 13.49000 0.6439000 0.7224000      0.8663000 
1 1 1 6  48 4  o 17.44000 0.4223000 16.87000 0.6017000 18.00000 0.5927000 -1.124000      0.8446000 
1 1 1 6  48 6  o 11.73000 0.4440000 11.63000 0.5060000 11.83000 0.7297000 -0.1948000     0.8880000 
1 1 1 6  48 8  o 14.06000 0.3890000 13.93000 0.4646000 14.19000 0.6239000 -0.2560000     0.7779000 
1 1 1 6  48 10 o 9.403000 0.5053000 9.126000 0.6231000 9.681000 0.7957000 -0.5557000     1.011000  
1 1 1 6  48 12 o 6.156000 0.9663000 7.269000 0.8193000 5.043000 1.750000  2.227000       1.933000  
1 1 1 6  48 14 o 6.079000 0.9573000 4.474000 1.163000  7.685000 1.521000  -3.212000      1.915000  
1 1 1 6  48 16 f 17.33000 0.5077000 17.05000 0.4047000 17.61000 0.9313000 -0.5658000     1.015000  
1 1 1 6  48 18 o 5.083000 1.092000  5.083000 1.092000  ?        ?         ?              ?         
1 1 1 6  48 20 o 8.120000 0.9456000 8.534000 0.6609000 7.707000 1.772000  0.8269000      1.891000  
1 1 1 6  48 22 o 9.930000 0.5494000 9.578000 0.5460000 10.28000 0.9536000 -0.7025000     1.099000  
1 1 1 6  48 24 o 8.434000 0.5467000 8.484000 0.6435000 8.385000 0.8840000 0.9882000E-01  1.093000  
1 1 1 6  48 26 o 4.085000 0.8530000 4.851000 1.153000  3.318000 1.257000  1.533000       1.706000  
1 1 1 6  48 28 o 8.102000 0.6273000 7.699000 0.9285000 8.505000 0.8439000 -0.8059000     1.255000  
1 1 1 6  48 30 o 9.901000 0.5028000 9.797000 0.7192000 10.00000 0.7030000 -0.2070000     1.006000  
1 1 1 6  48 32 o 7.159000 0.7127000 7.852000 0.9398000 6.467000 1.072000  1.385000       1.425000  
1 1 1 6  48 34 o 4.465000 0.9606000 3.310000 1.261000  5.621000 1.449000  -2.311000      1.921000  
1 1 1 6  48 36 o 3.204000 0.8718000 3.889000 1.312000  2.519000 1.148000  1.370000       1.744000  
1 1 1 6  48 38 o 7.500000 0.6933000 7.511000 0.9404000 7.489000 1.019000  0.2255000E-01  1.387000  
1 1 1 6  48 40 o 3.884000 0.9872000 3.880000 1.468000  3.889000 1.320000  -0.8789000E-02 1.974000  
1 1 1 6  48 42 o 3.208000 0.9314000 2.906000 1.276000  3.511000 1.357000  -0.6055000     1.863000  
1 1 1 6  49 1  o 15.83000 0.3956000 15.48000 0.6060000 16.18000 0.5086000 -0.7033000     0.7911000 
1 1 1 6  49 3  o 11.31000 0.4053000 11.04000 0.5881000 11.58000 0.5580000 -0.5435000     0.8107000 
1 1 1 6  49 5  f 17.26000 0.3435000 17.60000 0.4590000 16.93000 0.5111000 0.6667000      0.6869000 
1 1 1 6  49 7  o 10.01000 0.4548000 10.23000 0.5577000 9.788000 0.7186000 0.4419000      0.9096000 
1 1 1 6  49 9  f 9.579000 0.4856000 9.106000 0.6039000 10.05000 0.7607000 -0.9461000     0.9712000 
1 1 1 6  49 11 o 3.557000 0.8978000 2.760000 1.156000  4.354000 1.374000  -1.593000      1.796000  
1 1 1 6  49 13 o 5.521000 0.7932000 5.068000 0.9587000 5.973000 1.264000  -0.9042000     1.586000  
1 1 1 6  49 15 o 13.87000 0.3633000 14.23000 0.4373000 13.51000 0.5802000 0.7239000      0.7265000 
1 1 1 6  49 17 o 8.158000 1.078000  8.684000 0.6243000 7.631000 2.064000  1.053000       2.157000  
1 1 1 6  49 19 o 9.974000 0.4696000 10.25000 0.5701000 9.695000 0.7465000 0.5578000      0.9393000 
1 1 1 6  49 21 o 11.81000 0.4478000 11.23000 0.5891000 12.39000 0.6745000 -1.162000      0.8955000 
1 1 1 6  49 23 o 5.891000 0.7253000 6.452000 0.8438000 5.330000 1.180000  1.122000       1.451000  
1 1 1 6  49 25 o 7.961000 0.5676000 9.341000 0.6586000 6.580000 0.9246000 2.762000       1.135000  
1 1 1 6  49 27 o 14.43000 0.4647000 14.16000 0.7767000 14.70000 0.5103000 -0.5343000     0.9293000 
1 1 1 6  49 29 o 5.513000 0.8540000 6.582000 1.105000  4.445000 1.302000  2.137000       1.708000  
1 1 1 6  49 31 o 4.079000 0.9601000 4.069000 1.356000  4.088000 1.359000  -0.1934000E-01 1.920000  
1 1 1 6  49 33 o 5.057000 0.8564000 6.191000 0.9583000 3.924000 1.420000  2.267000       1.713000  
1 1 1 6  49 35 o 8.203000 0.6063000 8.959000 0.7192000 7.447000 0.9764000 1.511000       1.213000  
1 1 1 6  49 37 o 7.407000 0.6924000 8.040000 0.8651000 6.774000 1.081000  1.267000       1.385000  
1 1 1 6  49 39 o 6.804000 0.8574000 7.869000 1.175000  5.738000 1.249000  2.131000       1.715000  
1 1 1 6  49 41 o 3.087000 0.9260000 3.149000 1.351000  3.025000 1.267000  0.1243000      1.852000  
1 1 1 6  50 0  o 13.41000 0.5483000 13.41000 0.5483000 13.41000 0.5483000 0.000000       0.000000  
1 1 1 6  50 2  o 24.94000 0.3061000 24.30000 0.4270000 25.58000 0.4388000 -1.282000      0.6122000 
1 1 1 6  50 4  o 34.72000 0.3524000 34.28000 0.4709000 35.17000 0.5244000 -0.8900000     0.7048000 
1 1 1 6  50 6  o 17.43000 0.3635000 17.42000 0.5303000 17.44000 0.4972000 -0.2891000E-01 0.7269000 
1 1 1 6  50 8  o 10.42000 0.4696000 10.25000 0.6552000 10.60000 0.6728000 -0.3482000     0.9391000 
1 1 1 6  50 10 f 5.787000 0.7949000 7.077000 0.9011000 4.497000 1.310000  2.580000       1.590000  
1 1 1 6  50 12 o 2.534000 0.7785000 2.361000 1.048000  2.708000 1.152000  -0.3468000     1.557000  
1 1 1 6  50 14 o 2.741000 0.7995000 2.902000 1.128000  2.581000 1.133000  0.3208000      1.599000  
1 1 1 6  50 16 o 3.955000 0.8517000 4.754000 1.068000  3.156000 1.327000  1.598000       1.703000  
1 1 1 6  50 18 o 11.68000 0.4334000 12.31000 0.4992000 11.05000 0.7086000 1.259000       0.8667000 
1 1 1 6  50 20 o 16.47000 0.3518000 16.30000 0.4580000 16.64000 0.5342000 -0.3413000     0.7036000 
1 1 1 6  50 22 o 7.252000 0.5995000 6.889000 0.7842000 7.616000 0.9070000 -0.7269000     1.199000  
1 1 1 6  50 24 f 10.91000 0.5018000 11.57000 0.5951000 10.25000 0.8082000 1.324000       1.004000  
1 1 1 6  50 26 o 11.15000 0.4694000 10.56000 0.7119000 11.74000 0.6119000 -1.181000      0.9388000 
1 1 1 6  50 28 o 7.627000 0.6274000 7.416000 0.9222000 7.839000 0.8510000 -0.4228000     1.255000  
1 1 1 6  50 30 o 11.02000 0.4700000 11.46000 0.6613000 10.59000 0.6680000 0.8640000      0.9400000 
1 1 1 6  50 32 o 7.771000 0.6715000 7.941000 0.7955000 7.601000 1.082000  0.3398000      1.343000  
1 1 1 6  50 34 o 4.496000 0.9458000 4.414000 1.314000  4.578000 1.361000  -0.1636000     1.892000  
1 1 1 6  50 36 o 8.495000 0.6072000 8.767000 0.8201000 8.223000 0.8956000 0.5439000      1.214000  
1 1 1 6  50 38 o 11.73000 0.5435000 12.25000 0.8421000 11.22000 0.6873000 1.031000       1.087000  
1 1 1 6  50 40 o 5.624000 0.8180000 5.595000 1.204000  5.654000 1.107000  -0.5888000E-01 1.636000  
1 1 1 6  51 1  o 9.114000 0.5055000 9.084000 0.6919000 9.144000 0.7371000 -0.5987000E-01 1.011000  
1 1 1 6  51 3  o 20.29000 0.3394000 19.27000 0.4509000 21.32000 0.5074000 -2.049000      0.6788000 
1 1 1 6  51 5  o 12.21000 0.3876000 11.88000 0.5074000 12.55000 0.5861000 -0.6610000     0.7752000 
1 1 1 6  51 7  o 9.604000 0.4820000 9.829000 0.5961000 9.380000 0.7576000 0.4485000      0.9640000 
1 1 1 6  51 9  o 16.28000 0.4220000 16.07000 0.6702000 16.49000 0.5129000 -0.4219000     0.8440000 
1 1 1 6  51 11 o 8.998000 0.5147000 9.297000 0.6794000 8.699000 0.7735000 0.5982000      1.029000  
1 1 1 6  51 13 o 3.474000 0.9088000 2.636000 1.080000  4.312000 1.462000  -1.676000      1.818000  
1 1 1 6  51 15 o 7.946000 0.5424000 7.917000 0.7136000 7.975000 0.8170000 -0.5814000E-01 1.085000  
1 1 1 6  51 17 o 10.06000 0.4660000 10.90000 0.5449000 9.231000 0.7562000 1.667000       0.9321000 
1 1 1 6  51 19 o 5.860000 0.7919000 5.942000 0.9867000 5.777000 1.239000  0.1649000      1.584000  
1 1 1 6  51 21 o 5.495000 0.8447000 6.262000 0.8962000 4.727000 1.432000  1.536000       1.689000  
1 1 1 6  51 23 o 6.763000 0.6553000 6.974000 0.7631000 6.552000 1.066000  0.4222000      1.311000  
1 1 1 6  51 25 o 4.770000 0.8977000 5.002000 1.326000  4.538000 1.211000  0.4642000      1.795000  
1 1 1 6  51 27 o 3.141000 0.9049000 3.428000 1.327000  2.854000 1.230000  0.5735000      1.810000  
1 1 1 6  51 29 o 3.026000 0.8896000 2.797000 1.250000  3.255000 1.266000  -0.4585000     1.779000  
1 1 1 6  51 31 o 6.116000 0.8324000 6.147000 0.9718000 6.086000 1.352000  0.6082000E-01  1.665000  
1 1 1 6  51 33 o 3.105000 0.8875000 3.118000 1.224000  3.092000 1.286000  0.2596000E-01  1.775000  
1 1 1 6  51 35 o 10.49000 0.4803000 10.43000 0.6435000 10.56000 0.7133000 -0.1392000     0.9606000 
1 1 1 6  51 37 o 10.57000 0.5230000 9.649000 0.8375000 11.49000 0.6268000 -1.840000      1.046000  
1 1 1 6  51 39 o 3.505000 0.9712000 3.215000 1.275000  3.795000 1.465000  -0.5807000     1.942000  
1 1 1 6  52 0  o 6.712000 0.9222000 6.712000 0.9222000 6.712000 0.9222000 0.000000       0.000000  
1 1 1 6  52 2  o 3.347000 0.8756000 3.485000 1.218000  3.209000 1.258000  0.2760000      1.751000  
1 1 1 6  52 4  o 4.435000 0.8178000 5.321000 0.9756000 3.550000 1.313000  1.771000       1.636000  
1 1 1 6  52 6  o 8.657000 0.5045000 8.441000 0.6718000 8.873000 0.7528000 -0.4317000     1.009000  
1 1 1 6  52 8  o 2.674000 0.8115000 3.060000 1.226000  2.288000 1.064000  0.7721000      1.623000  
1 1 1 6  52 10 o 6.387000 0.6747000 6.482000 0.8638000 6.293000 1.037000  0.1896000      1.349000  
1 1 1 6  52 12 o 14.99000 0.4737000 14.72000 0.6866000 15.26000 0.6527000 -0.5478000     0.9473000 
1 1 1 6  52 14 o 15.19000 0.4008000 15.21000 0.5833000 15.17000 0.5498000 0.3653000E-01  0.8016000 
1 1 1 6  52 16 o 10.77000 0.4284000 10.61000 0.5755000 10.93000 0.6347000 -0.3246000     0.8568000 
1 1 1 6  52 18 o 9.630000 0.5232000 10.25000 0.6139000 9.012000 0.8473000 1.235000       1.046000  
1 1 1 6  52 20 o 11.47000 0.4749000 11.71000 0.6300000 11.23000 0.7107000 0.4725000      0.9497000 
1 1 1 6  52 22 o 7.696000 0.5810000 7.493000 0.7301000 7.900000 0.9040000 -0.4068000     1.162000  
1 1 1 6  52 24 o 4.973000 0.9346000 5.240000 1.257000  4.707000 1.384000  0.5326000      1.869000  
1 1 1 6  52 26 o 5.261000 0.8983000 6.049000 1.241000  4.472000 1.300000  1.577000       1.797000  
1 1 1 6  52 28 o 2.821000 0.8267000 2.062000 0.9801000 3.579000 1.332000  -1.517000      1.653000  
1 1 1 6  52 30 o 6.789000 0.7287000 6.761000 0.8974000 6.816000 1.148000  -0.5444000E-01 1.457000  
1 1 1 6  52 32 f 5.950000 0.8189000 5.494000 1.175000  6.407000 1.141000  -0.9125000     1.638000  
1 1 1 6  52 34 o 6.792000 0.7295000 6.903000 1.002000  6.682000 1.061000  0.2206000      1.459000  
1 1 1 6  52 36 o 11.63000 0.4643000 10.63000 0.6839000 12.63000 0.6282000 -2.000000      0.9286000 
1 1 1 6  52 38 o 7.525000 2.294000  7.525000 2.294000  ?        ?         ?              ?         
1 1 1 6  53 1  o 18.36000 0.3527000 17.39000 0.5131000 19.33000 0.4840000 -1.941000      0.7054000 
1 1 1 6  53 3  o 15.07000 0.3506000 14.80000 0.4516000 15.35000 0.5363000 -0.5543000     0.7011000 
1 1 1 6  53 5  o 7.220000 0.5599000 7.481000 0.7053000 6.958000 0.8697000 0.5237000      1.120000  
1 1 1 6  53 7  o 7.308000 0.6022000 7.705000 0.7755000 6.911000 0.9214000 0.7937000      1.204000  
1 1 1 6  53 9  o 8.924000 0.4645000 9.443000 0.5910000 8.405000 0.7167000 1.038000       0.9289000 
1 1 1 6  53 11 o 3.401000 0.9317000 3.431000 1.255000  3.371000 1.377000  0.6029000E-01  1.863000  
1 1 1 6  53 13 o 2.505000 0.7896000 2.708000 1.159000  2.303000 1.072000  0.4044000      1.579000  
1 1 1 6  53 15 o 6.472000 0.6981000 6.587000 1.032000  6.357000 0.9405000 0.2299000      1.396000  
1 1 1 6  53 17 o 8.459000 0.7376000 9.142000 1.201000  7.775000 0.8573000 1.367000       1.475000  
1 1 1 6  53 19 o 12.57000 0.4402000 12.33000 0.6223000 12.81000 0.6227000 -0.4873000     0.8803000 
1 1 1 6  53 21 o 10.54000 0.5151000 11.15000 0.6263000 9.936000 0.8181000 1.217000       1.030000  
1 1 1 6  53 23 o 7.340000 0.7106000 7.130000 1.022000  7.549000 0.9876000 -0.4196000     1.421000  
1 1 1 6  53 25 o 4.281000 0.9409000 4.769000 1.337000  3.793000 1.325000  0.9765000      1.882000  
1 1 1 6  53 27 o 3.743000 0.9374000 3.754000 1.296000  3.732000 1.355000  0.2239000E-01  1.875000  
1 1 1 6  53 29 f 4.503000 0.9790000 4.867000 1.301000  4.138000 1.463000  0.7286000      1.958000  
1 1 1 6  53 31 o 4.814000 0.8174000 3.061000 1.260000  6.568000 1.041000  -3.507000      1.635000  
1 1 1 6  53 33 f 5.941000 0.8222000 6.172000 1.071000  5.711000 1.248000  0.4614000      1.644000  
1 1 1 6  53 35 o 3.776000 0.9180000 4.415000 1.316000  3.137000 1.280000  1.278000       1.836000  
1 1 1 6  54 0  o 5.913000 1.035000  5.913000 1.035000  5.913000 1.035000  0.000000       0.000000  
1 1 1 6  54 2  o 5.357000 0.8231000 4.894000 1.242000  5.819000 1.080000  -0.9249000     1.646000  
1 1 1 6  54 4  o 7.676000 0.5728000 7.561000 0.7422000 7.792000 0.8726000 -0.2312000     1.146000  
1 1 1 6  54 6  o 12.36000 0.4189000 12.51000 0.5750000 12.22000 0.6093000 0.2874000      0.8378000 
1 1 1 6  54 8  o 3.008000 0.8719000 2.266000 1.020000  3.751000 1.414000  -1.485000      1.744000  
1 1 1 6  54 10 o 10.02000 0.4694000 9.455000 0.6375000 10.58000 0.6892000 -1.122000      0.9389000 
1 1 1 6  54 12 o 10.17000 0.4481000 9.774000 0.6263000 10.56000 0.6411000 -0.7818000     0.8962000 
1 1 1 6  54 14 o 8.455000 0.5934000 8.493000 0.8931000 8.416000 0.7818000 0.7707000E-01  1.187000  
1 1 1 6  54 16 o 8.128000 0.5309000 7.584000 0.7176000 8.672000 0.7827000 -1.088000      1.062000  
1 1 1 6  54 18 o 7.532000 0.6122000 7.941000 0.7755000 7.123000 0.9474000 0.8171000      1.224000  
1 1 1 6  54 20 o 3.375000 0.9249000 3.050000 1.236000  3.699000 1.376000  -0.6483000     1.850000  
1 1 1 6  54 22 o 3.827000 0.9722000 4.277000 1.381000  3.378000 1.368000  0.8987000      1.944000  
1 1 1 6  54 24 f 8.578000 0.5479000 8.494000 0.7695000 8.663000 0.7801000 -0.1693000     1.096000  
1 1 1 6  54 26 o 7.891000 0.6232000 8.801000 0.7681000 6.981000 0.9816000 1.820000       1.246000  
1 1 1 6  54 28 o 4.020000 0.9784000 3.652000 1.309000  4.388000 1.454000  -0.7358000     1.957000  
1 1 1 6  54 30 o 6.938000 0.7798000 7.901000 0.7916000 5.975000 1.344000  1.925000       1.560000  
1 1 1 6  54 32 o 12.45000 0.4596000 12.03000 0.6793000 12.87000 0.6191000 -0.8351000     0.9191000 
1 1 1 6  54 34 o 7.025000 0.9334000 6.228000 1.297000  7.822000 1.343000  -1.594000      1.867000  
1 1 1 6  55 1  o 11.36000 0.4483000 11.76000 0.6149000 10.97000 0.6524000 0.7931000      0.8966000 
1 1 1 6  55 3  o 7.246000 0.6391000 7.315000 0.7440000 7.177000 1.039000  0.1381000      1.278000  
1 1 1 6  55 5  o 3.682000 0.9367000 3.953000 1.298000  3.412000 1.350000  0.5419000      1.873000  
1 1 1 6  55 7  o 9.734000 0.4841000 10.38000 0.5654000 9.089000 0.7861000 1.289000       0.9683000 
1 1 1 6  55 9  o 7.144000 0.6236000 7.861000 0.7216000 6.427000 1.017000  1.434000       1.247000  
1 1 1 6  55 11 o 2.594000 0.8187000 2.554000 1.159000  2.634000 1.157000  -0.7963000E-01 1.637000  
1 1 1 6  55 13 f 4.624000 0.8641000 3.909000 1.225000  5.339000 1.219000  -1.431000      1.728000  
1 1 1 6  55 15 o 7.314000 0.5795000 7.707000 0.7322000 6.921000 0.8983000 0.7862000      1.159000  
1 1 1 6  55 17 o 4.443000 0.8609000 3.994000 1.157000  4.891000 1.275000  -0.8972000     1.722000  
1 1 1 6  55 19 o 5.677000 0.7661000 5.247000 1.039000  6.108000 1.126000  -0.8610000     1.532000  
1 1 1 6  55 21 o 4.832000 0.9170000 4.373000 1.282000  5.290000 1.312000  -0.9165000     1.834000  
1 1 1 6  55 23 o 3.797000 0.9660000 2.797000 1.157000  4.797000 1.547000  -2.000000      1.932000  
1 1 1 6  55 25 o 13.30000 0.4088000 13.48000 0.5435000 13.12000 0.6107000 0.3594000      0.8176000 
1 1 1 6  55 27 o 9.065000 0.5822000 10.22000 0.7737000 7.908000 0.8701000 2.313000       1.164000  
1 1 1 6  55 29 o 5.896000 0.9211000 7.018000 1.146000  4.774000 1.443000  2.244000       1.842000  
1 1 1 6  55 31 o 6.359000 0.8728000 6.537000 1.349000  6.182000 1.107000  0.3549000      1.746000  
1 1 1 6  56 0  o 12.48000 0.5868000 12.48000 0.5868000 12.48000 0.5868000 0.000000       0.000000  
1 1 1 6  56 2  o 16.31000 0.4176000 16.49000 0.4711000 16.13000 0.6897000 0.3644000      0.8352000 
1 1 1 6  56 4  o 5.765000 0.9289000 4.725000 1.293000  6.805000 1.334000  -2.080000      1.858000  
1 1 1 6  56 6  o 8.119000 0.5532000 8.675000 0.6728000 7.564000 0.8785000 1.111000       1.106000  
1 1 1 6  56 8  o 3.538000 0.9348000 3.781000 1.357000  3.294000 1.286000  0.4868000      1.870000  
1 1 1 6  56 10 o 3.476000 0.9135000 3.346000 1.251000  3.606000 1.331000  -0.2602000     1.827000  
1 1 1 6  56 12 o 4.039000 0.8819000 3.235000 1.209000  4.843000 1.284000  -1.608000      1.764000  
1 1 1 6  56 14 o 7.681000 0.5607000 7.427000 0.7430000 7.935000 0.8399000 -0.5081000     1.121000  
1 1 1 6  56 16 o 10.72000 0.4501000 10.32000 0.5742000 11.12000 0.6934000 -0.8060000     0.9003000 
1 1 1 6  56 18 o 5.538000 0.7684000 5.076000 1.033000  6.000000 1.138000  -0.9241000     1.537000  
1 1 1 6  56 20 o 5.025000 0.9028000 4.882000 1.227000  5.168000 1.325000  -0.2866000     1.806000  
1 1 1 6  56 22 o 9.969000 0.5287000 9.874000 0.6126000 10.06000 0.8618000 -0.1895000     1.057000  
1 1 1 6  56 24 f 11.29000 0.4674000 11.14000 0.6091000 11.43000 0.7090000 -0.2932000     0.9347000 
1 1 1 6  56 26 o 8.866000 0.5823000 9.613000 0.7139000 8.119000 0.9200000 1.494000       1.165000  
1 1 1 6  56 28 o 7.686000 0.7035000 7.909000 0.7106000 7.462000 1.214000  0.4476000      1.407000  
1 1 1 6  56 30 o 7.136000 0.8970000 8.181000 1.209000  6.091000 1.325000  2.090000       1.794000  
1 1 1 6  57 1  o 6.706000 1.155000  5.312000 1.638000  8.100000 1.629000  -2.788000      2.310000  
1 1 1 6  57 3  f 6.057000 0.7290000 5.858000 1.036000  6.257000 1.026000  -0.3986000     1.458000  
1 1 1 6  57 5  o 10.12000 0.5294000 10.39000 0.7129000 9.863000 0.7828000 0.5226000      1.059000  
1 1 1 6  57 7  o 12.01000 0.4645000 11.88000 0.6851000 12.13000 0.6274000 -0.2555000     0.9289000 
1 1 1 6  57 9  o 5.970000 0.7529000 6.684000 0.7685000 5.256000 1.295000  1.428000       1.506000  
1 1 1 6  57 11 o 5.446000 0.7648000 4.716000 1.080000  6.177000 1.084000  -1.460000      1.530000  
1 1 1 6  57 13 o 8.668000 0.5190000 8.550000 0.6713000 8.786000 0.7918000 -0.2356000     1.038000  
1 1 1 6  57 15 o 7.717000 0.5599000 7.076000 0.8059000 8.358000 0.7775000 -1.282000      1.120000  
1 1 1 6  57 17 o 4.508000 0.9012000 3.841000 1.196000  5.176000 1.349000  -1.336000      1.802000  
1 1 1 6  57 19 o 6.421000 0.8029000 6.612000 0.9820000 6.231000 1.271000  0.3802000      1.606000  
1 1 1 6  57 21 o 9.491000 0.5302000 9.803000 0.6217000 9.179000 0.8591000 0.6240000      1.060000  
1 1 1 6  57 23 o 3.494000 1.008000  3.125000 1.306000  3.863000 1.536000  -0.7382000     2.016000  
1 1 1 6  57 25 o 2.505000 0.7955000 2.499000 1.114000  2.512000 1.136000  -0.1274000E-01 1.591000  
1 1 1 6  57 27 o 6.663000 0.9857000 7.574000 0.9302000 5.753000 1.738000  1.821000       1.971000  
1 1 1 6  58 0  o 7.462000 1.332000  7.462000 1.332000  7.462000 1.332000  0.000000       0.000000  
1 1 1 6  58 2  o 6.954000 0.6760000 6.727000 1.012000  7.181000 0.8968000 -0.4537000     1.352000  
1 1 1 6  58 4  o 8.946000 0.5583000 8.142000 0.7968000 9.750000 0.7822000 -1.609000      1.117000  
1 1 1 6  58 6  o 4.229000 0.9138000 4.806000 1.252000  3.653000 1.331000  1.153000       1.828000  
1 1 1 6  58 8  o 7.096000 0.6404000 7.652000 0.7399000 6.540000 1.046000  1.112000       1.281000  
1 1 1 6  58 10 o 4.721000 0.8571000 4.539000 1.146000  4.904000 1.275000  -0.3658000     1.714000  
1 1 1 6  58 12 o 5.746000 0.7527000 5.744000 0.9652000 5.749000 1.155000  -0.4544000E-02 1.505000  
1 1 1 6  58 14 o 4.918000 0.8819000 4.984000 1.150000  4.851000 1.337000  0.1331000      1.764000  
1 1 1 6  58 16 o 5.513000 0.8423000 5.694000 1.025000  5.333000 1.337000  0.3609000      1.685000  
1 1 1 6  58 18 o 3.564000 0.9185000 3.925000 1.295000  3.203000 1.303000  0.7221000      1.837000  
1 1 1 6  58 20 o 5.415000 0.8724000 4.554000 1.239000  6.276000 1.228000  -1.722000      1.745000  
1 1 1 6  58 22 o 5.705000 0.9102000 6.259000 0.9191000 5.152000 1.571000  1.107000       1.820000  
1 1 1 6  58 24 o 3.511000 0.9548000 3.804000 1.347000  3.218000 1.354000  0.5853000      1.910000  
1 1 1 6  59 1  o 5.840000 1.043000  5.795000 0.9859000 5.885000 1.839000  -0.9012000E-01 2.086000  
1 1 1 6  59 3  o 2.917000 0.8623000 2.864000 1.199000  2.970000 1.240000  -0.1052000     1.725000  
1 1 1 6  59 5  o 3.716000 0.8973000 2.841000 1.174000  4.590000 1.357000  -1.750000      1.795000  
1 1 1 6  59 7  o 7.859000 0.6475000 7.859000 0.8228000 7.860000 1.000000  -0.8068000E-03 1.295000  
1 1 1 6  59 9  o 5.157000 0.9215000 4.752000 1.305000  5.562000 1.302000  -0.8095000     1.843000  
1 1 1 6  59 11 o 3.500000 0.9144000 2.874000 1.227000  4.125000 1.356000  -1.251000      1.829000  
1 1 1 6  59 13 o 4.582000 0.8864000 3.789000 1.315000  5.374000 1.189000  -1.585000      1.773000  
1 1 1 6  59 15 o 9.272000 0.5624000 9.807000 0.6865000 8.737000 0.8910000 1.070000       1.125000  
1 1 1 6  59 17 o 11.05000 0.5252000 10.57000 0.7386000 11.52000 0.7469000 -0.9581000     1.050000  
1 1 1 6  59 19 o 4.279000 0.9118000 4.928000 1.148000  3.630000 1.417000  1.298000       1.824000  
1 1 1 6  59 21 o 5.339000 0.9626000 5.351000 1.150000  5.327000 1.544000  0.2398000E-01  1.925000  
1 1 1 6  60 0  o 4.964000 1.491000  4.964000 1.491000  4.964000 1.491000  0.000000       0.000000  
1 1 1 6  60 2  o 2.813000 0.8649000 2.926000 1.217000  2.701000 1.229000  0.2248000      1.730000  
1 1 1 6  60 4  o 3.530000 0.8771000 3.166000 1.181000  3.893000 1.297000  -0.7265000     1.754000  
1 1 1 6  60 6  o 5.777000 0.8805000 5.635000 1.005000  5.919000 1.446000  -0.2839000     1.761000  
1 1 1 6  60 8  f 4.305000 0.9105000 3.454000 1.237000  5.156000 1.336000  -1.702000      1.821000  
1 1 1 6  60 10 o 10.57000 0.4828000 9.783000 0.6186000 11.36000 0.7415000 -1.580000      0.9656000 
1 1 1 6  60 12 o 10.55000 0.4849000 10.26000 0.6077000 10.85000 0.7558000 -0.5953000     0.9698000 
1 1 1 6  60 14 o 3.269000 0.9027000 2.622000 1.106000  3.915000 1.427000  -1.293000      1.805000  
1 1 1 6  60 16 o 2.968000 0.8594000 2.676000 1.113000  3.261000 1.310000  -0.5849000     1.719000  
1 1 1 6  60 18 o 3.585000 0.8816000 2.510000 1.084000  4.660000 1.390000  -2.150000      1.763000  
1 1 1 6  61 1  o 3.065000 0.8665000 2.500000 1.127000  3.631000 1.317000  -1.131000      1.733000  
1 1 1 6  61 3  o 4.309000 0.8868000 5.233000 1.038000  3.385000 1.438000  1.847000       1.774000  
1 1 1 6  61 5  o 6.370000 1.059000  5.290000 1.132000  7.450000 1.791000  -2.161000      2.119000  
1 1 1 6  61 7  o 2.943000 0.8538000 2.488000 1.074000  3.397000 1.327000  -0.9088000     1.708000  
1 1 1 6  61 9  o 3.863000 0.9580000 2.800000 1.136000  4.926000 1.543000  -2.125000      1.916000  
1 1 1 6  61 11 o 3.887000 0.9483000 3.529000 1.241000  4.245000 1.434000  -0.7151000     1.897000  
1 1 1 6  61 13 o 6.368000 0.7403000 5.562000 0.9315000 7.173000 1.151000  -1.612000      1.481000  
1 1 1 6  61 15 o 7.792000 1.110000  8.928000 1.615000  6.656000 1.522000  2.272000       2.219000  
1 1 1 6  62 0  o 4.682000 1.349000  4.682000 1.349000  4.682000 1.349000  0.000000       0.000000  
1 1 1 6  62 2  o 3.103000 0.8753000 3.152000 1.178000  3.053000 1.295000  0.9914000E-01  1.751000  
1 1 1 6  62 4  o 3.182000 0.8681000 3.040000 1.131000  3.324000 1.317000  -0.2841000     1.736000  
1 1 1 6  62 6  f 5.822000 1.074000  4.920000 1.100000  6.724000 1.845000  -1.804000      2.148000  
1 1 1 6  62 8  o 4.003000 0.9583000 4.189000 1.194000  3.816000 1.499000  0.3739000      1.917000  
1 1 1 7  0  1  o 11.42000 0.1973000 11.42000 0.1973000 11.42000 0.1973000 0.000000       0.000000  
1 1 1 7  0  3  o 124.1000 1.193000  124.1000 1.193000  124.1000 1.193000  0.000000       0.000000  
1 1 1 7  0  5  o 106.1000 1.022000  106.1000 1.022000  106.1000 1.022000  0.000000       0.000000  
1 1 1 7  0  7  o 83.98000 0.8128000 83.98000 0.8128000 83.98000 0.8128000 0.000000       0.000000  
1 1 1 7  0  9  o 40.38000 0.4733000 40.38000 0.4733000 40.38000 0.4733000 0.000000       0.000000  
1 1 1 7  0  11 o 31.80000 0.3419000 31.80000 0.3419000 31.80000 0.3419000 0.000000       0.000000  
1 1 1 7  0  13 o 50.07000 0.7107000 50.07000 0.7107000 50.07000 0.7107000 0.000000       0.000000  
1 1 1 7  0  15 o 16.99000 0.2767000 16.99000 0.2767000 16.99000 0.2767000 0.000000       0.000000  
1 1 1 7  0  17 o 189.1000 2.097000  189.1000 2.097000  189.1000 2.097000  0.000000       0.000000  
1 1 1 7  0  19 o 78.10000 0.7664000 78.10000 0.7664000 78.10000 0.7664000 0.000000       0.000000  
1 1 1 7  0  21 o 37.42000 0.4137000 37.42000 0.4137000 37.42000 0.4137000 0.000000       0.000000  
1 1 1 7  0  23 o 37.02000 0.4220000 37.02000 0.4220000 37.02000 0.4220000 0.000000       0.000000  
1 1 1 7  0  25 o 76.02000 0.8738000 76.02000 0.8738000 76.02000 0.8738000 0.000000       0.000000  
1 1 1 7  0  27 o 19.81000 0.4210000 19.81000 0.4210000 19.81000 0.4210000 0.000000       0.000000  
1 1 1 7  0  29 o 24.95000 0.5498000 24.95000 0.5498000 24.95000 0.5498000 0.000000       0.000000  
1 1 1 7  0  31 o 31.84000 0.4983000 31.84000 0.4983000 31.84000 0.4983000 0.000000       0.000000  
1 1 1 7  0  33 f 8.557000 0.8324000 8.557000 0.8324000 8.557000 0.8324000 0.000000       0.000000  
1 1 1 7  0  35 o 12.81000 0.6701000 12.81000 0.6701000 12.81000 0.6701000 0.000000       0.000000  
1 1 1 7  0  37 o 60.47000 0.6283000 60.47000 0.6283000 60.47000 0.6283000 0.000000       0.000000  
1 1 1 7  0  39 o 23.13000 0.6309000 23.13000 0.6309000 23.13000 0.6309000 0.000000       0.000000  
1 1 1 7  0  41 o 10.71000 0.8433000 10.71000 0.8433000 10.71000 0.8433000 0.000000       0.000000  
1 1 1 7  0  43 o 10.06000 0.8044000 10.06000 0.8044000 10.06000 0.8044000 0.000000       0.000000  
1 1 1 7  0  45 o 15.98000 0.7083000 15.98000 0.7083000 15.98000 0.7083000 0.000000       0.000000  
1 1 1 7  0  47 o 35.91000 0.4877000 35.91000 0.4877000 35.91000 0.4877000 0.000000       0.000000  
1 1 1 7  0  49 o 21.29000 0.5020000 21.29000 0.5020000 21.29000 0.5020000 0.000000       0.000000  
1 1 1 7  0  51 o 11.44000 0.7262000 11.44000 0.7262000 11.44000 0.7262000 0.000000       0.000000  
1 1 1 7  0  53 o 4.181000 1.504000  4.181000 1.504000  4.181000 1.504000  0.000000       0.000000  
1 1 1 7  0  55 o 5.649000 1.287000  5.649000 1.287000  5.649000 1.287000  0.000000       0.000000  
1 1 1 7  0  57 o 17.45000 0.6286000 17.45000 0.6286000 17.45000 0.6286000 0.000000       0.000000  
1 1 1 7  0  59 f 5.117000 1.403000  5.117000 1.403000  5.117000 1.403000  0.000000       0.000000  
1 1 1 7  0  61 o 3.888000 1.593000  3.888000 1.593000  3.888000 1.593000  0.000000       0.000000  
1 1 1 7  0  63 o 7.591000 1.145000  7.591000 1.145000  7.591000 1.145000  0.000000       0.000000  
1 1 1 7  0  65 f 10.45000 0.8348000 10.45000 0.8348000 10.45000 0.8348000 0.000000       0.000000  
1 1 1 7  0  67 o 4.368000 1.508000  4.368000 1.508000  4.368000 1.508000  0.000000       0.000000  
1 1 1 7  1  0  o 10.67000 0.1991000 10.67000 0.1991000 10.67000 0.1991000 0.000000       0.000000  
1 1 1 7  1  2  o 88.01000 0.6009000 87.90000 0.8485000 88.11000 0.8510000 -0.2140000     1.202000  
1 1 1 7  1  4  o 100.1000 0.6821000 99.93000 0.9628000 100.3000 0.9666000 -0.3358000     1.364000  
1 1 1 7  1  6  o 79.39000 0.5435000 79.02000 0.7650000 79.77000 0.7721000 -0.7485000     1.087000  
1 1 1 7  1  8  o 72.82000 0.5781000 72.80000 0.8174000 72.84000 0.8178000 -0.3795000E-01 1.156000  
1 1 1 7  1  10 o 79.56000 0.5467000 79.49000 0.7725000 79.64000 0.7739000 -0.1505000     1.093000  
1 1 1 7  1  12 o 61.79000 0.5245000 62.42000 0.6142000 61.16000 0.8504000 1.261000       1.049000  
1 1 1 7  1  14 o 80.19000 0.5969000 79.99000 0.8999000 80.39000 0.7845000 -0.4001000     1.194000  
1 1 1 7  1  16 o 53.69000 0.4119000 53.12000 0.5333000 54.26000 0.6280000 -1.138000      0.8239000 
1 1 1 7  1  18 o 68.65000 0.5177000 68.57000 0.7816000 68.73000 0.6792000 -0.1686000     1.035000  
1 1 1 7  1  20 o 15.61000 0.2369000 15.55000 0.3331000 15.67000 0.3368000 -0.1198000     0.4737000 
1 1 1 7  1  22 o 125.3000 0.8869000 126.4000 1.411000  124.2000 1.075000  2.234000       1.774000  
1 1 1 7  1  24 o 36.12000 0.3647000 36.26000 0.5935000 35.97000 0.4241000 0.2894000      0.7295000 
1 1 1 7  1  26 o 17.53000 0.3959000 18.07000 0.4847000 16.98000 0.6262000 1.092000       0.7918000 
1 1 1 7  1  28 o 34.74000 0.5357000 35.30000 0.8854000 34.18000 0.6035000 1.120000       1.071000  
1 1 1 7  1  30 o 80.59000 0.5674000 80.05000 0.7967000 81.12000 0.8082000 -1.068000      1.135000  
1 1 1 7  1  32 o 28.07000 0.3495000 27.85000 0.4855000 28.29000 0.5028000 -0.4464000     0.6989000 
1 1 1 7  1  34 o 41.62000 0.3409000 41.70000 0.4835000 41.54000 0.4806000 0.1663000      0.6818000 
1 1 1 7  1  36 o 39.21000 0.3318000 39.38000 0.4719000 39.03000 0.4666000 0.3504000      0.6636000 
1 1 1 7  1  38 o 24.45000 0.3511000 24.23000 0.5020000 24.68000 0.4910000 -0.4508000     0.7022000 
1 1 1 7  1  40 o 38.49000 0.3357000 38.38000 0.4771000 38.60000 0.4724000 -0.2192000     0.6714000 
1 1 1 7  1  42 o 18.34000 0.3857000 17.87000 0.5993000 18.81000 0.4857000 -0.9365000     0.7714000 
1 1 1 7  1  44 o 24.88000 0.3300000 25.18000 0.4728000 24.58000 0.4605000 0.6041000      0.6600000 
1 1 1 7  1  46 o 34.41000 0.3741000 33.95000 0.5694000 34.88000 0.4853000 -0.9371000     0.7482000 
1 1 1 7  1  48 o 19.58000 0.3746000 19.53000 0.5243000 19.62000 0.5351000 -0.9055000E-01 0.7491000 
1 1 1 7  1  50 o 26.07000 0.3861000 25.89000 0.5440000 26.25000 0.5479000 -0.3558000     0.7721000 
1 1 1 7  1  52 o 9.307000 0.5587000 9.032000 0.8145000 9.582000 0.7650000 -0.5504000     1.117000  
1 1 1 7  1  54 o 10.29000 0.5638000 10.27000 0.8691000 10.30000 0.7186000 -0.3154000E-01 1.128000  
1 1 1 7  1  56 o 5.699000 0.9937000 5.999000 1.241000  5.398000 1.552000  0.6012000      1.987000  
1 1 1 7  1  58 o 5.274000 0.9598000 5.301000 1.342000  5.247000 1.372000  0.5415000E-01  1.920000  
1 1 1 7  1  60 o 6.053000 1.020000  6.349000 1.468000  5.756000 1.415000  0.5929000      2.039000  
1 1 1 7  1  62 o 3.910000 1.069000  3.930000 1.530000  3.890000 1.492000  0.3940000E-01  2.137000  
1 1 1 7  1  64 o 2.919000 0.9374000 3.159000 1.387000  2.680000 1.261000  0.4783000      1.875000  
1 1 1 7  1  66 o 3.940000 1.074000  3.692000 1.456000  4.188000 1.579000  -0.4957000     2.148000  
1 1 1 7  2  1  o 185.3000 1.357000  185.8000 1.782000  184.8000 2.047000  1.013000       2.714000  
1 1 1 7  2  3  o 91.34000 0.6236000 90.97000 0.8790000 91.70000 0.8848000 -0.7321000     1.247000  
1 1 1 7  2  5  o 122.2000 0.8314000 121.8000 1.172000  122.7000 1.180000  -0.8637000     1.663000  
1 1 1 7  2  7  o 91.79000 0.6771000 91.77000 1.024000  91.81000 0.8866000 -0.3598000E-01 1.354000  
1 1 1 7  2  9  o 27.91000 0.2338000 28.52000 0.3120000 27.30000 0.3482000 1.223000       0.4675000 
1 1 1 7  2  11 o 51.89000 0.3942000 51.57000 0.5134000 52.21000 0.5985000 -0.6369000     0.7885000 
1 1 1 7  2  13 o 44.13000 0.3908000 43.67000 0.4460000 44.60000 0.6418000 -0.9326000     0.7816000 
1 1 1 7  2  15 o 15.02000 0.2297000 14.98000 0.3268000 15.06000 0.3228000 -0.7743000E-01 0.4594000 
1 1 1 7  2  17 o 87.76000 0.6049000 87.69000 0.8540000 87.82000 0.8570000 -0.1299000     1.210000  
1 1 1 7  2  19 o 135.6000 1.133000  135.9000 1.854000  135.2000 1.305000  0.7269000      2.267000  
1 1 1 7  2  21 o 102.1000 0.7256000 102.6000 1.150000  101.7000 0.8858000 0.8842000      1.451000  
1 1 1 7  2  23 o 71.04000 0.5168000 71.38000 0.8182000 70.71000 0.6316000 0.6735000      1.034000  
1 1 1 7  2  25 o 91.33000 0.9781000 90.94000 1.783000  91.72000 0.8053000 -0.7827000     1.956000  
1 1 1 7  2  27 o 109.3000 0.8129000 109.0000 1.225000  109.5000 1.069000  -0.4981000     1.626000  
1 1 1 7  2  29 o 14.70000 0.3557000 15.03000 0.4946000 14.36000 0.5113000 0.6724000      0.7113000 
1 1 1 7  2  31 o 16.20000 0.4720000 15.94000 0.7470000 16.46000 0.5770000 -0.5236000     0.9439000 
1 1 1 7  2  33 o 40.04000 0.3615000 39.87000 0.5496000 40.20000 0.4697000 -0.3378000     0.7230000 
1 1 1 7  2  35 o 54.19000 0.4069000 53.53000 0.5691000 54.86000 0.5818000 -1.326000      0.8138000 
1 1 1 7  2  37 o 27.06000 0.3056000 26.82000 0.4352000 27.29000 0.4291000 -0.4646000     0.6112000 
1 1 1 7  2  39 o 41.13000 0.3466000 40.42000 0.4868000 41.84000 0.4934000 -1.423000      0.6931000 
1 1 1 7  2  41 o 17.69000 0.4360000 17.17000 0.6744000 18.21000 0.5527000 -1.038000      0.8719000 
1 1 1 7  2  43 o 12.09000 0.5376000 13.20000 0.6576000 10.99000 0.8508000 2.213000       1.075000  
1 1 1 7  2  45 o 7.426000 0.9553000 6.285000 1.448000  8.568000 1.247000  -2.283000      1.911000  
1 1 1 7  2  47 o 4.448000 1.098000  4.425000 1.558000  4.472000 1.548000  -0.4739000E-01 2.196000  
1 1 1 7  2  49 o 24.24000 0.3415000 24.66000 0.4770000 23.82000 0.4889000 0.8413000      0.6830000 
1 1 1 7  2  51 o 13.49000 0.4284000 13.24000 0.6177000 13.74000 0.5937000 -0.4981000     0.8568000 
1 1 1 7  2  53 o 9.810000 0.6353000 10.51000 0.8782000 9.111000 0.9182000 1.397000       1.271000  
1 1 1 7  2  55 o 9.722000 0.6054000 10.69000 0.7173000 8.754000 0.9753000 1.937000       1.211000  
1 1 1 7  2  57 o 10.71000 0.6114000 10.88000 0.8632000 10.54000 0.8660000 0.3438000      1.223000  
1 1 1 7  2  59 o 9.098000 0.6326000 8.703000 0.9288000 9.493000 0.8592000 -0.7894000     1.265000  
1 1 1 7  2  61 o 7.919000 0.8195000 6.956000 1.361000  8.882000 0.9131000 -1.927000      1.639000  
1 1 1 7  2  63 o 8.479000 0.8081000 7.030000 1.277000  9.928000 0.9911000 -2.898000      1.616000  
1 1 1 7  2  65 o 6.441000 1.117000  7.181000 1.347000  5.702000 1.783000  1.480000       2.235000  
1 1 1 7  2  67 o 5.359000 1.025000  5.525000 1.513000  5.192000 1.384000  0.3331000      2.051000  
1 1 1 7  3  0  o 22.67000 0.2511000 22.67000 0.2511000 22.67000 0.2511000 0.000000       0.000000  
1 1 1 7  3  2  o 108.8000 0.7407000 109.3000 1.051000  108.4000 1.043000  0.8806000      1.481000  
1 1 1 7  3  4  f 146.0000 0.9914000 145.4000 1.396000  146.6000 1.408000  -1.225000      1.983000  
1 1 1 7  3  6  o 136.8000 1.003000  136.1000 1.510000  137.4000 1.321000  -1.329000      2.006000  
1 1 1 7  3  8  o 93.50000 0.6395000 94.55000 0.9139000 92.45000 0.8949000 2.102000       1.279000  
1 1 1 7  3  10 o 59.98000 0.4496000 60.38000 0.5939000 59.58000 0.6752000 0.7987000      0.8993000 
1 1 1 7  3  12 o 68.32000 0.5589000 68.76000 0.6018000 67.88000 0.9419000 0.8784000      1.118000  
1 1 1 7  3  14 o 62.19000 0.4492000 62.03000 0.5478000 62.34000 0.7120000 -0.3050000     0.8984000 
1 1 1 7  3  16 o 27.09000 0.2469000 27.22000 0.3712000 26.95000 0.3257000 0.2739000      0.4938000 
1 1 1 7  3  18 o 53.02000 0.3924000 53.42000 0.6220000 52.62000 0.4786000 0.8062000      0.7849000 
1 1 1 7  3  20 o 33.40000 0.2791000 33.77000 0.4395000 33.02000 0.3441000 0.7481000      0.5582000 
1 1 1 7  3  22 o 64.63000 0.4727000 64.70000 0.7455000 64.57000 0.5814000 0.1318000      0.9454000 
1 1 1 7  3  24 o 47.96000 0.5863000 47.82000 1.013000  48.10000 0.5914000 -0.2803000     1.173000  
1 1 1 7  3  26 o 21.08000 0.2879000 21.37000 0.4465000 20.78000 0.3635000 0.5891000      0.5758000 
1 1 1 7  3  28 o 37.32000 0.3841000 36.78000 0.6184000 37.86000 0.4556000 -1.089000      0.7682000 
1 1 1 7  3  30 o 52.18000 0.4236000 52.61000 0.5580000 51.76000 0.6374000 0.8471000      0.8471000 
1 1 1 7  3  32 o 27.37000 0.2997000 27.55000 0.4226000 27.20000 0.4252000 0.3522000      0.5995000 
1 1 1 7  3  34 o 15.42000 0.3981000 15.36000 0.6137000 15.49000 0.5073000 -0.1275000     0.7962000 
1 1 1 7  3  36 o 15.47000 0.4152000 15.13000 0.5730000 15.80000 0.6009000 -0.6640000     0.8303000 
1 1 1 7  3  38 o 7.425000 0.8086000 7.427000 1.169000  7.423000 1.118000  0.4279000E-02  1.617000  
1 1 1 7  3  40 o 14.42000 0.3990000 15.00000 0.5596000 13.85000 0.5687000 1.147000       0.7979000 
1 1 1 7  3  42 o 28.85000 0.3149000 28.74000 0.4445000 28.96000 0.4461000 -0.2198000     0.6298000 
1 1 1 7  3  44 o 31.76000 0.4306000 31.13000 0.5339000 32.40000 0.6759000 -1.270000      0.8613000 
1 1 1 7  3  46 o 38.09000 0.3833000 37.91000 0.5804000 38.28000 0.5010000 -0.3675000     0.7667000 
1 1 1 7  3  48 o 7.868000 0.7744000 7.676000 1.116000  8.059000 1.074000  -0.3830000     1.549000  
1 1 1 7  3  50 o 9.655000 0.6459000 9.152000 0.8927000 10.16000 0.9338000 -1.005000      1.292000  
1 1 1 7  3  52 o 8.141000 0.7738000 6.929000 1.311000  9.353000 0.8220000 -2.424000      1.548000  
1 1 1 7  3  54 o 8.762000 0.6108000 8.901000 0.8640000 8.624000 0.8635000 0.2768000      1.222000  
1 1 1 7  3  56 o 9.131000 0.6730000 9.541000 0.9272000 8.720000 0.9756000 0.8213000      1.346000  
1 1 1 7  3  58 f 14.15000 0.4368000 13.78000 0.6340000 14.51000 0.6011000 -0.7307000     0.8737000 
1 1 1 7  3  60 o 3.648000 1.010000  3.894000 1.441000  3.403000 1.415000  0.4911000      2.020000  
1 1 1 7  3  62 o 4.795000 1.090000  4.825000 1.619000  4.765000 1.459000  0.5951000E-01  2.180000  
1 1 1 7  3  64 o 3.230000 0.9687000 3.484000 1.422000  2.976000 1.316000  0.5082000      1.937000  
1 1 1 7  3  66 o 4.787000 1.162000  4.529000 1.788000  5.044000 1.484000  -0.5150000     2.323000  
1 1 1 7  4  1  o 118.6000 0.8065000 118.6000 1.140000  118.6000 1.141000  -0.6548000E-01 1.613000  
1 1 1 7  4  3  o 89.63000 0.6119000 89.67000 0.8660000 89.58000 0.8647000 0.8807000E-01  1.224000  
1 1 1 7  4  5  o 123.3000 0.9043000 122.2000 1.357000  124.4000 1.196000  -2.137000      1.809000  
1 1 1 7  4  7  o 43.63000 0.3554000 43.72000 0.5038000 43.54000 0.5013000 0.1824000      0.7107000 
1 1 1 7  4  9  o 56.43000 0.4822000 56.00000 0.5527000 56.87000 0.7903000 -0.8728000     0.9644000 
1 1 1 7  4  11 o 55.26000 0.4596000 55.07000 0.4877000 55.45000 0.7792000 -0.3848000     0.9193000 
1 1 1 7  4  13 o 28.15000 0.2442000 28.10000 0.3157000 28.21000 0.3727000 -0.1044000     0.4884000 
1 1 1 7  4  15 o 84.14000 0.6263000 83.99000 0.8179000 84.29000 0.9488000 -0.2952000     1.253000  
1 1 1 7  4  17 o 90.50000 0.6423000 90.16000 1.011000  90.84000 0.7924000 -0.6795000     1.285000  
1 1 1 7  4  19 f 66.00000 0.5446000 65.06000 0.9119000 66.94000 0.5957000 -1.880000      1.089000  
1 1 1 7  4  21 o 25.53000 0.3879000 26.35000 0.7095000 24.70000 0.3139000 1.650000       0.7758000 
1 1 1 7  4  23 o 70.05000 0.5100000 70.25000 0.8056000 69.84000 0.6255000 0.4073000      1.020000  
1 1 1 7  4  25 f 88.15000 0.6306000 87.05000 0.9867000 89.25000 0.7857000 -2.206000      1.261000  
1 1 1 7  4  27 o 43.80000 0.5432000 44.08000 0.9723000 43.53000 0.4845000 0.5521000      1.086000  
1 1 1 7  4  29 o 40.52000 0.3380000 39.92000 0.5250000 41.12000 0.4259000 -1.199000      0.6760000 
1 1 1 7  4  31 o 11.82000 0.4346000 11.98000 0.6402000 11.67000 0.5880000 0.3028000      0.8692000 
1 1 1 7  4  33 o 28.53000 0.2944000 28.37000 0.4126000 28.69000 0.4199000 -0.3199000     0.5887000 
1 1 1 7  4  35 o 74.24000 0.5293000 74.32000 0.7494000 74.15000 0.7478000 0.1746000      1.059000  
1 1 1 7  4  37 o 57.17000 0.4598000 57.33000 0.6049000 57.02000 0.6926000 0.3123000      0.9195000 
1 1 1 7  4  39 o 29.66000 0.3345000 29.58000 0.5010000 29.73000 0.4433000 -0.1550000     0.6690000 
1 1 1 7  4  41 o 7.143000 0.8400000 7.612000 0.9866000 6.675000 1.360000  0.9374000      1.680000  
1 1 1 7  4  43 o 42.05000 0.3595000 42.85000 0.5090000 41.24000 0.5078000 1.609000       0.7189000 
1 1 1 7  4  45 o 49.83000 0.3990000 49.25000 0.5587000 50.42000 0.5698000 -1.179000      0.7980000 
1 1 1 7  4  47 o 42.92000 0.3998000 42.96000 0.6075000 42.87000 0.5199000 0.9177000E-01  0.7996000 
1 1 1 7  4  49 o 18.41000 0.3763000 18.50000 0.5278000 18.33000 0.5366000 0.1676000      0.7527000 
1 1 1 7  4  51 f 13.64000 0.4779000 13.75000 0.7115000 13.53000 0.6382000 0.2209000      0.9558000 
1 1 1 7  4  53 o 4.709000 1.010000  3.541000 1.448000  5.877000 1.409000  -2.336000      2.020000  
1 1 1 7  4  55 o 10.45000 0.5749000 10.62000 0.7323000 10.28000 0.8864000 0.3382000      1.150000  
1 1 1 7  4  57 o 5.977000 0.9280000 5.148000 1.457000  6.806000 1.150000  -1.658000      1.856000  
1 1 1 7  4  59 o 3.418000 0.9808000 3.460000 1.399000  3.377000 1.375000  0.8318000E-01  1.962000  
1 1 1 7  4  61 o 3.595000 1.017000  3.480000 1.461000  3.710000 1.415000  -0.2300000     2.033000  
1 1 1 7  4  63 o 3.598000 1.049000  3.282000 1.407000  3.913000 1.557000  -0.6311000     2.098000  
1 1 1 7  4  65 o 6.148000 1.003000  7.247000 1.399000  5.048000 1.437000  2.198000       2.006000  
1 1 1 7  4  67 o 4.817000 1.034000  3.807000 1.666000  5.827000 1.224000  -2.020000      2.068000  
1 1 1 7  5  0  o 43.25000 0.4307000 43.25000 0.4307000 43.25000 0.4307000 0.000000       0.000000  
1 1 1 7  5  2  o 110.2000 0.7504000 110.8000 1.066000  109.7000 1.056000  1.089000       1.501000  
1 1 1 7  5  4  o 6.168000 0.1840000 6.189000 0.2609000 6.147000 0.2595000 0.4126000E-01  0.3680000 
1 1 1 7  5  6  o 34.67000 0.2886000 34.44000 0.4059000 34.90000 0.4104000 -0.4672000     0.5772000 
1 1 1 7  5  8  o 53.47000 0.4019000 54.18000 0.5348000 52.75000 0.6000000 1.428000       0.8037000 
1 1 1 7  5  10 o 24.63000 0.2106000 24.83000 0.2542000 24.42000 0.3358000 0.4047000      0.4211000 
1 1 1 7  5  12 o 91.18000 0.7413000 90.89000 0.7878000 91.48000 1.256000  -0.5910000     1.483000  
1 1 1 7  5  14 o 134.1000 0.9451000 133.4000 1.149000  134.9000 1.501000  -1.497000      1.890000  
1 1 1 7  5  16 o 49.03000 0.3807000 49.09000 0.4974000 48.96000 0.5764000 0.1273000      0.7614000 
1 1 1 7  5  18 o 105.5000 0.7465000 105.5000 1.179000  105.5000 0.9164000 -0.2205000E-01 1.493000  
1 1 1 7  5  20 f 96.61000 0.8152000 96.90000 1.332000  96.31000 0.9402000 0.5903000      1.630000  
1 1 1 7  5  22 o 72.84000 0.5270000 72.98000 0.8319000 72.70000 0.6472000 0.2789000      1.054000  
1 1 1 7  5  24 o 28.63000 0.3570000 29.39000 0.5395000 27.86000 0.4676000 1.529000       0.7139000 
1 1 1 7  5  26 o 71.95000 0.5478000 71.81000 0.8239000 72.08000 0.7220000 -0.2751000     1.096000  
1 1 1 7  5  28 o 75.11000 0.5733000 74.94000 0.8635000 75.29000 0.7544000 -0.3510000     1.147000  
1 1 1 7  5  30 o 52.97000 0.4583000 52.08000 0.6312000 53.86000 0.6647000 -1.780000      0.9167000 
1 1 1 7  5  32 o 22.97000 0.3037000 22.52000 0.4810000 23.43000 0.3708000 -0.9180000     0.6074000 
1 1 1 7  5  34 o 89.61000 0.7394000 89.36000 1.246000  89.86000 0.7957000 -0.4968000     1.479000  
1 1 1 7  5  36 o 56.63000 0.4530000 56.49000 0.6797000 56.77000 0.5989000 -0.2830000     0.9060000 
1 1 1 7  5  38 o 31.69000 0.3574000 31.80000 0.5038000 31.57000 0.5070000 0.2245000      0.7148000 
1 1 1 7  5  40 o 36.14000 0.4208000 36.46000 0.6411000 35.81000 0.5454000 0.6527000      0.8416000 
1 1 1 7  5  42 o 37.39000 0.3686000 36.49000 0.4739000 38.28000 0.5648000 -1.791000      0.7373000 
1 1 1 7  5  44 o 11.40000 0.6091000 11.43000 0.7800000 11.36000 0.9356000 0.7206000E-01  1.218000  
1 1 1 7  5  46 f 26.62000 0.3446000 26.28000 0.4863000 26.97000 0.4884000 -0.6945000     0.6893000 
1 1 1 7  5  48 o 32.97000 0.3429000 33.54000 0.4851000 32.40000 0.4847000 1.141000       0.6857000 
1 1 1 7  5  50 o 5.000000 1.021000  4.859000 1.474000  5.140000 1.414000  -0.2804000     2.043000  
1 1 1 7  5  52 o 20.06000 0.5532000 20.02000 0.9546000 20.10000 0.5593000 -0.8439000E-01 1.106000  
1 1 1 7  5  54 o 3.867000 0.9918000 4.290000 1.414000  3.444000 1.391000  0.8458000      1.984000  
1 1 1 7  5  56 o 6.849000 0.8593000 6.785000 1.054000  6.913000 1.358000  -0.1281000     1.719000  
1 1 1 7  5  58 o 10.24000 0.6240000 11.53000 0.8343000 8.951000 0.9281000 2.578000       1.248000  
1 1 1 7  5  60 o 3.760000 0.9890000 3.150000 1.398000  4.371000 1.399000  -1.221000      1.978000  
1 1 1 7  5  62 o 3.959000 0.9867000 5.173000 1.562000  2.746000 1.206000  2.428000       1.973000  
1 1 1 7  5  64 o 3.244000 0.9950000 3.640000 1.539000  2.848000 1.262000  0.7922000      1.990000  
1 1 1 7  5  66 o 3.442000 1.030000  3.625000 1.515000  3.258000 1.396000  0.3668000      2.060000  
1 1 1 7  6  1  o 63.99000 0.5076000 64.10000 0.7193000 63.89000 0.7164000 0.2159000      1.015000  
1 1 1 7  6  3  o 50.68000 0.4059000 50.24000 0.5691000 51.11000 0.5788000 -0.8687000     0.8118000 
1 1 1 7  6  5  o 19.06000 0.1841000 19.33000 0.2629000 18.80000 0.2580000 0.5267000      0.3683000 
1 1 1 7  6  7  o 58.95000 0.4090000 59.15000 0.5803000 58.75000 0.5766000 0.4020000      0.8181000 
1 1 1 7  6  9  o 75.81000 0.6151000 76.97000 0.6701000 74.66000 1.032000  2.320000       1.230000  
1 1 1 7  6  11 f 39.12000 0.3405000 38.76000 0.3562000 39.48000 0.5804000 -0.7227000     0.6810000 
1 1 1 7  6  13 o 38.66000 0.3088000 38.62000 0.4009000 38.71000 0.4698000 -0.8985000E-01 0.6175000 
1 1 1 7  6  15 o 91.12000 0.6262000 91.61000 0.8894000 90.62000 0.8816000 0.9849000      1.252000  
1 1 1 7  6  17 o 51.47000 0.4272000 50.94000 0.5975000 51.99000 0.6108000 -1.044000      0.8545000 
1 1 1 7  6  19 f 52.77000 0.3914000 52.85000 0.6156000 52.69000 0.4837000 0.1655000      0.7829000 
1 1 1 7  6  21 o 26.25000 0.3001000 26.42000 0.5077000 26.08000 0.3201000 0.3420000      0.6002000 
1 1 1 7  6  23 o 92.38000 0.6907000 92.93000 1.046000  91.83000 0.9020000 1.091000       1.381000  
1 1 1 7  6  25 o 94.14000 0.7036000 94.35000 1.064000  93.94000 0.9214000 0.4085000      1.407000  
1 1 1 7  6  27 o 47.51000 0.4241000 47.02000 0.7069000 48.00000 0.4686000 -0.9843000     0.8481000 
1 1 1 7  6  29 o 45.63000 0.3830000 46.11000 0.5776000 45.14000 0.5032000 0.9720000      0.7660000 
1 1 1 7  6  31 o 29.37000 0.3168000 29.30000 0.4775000 29.45000 0.4165000 -0.1446000     0.6336000 
1 1 1 7  6  33 o 67.33000 0.4974000 66.80000 0.7794000 67.86000 0.6182000 -1.062000      0.9948000 
1 1 1 7  6  35 o 57.01000 0.5009000 57.49000 0.8481000 56.54000 0.5334000 0.9517000      1.002000  
1 1 1 7  6  37 o 41.03000 0.3652000 40.93000 0.5442000 41.12000 0.4871000 -0.1897000     0.7304000 
1 1 1 7  6  39 o 51.86000 0.4660000 51.64000 0.7825000 52.07000 0.5063000 -0.4288000     0.9320000 
1 1 1 7  6  41 o 22.57000 0.3313000 22.75000 0.5263000 22.38000 0.4026000 0.3773000      0.6627000 
1 1 1 7  6  43 o 18.62000 0.4295000 18.49000 0.5937000 18.75000 0.6209000 -0.2607000     0.8591000 
1 1 1 7  6  45 o 10.83000 0.5612000 11.50000 0.7555000 10.17000 0.8299000 1.334000       1.122000  
1 1 1 7  6  47 o 42.98000 0.4336000 43.58000 0.6153000 42.38000 0.6113000 1.199000       0.8673000 
1 1 1 7  6  49 o 14.08000 0.4922000 14.84000 0.6346000 13.32000 0.7525000 1.524000       0.9843000 
1 1 1 7  6  51 o 8.110000 0.7591000 8.317000 1.130000  7.902000 1.013000  0.4147000      1.518000  
1 1 1 7  6  53 o 14.67000 0.4544000 14.25000 0.6612000 15.10000 0.6236000 -0.8548000     0.9089000 
1 1 1 7  6  55 o 22.20000 0.3453000 22.11000 0.5439000 22.29000 0.4256000 -0.1777000     0.6907000 
1 1 1 7  6  57 o 11.24000 0.4966000 11.77000 0.7863000 10.71000 0.6067000 1.056000       0.9932000 
1 1 1 7  6  59 o 7.136000 0.8129000 7.081000 1.349000  7.192000 0.9075000 -0.1110000     1.626000  
1 1 1 7  6  61 o 4.739000 1.148000  5.508000 1.846000  3.971000 1.366000  1.537000       2.296000  
1 1 1 7  6  63 o 7.966000 0.8289000 9.212000 1.104000  6.720000 1.237000  2.492000       1.658000  
1 1 1 7  6  65 o 5.573000 1.047000  5.872000 1.683000  5.274000 1.245000  0.5980000      2.093000  
1 1 1 7  6  67 o 5.584000 1.051000  6.332000 1.590000  4.836000 1.375000  1.496000       2.102000  
1 1 1 7  7  0  o 161.0000 1.784000  161.0000 1.784000  161.0000 1.784000  0.000000       0.000000  
1 1 1 7  7  2  f 93.48000 0.7357000 93.07000 1.036000  93.90000 1.045000  -0.8335000     1.471000  
1 1 1 7  7  4  o 38.86000 0.2981000 38.75000 0.3904000 38.96000 0.4506000 -0.2134000     0.5962000 
1 1 1 7  7  6  o 65.37000 0.4509000 65.61000 0.6397000 65.14000 0.6356000 0.4673000      0.9018000 
1 1 1 7  7  8  o 41.15000 0.3056000 41.35000 0.3725000 40.96000 0.4844000 0.3938000      0.6111000 
1 1 1 7  7  10 o 52.96000 0.4540000 53.48000 0.5263000 52.43000 0.7399000 1.058000       0.9080000 
1 1 1 7  7  12 o 31.72000 0.2633000 31.79000 0.3412000 31.65000 0.4012000 0.1401000      0.5267000 
1 1 1 7  7  14 o 114.9000 0.8479000 114.6000 1.279000  115.3000 1.114000  -0.6695000     1.696000  
1 1 1 7  7  16 o 91.86000 0.6319000 91.79000 0.8920000 91.94000 0.8953000 -0.1505000     1.264000  
1 1 1 7  7  18 o 134.3000 0.9452000 133.8000 1.489000  134.9000 1.165000  -1.116000      1.890000  
1 1 1 7  7  20 o 33.84000 0.2820000 34.11000 0.4412000 33.57000 0.3512000 0.5392000      0.5639000 
1 1 1 7  7  22 o 82.73000 0.5939000 82.89000 0.9377000 82.56000 0.7291000 0.3293000      1.188000  
1 1 1 7  7  24 o 38.25000 0.4374000 37.72000 0.5980000 38.79000 0.6384000 -1.070000      0.8747000 
1 1 1 7  7  26 f 28.24000 0.2896000 28.51000 0.4529000 27.96000 0.3611000 0.5501000      0.5793000 
1 1 1 7  7  28 o 19.83000 0.3356000 19.48000 0.4631000 20.18000 0.4857000 -0.7000000     0.6711000 
1 1 1 7  7  30 o 33.19000 0.3113000 33.69000 0.4924000 32.70000 0.3809000 0.9841000      0.6225000 
1 1 1 7  7  32 o 8.793000 0.5853000 8.820000 0.8803000 8.767000 0.7716000 0.5237000E-01  1.171000  
1 1 1 7  7  34 o 29.55000 0.3019000 29.75000 0.4730000 29.35000 0.3754000 0.3990000      0.6039000 
1 1 1 7  7  36 o 45.15000 0.3683000 45.62000 0.5793000 44.69000 0.4549000 0.9325000      0.7366000 
1 1 1 7  7  38 o 19.21000 0.3804000 19.15000 0.6369000 19.28000 0.4162000 -0.1313000     0.7608000 
1 1 1 7  7  40 o 49.56000 0.4550000 49.96000 0.7654000 49.16000 0.4921000 0.8021000      0.9100000 
1 1 1 7  7  42 o 14.51000 0.4815000 14.30000 0.6817000 14.71000 0.6802000 -0.4134000     0.9630000 
1 1 1 7  7  44 o 32.45000 0.3842000 32.55000 0.5307000 32.36000 0.5557000 0.1867000      0.7684000 
1 1 1 7  7  46 o 19.36000 0.3788000 19.75000 0.5830000 18.97000 0.4838000 0.7771000      0.7576000 
1 1 1 7  7  48 o 26.06000 0.5587000 25.23000 1.013000  26.89000 0.4723000 -1.656000      1.117000  
1 1 1 7  7  50 o 28.43000 0.3428000 28.60000 0.5422000 28.25000 0.4195000 0.3443000      0.6855000 
1 1 1 7  7  52 o 8.646000 0.6744000 8.593000 1.112000  8.700000 0.7638000 -0.1068000     1.349000  
1 1 1 7  7  54 f 10.95000 0.5655000 11.14000 0.8216000 10.76000 0.7772000 0.3731000      1.131000  
1 1 1 7  7  56 o 4.329000 0.9999000 3.908000 1.489000  4.750000 1.335000  -0.8421000     2.000000  
1 1 1 7  7  58 o 5.396000 0.9543000 5.227000 1.531000  5.564000 1.140000  -0.3373000     1.909000  
1 1 1 7  7  60 o 3.751000 0.9836000 3.353000 1.441000  4.149000 1.339000  -0.7968000     1.967000  
1 1 1 7  7  62 o 3.804000 1.050000  3.987000 1.558000  3.621000 1.407000  0.3659000      2.099000  
1 1 1 7  7  64 f 3.694000 1.052000  3.984000 1.574000  3.403000 1.396000  0.5808000      2.104000  
1 1 1 7  7  66 o 3.778000 1.055000  3.995000 1.583000  3.560000 1.394000  0.4348000      2.110000  
1 1 1 7  8  1  o 21.27000 0.1715000 21.26000 0.2430000 21.28000 0.2422000 -0.1056000E-01 0.3431000 
1 1 1 7  8  3  o 37.66000 0.2931000 37.63000 0.3805000 37.69000 0.4460000 -0.5877000E-01 0.5862000 
1 1 1 7  8  5  o 54.56000 0.4115000 54.70000 0.5381000 54.42000 0.6228000 0.2780000      0.8231000 
1 1 1 7  8  7  o 33.83000 0.2588000 34.23000 0.3149000 33.43000 0.4109000 0.8029000      0.5177000 
1 1 1 7  8  9  o 69.85000 0.7650000 70.02000 0.6800000 69.68000 1.371000  0.3365000      1.530000  
1 1 1 7  8  11 o 80.03000 0.5686000 80.48000 0.6996000 79.58000 0.8966000 0.8960000      1.137000  
1 1 1 7  8  13 o 52.53000 0.4841000 52.47000 0.7510000 52.59000 0.6110000 -0.1141000     0.9682000 
1 1 1 7  8  15 o 54.24000 0.3847000 54.08000 0.5415000 54.39000 0.5465000 -0.3085000     0.7694000 
1 1 1 7  8  17 o 123.9000 0.9133000 124.5000 1.202000  123.2000 1.375000  1.373000       1.827000  
1 1 1 7  8  19 o 58.37000 0.4277000 57.82000 0.6672000 58.92000 0.5354000 -1.099000      0.8554000 
1 1 1 7  8  21 o 75.95000 0.6269000 75.74000 1.056000  76.16000 0.6756000 -0.4148000     1.254000  
1 1 1 7  8  23 o 52.99000 0.4201000 52.82000 0.6275000 53.16000 0.5586000 -0.3427000     0.8401000 
1 1 1 7  8  25 o 53.43000 0.4043000 53.15000 0.6330000 53.70000 0.5032000 -0.5485000     0.8086000 
1 1 1 7  8  27 o 102.8000 0.8676000 102.6000 1.411000  103.0000 1.010000  -0.4867000     1.735000  
1 1 1 7  8  29 o 35.72000 0.3322000 36.21000 0.4988000 35.24000 0.4389000 0.9728000      0.6644000 
1 1 1 7  8  31 o 41.06000 0.3437000 41.15000 0.5395000 40.96000 0.4260000 0.1828000      0.6874000 
1 1 1 7  8  33 o 7.691000 0.6239000 7.441000 1.019000  7.941000 0.7206000 -0.5007000     1.248000  
1 1 1 7  8  35 o 44.15000 0.4351000 44.05000 0.7066000 44.25000 0.5079000 -0.2002000     0.8702000 
1 1 1 7  8  37 o 25.92000 0.3204000 26.19000 0.4766000 25.65000 0.4284000 0.5386000      0.6408000 
1 1 1 7  8  39 o 36.45000 0.3967000 36.53000 0.6400000 36.37000 0.4690000 0.1572000      0.7934000 
1 1 1 7  8  41 o 25.68000 0.3210000 26.13000 0.4983000 25.24000 0.4048000 0.8887000      0.6420000 
1 1 1 7  8  43 o 6.243000 0.9252000 4.866000 1.583000  7.620000 0.9580000 -2.754000      1.850000  
1 1 1 7  8  45 o 9.354000 0.7126000 9.388000 1.065000  9.320000 0.9476000 0.6814000E-01  1.425000  
1 1 1 7  8  47 o 11.57000 0.7073000 10.74000 1.248000  12.40000 0.6656000 -1.660000      1.415000  
1 1 1 7  8  49 o 11.12000 0.5726000 11.96000 0.8158000 10.28000 0.8036000 1.680000       1.145000  
1 1 1 7  8  51 o 30.06000 0.5012000 30.10000 0.8889000 30.03000 0.4633000 0.6925000E-01  1.002000  
1 1 1 7  8  53 o 16.79000 0.3984000 17.35000 0.6049000 16.22000 0.5187000 1.130000       0.7968000 
1 1 1 7  8  55 o 13.53000 0.4371000 13.93000 0.6947000 13.14000 0.5307000 0.7827000      0.8742000 
1 1 1 7  8  57 o 3.236000 0.9497000 3.215000 1.388000  3.256000 1.296000  -0.4159000E-01 1.899000  
1 1 1 7  8  59 o 14.24000 0.5185000 15.22000 0.8254000 13.26000 0.6276000 1.956000       1.037000  
1 1 1 7  8  61 o 8.678000 0.6987000 8.235000 1.168000  9.120000 0.7681000 -0.8847000     1.397000  
1 1 1 7  8  63 o 8.161000 0.7856000 8.151000 1.258000  8.171000 0.9411000 -0.1996000E-01 1.571000  
1 1 1 7  8  65 o 6.717000 0.8979000 7.239000 1.432000  6.195000 1.084000  1.044000       1.796000  
1 1 1 7  8  67 o 6.155000 1.202000  7.067000 1.517000  5.244000 1.865000  1.823000       2.404000  
1 1 1 7  9  0  o 8.609000 0.2132000 8.609000 0.2132000 8.609000 0.2132000 0.000000       0.000000  
1 1 1 7  9  2  o 37.80000 0.2702000 38.11000 0.3846000 37.49000 0.3795000 0.6256000      0.5403000 
1 1 1 7  9  4  o 39.56000 0.3304000 39.74000 0.4680000 39.38000 0.4664000 0.3618000      0.6607000 
1 1 1 7  9  6  o 60.59000 0.4877000 60.46000 0.6887000 60.73000 0.6908000 -0.2667000     0.9755000 
1 1 1 7  9  8  o 34.46000 0.3507000 34.46000 0.3507000 ?        ?         ?              ?         
1 1 1 7  9  10 o 72.38000 0.5794000 72.57000 0.8212000 72.19000 0.8176000 0.3856000      1.159000  
1 1 1 7  9  12 o 17.07000 0.2147000 16.93000 0.2910000 17.20000 0.3157000 -0.2694000     0.4294000 
1 1 1 7  9  14 o 51.01000 0.3636000 50.93000 0.5125000 51.09000 0.5159000 -0.1577000     0.7272000 
1 1 1 7  9  16 o 85.92000 0.5929000 85.51000 0.8334000 86.33000 0.8435000 -0.8276000     1.186000  
1 1 1 7  9  18 o 50.44000 0.3959000 50.12000 0.5116000 50.75000 0.6043000 -0.6283000     0.7918000 
1 1 1 7  9  20 o 92.94000 0.6608000 92.43000 1.038000  93.45000 0.8185000 -1.021000      1.322000  
1 1 1 7  9  22 o 31.80000 0.3362000 32.41000 0.5681000 31.19000 0.3596000 1.217000       0.6723000 
1 1 1 7  9  24 o 48.44000 0.4281000 49.08000 0.7216000 47.81000 0.4608000 1.275000       0.8562000 
1 1 1 7  9  26 o 8.180000 0.6200000 7.873000 1.037000  8.488000 0.6805000 -0.6152000     1.240000  
1 1 1 7  9  28 o 25.40000 0.3052000 25.53000 0.4546000 25.27000 0.4073000 0.2594000      0.6103000 
1 1 1 7  9  30 o 24.29000 0.2921000 24.39000 0.4527000 24.18000 0.3693000 0.2088000      0.5842000 
1 1 1 7  9  32 o 41.11000 0.3599000 40.94000 0.5338000 41.28000 0.4827000 -0.3467000     0.7197000 
1 1 1 7  9  34 o 52.40000 0.4077000 52.26000 0.6398000 52.54000 0.5054000 -0.2854000     0.8154000 
1 1 1 7  9  36 o 42.13000 0.4210000 41.91000 0.6828000 42.36000 0.4927000 -0.4476000     0.8420000 
1 1 1 7  9  38 o 28.69000 0.3933000 28.50000 0.6027000 28.88000 0.5055000 -0.3750000     0.7866000 
1 1 1 7  9  40 o 37.15000 0.3383000 36.48000 0.5215000 37.83000 0.4312000 -1.348000      0.6767000 
1 1 1 7  9  42 o 22.71000 0.3830000 22.87000 0.5314000 22.56000 0.5516000 0.3172000      0.7659000 
1 1 1 7  9  44 o 22.65000 0.3741000 22.01000 0.5647000 23.29000 0.4910000 -1.285000      0.7483000 
1 1 1 7  9  46 o 10.18000 0.6572000 9.823000 1.079000  10.54000 0.7507000 -0.7124000     1.314000  
1 1 1 7  9  48 o 37.92000 0.4555000 38.19000 0.7037000 37.64000 0.5784000 0.5480000      0.9109000 
1 1 1 7  9  50 o 8.093000 0.7587000 7.270000 1.302000  8.916000 0.7795000 -1.646000      1.517000  
1 1 1 7  9  52 o 8.705000 0.6551000 9.401000 0.9953000 8.010000 0.8521000 1.391000       1.310000  
1 1 1 7  9  54 o 4.460000 1.009000  4.284000 1.537000  4.636000 1.307000  -0.3518000     2.018000  
1 1 1 7  9  56 o 12.52000 0.4762000 12.83000 0.7369000 12.22000 0.6033000 0.6074000      0.9524000 
1 1 1 7  9  58 o 3.606000 0.9783000 3.341000 1.427000  3.872000 1.339000  -0.5309000     1.957000  
1 1 1 7  9  60 o 6.125000 0.8903000 5.571000 1.513000  6.679000 0.9383000 -1.108000      1.781000  
1 1 1 7  9  62 o 5.660000 1.004000  4.630000 1.655000  6.690000 1.138000  -2.060000      2.009000  
1 1 1 7  9  64 o 5.868000 1.088000  6.051000 1.767000  5.684000 1.269000  0.3674000      2.176000  
1 1 1 7  9  66 o 5.081000 1.052000  5.970000 1.606000  4.192000 1.360000  1.777000       2.105000  
1 1 1 7  10 1  o 33.62000 0.2449000 34.08000 0.3504000 33.15000 0.3422000 0.9334000      0.4898000 
1 1 1 7  10 3  o 52.80000 0.3996000 53.06000 0.5236000 52.54000 0.6039000 0.5280000      0.7993000 
1 1 1 7  10 5  o 38.89000 0.3638000 38.82000 0.5599000 38.96000 0.4648000 -0.1407000     0.7277000 
1 1 1 7  10 7  o 16.15000 0.3254000 15.72000 0.3430000 16.58000 0.5530000 -0.8545000     0.6508000 
1 1 1 7  10 9  f 46.56000 0.3445000 46.23000 0.4133000 46.90000 0.5513000 -0.6636000     0.6890000 
1 1 1 7  10 11 o 49.63000 0.3523000 50.08000 0.5020000 49.18000 0.4944000 0.9008000      0.7046000 
1 1 1 7  10 13 o 47.25000 0.3393000 47.73000 0.4840000 46.78000 0.4756000 0.9489000      0.6785000 
1 1 1 7  10 15 o 36.03000 0.2749000 36.25000 0.3892000 35.81000 0.3883000 0.4427000      0.5498000 
1 1 1 7  10 17 o 67.08000 0.4699000 67.04000 0.6632000 67.12000 0.6659000 -0.8292000E-01 0.9398000 
1 1 1 7  10 19 o 87.28000 0.6530000 87.07000 0.8504000 87.50000 0.9913000 -0.4309000     1.306000  
1 1 1 7  10 21 o 71.71000 0.5900000 70.88000 0.9866000 72.55000 0.6474000 -1.666000      1.180000  
1 1 1 7  10 23 o 21.14000 0.3383000 21.61000 0.5020000 20.66000 0.4536000 0.9524000      0.6766000 
1 1 1 7  10 25 o 41.41000 0.3839000 41.36000 0.6417000 41.45000 0.4214000 -0.8607000E-01 0.7677000 
1 1 1 7  10 27 o 91.38000 0.7330000 90.24000 1.021000  92.52000 1.052000  -2.277000      1.466000  
1 1 1 7  10 29 o 55.49000 0.4232000 56.13000 0.6698000 54.85000 0.5177000 1.288000       0.8465000 
1 1 1 7  10 31 o 20.53000 0.3117000 20.69000 0.4882000 20.37000 0.3878000 0.3199000      0.6235000 
1 1 1 7  10 33 o 31.91000 0.3243000 31.34000 0.4818000 32.49000 0.4343000 -1.143000      0.6486000 
1 1 1 7  10 35 o 25.55000 0.3041000 25.95000 0.4801000 25.15000 0.3735000 0.8057000      0.6083000 
1 1 1 7  10 37 o 29.51000 0.3286000 29.45000 0.4841000 29.57000 0.4445000 -0.1247000     0.6572000 
1 1 1 7  10 39 o 6.670000 0.8231000 6.626000 1.341000  6.713000 0.9549000 -0.8770000E-01 1.646000  
1 1 1 7  10 41 o 26.78000 0.4174000 26.31000 0.5158000 27.24000 0.6563000 -0.9271000     0.8347000 
1 1 1 7  10 43 o 38.72000 0.4079000 38.96000 0.6791000 38.47000 0.4519000 0.4953000      0.8158000 
1 1 1 7  10 45 o 13.74000 0.4819000 14.21000 0.7634000 13.26000 0.5882000 0.9493000      0.9637000 
1 1 1 7  10 47 o 8.812000 0.7252000 8.374000 1.193000  9.250000 0.8255000 -0.8764000     1.450000  
1 1 1 7  10 49 o 15.00000 0.4939000 13.83000 0.7141000 16.17000 0.6825000 -2.343000      0.9878000 
1 1 1 7  10 51 o 35.39000 0.5108000 35.65000 0.9272000 35.13000 0.4291000 0.5208000      1.022000  
1 1 1 7  10 53 o 13.33000 0.4892000 12.98000 0.7097000 13.68000 0.6735000 -0.7023000     0.9784000 
1 1 1 7  10 55 o 13.85000 0.4185000 14.34000 0.6502000 13.36000 0.5273000 0.9763000      0.8371000 
1 1 1 7  10 57 o 13.01000 0.4910000 13.27000 0.7319000 12.75000 0.6546000 0.5233000      0.9820000 
1 1 1 7  10 59 o 14.41000 0.5083000 14.53000 0.8089000 14.29000 0.6157000 0.2353000      1.017000  
1 1 1 7  10 61 o 11.89000 0.5456000 12.51000 0.7973000 11.27000 0.7451000 1.241000       1.091000  
1 1 1 7  10 63 f 4.167000 1.057000  3.837000 1.552000  4.496000 1.436000  -0.6591000     2.114000  
1 1 1 7  10 65 f 5.057000 1.038000  5.158000 1.619000  4.955000 1.299000  0.2027000      2.075000  
1 1 1 7  11 0  o 68.78000 0.6706000 68.78000 0.6706000 68.78000 0.6706000 0.000000       0.000000  
1 1 1 7  11 2  f 35.18000 0.2915000 34.98000 0.4101000 35.39000 0.4143000 -0.4050000     0.5829000 
1 1 1 7  11 4  o 27.16000 0.3003000 27.69000 0.4276000 26.62000 0.4216000 1.063000       0.6005000 
1 1 1 7  11 6  o 50.01000 0.4585000 49.40000 0.5736000 50.61000 0.7155000 -1.209000      0.9170000 
1 1 1 7  11 8  f 85.72000 0.7233000 85.64000 0.8328000 85.79000 1.183000  -0.1460000     1.447000  
1 1 1 7  11 10 o 63.88000 0.4444000 63.58000 0.6255000 64.17000 0.6314000 -0.5902000     0.8888000 
1 1 1 7  11 12 o 33.42000 0.2759000 33.69000 0.4189000 33.15000 0.3593000 0.5420000      0.5519000 
1 1 1 7  11 14 o 34.20000 0.2631000 34.26000 0.3718000 34.13000 0.3724000 0.1350000      0.5262000 
1 1 1 7  11 16 o 72.99000 0.5081000 73.59000 0.7231000 72.40000 0.7139000 1.192000       1.016000  
1 1 1 7  11 18 o 113.7000 0.8427000 113.2000 1.096000  114.2000 1.280000  -1.004000      1.685000  
1 1 1 7  11 20 o 157.2000 1.159000  158.6000 1.762000  155.8000 1.505000  2.830000       2.317000  
1 1 1 7  11 22 o 30.56000 0.3638000 31.15000 0.5646000 29.96000 0.4588000 1.195000       0.7275000 
1 1 1 7  11 24 o 22.89000 0.3277000 23.34000 0.5524000 22.45000 0.3527000 0.8859000      0.6554000 
1 1 1 7  11 26 o 68.05000 0.5915000 68.04000 0.9607000 68.07000 0.6903000 -0.3157000E-01 1.183000  
1 1 1 7  11 28 o 24.78000 0.2978000 24.28000 0.4369000 25.28000 0.4047000 -1.003000      0.5955000 
1 1 1 7  11 30 o 52.08000 0.4027000 52.72000 0.6372000 51.45000 0.4927000 1.275000       0.8055000 
1 1 1 7  11 32 o 9.074000 0.5222000 9.954000 0.7561000 8.193000 0.7206000 1.761000       1.044000  
1 1 1 7  11 34 o 40.23000 0.3431000 40.46000 0.5393000 40.00000 0.4243000 0.4578000      0.6862000 
1 1 1 7  11 36 o 36.50000 0.3951000 36.35000 0.6415000 36.65000 0.4614000 -0.2995000     0.7903000 
1 1 1 7  11 38 o 13.61000 0.4851000 13.45000 0.8140000 13.77000 0.5278000 -0.3284000     0.9701000 
1 1 1 7  11 40 o 32.27000 0.3712000 31.27000 0.5094000 33.26000 0.5401000 -1.992000      0.7425000 
1 1 1 7  11 42 f 16.20000 0.4359000 15.32000 0.6825000 17.07000 0.5425000 -1.756000      0.8719000 
1 1 1 7  11 44 o 27.30000 0.3418000 27.17000 0.5340000 27.43000 0.4269000 -0.2581000     0.6836000 
1 1 1 7  11 46 o 14.76000 0.4595000 15.04000 0.6925000 14.48000 0.6041000 0.5568000      0.9190000 
1 1 1 7  11 48 o 30.99000 0.3915000 29.66000 0.5417000 32.32000 0.5654000 -2.664000      0.7830000 
1 1 1 7  11 50 o 7.072000 0.9811000 7.199000 1.603000  6.945000 1.132000  0.2538000      1.962000  
1 1 1 7  11 52 o 8.004000 0.7526000 7.785000 1.179000  8.222000 0.9360000 -0.4363000     1.505000  
1 1 1 7  11 54 o 9.349000 0.5602000 8.873000 0.9076000 9.826000 0.6567000 -0.9533000     1.120000  
1 1 1 7  11 56 o 5.334000 0.9661000 5.325000 1.544000  5.343000 1.162000  -0.1801000E-01 1.932000  
1 1 1 7  11 58 o 3.634000 0.9949000 3.661000 1.463000  3.606000 1.349000  0.5568000E-01  1.990000  
1 1 1 7  11 60 o 6.165000 1.251000  6.319000 2.116000  6.012000 1.334000  0.3062000      2.501000  
1 1 1 7  11 62 o 5.806000 1.182000  7.444000 1.819000  4.168000 1.508000  3.277000       2.363000  
1 1 1 7  11 64 f 10.01000 0.6237000 9.683000 0.9690000 10.33000 0.7854000 -0.6514000     1.247000  
1 1 1 7  11 66 o 7.465000 0.8441000 8.016000 1.349000  6.915000 1.015000  1.100000       1.688000  
1 1 1 7  12 1  o 35.40000 0.2946000 35.01000 0.4125000 35.79000 0.4208000 -0.7780000     0.5893000 
1 1 1 7  12 3  o 53.73000 0.4892000 53.14000 0.6109000 54.32000 0.7643000 -1.183000      0.9785000 
1 1 1 7  12 5  o 51.69000 0.4724000 51.75000 0.5979000 51.62000 0.7316000 0.1305000      0.9449000 
1 1 1 7  12 7  o 37.31000 0.3615000 38.10000 0.4633000 36.52000 0.5551000 1.577000       0.7230000 
1 1 1 7  12 9  f 33.67000 0.2530000 33.78000 0.3579000 33.57000 0.3578000 0.2132000      0.5060000 
1 1 1 7  12 11 o 92.54000 0.6866000 92.89000 1.041000  92.19000 0.8953000 0.7072000      1.373000  
1 1 1 7  12 13 o 66.04000 0.4608000 66.12000 0.6518000 65.97000 0.6516000 0.1509000      0.9216000 
1 1 1 7  12 15 o 70.93000 0.4945000 71.39000 0.7026000 70.47000 0.6960000 0.9210000      0.9890000 
1 1 1 7  12 17 o 78.50000 0.5454000 77.69000 0.7624000 79.31000 0.7802000 -1.624000      1.091000  
1 1 1 7  12 19 o 108.5000 0.8049000 108.9000 1.057000  108.0000 1.214000  0.9535000      1.610000  
1 1 1 7  12 21 o 61.49000 0.4730000 61.20000 0.7078000 61.78000 0.6278000 -0.5717000     0.9461000 
1 1 1 7  12 23 o 54.24000 0.6155000 54.16000 1.121000  54.32000 0.5082000 -0.1548000     1.231000  
1 1 1 7  12 25 o 51.36000 0.4624000 51.08000 0.7463000 51.65000 0.5461000 -0.5682000     0.9248000 
1 1 1 7  12 27 o 42.97000 0.3667000 42.72000 0.5430000 43.21000 0.4931000 -0.4834000     0.7335000 
1 1 1 7  12 29 o 52.00000 0.4032000 53.14000 0.6387000 50.86000 0.4924000 2.275000       0.8064000 
1 1 1 7  12 31 o 77.96000 0.5697000 79.01000 0.9048000 76.91000 0.6926000 2.098000       1.139000  
1 1 1 7  12 33 o 50.22000 0.4140000 50.33000 0.6192000 50.10000 0.5496000 0.2260000      0.8279000 
1 1 1 7  12 35 o 23.37000 0.3545000 22.86000 0.6007000 23.89000 0.3768000 -1.032000      0.7091000 
1 1 1 7  12 37 o 39.23000 0.3994000 39.64000 0.6761000 38.82000 0.4253000 0.8259000      0.7988000 
1 1 1 7  12 39 o 16.77000 0.5309000 17.10000 0.9605000 16.44000 0.4526000 0.6598000      1.062000  
1 1 1 7  12 41 o 22.29000 0.3540000 21.94000 0.5293000 22.65000 0.4702000 -0.7087000     0.7080000 
1 1 1 7  12 43 o 13.73000 0.4699000 13.90000 0.7507000 13.55000 0.5654000 0.3544000      0.9398000 
1 1 1 7  12 45 o 24.85000 0.3466000 24.35000 0.5412000 25.36000 0.4330000 -1.009000      0.6931000 
1 1 1 7  12 47 o 17.83000 0.3980000 18.25000 0.6152000 17.41000 0.5050000 0.8427000      0.7960000 
1 1 1 7  12 49 o 15.56000 0.4860000 14.97000 0.7985000 16.15000 0.5541000 -1.183000      0.9719000 
1 1 1 7  12 51 o 14.06000 0.5172000 14.64000 0.8605000 13.49000 0.5742000 1.150000       1.034000  
1 1 1 7  12 53 o 15.39000 0.4759000 15.71000 0.6249000 15.06000 0.7179000 0.6444000      0.9517000 
1 1 1 7  12 55 o 16.51000 0.3923000 16.93000 0.6167000 16.09000 0.4850000 0.8368000      0.7846000 
1 1 1 7  12 57 o 5.130000 0.9784000 5.871000 1.461000  4.390000 1.302000  1.480000       1.957000  
1 1 1 7  12 59 o 11.43000 0.5287000 11.67000 0.8176000 11.19000 0.6706000 0.4789000      1.057000  
1 1 1 7  12 61 o 3.021000 0.9204000 2.565000 1.233000  3.477000 1.367000  -0.9117000     1.841000  
1 1 1 7  12 63 o 6.993000 0.7782000 7.494000 1.157000  6.492000 1.041000  1.001000       1.556000  
1 1 1 7  12 65 o 3.174000 0.9608000 3.383000 1.471000  2.965000 1.236000  0.4181000      1.922000  
1 1 1 7  13 0  o 72.04000 1.004000  72.04000 1.004000  72.04000 1.004000  0.000000       0.000000  
1 1 1 7  13 2  o 65.92000 0.4722000 65.95000 0.7480000 65.90000 0.5764000 0.4590000E-01  0.9444000 
1 1 1 7  13 4  o 74.76000 0.5970000 74.38000 0.8393000 75.14000 0.8493000 -0.7648000     1.194000  
1 1 1 7  13 6  o 64.21000 0.5182000 63.98000 0.7295000 64.43000 0.7362000 -0.4507000     1.036000  
1 1 1 7  13 8  o 42.68000 0.4061000 42.76000 0.5112000 42.59000 0.6310000 0.1774000      0.8121000 
1 1 1 7  13 10 o 78.06000 0.5389000 78.10000 0.7623000 78.01000 0.7620000 0.9063000E-01  1.078000  
1 1 1 7  13 12 o 52.02000 0.3707000 51.88000 0.5219000 52.17000 0.5266000 -0.2890000     0.7414000 
1 1 1 7  13 14 o 107.6000 0.7377000 107.4000 1.041000  107.8000 1.045000  -0.4226000     1.475000  
1 1 1 7  13 16 o 53.10000 0.3819000 53.41000 0.5414000 52.79000 0.5389000 0.6257000      0.7638000 
1 1 1 7  13 18 o 95.25000 0.6576000 93.64000 0.9140000 96.85000 0.9457000 -3.205000      1.315000  
1 1 1 7  13 20 o 26.92000 0.3273000 27.10000 0.3660000 26.74000 0.5427000 0.3608000      0.6546000 
1 1 1 7  13 22 o 43.78000 0.5530000 43.36000 0.9458000 44.21000 0.5733000 -0.8470000     1.106000  
1 1 1 7  13 24 o 36.02000 0.3240000 36.67000 0.4891000 35.37000 0.4250000 1.301000       0.6479000 
1 1 1 7  13 26 o 32.74000 0.2992000 32.19000 0.4567000 33.28000 0.3868000 -1.084000      0.5985000 
1 1 1 7  13 28 o 31.78000 0.3023000 31.76000 0.4691000 31.80000 0.3816000 -0.3089000E-01 0.6047000 
1 1 1 7  13 30 o 54.14000 0.4141000 53.42000 0.6436000 54.87000 0.5212000 -1.445000      0.8281000 
1 1 1 7  13 32 o 15.86000 0.3439000 16.32000 0.5314000 15.41000 0.4365000 0.9136000      0.6877000 
1 1 1 7  13 34 o 15.99000 0.4331000 16.26000 0.7066000 15.71000 0.5010000 0.5483000      0.8662000 
1 1 1 7  13 36 o 22.93000 0.3796000 22.73000 0.5736000 23.14000 0.4974000 -0.4176000     0.7593000 
1 1 1 7  13 38 o 35.62000 0.4914000 35.61000 0.8907000 35.62000 0.4156000 -0.9396000E-02 0.9829000 
1 1 1 7  13 40 o 21.63000 0.3400000 21.82000 0.5355000 21.45000 0.4192000 0.3736000      0.6800000 
1 1 1 7  13 42 o 17.09000 0.3948000 16.22000 0.6121000 17.96000 0.4988000 -1.741000      0.7896000 
1 1 1 7  13 44 o 23.88000 0.3558000 22.95000 0.5598000 24.80000 0.4392000 -1.846000      0.7115000 
1 1 1 7  13 46 o 10.70000 0.5964000 10.92000 0.9099000 10.47000 0.7712000 0.4452000      1.193000  
1 1 1 7  13 48 o 23.56000 0.3537000 23.84000 0.5551000 23.27000 0.4384000 0.5693000      0.7074000 
1 1 1 7  13 50 f 24.50000 0.3842000 24.59000 0.6525000 24.41000 0.4059000 0.1839000      0.7685000 
1 1 1 7  13 52 o 6.568000 0.8102000 5.747000 1.361000  7.388000 0.8795000 -1.641000      1.620000  
1 1 1 7  13 54 o 13.75000 0.4232000 14.22000 0.6753000 13.28000 0.5102000 0.9375000      0.8464000 
1 1 1 7  13 56 o 4.301000 0.9783000 3.780000 1.528000  4.822000 1.222000  -1.042000      1.957000  
1 1 1 7  13 58 o 3.870000 1.032000  3.717000 1.472000  4.024000 1.448000  -0.3075000     2.065000  
1 1 1 7  13 60 o 5.639000 1.287000  6.628000 2.201000  4.650000 1.333000  1.978000       2.573000  
1 1 1 7  13 62 o 5.665000 1.112000  5.457000 1.759000  5.873000 1.362000  -0.4163000     2.224000  
1 1 1 7  13 64 o 3.560000 1.012000  4.028000 1.536000  3.093000 1.319000  0.9351000      2.025000  
1 1 1 7  13 66 o 3.804000 1.123000  3.720000 1.590000  3.888000 1.587000  -0.1677000     2.246000  
1 1 1 7  14 1  o 45.74000 0.3528000 45.31000 0.5314000 46.17000 0.4641000 -0.8658000     0.7055000 
1 1 1 7  14 3  f 52.74000 0.4019000 53.00000 0.6124000 52.47000 0.5206000 0.5286000      0.8038000 
1 1 1 7  14 5  o 37.17000 0.3229000 36.94000 0.4530000 37.40000 0.4602000 -0.4612000     0.6457000 
1 1 1 7  14 7  o 114.0000 1.006000  114.8000 1.283000  113.2000 1.550000  1.614000       2.012000  
1 1 1 7  14 9  o 63.82000 0.4456000 63.02000 0.6222000 64.62000 0.6380000 -1.601000      0.8912000 
1 1 1 7  14 11 o 39.27000 0.3140000 38.52000 0.4669000 40.03000 0.4200000 -1.515000      0.6280000 
1 1 1 7  14 13 o 17.42000 0.1967000 17.51000 0.2740000 17.32000 0.2822000 0.1928000      0.3933000 
1 1 1 7  14 15 o 89.17000 0.6152000 89.02000 0.8680000 89.33000 0.8720000 -0.3108000     1.230000  
1 1 1 7  14 17 o 17.01000 0.2900000 17.19000 0.3946000 16.83000 0.4250000 0.3631000      0.5800000 
1 1 1 7  14 19 o 123.9000 1.039000  124.7000 1.207000  123.1000 1.691000  1.575000       2.077000  
1 1 1 7  14 21 o 31.58000 0.2999000 31.98000 0.3956000 31.19000 0.4510000 0.7922000      0.5999000 
1 1 1 7  14 23 o 32.10000 0.3556000 32.11000 0.5839000 32.08000 0.4060000 0.2373000E-01  0.7111000 
1 1 1 7  14 25 o 56.47000 0.4860000 56.47000 0.8150000 56.48000 0.5298000 -0.1552000E-01 0.9721000 
1 1 1 7  14 27 o 41.78000 0.3604000 42.01000 0.5387000 41.55000 0.4789000 0.4670000      0.7208000 
1 1 1 7  14 29 o 53.66000 0.4131000 54.64000 0.6558000 52.69000 0.5023000 1.960000       0.8261000 
1 1 1 7  14 31 o 28.94000 0.3158000 28.83000 0.4646000 29.05000 0.4280000 -0.2124000     0.6316000 
1 1 1 7  14 33 o 12.58000 0.4560000 13.04000 0.6544000 12.12000 0.6351000 0.9222000      0.9119000 
1 1 1 7  14 35 o 26.39000 0.3760000 26.66000 0.5811000 26.13000 0.4772000 0.5355000      0.7520000 
1 1 1 7  14 37 o 27.76000 0.3673000 27.88000 0.6243000 27.65000 0.3871000 0.2345000      0.7345000 
1 1 1 7  14 39 o 44.55000 0.3950000 44.75000 0.5937000 44.36000 0.5212000 0.3868000      0.7900000 
1 1 1 7  14 41 o 50.05000 0.4212000 50.07000 0.6328000 50.03000 0.5560000 0.3905000E-01  0.8424000 
1 1 1 7  14 43 o 32.08000 0.3385000 32.83000 0.5275000 31.33000 0.4243000 1.502000       0.6770000 
1 1 1 7  14 45 o 14.63000 0.4667000 14.73000 0.7446000 14.52000 0.5629000 0.2112000      0.9335000 
1 1 1 7  14 47 o 24.37000 0.3779000 25.02000 0.5352000 23.71000 0.5336000 1.308000       0.7558000 
1 1 1 7  14 49 o 10.01000 0.7254000 8.878000 1.306000  11.15000 0.6314000 -2.272000      1.451000  
1 1 1 7  14 51 o 8.391000 0.7784000 8.555000 1.265000  8.227000 0.9070000 0.3276000      1.557000  
1 1 1 7  14 53 o 7.489000 0.7643000 7.152000 1.220000  7.827000 0.9211000 -0.6752000     1.529000  
1 1 1 7  14 55 o 5.797000 0.9248000 5.037000 1.564000  6.558000 0.9869000 -1.521000      1.850000  
1 1 1 7  14 57 o 11.75000 0.5343000 12.82000 0.7381000 10.68000 0.7728000 2.142000       1.069000  
1 1 1 7  14 59 o 5.821000 1.129000  6.832000 1.801000  4.811000 1.362000  2.021000       2.258000  
1 1 1 7  14 61 o 7.105000 0.9279000 7.086000 1.427000  7.125000 1.186000  -0.3980000E-01 1.856000  
1 1 1 7  14 63 o 7.757000 0.7296000 7.940000 1.134000  7.574000 0.9178000 0.3664000      1.459000  
1 1 1 7  14 65 o 5.914000 1.014000  6.077000 1.693000  5.751000 1.116000  0.3257000      2.028000  
1 1 1 7  15 0  o 93.18000 0.9030000 93.18000 0.9030000 93.18000 0.9030000 0.000000       0.000000  
1 1 1 7  15 2  o 19.56000 0.2391000 19.18000 0.3687000 19.93000 0.3044000 -0.7487000     0.4781000 
1 1 1 7  15 4  o 21.05000 0.2426000 21.75000 0.4306000 20.35000 0.2233000 1.400000       0.4851000 
1 1 1 7  15 6  o 63.32000 0.5753000 63.37000 0.7259000 63.28000 0.8928000 0.8988000E-01  1.151000  
1 1 1 7  15 8  o 66.44000 0.5391000 65.83000 0.7541000 67.06000 0.7706000 -1.233000      1.078000  
1 1 1 7  15 10 o 180.8000 1.330000  181.4000 2.015000  180.2000 1.735000  1.156000       2.659000  
1 1 1 7  15 12 o 45.35000 0.3317000 45.54000 0.4691000 45.16000 0.4690000 0.3820000      0.6633000 
1 1 1 7  15 14 o 12.35000 0.2279000 11.97000 0.3282000 12.74000 0.3162000 -0.7631000     0.4558000 
1 1 1 7  15 16 o 11.81000 0.3259000 11.39000 0.5344000 12.24000 0.3732000 -0.8458000     0.6518000 
1 1 1 7  15 18 o 47.54000 0.3804000 47.67000 0.5001000 47.41000 0.5735000 0.2571000      0.7609000 
1 1 1 7  15 20 o 98.68000 0.7372000 98.62000 0.9614000 98.74000 1.118000  -0.1216000     1.474000  
1 1 1 7  15 22 o 80.98000 0.9048000 82.47000 1.629000  79.48000 0.7887000 2.988000       1.810000  
1 1 1 7  15 24 o 43.52000 0.3944000 43.12000 0.6550000 43.92000 0.4395000 -0.7998000     0.7888000 
1 1 1 7  15 26 o 26.35000 0.3037000 26.10000 0.4556000 26.60000 0.4018000 -0.5025000     0.6075000 
1 1 1 7  15 28 o 10.98000 0.4441000 11.43000 0.6803000 10.53000 0.5710000 0.8970000      0.8882000 
1 1 1 7  15 30 o 19.18000 0.3119000 18.84000 0.4860000 19.52000 0.3910000 -0.6740000     0.6238000 
1 1 1 7  15 32 o 35.20000 0.3785000 36.43000 0.6112000 33.97000 0.4465000 2.461000       0.7570000 
1 1 1 7  15 34 o 67.27000 0.5623000 66.69000 0.7818000 67.84000 0.8084000 -1.147000      1.125000  
1 1 1 7  15 36 o 27.35000 0.3157000 27.06000 0.4967000 27.64000 0.3898000 -0.5820000     0.6314000 
1 1 1 7  15 38 o 41.84000 0.5510000 42.13000 0.9809000 41.54000 0.5021000 0.5887000      1.102000  
1 1 1 7  15 40 o 16.27000 0.3985000 15.68000 0.6434000 16.87000 0.4702000 -1.187000      0.7969000 
1 1 1 7  15 42 o 7.465000 0.8136000 7.968000 1.277000  6.962000 1.009000  1.006000       1.627000  
1 1 1 7  15 44 o 40.27000 0.3637000 40.68000 0.5698000 39.87000 0.4521000 0.8076000      0.7274000 
1 1 1 7  15 46 f 17.37000 0.4050000 16.88000 0.6577000 17.86000 0.4727000 -0.9750000     0.8100000 
1 1 1 7  15 48 o 24.60000 0.3576000 24.74000 0.5416000 24.46000 0.4671000 0.2748000      0.7152000 
1 1 1 7  15 50 o 20.81000 0.4608000 21.36000 0.7105000 20.26000 0.5869000 1.100000       0.9216000 
1 1 1 7  15 52 o 2.990000 0.8828000 2.587000 1.217000  3.393000 1.279000  -0.8054000     1.766000  
1 1 1 7  15 54 o 9.174000 0.6077000 9.603000 0.9336000 8.745000 0.7781000 0.8585000      1.215000  
1 1 1 7  15 56 o 8.020000 0.6614000 8.522000 0.9628000 7.518000 0.9070000 1.004000       1.323000  
1 1 1 7  15 58 o 13.10000 0.6488000 13.31000 0.7697000 12.89000 1.045000  0.4203000      1.298000  
1 1 1 7  15 60 o 10.70000 0.5649000 9.956000 0.9496000 11.45000 0.6121000 -1.499000      1.130000  
1 1 1 7  15 62 o 7.779000 0.8750000 7.679000 1.429000  7.878000 1.010000  -0.1996000     1.750000  
1 1 1 7  15 64 o 3.836000 1.074000  4.221000 1.658000  3.450000 1.365000  0.7713000      2.147000  
1 1 1 7  16 1  o 56.84000 0.4322000 55.92000 0.6468000 57.76000 0.5736000 -1.838000      0.8645000 
1 1 1 7  16 3  o 30.25000 0.2348000 30.07000 0.3356000 30.43000 0.3286000 -0.3565000     0.4696000 
1 1 1 7  16 5  o 79.14000 0.5465000 79.41000 0.7749000 78.87000 0.7710000 0.5379000      1.093000  
1 1 1 7  16 7  f 46.63000 0.3879000 46.47000 0.5474000 46.79000 0.5498000 -0.3163000     0.7759000 
1 1 1 7  16 9  o 61.28000 0.4685000 60.89000 0.6054000 61.68000 0.7152000 -0.7929000     0.9370000 
1 1 1 7  16 11 o 99.21000 0.6820000 98.17000 0.9543000 100.2000 0.9746000 -2.073000      1.364000  
1 1 1 7  16 13 o 94.19000 0.6493000 93.56000 0.9111000 94.82000 0.9254000 -1.255000      1.299000  
1 1 1 7  16 15 o 83.15000 0.5775000 82.99000 0.8145000 83.32000 0.8188000 -0.3269000     1.155000  
1 1 1 7  16 17 o 58.41000 0.4507000 58.26000 0.5897000 58.55000 0.6818000 -0.2919000     0.9015000 
1 1 1 7  16 19 o 99.08000 0.7392000 100.1000 0.9754000 98.06000 1.111000  2.033000       1.478000  
1 1 1 7  16 21 o 43.68000 0.4290000 44.69000 0.6673000 42.68000 0.5392000 2.015000       0.8580000 
1 1 1 7  16 23 o 33.83000 0.4664000 33.02000 0.8256000 34.64000 0.4341000 -1.619000      0.9328000 
1 1 1 7  16 25 o 33.41000 0.3042000 33.60000 0.4720000 33.22000 0.3840000 0.3783000      0.6085000 
1 1 1 7  16 27 o 43.18000 0.3517000 42.47000 0.5418000 43.88000 0.4485000 -1.413000      0.7033000 
1 1 1 7  16 29 o 25.47000 0.3089000 25.15000 0.4568000 25.79000 0.4160000 -0.6367000     0.6179000 
1 1 1 7  16 31 f 13.86000 0.4162000 13.86000 0.6924000 13.86000 0.4622000 -0.6400000E-02 0.8325000 
1 1 1 7  16 33 o 27.28000 0.3054000 26.78000 0.4781000 27.78000 0.3801000 -0.9979000     0.6108000 
1 1 1 7  16 35 o 30.10000 0.3169000 30.65000 0.4977000 29.54000 0.3923000 1.109000       0.6337000 
1 1 1 7  16 37 o 22.93000 0.5290000 22.30000 0.9548000 23.56000 0.4559000 -1.260000      1.058000  
1 1 1 7  16 39 o 11.99000 0.4924000 11.78000 0.7988000 12.20000 0.5759000 -0.4215000     0.9848000 
1 1 1 7  16 41 o 40.40000 0.3785000 40.58000 0.5668000 40.21000 0.5019000 0.3709000      0.7571000 
1 1 1 7  16 43 o 30.44000 0.3515000 30.80000 0.5292000 30.09000 0.4626000 0.7152000      0.7029000 
1 1 1 7  16 45 o 9.514000 0.6329000 9.835000 1.003000  9.193000 0.7722000 0.6416000      1.266000  
1 1 1 7  16 47 o 12.59000 0.5514000 13.40000 0.7581000 11.79000 0.8008000 1.611000       1.103000  
1 1 1 7  16 49 o 24.39000 0.3869000 24.39000 0.6509000 24.39000 0.4183000 0.3807000E-02  0.7737000 
1 1 1 7  16 51 o 6.046000 0.9376000 6.922000 1.499000  5.171000 1.126000  1.751000       1.875000  
1 1 1 7  16 53 o 10.44000 0.5486000 10.55000 0.8649000 10.34000 0.6753000 0.2071000      1.097000  
1 1 1 7  16 55 o 3.660000 0.9754000 4.452000 1.529000  2.869000 1.212000  1.584000       1.951000  
1 1 1 7  16 57 o 3.113000 0.9383000 3.441000 1.440000  2.785000 1.203000  0.6558000      1.877000  
1 1 1 7  16 59 o 8.204000 0.8910000 8.141000 1.601000  8.267000 0.7832000 -0.1264000     1.782000  
1 1 1 7  16 61 o 4.230000 1.046000  5.524000 1.701000  2.936000 1.218000  2.588000       2.092000  
1 1 1 7  16 63 o 6.186000 0.9931000 6.957000 1.536000  5.415000 1.259000  1.542000       1.986000  
1 1 1 7  16 65 o 3.884000 1.092000  4.165000 1.672000  3.604000 1.403000  0.5605000      2.183000  
1 1 1 7  17 0  o 83.78000 0.8173000 83.78000 0.8173000 83.78000 0.8173000 0.000000       0.000000  
1 1 1 7  17 2  o 75.57000 0.5228000 76.33000 0.7474000 74.81000 0.7312000 1.524000       1.046000  
1 1 1 7  17 4  o 48.84000 0.3497000 48.84000 0.4968000 48.85000 0.4924000 -0.1232000E-01 0.6995000 
1 1 1 7  17 6  o 32.93000 0.2748000 32.68000 0.3565000 33.17000 0.4183000 -0.4926000     0.5496000 
1 1 1 7  17 8  o 38.68000 0.3331000 38.81000 0.4727000 38.54000 0.4694000 0.2727000      0.6662000 
1 1 1 7  17 10 f 122.1000 0.9645000 123.3000 1.377000  120.8000 1.351000  2.461000       1.929000  
1 1 1 7  17 12 o 70.26000 0.5309000 70.18000 0.8000000 70.34000 0.6982000 -0.1614000     1.062000  
1 1 1 7  17 14 o 112.3000 0.7706000 111.7000 1.083000  113.0000 1.097000  -1.288000      1.541000  
1 1 1 7  17 16 o 55.86000 0.4347000 55.65000 0.5674000 56.07000 0.6587000 -0.4223000     0.8694000 
1 1 1 7  17 18 f 116.5000 0.8004000 117.6000 1.141000  115.3000 1.123000  2.244000       1.601000  
1 1 1 7  17 20 o 77.99000 0.7719000 77.67000 1.078000  78.30000 1.105000  -0.6295000     1.544000  
1 1 1 7  17 22 o 81.36000 0.5704000 81.96000 0.8104000 80.77000 0.8030000 1.194000       1.141000  
1 1 1 7  17 24 o 79.07000 0.8587000 79.00000 1.565000  79.14000 0.7079000 -0.1410000     1.717000  
1 1 1 7  17 26 o 32.00000 0.3163000 31.56000 0.4675000 32.43000 0.4262000 -0.8665000     0.6326000 
1 1 1 7  17 28 o 27.29000 0.3391000 27.28000 0.5442000 27.29000 0.4048000 -0.3435000E-02 0.6782000 
1 1 1 7  17 30 o 23.07000 0.2940000 22.94000 0.4583000 23.19000 0.3686000 -0.2506000     0.5881000 
1 1 1 7  17 32 o 26.29000 0.3014000 26.53000 0.4736000 26.04000 0.3730000 0.4820000      0.6029000 
1 1 1 7  17 34 o 14.05000 0.4558000 14.53000 0.6096000 13.57000 0.6777000 0.9564000      0.9116000 
1 1 1 7  17 36 o 23.58000 0.3307000 23.44000 0.4925000 23.73000 0.4415000 -0.2906000     0.6614000 
1 1 1 7  17 38 o 9.402000 0.8720000 9.739000 1.592000  9.066000 0.7119000 0.6732000      1.744000  
1 1 1 7  17 40 o 17.62000 0.3792000 17.86000 0.5785000 17.37000 0.4905000 0.4864000      0.7585000 
1 1 1 7  17 42 o 4.756000 1.054000  5.393000 1.635000  4.118000 1.329000  1.275000       2.107000  
1 1 1 7  17 44 o 17.21000 0.4001000 17.04000 0.6317000 17.39000 0.4913000 -0.3492000     0.8002000 
1 1 1 7  17 46 o 7.984000 0.8177000 7.340000 1.290000  8.629000 1.005000  -1.289000      1.635000  
1 1 1 7  17 48 o 10.80000 0.5289000 9.679000 0.9109000 11.92000 0.5380000 -2.236000      1.058000  
1 1 1 7  17 50 o 9.685000 0.6430000 10.28000 1.064000  9.087000 0.7222000 1.196000       1.286000  
1 1 1 7  17 52 o 4.596000 0.9805000 4.108000 1.534000  5.084000 1.222000  -0.9764000     1.961000  
1 1 1 7  17 54 f 9.628000 0.5927000 9.583000 0.9301000 9.674000 0.7349000 -0.9075000E-01 1.185000  
1 1 1 7  17 56 o 3.927000 1.011000  4.373000 1.528000  3.481000 1.325000  0.8918000      2.022000  
1 1 1 7  17 58 o 6.035000 0.8878000 6.850000 1.322000  5.220000 1.185000  1.631000       1.776000  
1 1 1 7  17 60 o 6.100000 0.9781000 5.619000 1.657000  6.580000 1.040000  -0.9608000     1.956000  
1 1 1 7  17 62 o 10.04000 0.7330000 10.35000 0.9221000 9.719000 1.140000  0.6340000      1.466000  
1 1 1 7  17 64 o 10.15000 0.6414000 10.61000 1.067000  9.689000 0.7124000 0.9217000      1.283000  
1 1 1 7  18 1  o 41.99000 0.3079000 42.13000 0.4381000 41.85000 0.4329000 0.2820000      0.6159000 
1 1 1 7  18 3  o 31.46000 0.2913000 31.20000 0.4143000 31.71000 0.4096000 -0.5014000     0.5826000 
1 1 1 7  18 5  o 60.98000 0.4641000 60.78000 0.6040000 61.18000 0.7046000 -0.3999000     0.9281000 
1 1 1 7  18 7  o 107.2000 0.7605000 106.7000 0.9253000 107.7000 1.207000  -0.9517000     1.521000  
1 1 1 7  18 9  o 144.0000 1.202000  143.3000 1.958000  144.6000 1.396000  -1.341000      2.405000  
1 1 1 7  18 11 o 137.9000 0.9421000 139.8000 1.350000  136.0000 1.314000  3.773000       1.884000  
1 1 1 7  18 13 o 126.4000 0.9983000 126.4000 1.411000  126.5000 1.413000  -0.1142000     1.997000  
1 1 1 7  18 15 o 116.3000 0.8609000 116.0000 1.124000  116.5000 1.304000  -0.5320000     1.722000  
1 1 1 7  18 17 f 59.75000 0.4675000 59.92000 0.6077000 59.59000 0.7106000 0.3258000      0.9350000 
1 1 1 7  18 19 o 51.09000 0.4882000 51.32000 0.7465000 50.86000 0.6293000 0.4543000      0.9764000 
1 1 1 7  18 21 o 35.38000 0.3316000 35.26000 0.4204000 35.49000 0.5130000 -0.2315000     0.6633000 
1 1 1 7  18 23 o 30.76000 0.4553000 31.08000 0.8188000 30.44000 0.3984000 0.6399000      0.9106000 
1 1 1 7  18 25 o 60.75000 0.5411000 62.24000 0.8880000 59.27000 0.6185000 2.965000       1.082000  
1 1 1 7  18 27 o 38.17000 0.3458000 38.90000 0.5189000 37.45000 0.4573000 1.447000       0.6917000 
1 1 1 7  18 29 o 26.68000 0.2937000 26.81000 0.4565000 26.54000 0.3696000 0.2732000      0.5873000 
1 1 1 7  18 31 o 36.46000 0.3250000 36.43000 0.5048000 36.50000 0.4094000 -0.6534000E-01 0.6500000 
1 1 1 7  18 33 o 41.04000 0.3639000 41.13000 0.5441000 40.96000 0.4834000 0.1687000      0.7278000 
1 1 1 7  18 35 o 25.69000 0.3092000 25.84000 0.4803000 25.54000 0.3896000 0.3016000      0.6185000 
1 1 1 7  18 37 o 9.401000 0.8946000 8.789000 1.656000  10.01000 0.6778000 -1.224000      1.789000  
1 1 1 7  18 39 f 12.06000 0.4876000 12.40000 0.7604000 11.72000 0.6107000 0.6750000      0.9753000 
1 1 1 7  18 41 o 32.87000 0.3539000 32.35000 0.5330000 33.38000 0.4655000 -1.027000      0.7077000 
1 1 1 7  18 43 o 14.09000 0.4611000 13.97000 0.7293000 14.21000 0.5645000 -0.2378000     0.9223000 
1 1 1 7  18 45 o 12.48000 0.5115000 12.81000 0.8200000 12.15000 0.6116000 0.6631000      1.023000  
1 1 1 7  18 47 o 23.36000 0.3559000 23.04000 0.5338000 23.68000 0.4708000 -0.6452000     0.7118000 
1 1 1 7  18 49 o 7.486000 0.7861000 7.145000 1.349000  7.826000 0.8072000 -0.6813000     1.572000  
1 1 1 7  18 51 o 12.23000 0.5515000 12.08000 0.9462000 12.38000 0.5669000 -0.3014000     1.103000  
1 1 1 7  18 53 o 14.32000 0.4401000 13.84000 0.6888000 14.80000 0.5480000 -0.9640000     0.8802000 
1 1 1 7  18 55 o 8.934000 0.6014000 10.03000 0.8528000 7.835000 0.8483000 2.197000       1.203000  
1 1 1 7  18 57 o 6.212000 0.9774000 6.608000 1.454000  5.816000 1.306000  0.7915000      1.955000  
1 1 1 7  18 59 o 4.420000 1.149000  4.738000 1.803000  4.101000 1.426000  0.6370000      2.298000  
1 1 1 7  18 61 o 6.638000 1.048000  7.238000 1.756000  6.037000 1.144000  1.201000       2.096000  
1 1 1 7  18 63 f 8.768000 0.8829000 9.727000 1.059000  7.809000 1.413000  1.918000       1.766000  
1 1 1 7  19 0  o 137.4000 1.325000  137.4000 1.325000  137.4000 1.325000  0.000000       0.000000  
1 1 1 7  19 2  o 21.77000 0.2068000 21.50000 0.2970000 22.05000 0.2879000 -0.5502000     0.4136000 
1 1 1 7  19 4  o 56.98000 0.4368000 56.80000 0.5685000 57.16000 0.6632000 -0.3662000     0.8735000 
1 1 1 7  19 6  o 60.41000 0.4419000 59.93000 0.5368000 60.89000 0.7020000 -0.9545000     0.8837000 
1 1 1 7  19 8  o 19.54000 0.2902000 19.50000 0.3315000 19.59000 0.4763000 -0.8721000E-01 0.5803000 
1 1 1 7  19 10 o 38.23000 0.2945000 38.00000 0.4135000 38.46000 0.4194000 -0.4604000     0.5889000 
1 1 1 7  19 12 o 91.27000 0.6311000 91.57000 0.8950000 90.97000 0.8902000 0.5958000      1.262000  
1 1 1 7  19 14 o 24.62000 0.4131000 25.07000 0.3471000 24.16000 0.7497000 0.9048000      0.8262000 
1 1 1 7  19 16 o 92.47000 0.6916000 91.98000 0.9000000 92.96000 1.050000  -0.9836000     1.383000  
1 1 1 7  19 18 o 50.77000 0.4378000 50.97000 0.6078000 50.58000 0.6303000 0.3865000      0.8756000 
1 1 1 7  19 20 o 36.63000 0.4002000 37.02000 0.4922000 36.24000 0.6311000 0.7751000      0.8003000 
1 1 1 7  19 22 o 111.9000 0.7712000 112.4000 1.094000  111.4000 1.087000  0.9647000      1.542000  
1 1 1 7  19 24 o 47.19000 0.5648000 46.02000 0.9974000 48.36000 0.5303000 -2.339000      1.130000  
1 1 1 7  19 26 o 44.21000 0.3564000 44.53000 0.5582000 43.89000 0.4433000 0.6450000      0.7128000 
1 1 1 7  19 28 o 45.05000 0.3614000 44.95000 0.5644000 45.14000 0.4517000 -0.1909000     0.7229000 
1 1 1 7  19 30 o 57.70000 0.4377000 57.93000 0.6869000 57.47000 0.5427000 0.4563000      0.8754000 
1 1 1 7  19 32 o 26.24000 0.3138000 25.89000 0.4676000 26.60000 0.4186000 -0.7037000     0.6276000 
1 1 1 7  19 34 o 10.76000 0.5118000 10.92000 0.7450000 10.59000 0.7019000 0.3268000      1.024000  
1 1 1 7  19 36 o 43.98000 0.4213000 44.05000 0.7065000 43.90000 0.4593000 0.1499000      0.8427000 
1 1 1 7  19 38 o 9.142000 0.8031000 8.438000 1.435000  9.845000 0.7210000 -1.407000      1.606000  
1 1 1 7  19 40 o 26.28000 0.3756000 26.39000 0.5306000 26.16000 0.5317000 0.2279000      0.7511000 
1 1 1 7  19 42 o 12.40000 0.5007000 12.71000 0.8076000 12.09000 0.5923000 0.6235000      1.001000  
1 1 1 7  19 44 o 23.87000 0.3472000 23.68000 0.5439000 24.05000 0.4315000 -0.3610000     0.6943000 
1 1 1 7  19 46 o 15.14000 0.4333000 14.48000 0.7056000 15.80000 0.5032000 -1.316000      0.8667000 
1 1 1 7  19 48 o 17.50000 0.4948000 17.11000 0.7797000 17.89000 0.6095000 -0.7822000     0.9897000 
1 1 1 7  19 50 o 17.50000 0.5475000 17.08000 0.9985000 17.91000 0.4494000 -0.8318000     1.095000  
1 1 1 7  19 52 o 12.94000 0.4600000 12.70000 0.7528000 13.18000 0.5289000 -0.4704000     0.9200000 
1 1 1 7  19 54 o 3.489000 0.9472000 4.417000 1.508000  2.561000 1.146000  1.856000       1.894000  
1 1 1 7  19 56 f 3.955000 1.058000  3.943000 1.508000  3.966000 1.484000  -0.2290000E-01 2.116000  
1 1 1 7  19 58 o 4.075000 1.096000  4.760000 1.781000  3.390000 1.279000  1.371000       2.192000  
1 1 1 7  19 60 f 4.249000 1.055000  4.889000 1.660000  3.609000 1.302000  1.280000       2.110000  
1 1 1 7  19 62 o 9.004000 0.6510000 8.922000 1.038000  9.086000 0.7866000 -0.1642000     1.302000  
1 1 1 7  19 64 o 8.864000 0.7868000 8.770000 1.345000  8.959000 0.8175000 -0.1893000     1.574000  
1 1 1 7  20 1  o 92.86000 0.6394000 92.46000 0.9013000 93.25000 0.9073000 -0.7963000     1.279000  
1 1 1 7  20 3  o 53.78000 0.4157000 53.87000 0.5443000 53.69000 0.6285000 0.1802000      0.8314000 
1 1 1 7  20 5  o 68.16000 0.4929000 68.20000 0.6038000 68.12000 0.7793000 0.7841000E-01  0.9858000 
1 1 1 7  20 7  o 81.28000 0.5824000 81.18000 0.7120000 81.37000 0.9218000 -0.1866000     1.165000  
1 1 1 7  20 9  o 60.01000 0.4395000 60.45000 0.5437000 59.58000 0.6906000 0.8662000      0.8790000 
1 1 1 7  20 11 o 86.90000 0.7350000 86.79000 0.8502000 87.01000 1.199000  -0.2197000     1.470000  
1 1 1 7  20 13 o 77.42000 0.5830000 77.78000 0.7675000 77.07000 0.8779000 0.7161000      1.166000  
1 1 1 7  20 15 o 6.589000 0.5066000 7.108000 0.6147000 6.070000 0.8055000 1.037000       1.013000  
1 1 1 7  20 17 o 37.41000 0.4833000 37.43000 0.8649000 37.38000 0.4316000 0.5468000E-01  0.9666000 
1 1 1 7  20 19 o 63.15000 0.5907000 63.08000 0.7385000 63.22000 0.9221000 -0.1432000     1.181000  
1 1 1 7  20 21 o 47.35000 0.4142000 46.55000 0.5742000 48.16000 0.5971000 -1.606000      0.8284000 
1 1 1 7  20 23 o 44.58000 0.4335000 44.76000 0.7105000 44.40000 0.4969000 0.3572000      0.8670000 
1 1 1 7  20 25 o 61.04000 0.5262000 62.70000 0.8937000 59.37000 0.5557000 3.331000       1.052000  
1 1 1 7  20 27 o 23.61000 0.2890000 23.72000 0.4415000 23.49000 0.3731000 0.2300000      0.5780000 
1 1 1 7  20 29 o 37.25000 0.3240000 37.39000 0.5023000 37.11000 0.4093000 0.2777000      0.6480000 
1 1 1 7  20 31 o 23.36000 0.3100000 23.82000 0.4654000 22.89000 0.4097000 0.9213000      0.6201000 
1 1 1 7  20 33 o 14.88000 0.3905000 14.50000 0.5968000 15.27000 0.5039000 -0.7720000     0.7810000 
1 1 1 7  20 35 o 17.60000 0.3880000 17.93000 0.5764000 17.27000 0.5197000 0.6550000      0.7761000 
1 1 1 7  20 37 o 61.40000 0.5346000 61.15000 0.8953000 61.65000 0.5846000 -0.4991000     1.069000  
1 1 1 7  20 39 o 15.83000 0.4173000 15.36000 0.6863000 16.30000 0.4750000 -0.9393000     0.8346000 
1 1 1 7  20 41 o 18.00000 0.4056000 18.15000 0.6167000 17.85000 0.5269000 0.3078000      0.8111000 
1 1 1 7  20 43 o 13.86000 0.4748000 13.13000 0.7859000 14.59000 0.5329000 -1.461000      0.9495000 
1 1 1 7  20 45 o 21.57000 0.3878000 22.03000 0.5406000 21.12000 0.5563000 0.9063000      0.7757000 
1 1 1 7  20 47 o 4.374000 1.094000  5.409000 1.721000  3.340000 1.352000  2.068000       2.188000  
1 1 1 7  20 49 o 13.04000 0.4535000 12.27000 0.7463000 13.80000 0.5154000 -1.527000      0.9070000 
1 1 1 7  20 51 o 20.08000 0.3531000 19.38000 0.5640000 20.79000 0.4252000 -1.414000      0.7063000 
1 1 1 7  20 53 o 3.729000 1.017000  4.250000 1.536000  3.208000 1.334000  1.042000       2.035000  
1 1 1 7  20 55 o 5.263000 0.9478000 5.026000 1.466000  5.499000 1.202000  -0.4724000     1.896000  
1 1 1 7  20 57 f 8.251000 1.059000  9.073000 1.894000  7.429000 0.9468000 1.644000       2.117000  
1 1 1 7  20 59 o 14.02000 0.5131000 14.24000 0.7692000 13.79000 0.6794000 0.4552000      1.026000  
1 1 1 7  20 61 o 4.695000 1.163000  6.541000 1.975000  2.850000 1.229000  3.691000       2.327000  
1 1 1 7  20 63 o 10.92000 0.6228000 11.76000 0.9703000 10.09000 0.7809000 1.674000       1.246000  
1 1 1 7  21 0  o 33.21000 0.3783000 33.21000 0.3783000 33.21000 0.3783000 0.000000       0.000000  
1 1 1 7  21 2  o 79.45000 0.6380000 79.69000 0.9057000 79.21000 0.8989000 0.4766000      1.276000  
1 1 1 7  21 4  o 24.34000 0.2459000 24.55000 0.3234000 24.13000 0.3705000 0.4162000      0.4918000 
1 1 1 7  21 6  o 89.01000 0.6356000 88.90000 0.7774000 89.13000 1.006000  -0.2339000     1.271000  
1 1 1 7  21 8  o 32.02000 0.3241000 32.59000 0.3384000 31.44000 0.5527000 1.158000       0.6481000 
1 1 1 7  21 10 f 67.06000 0.5520000 68.30000 0.6105000 65.82000 0.9197000 2.483000       1.104000  
1 1 1 7  21 12 o 79.76000 0.5745000 79.52000 0.7019000 80.00000 0.9097000 -0.4749000     1.149000  
1 1 1 7  21 14 o 21.67000 0.3056000 22.24000 0.4704000 21.11000 0.3903000 1.132000       0.6112000 
1 1 1 7  21 16 o 50.20000 0.3998000 49.91000 0.5963000 50.49000 0.5327000 -0.5778000     0.7996000 
1 1 1 7  21 18 o 39.06000 0.4000000 39.08000 0.5128000 39.04000 0.6140000 0.4165000E-01  0.8000000 
1 1 1 7  21 20 o 11.40000 0.4177000 11.75000 0.5054000 11.04000 0.6653000 0.7096000      0.8355000 
1 1 1 7  21 22 o 54.78000 0.4645000 55.35000 0.6610000 54.22000 0.6527000 1.126000       0.9290000 
1 1 1 7  21 24 o 21.09000 0.4329000 21.75000 0.5662000 20.44000 0.6551000 1.307000       0.8659000 
1 1 1 7  21 26 o 39.63000 0.3335000 39.76000 0.5187000 39.50000 0.4192000 0.2587000      0.6669000 
1 1 1 7  21 28 o 40.61000 0.3410000 40.95000 0.5312000 40.27000 0.4278000 0.6813000      0.6821000 
1 1 1 7  21 30 o 21.68000 0.3092000 22.06000 0.4553000 21.31000 0.4185000 0.7517000      0.6184000 
1 1 1 7  21 32 o 16.40000 0.3682000 15.91000 0.5604000 16.89000 0.4778000 -0.9804000     0.7364000 
1 1 1 7  21 34 o 22.13000 0.3300000 22.62000 0.4983000 21.64000 0.4327000 0.9813000      0.6599000 
1 1 1 7  21 36 o 27.44000 0.3664000 27.62000 0.6201000 27.26000 0.3905000 0.3660000      0.7328000 
1 1 1 7  21 38 o 19.21000 0.4162000 18.74000 0.7108000 19.68000 0.4334000 -0.9395000     0.8325000 
1 1 1 7  21 40 o 13.25000 0.5149000 13.38000 0.7870000 13.11000 0.6641000 0.2717000      1.030000  
1 1 1 7  21 42 o 19.63000 0.3724000 19.60000 0.6087000 19.67000 0.4293000 -0.7858000E-01 0.7449000 
1 1 1 7  21 44 o 10.46000 0.6158000 10.01000 1.004000  10.92000 0.7136000 -0.9062000     1.232000  
1 1 1 7  21 46 f 13.68000 0.4327000 13.45000 0.7054000 13.92000 0.5013000 -0.4617000     0.8654000 
1 1 1 7  21 48 o 12.88000 0.4888000 13.36000 0.7101000 12.41000 0.6718000 0.9508000      0.9776000 
1 1 1 7  21 50 o 12.72000 0.5111000 12.29000 0.8721000 13.15000 0.5330000 -0.8654000     1.022000  
1 1 1 7  21 52 o 4.101000 1.023000  4.292000 1.563000  3.910000 1.319000  0.3819000      2.046000  
1 1 1 7  21 54 o 14.28000 0.4433000 14.50000 0.6847000 14.06000 0.5634000 0.4322000      0.8867000 
1 1 1 7  21 56 o 7.123000 0.9013000 7.292000 1.477000  6.955000 1.033000  0.3362000      1.803000  
1 1 1 7  21 58 o 8.030000 0.7691000 7.782000 1.308000  8.278000 0.8087000 -0.4967000     1.538000  
1 1 1 7  21 60 o 4.469000 1.033000  5.617000 1.605000  3.321000 1.301000  2.296000       2.066000  
1 1 1 7  21 62 o 9.559000 0.6381000 9.305000 1.046000  9.812000 0.7313000 -0.5070000     1.276000  
1 1 1 7  22 1  o 54.41000 0.3909000 54.25000 0.5518000 54.58000 0.5539000 -0.3294000     0.7818000 
1 1 1 7  22 3  o 103.6000 0.7355000 103.8000 0.9024000 103.5000 1.162000  0.3500000      1.471000  
1 1 1 7  22 5  o 65.01000 0.4731000 65.37000 0.5837000 64.64000 0.7446000 0.7357000      0.9461000 
1 1 1 7  22 7  o 59.20000 0.4582000 58.55000 0.5944000 59.85000 0.6976000 -1.303000      0.9165000 
1 1 1 7  22 9  o 53.40000 0.4514000 54.14000 0.4962000 52.66000 0.7542000 1.488000       0.9028000 
1 1 1 7  22 11 o 84.14000 0.6047000 83.96000 0.7391000 84.33000 0.9571000 -0.3661000     1.209000  
1 1 1 7  22 13 o 117.8000 0.9571000 117.0000 1.017000  118.5000 1.622000  -1.517000      1.914000  
1 1 1 7  22 15 o 22.94000 0.2736000 22.85000 0.3738000 23.03000 0.3996000 -0.1781000     0.5472000 
1 1 1 7  22 17 o 68.12000 0.5243000 68.50000 0.7949000 67.73000 0.6839000 0.7678000      1.049000  
1 1 1 7  22 19 o 29.51000 0.3073000 29.49000 0.3878000 29.54000 0.4767000 -0.5522000E-01 0.6145000 
1 1 1 7  22 21 o 35.27000 0.3234000 34.93000 0.4828000 35.62000 0.4304000 -0.6915000     0.6468000 
1 1 1 7  22 23 o 37.13000 0.4031000 37.38000 0.6289000 36.87000 0.5044000 0.5008000      0.8062000 
1 1 1 7  22 25 o 39.78000 0.3480000 39.41000 0.5155000 40.16000 0.4676000 -0.7446000     0.6960000 
1 1 1 7  22 27 o 32.39000 0.3026000 32.27000 0.4646000 32.51000 0.3877000 -0.2412000     0.6052000 
1 1 1 7  22 29 o 31.70000 0.3162000 31.73000 0.4673000 31.67000 0.4261000 0.5915000E-01  0.6324000 
1 1 1 7  22 31 o 41.95000 0.3508000 41.77000 0.5431000 42.13000 0.4442000 -0.3601000     0.7016000 
1 1 1 7  22 33 o 15.47000 0.3849000 15.03000 0.5863000 15.91000 0.4988000 -0.8804000     0.7698000 
1 1 1 7  22 35 f 24.93000 0.3823000 25.60000 0.6159000 24.26000 0.4532000 1.340000       0.7647000 
1 1 1 7  22 37 o 26.23000 0.3697000 26.21000 0.6149000 26.25000 0.4107000 -0.4018000E-01 0.7395000 
1 1 1 7  22 39 o 38.01000 0.3530000 37.81000 0.5491000 38.21000 0.4438000 -0.4033000     0.7061000 
1 1 1 7  22 41 o 7.644000 0.7817000 7.739000 1.288000  7.548000 0.8867000 0.1903000      1.563000  
1 1 1 7  22 43 o 21.78000 0.3694000 22.07000 0.5574000 21.49000 0.4848000 0.5762000      0.7387000 
1 1 1 7  22 45 o 29.96000 0.3308000 30.06000 0.5166000 29.85000 0.4132000 0.2106000      0.6615000 
1 1 1 7  22 47 o 4.310000 1.094000  4.532000 1.721000  4.088000 1.350000  0.4445000      2.187000  
1 1 1 7  22 49 o 5.054000 0.9854000 5.157000 1.528000  4.950000 1.244000  0.2061000      1.971000  
1 1 1 7  22 51 o 8.044000 0.7285000 8.147000 1.246000  7.941000 0.7549000 0.2055000      1.457000  
1 1 1 7  22 53 o 6.492000 0.8597000 7.113000 1.261000  5.871000 1.169000  1.242000       1.719000  
1 1 1 7  22 55 o 4.930000 1.046000  5.986000 1.367000  3.873000 1.583000  2.113000       2.091000  
1 1 1 7  22 57 o 5.679000 1.008000  6.540000 1.333000  4.818000 1.513000  1.722000       2.017000  
1 1 1 7  22 59 o 7.502000 0.8466000 7.726000 1.289000  7.278000 1.098000  0.4476000      1.693000  
1 1 1 7  22 61 o 3.677000 1.071000  3.836000 1.633000  3.518000 1.386000  0.3185000      2.142000  
1 1 1 7  22 63 o 9.302000 0.7225000 10.43000 0.9637000 8.169000 1.077000  2.265000       1.445000  
1 1 1 7  23 0  o 63.11000 0.6322000 63.11000 0.6322000 63.11000 0.6322000 0.000000       0.000000  
1 1 1 7  23 2  o 66.70000 0.5107000 65.54000 0.6544000 67.85000 0.7841000 -2.313000      1.021000  
1 1 1 7  23 4  o 83.88000 0.6028000 83.51000 0.7340000 84.24000 0.9564000 -0.7309000     1.206000  
1 1 1 7  23 6  o 40.76000 0.3786000 41.05000 0.4487000 40.47000 0.6099000 0.5821000      0.7571000 
1 1 1 7  23 8  o 104.8000 0.8580000 103.2000 0.8992000 106.4000 1.461000  -3.243000      1.716000  
1 1 1 7  23 10 o 86.45000 0.6204000 86.33000 0.7594000 86.57000 0.9813000 -0.2406000     1.241000  
1 1 1 7  23 12 o 37.62000 0.3102000 37.08000 0.3811000 38.16000 0.4895000 -1.087000      0.6204000 
1 1 1 7  23 14 o 28.13000 0.3222000 27.93000 0.4103000 28.34000 0.4969000 -0.4137000     0.6444000 
1 1 1 7  23 16 o 63.58000 0.4912000 63.23000 0.6411000 63.92000 0.7444000 -0.6971000     0.9824000 
1 1 1 7  23 18 o 39.50000 0.3977000 39.38000 0.4441000 39.62000 0.6598000 -0.2485000     0.7954000 
1 1 1 7  23 20 o 38.99000 0.3176000 39.07000 0.4447000 38.90000 0.4534000 0.1631000      0.6351000 
1 1 1 7  23 22 o 40.82000 0.4158000 40.57000 0.4575000 41.07000 0.6944000 -0.5039000     0.8316000 
1 1 1 7  23 24 o 30.14000 0.3121000 29.79000 0.4715000 30.48000 0.4090000 -0.6976000     0.6242000 
1 1 1 7  23 26 o 20.14000 0.3315000 20.00000 0.5290000 20.28000 0.3995000 -0.2763000     0.6629000 
1 1 1 7  23 28 o 32.66000 0.3188000 33.11000 0.4752000 32.22000 0.4251000 0.8923000      0.6376000 
1 1 1 7  23 30 o 16.08000 0.3457000 15.98000 0.5315000 16.18000 0.4420000 -0.1941000     0.6913000 
1 1 1 7  23 32 o 29.11000 0.3204000 29.32000 0.4766000 28.90000 0.4283000 0.4104000      0.6408000 
1 1 1 7  23 34 o 39.08000 0.3952000 39.35000 0.6615000 38.81000 0.4325000 0.5386000      0.7903000 
1 1 1 7  23 36 o 59.73000 0.5257000 60.03000 0.8854000 59.43000 0.5670000 0.6001000      1.051000  
1 1 1 7  23 38 f 17.97000 0.4495000 18.63000 0.7291000 17.31000 0.5261000 1.316000       0.8990000 
1 1 1 7  23 40 o 20.45000 0.3784000 20.30000 0.5842000 20.60000 0.4812000 -0.2988000     0.7568000 
1 1 1 7  23 42 o 33.87000 0.3455000 33.89000 0.5407000 33.85000 0.4303000 0.3843000E-01  0.6910000 
1 1 1 7  23 44 o 13.15000 0.4725000 12.60000 0.7350000 13.70000 0.5940000 -1.100000      0.9450000 
1 1 1 7  23 46 o 13.07000 0.5238000 12.30000 0.9008000 13.84000 0.5349000 -1.539000      1.048000  
1 1 1 7  23 48 o 17.05000 0.3995000 17.57000 0.6008000 16.54000 0.5268000 1.027000       0.7991000 
1 1 1 7  23 50 o 5.480000 0.9905000 5.220000 1.697000  5.740000 1.022000  -0.5200000     1.981000  
1 1 1 7  23 52 o 4.523000 1.013000  5.099000 1.507000  3.947000 1.354000  1.152000       2.026000  
1 1 1 7  23 54 o 14.70000 0.4809000 14.40000 0.6744000 15.00000 0.6857000 -0.6016000     0.9618000 
1 1 1 7  23 56 o 3.753000 1.085000  4.674000 1.758000  2.832000 1.274000  1.842000       2.171000  
1 1 1 7  23 58 o 3.681000 1.033000  3.794000 1.580000  3.569000 1.331000  0.2249000      2.067000  
1 1 1 7  23 60 o 8.068000 0.8077000 7.564000 1.402000  8.572000 0.8033000 -1.008000      1.615000  
1 1 1 7  23 62 o 6.805000 0.9411000 8.480000 1.409000  5.130000 1.248000  3.350000       1.882000  
1 1 1 7  24 1  o 14.99000 0.2840000 14.83000 0.3599000 15.15000 0.4394000 -0.3272000     0.5680000 
1 1 1 7  24 3  o 64.53000 0.5385000 64.78000 0.5803000 64.29000 0.9073000 0.4850000      1.077000  
1 1 1 7  24 5  o 33.85000 0.4774000 33.99000 0.4735000 33.71000 0.8292000 0.2803000      0.9549000 
1 1 1 7  24 7  o 45.39000 0.3546000 45.23000 0.4342000 45.56000 0.5608000 -0.3327000     0.7093000 
1 1 1 7  24 9  o 21.25000 0.3133000 21.47000 0.3121000 21.02000 0.5433000 0.4416000      0.6266000 
1 1 1 7  24 11 o 43.17000 0.3979000 43.78000 0.4733000 42.56000 0.6397000 1.214000       0.7957000 
1 1 1 7  24 13 o 35.25000 0.3296000 35.22000 0.4620000 35.27000 0.4702000 -0.5070000E-01 0.6592000 
1 1 1 7  24 15 o 64.41000 0.4965000 64.16000 0.6494000 64.66000 0.7511000 -0.5011000     0.9929000 
1 1 1 7  24 17 o 42.15000 0.3561000 41.26000 0.4579000 43.05000 0.5455000 -1.793000      0.7122000 
1 1 1 7  24 19 o 9.979000 0.5130000 9.726000 0.4595000 10.23000 0.9173000 -0.5060000     1.026000  
1 1 1 7  24 21 o 50.59000 0.4371000 51.62000 0.6263000 49.56000 0.6099000 2.060000       0.8742000 
1 1 1 7  24 23 o 13.51000 0.3686000 13.47000 0.5708000 13.56000 0.4666000 -0.9364000E-01 0.7372000 
1 1 1 7  24 25 o 48.96000 0.3835000 48.36000 0.5932000 49.56000 0.4862000 -1.191000      0.7670000 
1 1 1 7  24 27 o 36.07000 0.3330000 36.29000 0.4974000 35.84000 0.4429000 0.4449000      0.6660000 
1 1 1 7  24 29 o 19.02000 0.3444000 19.36000 0.5669000 18.68000 0.3913000 0.6788000      0.6888000 
1 1 1 7  24 31 o 38.31000 0.3716000 38.51000 0.5225000 38.12000 0.5285000 0.3857000      0.7432000 
1 1 1 7  24 33 o 7.018000 0.7216000 7.488000 1.106000  6.548000 0.9269000 0.9396000      1.443000  
1 1 1 7  24 35 o 13.84000 0.5152000 13.06000 0.8364000 14.62000 0.6018000 -1.559000      1.030000  
1 1 1 7  24 37 o 25.51000 0.3358000 25.47000 0.5250000 25.55000 0.4187000 -0.8072000E-01 0.6715000 
1 1 1 7  24 39 o 19.18000 0.3719000 18.96000 0.5515000 19.41000 0.4989000 -0.4514000     0.7437000 
1 1 1 7  24 41 o 18.61000 0.3794000 18.66000 0.6008000 18.56000 0.4636000 0.9913000E-01  0.7588000 
1 1 1 7  24 43 o 19.61000 0.4059000 19.33000 0.5761000 19.88000 0.5719000 -0.5469000     0.8118000 
1 1 1 7  24 45 o 15.85000 0.4083000 15.73000 0.6047000 15.97000 0.5489000 -0.2414000     0.8167000 
1 1 1 7  24 47 o 7.609000 0.6958000 7.815000 1.108000  7.403000 0.8415000 0.4121000      1.392000  
1 1 1 7  24 49 o 4.075000 0.9468000 4.911000 1.426000  3.238000 1.245000  1.672000       1.894000  
1 1 1 7  24 51 o 3.460000 1.000000  4.477000 1.653000  2.442000 1.126000  2.034000       2.000000  
1 1 1 7  24 53 o 20.37000 0.3729000 20.78000 0.5705000 19.97000 0.4803000 0.8028000      0.7458000 
1 1 1 7  24 55 o 4.404000 0.9707000 4.901000 1.479000  3.907000 1.258000  0.9939000      1.941000  
1 1 1 7  24 57 o 5.297000 0.9830000 4.710000 1.615000  5.883000 1.121000  -1.173000      1.966000  
1 1 1 7  24 59 o 3.780000 1.030000  3.799000 1.559000  3.761000 1.347000  0.3786000E-01  2.060000  
1 1 1 7  24 61 o 3.619000 1.073000  3.893000 1.706000  3.344000 1.301000  0.5485000      2.145000  
1 1 1 7  25 0  o 39.98000 0.6272000 39.98000 0.6272000 39.98000 0.6272000 0.000000       0.000000  
1 1 1 7  25 2  o 42.62000 0.3841000 42.43000 0.4089000 42.80000 0.6502000 -0.3778000     0.7681000 
1 1 1 7  25 4  o 8.545000 0.4388000 8.485000 0.5731000 8.605000 0.6648000 -0.1209000     0.8777000 
1 1 1 7  25 6  o 81.76000 0.5895000 81.65000 0.7214000 81.87000 0.9326000 -0.2285000     1.179000  
1 1 1 7  25 8  o 51.45000 0.6285000 51.83000 0.6306000 51.07000 1.087000  0.7608000      1.257000  
1 1 1 7  25 10 o 46.43000 0.3997000 46.84000 0.5654000 46.02000 0.5651000 0.8133000      0.7994000 
1 1 1 7  25 12 o 12.43000 0.3225000 12.19000 0.4773000 12.67000 0.4338000 -0.4815000     0.6450000 
1 1 1 7  25 14 o 22.54000 0.2813000 23.14000 0.3937000 21.93000 0.4020000 1.212000       0.5627000 
1 1 1 7  25 16 o 68.53000 0.5254000 68.55000 0.6887000 68.50000 0.7936000 0.4231000E-01  1.051000  
1 1 1 7  25 18 o 72.39000 0.6130000 71.96000 0.6454000 72.81000 1.042000  -0.8446000     1.226000  
1 1 1 7  25 20 o 24.28000 0.4675000 24.72000 0.3699000 23.85000 0.8588000 0.8648000      0.9351000 
1 1 1 7  25 22 o 53.64000 0.4099000 53.90000 0.5054000 53.38000 0.6454000 0.5227000      0.8197000 
1 1 1 7  25 24 o 40.64000 0.3578000 40.23000 0.5381000 41.06000 0.4718000 -0.8301000     0.7156000 
1 1 1 7  25 26 o 57.16000 0.4557000 57.68000 0.6866000 56.65000 0.5994000 1.030000       0.9115000 
1 1 1 7  25 28 o 24.63000 0.2911000 24.59000 0.4466000 24.66000 0.3734000 -0.7096000E-01 0.5822000 
1 1 1 7  25 30 f 36.92000 0.3670000 36.78000 0.5100000 37.06000 0.5280000 -0.2769000     0.7341000 
1 1 1 7  25 32 o 14.26000 0.4457000 13.74000 0.7471000 14.78000 0.4861000 -1.043000      0.8913000 
1 1 1 7  25 34 o 23.64000 0.3744000 23.84000 0.6243000 23.43000 0.4134000 0.4132000      0.7488000 
1 1 1 7  25 36 f 27.06000 0.3335000 27.07000 0.5175000 27.05000 0.4208000 0.1454000E-01  0.6670000 
1 1 1 7  25 38 o 29.60000 0.3927000 29.53000 0.6614000 29.67000 0.4235000 -0.1467000     0.7853000 
1 1 1 7  25 40 o 17.53000 0.3948000 17.54000 0.6060000 17.52000 0.5062000 0.1789000E-01  0.7896000 
1 1 1 7  25 42 o 10.20000 0.5640000 11.31000 0.8139000 9.088000 0.7810000 2.221000       1.128000  
1 1 1 7  25 44 o 17.50000 0.3762000 17.39000 0.5401000 17.61000 0.5239000 -0.2259000     0.7525000 
1 1 1 7  25 46 o 13.97000 0.4172000 13.18000 0.6636000 14.75000 0.5057000 -1.567000      0.8343000 
1 1 1 7  25 48 o 16.63000 0.3858000 16.59000 0.5878000 16.67000 0.4999000 -0.8307000E-01 0.7716000 
1 1 1 7  25 50 o 11.27000 0.6132000 10.45000 1.068000  12.08000 0.6035000 -1.624000      1.226000  
1 1 1 7  25 52 o 6.947000 0.8239000 7.353000 1.184000  6.541000 1.146000  0.8115000      1.648000  
1 1 1 7  25 54 o 9.443000 0.6041000 9.054000 0.9646000 9.832000 0.7275000 -0.7780000     1.208000  
1 1 1 7  25 56 o 3.690000 0.9442000 2.972000 1.310000  4.409000 1.360000  -1.437000      1.888000  
1 1 1 7  25 58 o 4.974000 1.040000  5.070000 1.579000  4.878000 1.355000  0.1919000      2.081000  
1 1 1 7  25 60 o 7.110000 0.9358000 6.507000 1.503000  7.713000 1.115000  -1.205000      1.872000  
1 1 1 7  26 1  o 16.95000 0.4708000 18.16000 0.3726000 15.74000 0.8646000 2.416000       0.9415000 
1 1 1 7  26 3  o 52.43000 0.6352000 53.62000 0.6364000 51.23000 1.100000  2.386000       1.270000  
1 1 1 7  26 5  o 39.70000 0.3385000 39.78000 0.4410000 39.63000 0.5136000 0.1454000      0.6769000 
1 1 1 7  26 7  o 74.57000 0.6778000 73.33000 0.8434000 75.82000 1.061000  -2.487000      1.356000  
1 1 1 7  26 9  o 43.95000 0.3859000 43.87000 0.5410000 44.04000 0.5505000 -0.1627000     0.7719000 
1 1 1 7  26 11 o 4.559000 0.7189000 3.950000 1.088000  5.169000 0.9398000 -1.219000      1.438000  
1 1 1 7  26 13 o 32.92000 0.3365000 33.28000 0.4048000 32.56000 0.5376000 0.7230000      0.6729000 
1 1 1 7  26 15 o 94.79000 0.7100000 94.88000 0.9308000 94.71000 1.072000  0.1780000      1.420000  
1 1 1 7  26 17 o 8.966000 0.5607000 8.730000 0.5732000 9.202000 0.9637000 -0.4712000     1.121000  
1 1 1 7  26 19 o 66.78000 0.5831000 66.80000 0.6756000 66.77000 0.9505000 0.3525000E-01  1.166000  
1 1 1 7  26 21 o 39.96000 0.3340000 39.64000 0.4065000 40.28000 0.5300000 -0.6399000     0.6680000 
1 1 1 7  26 23 f 23.66000 0.2930000 24.02000 0.4005000 23.31000 0.4278000 0.7042000      0.5861000 
1 1 1 7  26 25 o 47.18000 0.4241000 47.18000 0.4593000 47.18000 0.7130000 -0.1282000E-02 0.8481000 
1 1 1 7  26 27 o 35.55000 0.3165000 35.13000 0.4854000 35.97000 0.4062000 -0.8402000     0.6329000 
1 1 1 7  26 29 o 22.23000 0.3124000 21.96000 0.4577000 22.49000 0.4254000 -0.5278000     0.6249000 
1 1 1 7  26 31 o 44.65000 0.3707000 44.72000 0.5786000 44.59000 0.4634000 0.1319000      0.7413000 
1 1 1 7  26 33 o 47.61000 0.4652000 48.40000 0.7506000 46.82000 0.5499000 1.586000       0.9305000 
1 1 1 7  26 35 o 34.79000 0.5241000 34.14000 0.8778000 35.44000 0.5727000 -1.303000      1.048000  
1 1 1 7  26 37 f 25.89000 0.3414000 25.65000 0.5052000 26.12000 0.4594000 -0.4761000     0.6828000 
1 1 1 7  26 39 o 4.230000 1.143000  4.484000 1.747000  3.975000 1.474000  0.5095000      2.286000  
1 1 1 7  26 41 o 22.11000 0.3595000 21.24000 0.5400000 22.98000 0.4748000 -1.743000      0.7190000 
1 1 1 7  26 43 f 29.71000 0.3481000 29.61000 0.5174000 29.80000 0.4657000 -0.1834000     0.6961000 
1 1 1 7  26 45 o 12.83000 0.5268000 13.17000 0.8878000 12.50000 0.5673000 0.6716000      1.054000  
1 1 1 7  26 47 o 12.51000 0.4496000 12.88000 0.6926000 12.13000 0.5735000 0.7478000      0.8992000 
1 1 1 7  26 49 o 5.774000 0.9708000 5.605000 1.654000  5.943000 1.017000  -0.3377000     1.942000  
1 1 1 7  26 51 o 7.857000 0.8351000 7.624000 1.442000  8.090000 0.8428000 -0.4667000     1.670000  
1 1 1 7  26 53 o 11.91000 0.5221000 11.54000 0.8175000 12.27000 0.6495000 -0.7312000     1.044000  
1 1 1 7  26 55 o 9.366000 0.7185000 9.671000 1.223000  9.062000 0.7548000 0.6087000      1.437000  
1 1 1 7  26 57 o 3.328000 0.9517000 3.903000 1.473000  2.752000 1.205000  1.151000       1.903000  
1 1 1 7  26 59 o 3.330000 0.9698000 3.836000 1.516000  2.825000 1.211000  1.011000       1.940000  
1 1 1 7  26 61 o 2.907000 0.8635000 2.328000 1.143000  3.487000 1.295000  -1.159000      1.727000  
1 1 1 7  27 0  o 50.48000 0.5279000 50.48000 0.5279000 50.48000 0.5279000 0.000000       0.000000  
1 1 1 7  27 2  o 38.48000 0.3333000 38.71000 0.4343000 38.24000 0.5057000 0.4725000      0.6666000 
1 1 1 7  27 4  f 48.13000 0.5835000 47.58000 0.5027000 48.69000 1.053000  -1.116000      1.167000  
1 1 1 7  27 6  o 34.10000 0.3115000 33.61000 0.4029000 34.59000 0.4753000 -0.9780000     0.6231000 
1 1 1 7  27 8  o 88.99000 0.6687000 88.59000 0.8713000 89.38000 1.015000  -0.7852000     1.337000  
1 1 1 7  27 10 o 35.84000 0.3807000 36.00000 0.4345000 35.69000 0.6252000 0.3063000      0.7613000 
1 1 1 7  27 12 o 18.38000 0.2857000 18.91000 0.3999000 17.84000 0.4081000 1.069000       0.5714000 
1 1 1 7  27 14 f 46.65000 0.3659000 46.56000 0.4511000 46.73000 0.5762000 -0.1713000     0.7318000 
1 1 1 7  27 16 o 57.21000 0.5001000 57.50000 0.5317000 56.92000 0.8473000 0.5755000      1.000000  
1 1 1 7  27 18 o 32.51000 0.4772000 33.13000 0.4123000 31.89000 0.8607000 1.236000       0.9543000 
1 1 1 7  27 20 o 96.81000 0.6954000 96.32000 0.8468000 97.31000 1.103000  -0.9887000     1.391000  
1 1 1 7  27 22 o 30.91000 0.3118000 30.77000 0.4184000 31.06000 0.4623000 -0.2890000     0.6235000 
1 1 1 7  27 24 o 35.86000 0.3543000 36.01000 0.3911000 35.71000 0.5910000 0.3089000      0.7087000 
1 1 1 7  27 26 o 40.29000 0.3285000 40.49000 0.4594000 40.09000 0.4696000 0.4044000      0.6569000 
1 1 1 7  27 28 o 58.15000 0.4632000 57.86000 0.6023000 58.44000 0.7040000 -0.5890000     0.9265000 
1 1 1 7  27 30 o 74.62000 0.5756000 75.66000 0.8753000 73.58000 0.7476000 2.073000       1.151000  
1 1 1 7  27 32 o 24.01000 0.3547000 24.05000 0.5903000 23.98000 0.3934000 0.7119000E-01  0.7094000 
1 1 1 7  27 34 o 20.35000 0.3904000 20.32000 0.6482000 20.39000 0.4354000 -0.6979000E-01 0.7809000 
1 1 1 7  27 36 o 31.58000 0.3383000 31.92000 0.5262000 31.24000 0.4254000 0.6800000      0.6767000 
1 1 1 7  27 38 o 36.17000 0.4466000 36.96000 0.6775000 35.37000 0.5821000 1.594000       0.8932000 
1 1 1 7  27 40 o 22.20000 0.4457000 22.21000 0.7104000 22.19000 0.5386000 0.2067000E-01  0.8915000 
1 1 1 7  27 42 o 5.166000 1.015000  5.165000 1.513000  5.168000 1.354000  -0.2773000E-02 2.030000  
1 1 1 7  27 44 o 4.338000 0.9912000 3.497000 1.543000  5.179000 1.244000  -1.682000      1.982000  
1 1 1 7  27 46 o 17.87000 0.4252000 17.47000 0.7159000 18.27000 0.4591000 -0.8031000     0.8505000 
1 1 1 7  27 48 o 15.17000 0.4241000 14.24000 0.6820000 16.10000 0.5045000 -1.861000      0.8483000 
1 1 1 7  27 50 o 3.636000 0.9342000 2.904000 1.317000  4.368000 1.326000  -1.464000      1.868000  
1 1 1 7  27 52 o 18.89000 0.4029000 19.66000 0.5629000 18.12000 0.5767000 1.540000       0.8059000 
1 1 1 7  27 54 o 7.063000 0.8439000 6.761000 1.349000  7.364000 1.015000  -0.6035000     1.688000  
1 1 1 7  27 56 f 7.116000 0.8018000 6.931000 1.261000  7.302000 0.9903000 -0.3707000     1.604000  
1 1 1 7  27 58 o 6.482000 0.8638000 6.187000 1.371000  6.778000 1.051000  -0.5916000     1.728000  
1 1 1 7  27 60 o 3.897000 1.085000  4.123000 1.685000  3.672000 1.367000  0.4517000      2.170000  
1 1 1 7  28 1  o 37.69000 0.3901000 37.28000 0.4847000 38.09000 0.6114000 -0.8145000     0.7802000 
1 1 1 7  28 3  o 29.36000 0.3166000 28.95000 0.4469000 29.76000 0.4487000 -0.8059000     0.6333000 
1 1 1 7  28 5  o 59.44000 0.5312000 59.58000 0.6056000 59.31000 0.8729000 0.2733000      1.062000  
1 1 1 7  28 7  o 94.12000 0.7037000 95.38000 0.9351000 92.85000 1.052000  2.532000       1.407000  
1 1 1 7  28 9  o 101.4000 0.7268000 100.3000 0.8786000 102.6000 1.158000  -2.296000      1.454000  
1 1 1 7  28 11 o 19.23000 0.2632000 19.68000 0.3360000 18.77000 0.4053000 0.9042000      0.5265000 
1 1 1 7  28 13 o 30.62000 0.2836000 30.68000 0.3556000 30.55000 0.4419000 0.1320000      0.5672000 
1 1 1 7  28 15 o 35.60000 0.4770000 35.67000 0.3787000 35.54000 0.8757000 0.1236000      0.9541000 
1 1 1 7  28 17 o 33.09000 0.4717000 33.11000 0.3655000 33.08000 0.8697000 0.3117000E-01  0.9434000 
1 1 1 7  28 19 o 11.33000 0.3741000 11.29000 0.4678000 11.38000 0.5839000 -0.9206000E-01 0.7482000 
1 1 1 7  28 21 o 5.359000 0.7450000 6.051000 0.7425000 4.666000 1.292000  1.385000       1.490000  
1 1 1 7  28 23 o 11.95000 0.4286000 12.02000 0.5430000 11.87000 0.6634000 0.1458000      0.8572000 
1 1 1 7  28 25 o 20.50000 0.2922000 20.12000 0.3670000 20.87000 0.4548000 -0.7467000     0.5844000 
1 1 1 7  28 27 o 10.27000 0.4547000 9.666000 0.6156000 10.88000 0.6693000 -1.210000      0.9093000 
1 1 1 7  28 29 o 27.89000 0.3146000 27.99000 0.4681000 27.79000 0.4206000 0.1983000      0.6293000 
1 1 1 7  28 31 o 37.18000 0.3286000 37.08000 0.4613000 37.27000 0.4681000 -0.1867000     0.6572000 
1 1 1 7  28 33 f 17.71000 0.3760000 17.81000 0.5577000 17.61000 0.5046000 0.2045000      0.7521000 
1 1 1 7  28 35 o 26.41000 0.3825000 27.31000 0.5278000 25.51000 0.5537000 1.807000       0.7649000 
1 1 1 7  28 37 o 24.88000 0.3407000 25.31000 0.5271000 24.45000 0.4318000 0.8603000      0.6814000 
1 1 1 7  28 39 o 25.09000 0.3897000 24.89000 0.6350000 25.28000 0.4517000 -0.3885000     0.7793000 
1 1 1 7  28 41 o 12.04000 0.5074000 12.04000 0.7627000 12.04000 0.6696000 -0.8213000E-02 1.015000  
1 1 1 7  28 43 o 6.166000 0.9985000 6.181000 1.639000  6.152000 1.140000  0.2895000E-01  1.997000  
1 1 1 7  28 45 o 6.422000 0.9840000 6.272000 1.612000  6.571000 1.129000  -0.2990000     1.968000  
1 1 1 7  28 47 o 11.01000 0.4950000 10.99000 0.7774000 11.03000 0.6130000 -0.3750000E-01 0.9901000 
1 1 1 7  28 49 o 11.08000 0.5425000 11.07000 0.8835000 11.09000 0.6299000 -0.1999000E-01 1.085000  
1 1 1 7  28 51 o 4.808000 0.9587000 3.588000 1.549000  6.029000 1.131000  -2.441000      1.917000  
1 1 1 7  28 53 o 6.995000 0.8661000 6.978000 1.327000  7.011000 1.113000  -0.3343000E-01 1.732000  
1 1 1 7  28 55 o 10.54000 0.5896000 10.02000 0.9568000 11.06000 0.6894000 -1.037000      1.179000  
1 1 1 7  28 57 o 8.798000 0.6708000 8.794000 1.108000  8.802000 0.7560000 -0.7910000E-02 1.342000  
1 1 1 7  28 59 o 4.617000 0.9819000 4.144000 1.511000  5.089000 1.254000  -0.9448000     1.964000  
1 1 1 7  29 0  o 56.21000 0.8184000 56.21000 0.8184000 56.21000 0.8184000 0.000000       0.000000  
1 1 1 7  29 2  o 60.07000 0.4684000 60.62000 0.6146000 59.52000 0.7068000 1.093000       0.9367000 
1 1 1 7  29 4  o 39.82000 0.3428000 39.75000 0.4424000 39.88000 0.5237000 -0.1324000     0.6856000 
1 1 1 7  29 6  o 3.520000 0.9565000 2.695000 1.075000  4.345000 1.582000  -1.650000      1.913000  
1 1 1 7  29 8  o 68.35000 0.5783000 69.51000 0.6270000 67.19000 0.9718000 2.328000       1.157000  
1 1 1 7  29 10 o 36.51000 0.3671000 36.82000 0.3877000 36.20000 0.6234000 0.6150000      0.7341000 
1 1 1 7  29 12 o 46.16000 0.5583000 45.95000 0.4461000 46.37000 1.024000  -0.4169000     1.117000  
1 1 1 7  29 14 o 40.99000 0.5286000 40.29000 0.4584000 41.69000 0.9528000 -1.399000      1.057000  
1 1 1 7  29 16 o 25.15000 0.4470000 24.95000 0.3354000 25.35000 0.8287000 -0.3997000     0.8940000 
1 1 1 7  29 18 o 8.883000 0.4404000 8.927000 0.5700000 8.840000 0.6715000 0.8614000E-01  0.8808000 
1 1 1 7  29 20 o 19.92000 0.2821000 19.78000 0.3511000 20.06000 0.4417000 -0.2772000     0.5643000 
1 1 1 7  29 22 o 54.04000 0.4925000 53.19000 0.5688000 54.90000 0.8041000 -1.710000      0.9849000 
1 1 1 7  29 24 o 35.26000 0.3181000 34.87000 0.3893000 35.66000 0.5032000 -0.7880000     0.6362000 
1 1 1 7  29 26 o 24.71000 0.3021000 24.73000 0.3933000 24.68000 0.4587000 0.4749000E-01  0.6043000 
1 1 1 7  29 28 o 9.632000 0.5075000 10.44000 0.6954000 8.828000 0.7393000 1.607000       1.015000  
1 1 1 7  29 30 o 24.63000 0.3016000 25.02000 0.4230000 24.23000 0.4301000 0.7942000      0.6032000 
1 1 1 7  29 32 o 16.88000 0.3508000 16.56000 0.4957000 17.20000 0.4965000 -0.6385000     0.7016000 
1 1 1 7  29 34 o 37.17000 0.3653000 38.15000 0.5507000 36.20000 0.4801000 1.958000       0.7306000 
1 1 1 7  29 36 o 27.26000 0.3253000 26.65000 0.4614000 27.87000 0.4588000 -1.220000      0.6506000 
1 1 1 7  29 38 o 22.65000 0.4265000 22.54000 0.5489000 22.76000 0.6530000 -0.2154000     0.8531000 
1 1 1 7  29 40 o 23.72000 0.3319000 23.48000 0.4646000 23.97000 0.4742000 -0.4844000     0.6638000 
1 1 1 7  29 42 o 15.08000 0.3923000 14.82000 0.5629000 15.35000 0.5466000 -0.5280000     0.7846000 
1 1 1 7  29 44 o 19.07000 0.4113000 18.58000 0.5925000 19.55000 0.5706000 -0.9742000     0.8226000 
1 1 1 7  29 46 o 15.79000 0.4112000 15.95000 0.6443000 15.63000 0.5113000 0.3139000      0.8225000 
1 1 1 7  29 48 o 3.122000 0.9368000 3.269000 1.330000  2.974000 1.320000  0.2951000      1.874000  
1 1 1 7  29 50 o 7.156000 0.7458000 6.866000 1.065000  7.446000 1.045000  -0.5796000     1.492000  
1 1 1 7  29 52 o 10.45000 0.5676000 10.19000 0.8718000 10.71000 0.7271000 -0.5239000     1.135000  
1 1 1 7  29 54 o 3.942000 1.018000  4.190000 1.498000  3.694000 1.378000  0.4962000      2.036000  
1 1 1 7  29 56 o 3.183000 0.9368000 3.386000 1.370000  2.981000 1.278000  0.4049000      1.874000  
1 1 1 7  29 58 o 2.819000 0.8722000 3.099000 1.319000  2.539000 1.142000  0.5597000      1.744000  
1 1 1 7  30 1  o 9.147000 0.5177000 8.207000 0.8784000 10.09000 0.5480000 -1.881000      1.035000  
1 1 1 7  30 3  o 30.88000 0.4018000 30.22000 0.3505000 31.54000 0.7231000 -1.321000      0.8036000 
1 1 1 7  30 5  f 27.07000 0.3158000 27.26000 0.3694000 26.88000 0.5122000 0.3757000      0.6315000 
1 1 1 7  30 7  o 94.42000 0.7714000 95.28000 0.8376000 93.55000 1.296000  1.732000       1.543000  
1 1 1 7  30 9  f 82.64000 0.8957000 83.87000 0.7438000 81.40000 1.630000  2.467000       1.791000  
1 1 1 7  30 11 o 31.19000 0.4525000 31.70000 0.3616000 30.68000 0.8297000 1.018000       0.9051000 
1 1 1 7  30 13 o 73.95000 0.8342000 73.93000 0.7412000 73.96000 1.495000  -0.3282000E-01 1.668000  
1 1 1 7  30 15 o 66.14000 0.5672000 65.90000 0.5989000 66.38000 0.9633000 -0.4831000     1.134000  
1 1 1 7  30 17 o 50.57000 0.4102000 50.85000 0.5414000 50.29000 0.6164000 0.5594000      0.8204000 
1 1 1 7  30 19 o 14.80000 0.3099000 15.39000 0.3840000 14.21000 0.4865000 1.179000       0.6198000 
1 1 1 7  30 21 o 42.80000 0.4117000 43.11000 0.4909000 42.50000 0.6609000 0.6018000      0.8233000 
1 1 1 7  30 23 o 44.82000 0.3642000 44.65000 0.4451000 44.99000 0.5766000 -0.3435000     0.7284000 
1 1 1 7  30 25 o 52.84000 0.4287000 53.01000 0.5620000 52.67000 0.6476000 0.3442000      0.8575000 
1 1 1 7  30 27 o 23.99000 0.3107000 24.15000 0.4512000 23.83000 0.4274000 0.3236000      0.6215000 
1 1 1 7  30 29 o 40.72000 0.3441000 40.92000 0.4859000 40.53000 0.4873000 0.3919000      0.6882000 
1 1 1 7  30 31 o 32.15000 0.3422000 32.46000 0.5148000 31.83000 0.4508000 0.6263000      0.6843000 
1 1 1 7  30 33 o 24.68000 0.3424000 24.65000 0.5139000 24.71000 0.4526000 -0.5750000E-01 0.6848000 
1 1 1 7  30 35 o 23.30000 0.3518000 22.37000 0.4572000 24.22000 0.5349000 -1.848000      0.7037000 
1 1 1 7  30 37 o 14.73000 0.5103000 15.43000 0.5621000 14.04000 0.8518000 1.385000       1.021000  
1 1 1 7  30 39 o 8.055000 0.7126000 8.992000 0.9551000 7.118000 1.058000  1.874000       1.425000  
1 1 1 7  30 41 o 17.18000 0.3922000 16.96000 0.6010000 17.40000 0.5042000 -0.4375000     0.7844000 
1 1 1 7  30 43 o 13.52000 0.4654000 13.16000 0.7245000 13.89000 0.5844000 -0.7355000     0.9308000 
1 1 1 7  30 45 o 12.12000 0.4361000 12.75000 0.6367000 11.50000 0.5960000 1.246000       0.8721000 
1 1 1 7  30 47 o 9.023000 0.5811000 8.730000 0.8465000 9.316000 0.7963000 -0.5857000     1.162000  
1 1 1 7  30 49 o 12.73000 0.6307000 12.16000 1.059000  13.30000 0.6859000 -1.144000      1.261000  
1 1 1 7  30 51 o 10.70000 0.6473000 10.48000 1.010000  10.92000 0.8095000 -0.4395000     1.295000  
1 1 1 7  30 53 o 5.086000 1.034000  4.955000 1.601000  5.216000 1.310000  -0.2612000     2.069000  
1 1 1 7  30 55 o 4.281000 1.015000  4.345000 1.475000  4.217000 1.394000  0.1281000      2.030000  
1 1 1 7  30 57 o 3.255000 0.9602000 2.998000 1.319000  3.512000 1.396000  -0.5143000     1.920000  
1 1 1 7  30 59 o 8.267000 0.7476000 8.265000 0.9362000 8.269000 1.166000  -0.3567000E-02 1.495000  
1 1 1 7  31 0  o 53.57000 0.5603000 53.57000 0.5603000 53.57000 0.5603000 0.000000       0.000000  
1 1 1 7  31 2  o 63.95000 0.4973000 64.97000 0.6601000 62.92000 0.7438000 2.058000       0.9945000 
1 1 1 7  31 4  o 32.96000 0.3360000 33.29000 0.3675000 32.63000 0.5625000 0.6633000      0.6719000 
1 1 1 7  31 6  o 50.82000 0.5883000 49.83000 0.5263000 51.82000 1.052000  -1.982000      1.177000  
1 1 1 7  31 8  o 18.82000 0.2998000 18.90000 0.3493000 18.73000 0.4875000 0.1683000      0.5997000 
1 1 1 7  31 10 o 51.55000 0.4528000 50.95000 0.4827000 52.15000 0.7661000 -1.195000      0.9055000 
1 1 1 7  31 12 o 57.01000 0.4527000 56.34000 0.5870000 57.67000 0.6893000 -1.333000      0.9053000 
1 1 1 7  31 14 o 10.19000 0.3769000 9.742000 0.5017000 10.64000 0.5627000 -0.8984000     0.7539000 
1 1 1 7  31 16 o 9.357000 0.4293000 9.779000 0.5611000 8.934000 0.6499000 0.8444000      0.8586000 
1 1 1 7  31 18 o 16.33000 0.2907000 16.72000 0.3669000 15.94000 0.4510000 0.7809000      0.5814000 
1 1 1 7  31 20 o 23.01000 0.3308000 22.78000 0.4119000 23.24000 0.5179000 -0.4662000     0.6617000 
1 1 1 7  31 22 o 7.968000 0.5252000 7.692000 0.6081000 8.244000 0.8565000 -0.5514000     1.050000  
1 1 1 7  31 24 o 14.35000 0.3466000 14.87000 0.4305000 13.84000 0.5434000 1.028000       0.6932000 
1 1 1 7  31 26 o 30.81000 0.3053000 31.17000 0.3791000 30.45000 0.4787000 0.7190000      0.6106000 
1 1 1 7  31 28 o 6.027000 0.7963000 6.685000 0.9781000 5.368000 1.257000  1.317000       1.593000  
1 1 1 7  31 30 o 22.33000 0.3379000 22.74000 0.5036000 21.93000 0.4507000 0.8159000      0.6758000 
1 1 1 7  31 32 o 10.95000 0.5250000 11.21000 0.7901000 10.69000 0.6915000 0.5222000      1.050000  
1 1 1 7  31 34 o 5.777000 0.9156000 5.663000 1.220000  5.890000 1.365000  -0.2270000     1.831000  
1 1 1 7  31 36 o 8.768000 0.7952000 8.900000 0.8389000 8.636000 1.351000  0.2640000      1.590000  
1 1 1 7  31 38 o 11.35000 0.5283000 12.40000 0.7642000 10.31000 0.7296000 2.086000       1.057000  
1 1 1 7  31 40 o 26.78000 0.4207000 26.85000 0.5379000 26.71000 0.6471000 0.1446000      0.8414000 
1 1 1 7  31 42 o 3.972000 1.024000  4.394000 1.538000  3.550000 1.354000  0.8439000      2.048000  
1 1 1 7  31 44 o 18.46000 0.3376000 18.21000 0.4903000 18.72000 0.4643000 -0.5073000     0.6753000 
1 1 1 7  31 46 o 7.883000 0.6525000 7.921000 0.9506000 7.844000 0.8942000 0.7711000E-01  1.305000  
1 1 1 7  31 48 o 9.264000 0.6410000 8.182000 1.096000  10.35000 0.6644000 -2.165000      1.282000  
1 1 1 7  31 50 o 3.765000 0.9791000 3.922000 1.397000  3.608000 1.372000  0.3139000      1.958000  
1 1 1 7  31 52 o 3.240000 0.9601000 3.123000 1.345000  3.356000 1.370000  -0.2330000     1.920000  
1 1 1 7  31 54 o 4.475000 1.066000  5.034000 1.628000  3.916000 1.377000  1.118000       2.132000  
1 1 1 7  31 56 o 3.518000 0.9963000 3.603000 1.465000  3.432000 1.351000  0.1707000      1.993000  
1 1 1 7  31 58 o 4.335000 1.017000  4.647000 1.519000  4.023000 1.354000  0.6243000      2.035000  
1 1 1 7  32 1  o 23.92000 0.2629000 23.84000 0.3735000 24.01000 0.3701000 -0.1677000     0.5258000 
1 1 1 7  32 3  o 28.29000 0.2974000 28.17000 0.3896000 28.41000 0.4495000 -0.2338000     0.5949000 
1 1 1 7  32 5  o 9.035000 0.4802000 8.699000 0.6498000 9.372000 0.7073000 -0.6729000     0.9605000 
1 1 1 7  32 7  o 58.05000 0.4380000 58.54000 0.5426000 57.56000 0.6878000 0.9854000      0.8760000 
1 1 1 7  32 9  o 23.92000 0.3100000 23.75000 0.3670000 24.10000 0.4997000 -0.3565000     0.6200000 
1 1 1 7  32 11 o 36.21000 0.3310000 35.85000 0.4329000 36.57000 0.5009000 -0.7261000     0.6620000 
1 1 1 7  32 13 f 61.27000 0.4582000 62.14000 0.5718000 60.40000 0.7162000 1.747000       0.9165000 
1 1 1 7  32 15 o 39.13000 0.3468000 39.27000 0.4610000 38.98000 0.5181000 0.2855000      0.6935000 
1 1 1 7  32 17 o 14.23000 0.3143000 14.76000 0.3856000 13.69000 0.4964000 1.077000       0.6286000 
1 1 1 7  32 19 o 16.02000 0.3520000 15.88000 0.4623000 16.16000 0.5311000 -0.2770000     0.7041000 
1 1 1 7  32 21 f 31.41000 0.3567000 31.85000 0.4329000 30.97000 0.5670000 0.8770000      0.7134000 
1 1 1 7  32 23 o 28.20000 0.3121000 27.71000 0.4009000 28.68000 0.4785000 -0.9683000     0.6242000 
1 1 1 7  32 25 o 41.55000 0.3517000 42.04000 0.4390000 41.05000 0.5497000 0.9888000      0.7035000 
1 1 1 7  32 27 o 17.37000 0.3304000 17.64000 0.4541000 17.10000 0.4802000 0.5336000      0.6609000 
1 1 1 7  32 29 o 6.193000 0.7736000 6.401000 1.020000  5.985000 1.164000  0.4162000      1.547000  
1 1 1 7  32 31 o 18.32000 0.3591000 18.77000 0.5359000 17.87000 0.4783000 0.9025000      0.7183000 
1 1 1 7  32 33 o 17.45000 0.3562000 17.69000 0.4964000 17.22000 0.5111000 0.4720000      0.7125000 
1 1 1 7  32 35 o 11.84000 0.5167000 12.49000 0.6033000 11.19000 0.8390000 1.299000       1.033000  
1 1 1 7  32 37 o 16.48000 0.3702000 16.36000 0.5319000 16.60000 0.5150000 -0.2369000     0.7403000 
1 1 1 7  32 39 o 7.643000 0.8590000 7.499000 1.397000  7.787000 1.000000  -0.2877000     1.718000  
1 1 1 7  32 41 o 3.460000 0.9260000 3.982000 1.354000  2.938000 1.264000  1.043000       1.852000  
1 1 1 7  32 43 o 12.53000 0.4246000 12.70000 0.6090000 12.36000 0.5919000 0.3340000      0.8493000 
1 1 1 7  32 45 o 7.579000 0.6650000 8.097000 0.8932000 7.062000 0.9853000 1.035000       1.330000  
1 1 1 7  32 47 o 16.62000 0.4006000 15.96000 0.6156000 17.28000 0.5128000 -1.315000      0.8012000 
1 1 1 7  32 49 o 8.889000 0.6451000 8.971000 0.8665000 8.806000 0.9559000 0.1647000      1.290000  
1 1 1 7  32 51 f 6.852000 0.7371000 6.349000 1.138000  7.355000 0.9374000 -1.007000      1.474000  
1 1 1 7  32 53 o 5.796000 0.8939000 5.653000 1.306000  5.938000 1.221000  -0.2848000     1.788000  
1 1 1 7  32 55 o 6.173000 0.9067000 6.039000 1.451000  6.308000 1.087000  -0.2690000     1.813000  
1 1 1 7  32 57 o 7.339000 0.8992000 6.654000 1.516000  8.024000 0.9669000 -1.370000      1.798000  
1 1 1 7  33 0  o 61.26000 0.6270000 61.26000 0.6270000 61.26000 0.6270000 0.000000       0.000000  
1 1 1 7  33 2  o 65.17000 0.4841000 65.20000 0.5931000 65.14000 0.7653000 0.5794000E-01  0.9682000 
1 1 1 7  33 4  o 12.80000 0.3265000 12.75000 0.4056000 12.85000 0.5118000 -0.9769000E-01 0.6530000 
1 1 1 7  33 6  o 24.82000 0.2911000 24.53000 0.3860000 25.10000 0.4359000 -0.5709000     0.5823000 
1 1 1 7  33 8  o 38.81000 0.3442000 38.24000 0.4482000 39.38000 0.5224000 -1.143000      0.6883000 
1 1 1 7  33 10 o 22.38000 0.2944000 22.12000 0.3885000 22.63000 0.4424000 -0.5097000     0.5888000 
1 1 1 7  33 12 o 39.01000 0.3839000 38.70000 0.4474000 39.32000 0.6239000 -0.6154000     0.7677000 
1 1 1 7  33 14 o 50.48000 0.4129000 50.70000 0.5459000 50.25000 0.6196000 0.4495000      0.8258000 
1 1 1 7  33 16 o 51.81000 0.4233000 52.14000 0.5639000 51.48000 0.6315000 0.6577000      0.8466000 
1 1 1 7  33 18 o 68.07000 0.5980000 68.18000 0.7004000 67.96000 0.9695000 0.2171000      1.196000  
1 1 1 7  33 20 f 44.49000 0.3821000 44.61000 0.5103000 44.37000 0.5688000 0.2378000      0.7641000 
1 1 1 7  33 22 o 25.39000 0.3067000 25.77000 0.4032000 25.00000 0.4623000 0.7726000      0.6134000 
1 1 1 7  33 24 o 18.17000 0.3287000 18.07000 0.4034000 18.28000 0.5192000 -0.2099000     0.6575000 
1 1 1 7  33 26 o 24.66000 0.3180000 25.01000 0.4063000 24.31000 0.4893000 0.6951000      0.6360000 
1 1 1 7  33 28 o 11.39000 0.4475000 12.07000 0.5774000 10.70000 0.6838000 1.372000       0.8950000 
1 1 1 7  33 30 o 15.28000 0.3971000 15.13000 0.6067000 15.44000 0.5124000 -0.3153000     0.7941000 
1 1 1 7  33 32 o 13.78000 0.4024000 13.62000 0.5607000 13.95000 0.5773000 -0.3332000     0.8048000 
1 1 1 7  33 34 o 16.32000 0.4052000 16.66000 0.4933000 15.99000 0.6430000 0.6680000      0.8104000 
1 1 1 7  33 36 o 7.401000 0.9077000 8.301000 0.9781000 6.502000 1.529000  1.799000       1.815000  
1 1 1 7  33 38 o 9.970000 0.5736000 9.413000 0.8555000 10.53000 0.7644000 -1.114000      1.147000  
1 1 1 7  33 40 o 17.96000 0.3502000 18.29000 0.4911000 17.64000 0.4993000 0.6557000      0.7004000 
1 1 1 7  33 42 o 22.34000 0.3249000 22.03000 0.4670000 22.65000 0.4518000 -0.6154000     0.6498000 
1 1 1 7  33 44 o 12.00000 0.4521000 12.00000 0.6343000 12.01000 0.6443000 -0.1016000E-01 0.9041000 
1 1 1 7  33 46 o 16.24000 0.3813000 15.30000 0.5696000 17.19000 0.5069000 -1.890000      0.7625000 
1 1 1 7  33 48 o 15.02000 0.4356000 15.51000 0.5753000 14.53000 0.6542000 0.9727000      0.8712000 
1 1 1 7  33 50 o 12.90000 0.5823000 13.30000 0.6336000 12.50000 0.9771000 0.7976000      1.165000  
1 1 1 7  33 52 o 11.14000 0.6159000 11.50000 1.016000  10.78000 0.6961000 0.7215000      1.232000  
1 1 1 7  33 54 o 5.365000 0.8968000 4.279000 1.366000  6.452000 1.163000  -2.173000      1.794000  
1 1 1 7  33 56 f 10.54000 0.5123000 10.20000 0.7373000 10.88000 0.7115000 -0.6732000     1.025000  
1 1 1 7  34 1  o 45.36000 0.3510000 44.79000 0.4927000 45.92000 0.5001000 -1.135000      0.7020000 
1 1 1 7  34 3  f 36.04000 0.3162000 36.13000 0.3863000 35.95000 0.5007000 0.1749000      0.6324000 
1 1 1 7  34 5  o 53.66000 0.4120000 53.91000 0.5060000 53.41000 0.6504000 0.5000000      0.8240000 
1 1 1 7  34 7  o 15.88000 0.4077000 16.23000 0.4243000 15.54000 0.6963000 0.6951000      0.8154000 
1 1 1 7  34 9  o 20.26000 0.3224000 19.78000 0.4771000 20.74000 0.4336000 -0.9630000     0.6447000 
1 1 1 7  34 11 o 43.96000 0.3576000 43.37000 0.4330000 44.54000 0.5692000 -1.172000      0.7152000 
1 1 1 7  34 13 o 40.55000 0.3410000 40.96000 0.4238000 40.14000 0.5343000 0.8241000      0.6820000 
1 1 1 7  34 15 o 16.65000 0.3661000 17.18000 0.5082000 16.12000 0.5270000 1.067000       0.7321000 
1 1 1 7  34 17 o 17.75000 0.3424000 18.69000 0.4354000 16.80000 0.5286000 1.894000       0.6848000 
1 1 1 7  34 19 o 27.02000 0.3183000 26.78000 0.4281000 27.26000 0.4710000 -0.4709000     0.6365000 
1 1 1 7  34 21 o 21.85000 0.3031000 21.90000 0.3966000 21.80000 0.4584000 0.1044000      0.6062000 
1 1 1 7  34 23 o 21.37000 0.3042000 21.80000 0.3793000 20.95000 0.4758000 0.8487000      0.6085000 
1 1 1 7  34 25 o 51.17000 0.4264000 51.02000 0.5556000 51.31000 0.6471000 -0.2878000     0.8529000 
1 1 1 7  34 27 o 24.82000 0.2981000 25.19000 0.4153000 24.46000 0.4277000 0.7287000      0.5962000 
1 1 1 7  34 29 o 17.79000 0.3667000 18.14000 0.5334000 17.43000 0.5034000 0.7067000      0.7334000 
1 1 1 7  34 31 o 10.11000 0.4779000 10.31000 0.6739000 9.909000 0.6777000 0.3990000      0.9557000 
1 1 1 7  34 33 f 10.60000 0.4776000 10.88000 0.6731000 10.32000 0.6778000 0.5649000      0.9552000 
1 1 1 7  34 35 o 2.964000 0.8950000 2.489000 1.125000  3.440000 1.392000  -0.9506000     1.790000  
1 1 1 7  34 37 o 14.23000 0.4035000 14.70000 0.5529000 13.76000 0.5878000 0.9450000      0.8070000 
1 1 1 7  34 39 o 16.23000 0.3629000 16.66000 0.5032000 15.81000 0.5231000 0.8564000      0.7258000 
1 1 1 7  34 41 o 13.42000 0.4483000 14.00000 0.6775000 12.84000 0.5872000 1.167000       0.8966000 
1 1 1 7  34 43 o 3.367000 0.8958000 2.655000 1.184000  4.078000 1.344000  -1.423000      1.792000  
1 1 1 7  34 45 o 4.287000 0.8964000 5.021000 1.250000  3.554000 1.285000  1.467000       1.793000  
1 1 1 7  34 47 o 9.271000 0.6306000 9.570000 0.8415000 8.972000 0.9393000 0.5976000      1.261000  
1 1 1 7  34 49 o 9.242000 0.7992000 9.485000 0.9275000 8.998000 1.302000  0.4869000      1.598000  
1 1 1 7  34 51 o 12.07000 0.5226000 11.16000 0.8241000 12.99000 0.6430000 -1.836000      1.045000  
1 1 1 7  34 53 o 10.61000 0.5418000 11.55000 0.7435000 9.680000 0.7882000 1.866000       1.084000  
1 1 1 7  34 55 o 4.680000 0.9252000 5.665000 1.315000  3.695000 1.302000  1.971000       1.850000  
1 1 1 7  35 0  o 25.94000 0.3876000 25.94000 0.3876000 25.94000 0.3876000 0.000000       0.000000  
1 1 1 7  35 2  o 40.56000 0.3541000 40.07000 0.4571000 41.04000 0.5409000 -0.9693000     0.7081000 
1 1 1 7  35 4  o 57.11000 0.4352000 56.70000 0.5274000 57.52000 0.6925000 -0.8267000     0.8704000 
1 1 1 7  35 6  o 21.83000 0.2810000 21.81000 0.3504000 21.84000 0.4394000 -0.3257000E-01 0.5620000 
1 1 1 7  35 8  o 31.56000 0.3422000 31.87000 0.4992000 31.26000 0.4682000 0.6073000      0.6844000 
1 1 1 7  35 10 o 36.46000 0.3381000 36.22000 0.4461000 36.70000 0.5083000 -0.4783000     0.6762000 
1 1 1 7  35 12 o 32.71000 0.3237000 32.74000 0.4328000 32.68000 0.4816000 0.5592000E-01  0.6475000 
1 1 1 7  35 14 o 20.83000 0.3292000 20.67000 0.4188000 21.00000 0.5080000 -0.3286000     0.6584000 
1 1 1 7  35 16 f 12.45000 0.4024000 12.79000 0.5551000 12.12000 0.5826000 0.6696000      0.8047000 
1 1 1 7  35 18 o 3.821000 0.8746000 3.813000 1.171000  3.830000 1.299000  -0.1751000E-01 1.749000  
1 1 1 7  35 20 o 9.658000 0.4875000 9.492000 0.6309000 9.825000 0.7433000 -0.3336000     0.9750000 
1 1 1 7  35 22 o 16.16000 0.3376000 16.64000 0.4137000 15.68000 0.5336000 0.9569000      0.6752000 
1 1 1 7  35 24 o 24.74000 0.3213000 24.66000 0.4211000 24.82000 0.4853000 -0.1581000     0.6425000 
1 1 1 7  35 26 o 21.70000 0.3201000 21.50000 0.3943000 21.89000 0.5044000 -0.3910000     0.6402000 
1 1 1 7  35 28 o 35.85000 0.3982000 35.87000 0.6447000 35.83000 0.4675000 0.4055000E-01  0.7964000 
1 1 1 7  35 30 o 18.78000 0.3328000 19.06000 0.4650000 18.51000 0.4762000 0.5500000      0.6656000 
1 1 1 7  35 32 o 6.968000 0.8037000 5.811000 1.279000  8.126000 0.9734000 -2.315000      1.607000  
1 1 1 7  35 34 o 26.67000 0.3937000 25.93000 0.4344000 27.41000 0.6567000 -1.478000      0.7873000 
1 1 1 7  35 36 o 16.07000 0.3661000 15.80000 0.5063000 16.35000 0.5289000 -0.5527000     0.7322000 
1 1 1 7  35 38 o 23.63000 0.3401000 24.20000 0.5090000 23.06000 0.4513000 1.144000       0.6802000 
1 1 1 7  35 40 o 13.62000 0.4395000 14.06000 0.6738000 13.19000 0.5646000 0.8711000      0.8791000 
1 1 1 7  35 42 o 5.923000 0.8012000 6.445000 1.058000  5.401000 1.204000  1.044000       1.602000  
1 1 1 7  35 44 o 5.178000 0.8662000 5.984000 1.136000  4.373000 1.308000  1.611000       1.732000  
1 1 1 7  35 46 o 11.33000 0.5376000 11.78000 0.7196000 10.88000 0.7989000 0.9025000      1.075000  
1 1 1 7  35 48 o 7.046000 0.8387000 7.444000 1.161000  6.647000 1.211000  0.7965000      1.677000  
1 1 1 7  35 50 o 10.60000 0.5469000 9.839000 0.8234000 11.37000 0.7198000 -1.529000      1.094000  
1 1 1 7  35 52 o 5.582000 0.9720000 4.234000 1.608000  6.931000 1.092000  -2.697000      1.944000  
1 1 1 7  35 54 o 3.021000 0.9189000 3.133000 1.357000  2.910000 1.239000  0.2228000      1.838000  
1 1 1 7  35 56 o 7.818000 2.048000  7.818000 2.048000  ?        ?         ?              ?         
1 1 1 7  36 1  o 28.11000 0.2789000 28.00000 0.3957000 28.22000 0.3932000 -0.2175000     0.5579000 
1 1 1 7  36 3  o 68.89000 0.5117000 68.15000 0.6186000 69.62000 0.8152000 -1.468000      1.023000  
1 1 1 7  36 5  o 38.89000 0.3311000 39.13000 0.4079000 38.64000 0.5218000 0.4839000      0.6623000 
1 1 1 7  36 7  o 7.808000 0.4906000 7.649000 0.6379000 7.967000 0.7456000 -0.3181000     0.9812000 
1 1 1 7  36 9  o 25.69000 0.2998000 25.82000 0.4048000 25.57000 0.4423000 0.2477000      0.5996000 
1 1 1 7  36 11 o 50.92000 0.4206000 50.11000 0.5454000 51.73000 0.6405000 -1.613000      0.8413000 
1 1 1 7  36 13 o 59.56000 0.5345000 59.30000 0.6251000 59.82000 0.8673000 -0.5270000     1.069000  
1 1 1 7  36 15 o 37.41000 0.3453000 37.43000 0.4603000 37.38000 0.5148000 0.4488000E-01  0.6906000 
1 1 1 7  36 17 o 28.09000 0.3037000 28.04000 0.3810000 28.15000 0.4730000 -0.1155000     0.6073000 
1 1 1 7  36 19 o 7.137000 0.6436000 7.452000 0.8121000 6.823000 0.9986000 0.6287000      1.287000  
1 1 1 7  36 21 o 14.01000 0.3837000 14.66000 0.4792000 13.37000 0.5993000 1.290000       0.7673000 
1 1 1 7  36 23 o 18.16000 0.3426000 18.61000 0.4424000 17.72000 0.5233000 0.8912000      0.6852000 
1 1 1 7  36 25 o 10.96000 0.4746000 11.25000 0.5668000 10.66000 0.7613000 0.5890000      0.9492000 
1 1 1 7  36 27 o 23.46000 0.3764000 23.48000 0.6066000 23.44000 0.4457000 0.3375000E-01  0.7527000 
1 1 1 7  36 29 o 9.938000 0.4890000 9.738000 0.6511000 10.14000 0.7299000 -0.4004000     0.9781000 
1 1 1 7  36 31 o 11.94000 0.4899000 11.63000 0.6000000 12.25000 0.7746000 -0.6158000     0.9798000 
1 1 1 7  36 33 o 6.254000 0.9366000 6.323000 1.015000  6.184000 1.574000  0.1384000      1.873000  
1 1 1 7  36 35 o 28.81000 0.3270000 28.82000 0.4270000 28.80000 0.4955000 0.1390000E-01  0.6541000 
1 1 1 7  36 37 o 8.220000 0.6285000 8.441000 0.9198000 8.000000 0.8569000 0.4403000      1.257000  
1 1 1 7  36 39 o 7.885000 0.5713000 6.817000 0.8774000 8.953000 0.7320000 -2.136000      1.143000  
1 1 1 7  36 41 o 5.958000 0.8204000 5.072000 1.332000  6.844000 0.9575000 -1.772000      1.641000  
1 1 1 7  36 43 o 7.242000 0.6582000 7.802000 0.8827000 6.682000 0.9766000 1.120000       1.316000  
1 1 1 7  36 45 o 8.289000 0.6794000 8.429000 0.8254000 8.148000 1.079000  0.2810000      1.359000  
1 1 1 7  36 47 o 5.125000 0.9064000 5.411000 1.288000  4.839000 1.276000  0.5726000      1.813000  
1 1 1 7  36 49 o 12.12000 0.6043000 12.71000 0.6232000 11.53000 1.036000  1.176000       1.209000  
1 1 1 7  36 51 o 8.006000 0.6361000 8.011000 0.9029000 8.001000 0.8963000 0.9665000E-02  1.272000  
1 1 1 7  36 53 o 5.283000 1.011000  4.787000 1.469000  5.779000 1.391000  -0.9923000     2.023000  
1 1 1 7  36 55 f 5.081000 1.063000  4.543000 1.506000  5.619000 1.500000  -1.077000      2.126000  
1 1 1 7  37 0  o 50.45000 0.5417000 50.45000 0.5417000 50.45000 0.5417000 0.000000       0.000000  
1 1 1 7  37 2  o 13.64000 0.3366000 13.38000 0.4902000 13.89000 0.4613000 -0.5060000     0.6731000 
1 1 1 7  37 4  o 38.46000 0.3337000 38.10000 0.4058000 38.83000 0.5298000 -0.7361000     0.6674000 
1 1 1 7  37 6  o 15.82000 0.3121000 15.92000 0.3885000 15.72000 0.4887000 0.2051000      0.6243000 
1 1 1 7  37 8  o 48.26000 0.4039000 48.08000 0.5229000 48.45000 0.6159000 -0.3711000     0.8079000 
1 1 1 7  37 10 o 36.24000 0.3259000 36.25000 0.4045000 36.22000 0.5111000 0.3188000E-01  0.6517000 
1 1 1 7  37 12 o 20.07000 0.3468000 19.82000 0.4186000 20.31000 0.5531000 -0.4860000     0.6936000 
1 1 1 7  37 14 o 35.92000 0.3256000 36.38000 0.4042000 35.45000 0.5106000 0.9241000      0.6513000 
1 1 1 7  37 16 o 31.53000 0.3120000 31.88000 0.3932000 31.19000 0.4845000 0.6994000      0.6240000 
1 1 1 7  37 18 o 25.78000 0.3164000 26.16000 0.4150000 25.40000 0.4777000 0.7658000      0.6328000 
1 1 1 7  37 20 o 12.58000 0.4082000 12.84000 0.4886000 12.32000 0.6540000 0.5237000      0.8163000 
1 1 1 7  37 22 o 20.76000 0.3516000 21.17000 0.3939000 20.34000 0.5825000 0.8238000      0.7032000 
1 1 1 7  37 24 o 18.03000 0.3575000 18.46000 0.4533000 17.60000 0.5531000 0.8629000      0.7151000 
1 1 1 7  37 26 o 6.832000 0.8330000 7.111000 1.156000  6.553000 1.200000  0.5577000      1.666000  
1 1 1 7  37 28 o 22.46000 0.3822000 22.31000 0.5174000 22.60000 0.5626000 -0.2905000     0.7643000 
1 1 1 7  37 30 o 5.098000 0.8386000 6.308000 0.9406000 3.888000 1.389000  2.420000       1.677000  
1 1 1 7  37 32 o 13.00000 0.4286000 13.05000 0.5220000 12.95000 0.6798000 0.1006000      0.8571000 
1 1 1 7  37 34 o 20.00000 0.3904000 20.54000 0.4381000 19.46000 0.6464000 1.077000       0.7809000 
1 1 1 7  37 36 o 6.087000 0.8278000 7.170000 1.028000  5.003000 1.298000  2.166000       1.656000  
1 1 1 7  37 38 o 13.47000 0.4143000 13.71000 0.6274000 13.23000 0.5413000 0.4794000      0.8286000 
1 1 1 7  37 40 o 13.70000 0.3984000 13.92000 0.5789000 13.48000 0.5474000 0.4375000      0.7967000 
1 1 1 7  37 42 f 8.231000 0.5925000 8.761000 0.8433000 7.701000 0.8325000 1.060000       1.185000  
1 1 1 7  37 44 o 5.674000 0.9308000 5.707000 1.197000  5.642000 1.426000  0.6478000E-01  1.862000  
1 1 1 7  37 46 o 14.06000 0.4201000 13.89000 0.6125000 14.24000 0.5750000 -0.3559000     0.8401000 
1 1 1 7  37 48 o 11.23000 0.6352000 12.02000 0.7124000 10.43000 1.052000  1.593000       1.270000  
1 1 1 7  37 50 o 6.725000 0.7919000 6.624000 1.222000  6.826000 1.007000  -0.2020000     1.584000  
1 1 1 7  37 52 o 6.559000 0.8755000 6.858000 1.294000  6.259000 1.180000  0.5990000      1.751000  
1 1 1 7  37 54 o 3.043000 0.9022000 2.980000 1.260000  3.106000 1.291000  -0.1261000     1.804000  
1 1 1 7  38 1  o 46.15000 0.3598000 46.18000 0.5091000 46.13000 0.5085000 0.5028000E-01  0.7196000 
1 1 1 7  38 3  o 26.40000 0.2997000 26.22000 0.3634000 26.57000 0.4767000 -0.3449000     0.5994000 
1 1 1 7  38 5  o 12.94000 0.3883000 12.58000 0.5342000 13.30000 0.5636000 -0.7151000     0.7765000 
1 1 1 7  38 7  o 20.66000 0.2966000 20.55000 0.3715000 20.77000 0.4624000 -0.2186000     0.5932000 
1 1 1 7  38 9  o 14.92000 0.3651000 14.33000 0.4478000 15.51000 0.5768000 -1.181000      0.7302000 
1 1 1 7  38 11 o 22.08000 0.3109000 22.47000 0.4232000 21.68000 0.4556000 0.7925000      0.6218000 
1 1 1 7  38 13 o 19.10000 0.3126000 19.04000 0.3905000 19.15000 0.4882000 -0.1117000     0.6252000 
1 1 1 7  38 15 o 21.81000 0.3138000 22.05000 0.4152000 21.57000 0.4706000 0.4859000      0.6276000 
1 1 1 7  38 17 o 23.75000 0.3048000 24.15000 0.3879000 23.36000 0.4702000 0.7887000      0.6095000 
1 1 1 7  38 19 o 23.74000 0.3075000 24.71000 0.4008000 22.78000 0.4664000 1.925000       0.6150000 
1 1 1 7  38 21 o 9.474000 0.5570000 10.33000 0.6054000 8.618000 0.9352000 1.712000       1.114000  
1 1 1 7  38 23 o 23.51000 0.3190000 23.79000 0.3930000 23.23000 0.5025000 0.5603000      0.6379000 
1 1 1 7  38 25 o 20.48000 0.4168000 20.23000 0.5442000 20.73000 0.6314000 -0.5032000     0.8336000 
1 1 1 7  38 27 o 11.47000 0.4667000 10.82000 0.6420000 12.13000 0.6774000 -1.304000      0.9333000 
1 1 1 7  38 29 o 14.50000 0.3829000 14.98000 0.4964000 14.02000 0.5832000 0.9592000      0.7659000 
1 1 1 7  38 31 o 9.572000 0.5287000 8.971000 0.6857000 10.17000 0.8049000 -1.202000      1.057000  
1 1 1 7  38 33 o 21.30000 0.3920000 21.22000 0.4335000 21.38000 0.6532000 -0.1597000     0.7839000 
1 1 1 7  38 35 o 26.75000 0.3300000 26.36000 0.4875000 27.14000 0.4448000 -0.7831000     0.6599000 
1 1 1 7  38 37 o 4.065000 0.9597000 4.130000 1.442000  4.000000 1.267000  0.1295000      1.919000  
1 1 1 7  38 39 o 12.55000 0.3964000 12.49000 0.5763000 12.61000 0.5444000 -0.1206000     0.7928000 
1 1 1 7  38 41 o 4.122000 0.9404000 4.653000 1.362000  3.591000 1.297000  1.062000       1.881000  
1 1 1 7  38 43 o 10.14000 0.5004000 10.16000 0.7245000 10.13000 0.6906000 0.2124000E-01  1.001000  
1 1 1 7  38 45 o 6.665000 0.8176000 6.256000 1.300000  7.073000 0.9924000 -0.8169000     1.635000  
1 1 1 7  38 47 o 10.35000 0.5950000 10.27000 0.9398000 10.43000 0.7301000 -0.1627000     1.190000  
1 1 1 7  38 49 o 10.79000 0.5482000 12.06000 0.8399000 9.509000 0.7047000 2.553000       1.096000  
1 1 1 7  38 51 o 7.100000 0.7873000 6.341000 1.258000  7.860000 0.9474000 -1.519000      1.575000  
1 1 1 7  38 53 o 3.731000 0.9509000 3.510000 1.342000  3.952000 1.348000  -0.4417000     1.902000  
1 1 1 7  39 0  o 17.24000 0.4298000 17.24000 0.4298000 17.24000 0.4298000 0.000000       0.000000  
1 1 1 7  39 2  o 36.87000 0.3206000 36.68000 0.4527000 37.05000 0.4542000 -0.3731000     0.6412000 
1 1 1 7  39 4  o 37.35000 0.3772000 36.46000 0.5262000 38.23000 0.5405000 -1.774000      0.7543000 
1 1 1 7  39 6  o 23.50000 0.2940000 23.97000 0.3713000 23.02000 0.4560000 0.9552000      0.5880000 
1 1 1 7  39 8  o 26.92000 0.4087000 26.09000 0.3782000 27.76000 0.7247000 -1.671000      0.8175000 
1 1 1 7  39 10 o 26.40000 0.3140000 25.78000 0.4128000 27.03000 0.4733000 -1.254000      0.6281000 
1 1 1 7  39 12 o 33.05000 0.3194000 33.16000 0.3965000 32.94000 0.5009000 0.2157000      0.6388000 
1 1 1 7  39 14 o 35.42000 0.3645000 35.89000 0.5209000 34.95000 0.5100000 0.9395000      0.7290000 
1 1 1 7  39 16 o 62.70000 0.4752000 63.59000 0.5943000 61.82000 0.7416000 1.775000       0.9504000 
1 1 1 7  39 18 f 25.81000 0.3071000 25.55000 0.3892000 26.07000 0.4750000 -0.5208000     0.6141000 
1 1 1 7  39 20 o 13.21000 0.4283000 13.82000 0.5900000 12.60000 0.6209000 1.222000       0.8565000 
1 1 1 7  39 22 o 9.989000 0.5054000 9.355000 0.6643000 10.62000 0.7618000 -1.268000      1.011000  
1 1 1 7  39 24 o 31.23000 0.4126000 30.83000 0.4489000 31.63000 0.6924000 -0.7968000     0.8252000 
1 1 1 7  39 26 o 16.81000 0.3586000 16.77000 0.4306000 16.84000 0.5735000 -0.7817000E-01 0.7172000 
1 1 1 7  39 28 o 6.861000 0.6654000 6.421000 0.9480000 7.301000 0.9341000 -0.8804000     1.331000  
1 1 1 7  39 30 o 14.09000 0.4501000 14.23000 0.4898000 13.96000 0.7552000 0.2736000      0.9002000 
1 1 1 7  39 32 o 15.42000 0.4438000 14.98000 0.4700000 15.87000 0.7529000 -0.8971000     0.8876000 
1 1 1 7  39 34 o 4.811000 0.8761000 4.752000 1.210000  4.870000 1.267000  -0.1180000     1.752000  
1 1 1 7  39 36 o 11.02000 0.4235000 10.68000 0.6195000 11.36000 0.5777000 -0.6738000     0.8471000 
1 1 1 7  39 38 o 12.59000 0.4530000 12.84000 0.7425000 12.35000 0.5191000 0.4893000      0.9060000 
1 1 1 7  39 40 o 2.971000 0.8688000 2.885000 1.235000  3.057000 1.222000  -0.1719000     1.738000  
1 1 1 7  39 42 o 9.589000 0.5130000 9.914000 0.7031000 9.265000 0.7471000 0.6494000      1.026000  
1 1 1 7  39 44 f 6.705000 0.7536000 7.112000 1.083000  6.297000 1.048000  0.8150000      1.507000  
1 1 1 7  39 46 o 6.039000 0.8774000 7.013000 1.228000  5.064000 1.253000  1.949000       1.755000  
1 1 1 7  39 48 o 5.588000 1.074000  5.878000 1.376000  5.299000 1.650000  0.5794000      2.148000  
1 1 1 7  39 50 o 3.198000 0.9029000 2.676000 1.206000  3.719000 1.344000  -1.043000      1.806000  
1 1 1 7  39 52 o 4.275000 0.9335000 4.714000 1.296000  3.837000 1.344000  0.8767000      1.867000  
1 1 1 7  40 1  o 16.64000 0.3295000 16.65000 0.4647000 16.63000 0.4674000 0.2338000E-01  0.6590000 
1 1 1 7  40 3  o 8.219000 0.6086000 7.909000 0.8214000 8.530000 0.8984000 -0.6216000     1.217000  
1 1 1 7  40 5  o 24.78000 0.3440000 24.70000 0.3810000 24.85000 0.5729000 -0.1547000     0.6880000 
1 1 1 7  40 7  o 24.40000 0.3513000 25.23000 0.3726000 23.57000 0.5955000 1.658000       0.7025000 
1 1 1 7  40 9  o 9.505000 0.5112000 8.694000 0.7644000 10.32000 0.6790000 -1.623000      1.022000  
1 1 1 7  40 11 o 27.51000 0.3269000 26.92000 0.4442000 28.11000 0.4796000 -1.189000      0.6537000 
1 1 1 7  40 13 o 7.625000 0.6256000 6.962000 0.9130000 8.288000 0.8555000 -1.326000      1.251000  
1 1 1 7  40 15 o 5.781000 0.8008000 4.630000 1.226000  6.931000 1.031000  -2.301000      1.602000  
1 1 1 7  40 17 o 11.51000 0.4362000 11.03000 0.5809000 11.99000 0.6510000 -0.9557000     0.8725000 
1 1 1 7  40 19 o 20.32000 0.3233000 20.06000 0.4079000 20.58000 0.5017000 -0.5260000     0.6466000 
1 1 1 7  40 21 o 10.52000 0.6762000 10.81000 0.9104000 10.23000 1.000000  0.5811000      1.352000  
1 1 1 7  40 23 o 24.76000 0.3334000 24.91000 0.4416000 24.60000 0.4996000 0.3025000      0.6668000 
1 1 1 7  40 25 o 15.33000 0.3833000 15.33000 0.4498000 15.32000 0.6209000 0.1198000E-01  0.7667000 
1 1 1 7  40 27 o 15.85000 0.3494000 15.62000 0.4821000 16.07000 0.5058000 -0.4480000     0.6988000 
1 1 1 7  40 29 o 31.12000 0.3620000 30.61000 0.5050000 31.62000 0.5189000 -1.014000      0.7240000 
1 1 1 7  40 31 o 29.41000 0.3375000 29.44000 0.4404000 29.39000 0.5115000 0.5191000E-01  0.6750000 
1 1 1 7  40 33 o 14.93000 0.4396000 15.35000 0.4767000 14.52000 0.7388000 0.8386000      0.8793000 
1 1 1 7  40 35 o 4.104000 0.8890000 4.360000 1.215000  3.849000 1.298000  0.5112000      1.778000  
1 1 1 7  40 37 o 12.85000 0.5064000 12.29000 0.8540000 13.41000 0.5443000 -1.119000      1.013000  
1 1 1 7  40 39 o 4.369000 0.8722000 4.790000 1.200000  3.948000 1.267000  0.8422000      1.744000  
1 1 1 7  40 41 o 6.461000 0.6999000 6.624000 0.9820000 6.299000 0.9977000 0.3250000      1.400000  
1 1 1 7  40 43 o 7.066000 0.6528000 6.407000 0.9427000 7.724000 0.9034000 -1.316000      1.306000  
1 1 1 7  40 45 o 10.96000 0.4934000 11.22000 0.7409000 10.69000 0.6518000 0.5318000      0.9868000 
1 1 1 7  40 47 o 8.281000 0.7161000 8.551000 0.8807000 8.011000 1.130000  0.5400000      1.432000  
1 1 1 7  40 49 o 3.639000 0.9339000 3.282000 1.306000  3.995000 1.335000  -0.7138000     1.868000  
1 1 1 7  40 51 o 5.111000 0.9559000 5.984000 1.355000  4.238000 1.349000  1.746000       1.912000  
1 1 1 7  41 0  o 13.30000 0.5329000 13.30000 0.5329000 13.30000 0.5329000 0.000000       0.000000  
1 1 1 7  41 2  o 9.938000 0.5481000 9.615000 0.8227000 10.26000 0.7244000 -0.6455000     1.096000  
1 1 1 7  41 4  o 12.19000 0.4563000 12.28000 0.5391000 12.11000 0.7365000 0.1699000      0.9127000 
1 1 1 7  41 6  o 17.65000 0.3328000 17.39000 0.4254000 17.92000 0.5118000 -0.5367000     0.6655000 
1 1 1 7  41 8  o 17.36000 0.3563000 17.07000 0.4970000 17.65000 0.5107000 -0.5782000     0.7127000 
1 1 1 7  41 10 o 14.90000 0.3699000 15.37000 0.4976000 14.43000 0.5475000 0.9464000      0.7398000 
1 1 1 7  41 12 o 6.439000 0.7223000 5.835000 1.081000  7.044000 0.9579000 -1.209000      1.445000  
1 1 1 7  41 14 o 13.46000 0.3892000 13.81000 0.5082000 13.12000 0.5895000 0.6873000      0.7783000 
1 1 1 7  41 16 f 24.24000 0.3053000 25.06000 0.3868000 23.42000 0.4724000 1.632000       0.6106000 
1 1 1 7  41 18 o 17.44000 0.3432000 17.87000 0.4640000 17.01000 0.5060000 0.8627000      0.6865000 
1 1 1 7  41 20 o 8.013000 0.6768000 7.910000 0.9412000 8.116000 0.9729000 -0.2060000     1.354000  
1 1 1 7  41 22 o 14.88000 0.4024000 15.35000 0.5344000 14.41000 0.6017000 0.9415000      0.8047000 
1 1 1 7  41 24 o 4.063000 0.9264000 3.343000 1.203000  4.783000 1.409000  -1.440000      1.853000  
1 1 1 7  41 26 o 7.939000 0.6977000 8.121000 0.6822000 7.757000 1.217000  0.3642000      1.395000  
1 1 1 7  41 28 o 21.22000 0.3318000 21.20000 0.4205000 21.24000 0.5135000 -0.4648000E-01 0.6637000 
1 1 1 7  41 30 o 18.11000 0.3478000 18.49000 0.4577000 17.73000 0.5237000 0.7540000      0.6956000 
1 1 1 7  41 32 o 11.21000 0.4996000 11.77000 0.5769000 10.64000 0.8157000 1.128000       0.9991000 
1 1 1 7  41 34 o 12.18000 0.4158000 12.14000 0.5824000 12.21000 0.5935000 -0.6297000E-01 0.8315000 
1 1 1 7  41 36 o 3.657000 0.8931000 2.851000 1.241000  4.464000 1.285000  -1.613000      1.786000  
1 1 1 7  41 38 o 10.17000 0.4502000 9.593000 0.6479000 10.75000 0.6252000 -1.154000      0.9004000 
1 1 1 7  41 40 o 4.251000 0.9067000 3.789000 1.329000  4.713000 1.234000  -0.9239000     1.813000  
1 1 1 7  41 42 o 3.515000 0.9124000 3.990000 1.326000  3.040000 1.254000  0.9508000      1.825000  
1 1 1 7  41 44 o 7.473000 0.7640000 6.510000 1.215000  8.435000 0.9260000 -1.925000      1.528000  
1 1 1 7  41 46 o 4.224000 0.9377000 4.402000 1.364000  4.045000 1.287000  0.3566000      1.875000  
1 1 1 7  41 48 o 4.531000 0.9275000 5.190000 1.288000  3.873000 1.335000  1.317000       1.855000  
1 1 1 7  41 50 o 3.633000 0.9479000 3.364000 1.339000  3.902000 1.342000  -0.5383000     1.896000  
1 1 1 7  42 1  o 29.07000 0.4070000 29.00000 0.6425000 29.14000 0.4999000 -0.1365000     0.8140000 
1 1 1 7  42 3  f 20.55000 0.3304000 20.88000 0.4299000 20.22000 0.5019000 0.6562000      0.6608000 
1 1 1 7  42 5  o 16.53000 0.3622000 16.18000 0.4529000 16.89000 0.5653000 -0.7101000     0.7244000 
1 1 1 7  42 7  o 11.71000 0.4449000 11.54000 0.5985000 11.88000 0.6584000 -0.3445000     0.8898000 
1 1 1 7  42 9  o 12.03000 0.4280000 12.08000 0.5978000 11.99000 0.6127000 0.8969000E-01  0.8561000 
1 1 1 7  42 11 o 31.75000 0.3246000 31.71000 0.3988000 31.79000 0.5123000 -0.8249000E-01 0.6492000 
1 1 1 7  42 13 o 45.36000 0.3775000 45.72000 0.4709000 44.99000 0.5900000 0.7365000      0.7549000 
1 1 1 7  42 15 o 14.82000 0.3880000 14.38000 0.5253000 15.25000 0.5712000 -0.8695000     0.7760000 
1 1 1 7  42 17 o 16.06000 0.4502000 16.20000 0.4941000 15.92000 0.7528000 0.2848000      0.9004000 
1 1 1 7  42 19 o 7.067000 0.7540000 7.128000 1.116000  7.005000 1.014000  0.1238000      1.508000  
1 1 1 7  42 21 o 24.48000 0.3123000 24.05000 0.3843000 24.92000 0.4925000 -0.8713000     0.6247000 
1 1 1 7  42 23 o 10.34000 0.4841000 10.68000 0.6324000 10.01000 0.7331000 0.6732000      0.9682000 
1 1 1 7  42 25 o 17.03000 0.3837000 16.68000 0.4130000 17.37000 0.6469000 -0.6915000     0.7674000 
1 1 1 7  42 27 o 23.34000 0.3230000 23.34000 0.4100000 23.35000 0.4992000 -0.8207000E-02 0.6460000 
1 1 1 7  42 29 o 23.90000 0.3279000 24.22000 0.4133000 23.58000 0.5091000 0.6424000      0.6557000 
1 1 1 7  42 31 o 18.14000 0.3576000 18.65000 0.4348000 17.63000 0.5678000 1.017000       0.7152000 
1 1 1 7  42 33 o 7.265000 0.7435000 6.437000 1.229000  8.093000 0.8367000 -1.656000      1.487000  
1 1 1 7  42 35 o 5.345000 0.7749000 4.465000 1.163000  6.226000 1.024000  -1.760000      1.550000  
1 1 1 7  42 37 o 7.924000 0.6032000 8.769000 0.8615000 7.079000 0.8445000 1.690000       1.206000  
1 1 1 7  42 39 o 6.159000 0.8725000 5.478000 1.206000  6.840000 1.261000  -1.363000      1.745000  
1 1 1 7  42 41 o 2.110000 0.7082000 2.050000 0.9882000 2.171000 1.015000  -0.1217000     1.416000  
1 1 1 7  42 43 o 6.002000 0.8369000 5.727000 1.348000  6.276000 0.9918000 -0.5490000     1.674000  
1 1 1 7  42 45 o 2.642000 0.8261000 2.195000 1.047000  3.090000 1.278000  -0.8959000     1.652000  
1 1 1 7  42 47 o 3.309000 0.9170000 3.300000 1.305000  3.318000 1.289000  -0.1727000E-01 1.834000  
1 1 1 7  42 49 o 5.122000 1.014000  5.266000 1.391000  4.978000 1.476000  0.2885000      2.028000  
1 1 1 7  43 0  o 15.90000 0.6478000 15.90000 0.6478000 15.90000 0.6478000 0.000000       0.000000  
1 1 1 7  43 2  o 11.67000 0.4597000 11.37000 0.5861000 11.97000 0.7084000 -0.5994000     0.9194000 
1 1 1 7  43 4  o 33.70000 0.3434000 33.67000 0.4530000 33.73000 0.5161000 -0.6061000E-01 0.6867000 
1 1 1 7  43 6  o 17.20000 0.4045000 16.50000 0.6235000 17.90000 0.5156000 -1.400000      0.8091000 
1 1 1 7  43 8  o 18.97000 0.3588000 19.42000 0.5106000 18.53000 0.5041000 0.8871000      0.7175000 
1 1 1 7  43 10 o 22.63000 0.3328000 22.58000 0.4559000 22.67000 0.4849000 -0.9173000E-01 0.6655000 
1 1 1 7  43 12 o 9.794000 0.5328000 10.05000 0.7072000 9.544000 0.7970000 0.5014000      1.066000  
1 1 1 7  43 14 o 17.23000 0.4371000 17.34000 0.4910000 17.12000 0.7234000 0.2189000      0.8743000 
1 1 1 7  43 16 o 19.85000 0.3386000 20.22000 0.4623000 19.48000 0.4949000 0.7343000      0.6773000 
1 1 1 7  43 18 o 18.86000 0.3356000 18.76000 0.4517000 18.96000 0.4964000 -0.2055000     0.6712000 
1 1 1 7  43 20 f 6.908000 0.6401000 6.702000 0.8401000 7.115000 0.9660000 -0.4134000     1.280000  
1 1 1 7  43 22 o 9.184000 0.5395000 9.840000 0.6841000 8.527000 0.8343000 1.313000       1.079000  
1 1 1 7  43 24 o 15.30000 0.4596000 15.35000 0.4351000 15.24000 0.8097000 0.1125000      0.9192000 
1 1 1 7  43 26 o 11.66000 0.4583000 11.08000 0.5146000 12.24000 0.7585000 -1.160000      0.9166000 
1 1 1 7  43 28 o 17.65000 0.3544000 17.42000 0.4419000 17.89000 0.5542000 -0.4689000     0.7088000 
1 1 1 7  43 30 o 7.756000 0.5634000 9.038000 0.6640000 6.474000 0.9103000 2.564000       1.127000  
1 1 1 7  43 32 o 14.31000 0.3735000 14.89000 0.5398000 13.73000 0.5165000 1.163000       0.7471000 
1 1 1 7  43 34 o 4.685000 0.8759000 4.014000 1.324000  5.356000 1.147000  -1.342000      1.752000  
1 1 1 7  43 36 f 3.076000 0.8864000 2.739000 1.232000  3.414000 1.275000  -0.6752000     1.773000  
1 1 1 7  43 38 o 10.91000 0.4498000 10.85000 0.6416000 10.96000 0.6305000 -0.1137000     0.8995000 
1 1 1 7  43 40 o 8.970000 0.5674000 8.897000 0.7654000 9.042000 0.8380000 -0.1447000     1.135000  
1 1 1 7  43 42 o 3.570000 0.9603000 4.124000 1.376000  3.017000 1.339000  1.108000       1.921000  
1 1 1 7  43 44 o 3.744000 0.9860000 3.938000 1.372000  3.549000 1.416000  0.3892000      1.972000  
1 1 1 7  43 46 o 5.041000 0.9273000 3.368000 1.383000  6.714000 1.236000  -3.346000      1.855000  
1 1 1 7  43 48 o 4.719000 0.9564000 3.825000 1.379000  5.614000 1.326000  -1.790000      1.913000  
1 1 1 7  44 1  o 34.13000 0.3594000 34.32000 0.4617000 33.94000 0.5509000 0.3735000      0.7188000 
1 1 1 7  44 3  o 22.22000 0.3338000 22.07000 0.4304000 22.38000 0.5105000 -0.3159000     0.6677000 
1 1 1 7  44 5  o 28.14000 0.3485000 28.04000 0.4885000 28.24000 0.4971000 -0.2037000     0.6969000 
1 1 1 7  44 7  o 11.91000 0.4272000 11.88000 0.5347000 11.95000 0.6665000 -0.7042000E-01 0.8545000 
1 1 1 7  44 9  o 20.22000 0.3235000 20.96000 0.4224000 19.48000 0.4901000 1.479000       0.6470000 
1 1 1 7  44 11 o 30.16000 0.4225000 30.64000 0.5391000 29.69000 0.6507000 0.9572000      0.8450000 
1 1 1 7  44 13 o 33.21000 0.3326000 32.89000 0.4131000 33.54000 0.5215000 -0.6505000     0.6653000 
1 1 1 7  44 15 o 22.81000 0.3132000 22.32000 0.3885000 23.30000 0.4914000 -0.9821000     0.6264000 
1 1 1 7  44 17 o 14.87000 0.3700000 14.57000 0.5075000 15.16000 0.5384000 -0.5843000     0.7399000 
1 1 1 7  44 19 o 4.118000 0.8746000 3.596000 1.210000  4.639000 1.264000  -1.043000      1.749000  
1 1 1 7  44 21 o 12.24000 0.4069000 12.58000 0.5369000 11.90000 0.6114000 0.6805000      0.8137000 
1 1 1 7  44 23 o 13.67000 0.4948000 13.78000 0.4616000 13.55000 0.8753000 0.2353000      0.9896000 
1 1 1 7  44 25 o 10.92000 0.4726000 11.02000 0.5054000 10.82000 0.7986000 0.2060000      0.9451000 
1 1 1 7  44 27 f 5.336000 0.8286000 6.173000 0.9480000 4.498000 1.359000  1.675000       1.657000  
1 1 1 7  44 29 o 3.491000 0.8945000 3.458000 1.209000  3.524000 1.318000  -0.6626000E-01 1.789000  
1 1 1 7  44 31 o 4.987000 0.9511000 5.154000 1.227000  4.821000 1.454000  0.3327000      1.902000  
1 1 1 7  44 33 o 7.933000 0.5434000 7.255000 0.8056000 8.610000 0.7295000 -1.355000      1.087000  
1 1 1 7  44 35 o 8.130000 0.6348000 7.633000 1.030000  8.628000 0.7428000 -0.9947000     1.270000  
1 1 1 7  44 37 o 12.54000 0.4349000 12.23000 0.6654000 12.85000 0.5602000 -0.6129000     0.8698000 
1 1 1 7  44 39 f 5.077000 0.8240000 6.891000 0.9927000 3.264000 1.315000  3.627000       1.648000  
1 1 1 7  44 41 o 6.041000 0.8447000 5.667000 1.193000  6.415000 1.196000  -0.7482000     1.689000  
1 1 1 7  44 43 o 2.890000 0.8959000 3.133000 1.337000  2.648000 1.193000  0.4851000      1.792000  
1 1 1 7  44 45 o 3.208000 0.9917000 3.178000 1.344000  3.239000 1.458000  -0.6131000E-01 1.983000  
1 1 1 7  44 47 o 3.981000 0.9790000 3.404000 1.332000  4.557000 1.436000  -1.153000      1.958000  
1 1 1 7  45 0  o 5.248000 1.381000  5.248000 1.381000  5.248000 1.381000  0.000000       0.000000  
1 1 1 7  45 2  o 9.953000 0.6745000 8.691000 0.8291000 11.21000 1.064000  -2.522000      1.349000  
1 1 1 7  45 4  o 30.45000 0.3970000 30.62000 0.4502000 30.29000 0.6541000 0.3312000      0.7941000 
1 1 1 7  45 6  o 36.75000 0.3423000 35.92000 0.4170000 37.58000 0.5428000 -1.660000      0.6845000 
1 1 1 7  45 8  o 33.28000 0.4029000 33.43000 0.4572000 33.12000 0.6635000 0.3071000      0.8057000 
1 1 1 7  45 10 o 20.30000 0.3239000 20.65000 0.4147000 19.96000 0.4975000 0.6854000      0.6477000 
1 1 1 7  45 12 o 17.90000 0.3271000 17.98000 0.4227000 17.83000 0.4993000 0.1461000      0.6542000 
1 1 1 7  45 14 o 16.57000 0.3395000 15.98000 0.4375000 17.16000 0.5192000 -1.182000      0.6790000 
1 1 1 7  45 16 o 24.41000 0.3182000 24.15000 0.4230000 24.67000 0.4754000 -0.5217000     0.6363000 
1 1 1 7  45 18 o 6.924000 0.6102000 6.590000 0.8257000 7.257000 0.8987000 -0.6670000     1.220000  
1 1 1 7  45 20 o 16.80000 0.3729000 16.64000 0.4508000 16.95000 0.5941000 -0.3068000     0.7458000 
1 1 1 7  45 22 o 25.44000 0.4153000 25.33000 0.3852000 25.54000 0.7359000 -0.2058000     0.8306000 
1 1 1 7  45 24 o 13.96000 0.3755000 14.00000 0.4653000 13.92000 0.5896000 0.7524000E-01  0.7511000 
1 1 1 7  45 26 o 7.981000 0.5652000 7.693000 0.7294000 8.269000 0.8635000 -0.5761000     1.130000  
1 1 1 7  45 28 o 5.097000 0.8050000 4.434000 1.166000  5.760000 1.111000  -1.326000      1.610000  
1 1 1 7  45 30 o 5.379000 0.9460000 4.829000 1.232000  5.929000 1.436000  -1.100000      1.892000  
1 1 1 7  45 32 o 6.577000 0.7061000 6.515000 0.9310000 6.640000 1.062000  -0.1249000     1.412000  
1 1 1 7  45 34 o 13.56000 0.4126000 14.00000 0.5657000 13.12000 0.6007000 0.8786000      0.8252000 
1 1 1 7  45 36 o 4.138000 0.9909000 3.339000 1.386000  4.937000 1.417000  -1.598000      1.982000  
1 1 1 7  45 38 o 11.60000 0.5215000 11.42000 0.8029000 11.78000 0.6656000 -0.3610000     1.043000  
1 1 1 7  45 40 o 6.406000 0.8113000 5.678000 1.210000  7.134000 1.082000  -1.456000      1.623000  
1 1 1 7  45 42 o 4.390000 0.9177000 3.312000 1.333000  5.468000 1.261000  -2.156000      1.835000  
1 1 1 7  45 44 o 2.622000 0.8457000 2.655000 1.200000  2.590000 1.192000  0.6522000E-01  1.691000  
1 1 1 7  45 46 o 3.865000 0.9737000 4.267000 1.421000  3.463000 1.332000  0.8043000      1.947000  
1 1 1 7  46 1  o 15.52000 0.4245000 14.94000 0.4971000 16.09000 0.6881000 -1.153000      0.8489000 
1 1 1 7  46 3  o 11.10000 0.5137000 11.35000 0.5629000 10.86000 0.8594000 0.4895000      1.027000  
1 1 1 7  46 5  f 6.874000 0.8416000 8.135000 0.7820000 5.613000 1.491000  2.522000       1.683000  
1 1 1 7  46 7  o 9.634000 0.5101000 10.00000 0.6034000 9.265000 0.8227000 0.7370000      1.020000  
1 1 1 7  46 9  o 13.24000 0.3854000 12.67000 0.4838000 13.80000 0.6001000 -1.130000      0.7708000 
1 1 1 7  46 11 o 11.75000 0.3957000 11.41000 0.5260000 12.09000 0.5913000 -0.6830000     0.7915000 
1 1 1 7  46 13 o 7.231000 0.5681000 7.181000 0.7364000 7.280000 0.8653000 -0.9896000E-01 1.136000  
1 1 1 7  46 15 o 23.40000 0.3441000 23.37000 0.4253000 23.43000 0.5411000 -0.6069000E-01 0.6882000 
1 1 1 7  46 17 o 15.91000 0.3646000 15.94000 0.4169000 15.88000 0.5983000 0.5432000E-01  0.7293000 
1 1 1 7  46 19 o 28.90000 0.3625000 28.71000 0.4272000 29.08000 0.5858000 -0.3672000     0.7251000 
1 1 1 7  46 21 o 18.99000 0.3546000 19.33000 0.3897000 18.66000 0.5924000 0.6701000      0.7091000 
1 1 1 7  46 23 o 4.290000 0.8432000 3.146000 1.148000  5.435000 1.235000  -2.289000      1.686000  
1 1 1 7  46 25 o 10.67000 0.4651000 11.03000 0.5425000 10.32000 0.7557000 0.7161000      0.9303000 
1 1 1 7  46 27 o 18.14000 0.3150000 18.33000 0.4361000 17.95000 0.4545000 0.3877000      0.6299000 
1 1 1 7  46 29 o 9.330000 0.5425000 8.721000 0.6989000 9.939000 0.8299000 -1.218000      1.085000  
1 1 1 7  46 31 o 13.87000 0.3796000 14.36000 0.4909000 13.37000 0.5791000 0.9898000      0.7591000 
1 1 1 7  46 33 o 15.43000 0.4081000 15.76000 0.5937000 15.10000 0.5599000 0.6593000      0.8161000 
1 1 1 7  46 35 o 4.480000 0.9880000 5.852000 1.488000  3.109000 1.300000  2.743000       1.976000  
1 1 1 7  46 37 o 10.71000 0.4898000 10.29000 0.7208000 11.13000 0.6632000 -0.8450000     0.9795000 
1 1 1 7  46 39 o 6.904000 0.7602000 6.332000 1.153000  7.477000 0.9913000 -1.145000      1.520000  
1 1 1 7  46 41 o 2.970000 0.8915000 2.713000 1.200000  3.227000 1.319000  -0.5139000     1.783000  
1 1 1 7  46 43 o 6.788000 0.7670000 7.100000 0.8936000 6.477000 1.247000  0.6232000      1.534000  
1 1 1 7  46 45 o 8.848000 0.5807000 8.735000 0.8284000 8.960000 0.8141000 -0.2246000     1.161000  
1 1 1 7  47 0  o 14.98000 0.5606000 14.98000 0.5606000 14.98000 0.5606000 0.000000       0.000000  
1 1 1 7  47 2  o 5.557000 1.016000  5.940000 1.076000  5.173000 1.723000  0.7670000      2.032000  
1 1 1 7  47 4  o 28.85000 0.3547000 29.05000 0.3967000 28.65000 0.5880000 0.4047000      0.7093000 
1 1 1 7  47 6  o 11.73000 0.6713000 11.23000 0.5319000 12.22000 1.233000  -0.9857000     1.343000  
1 1 1 7  47 8  o 11.79000 0.4305000 11.76000 0.5086000 11.81000 0.6948000 -0.5400000E-01 0.8610000 
1 1 1 7  47 10 o 9.492000 0.5139000 9.210000 0.6352000 9.774000 0.8081000 -0.5647000     1.028000  
1 1 1 7  47 12 o 8.004000 0.5796000 7.385000 0.7682000 8.622000 0.8680000 -1.238000      1.159000  
1 1 1 7  47 14 o 12.86000 0.4199000 11.92000 0.5750000 13.80000 0.6121000 -1.884000      0.8398000 
1 1 1 7  47 16 o 7.611000 0.5960000 7.427000 0.7192000 7.795000 0.9506000 -0.3673000     1.192000  
1 1 1 7  47 18 o 2.873000 0.8486000 3.072000 1.188000  2.674000 1.212000  0.3983000      1.697000  
1 1 1 7  47 20 o 2.274000 0.7321000 2.443000 1.058000  2.105000 1.012000  0.3374000      1.464000  
1 1 1 7  47 22 o 3.801000 0.8895000 3.795000 1.174000  3.807000 1.337000  -0.1243000E-01 1.779000  
1 1 1 7  47 24 f 6.399000 0.7001000 6.886000 0.7649000 5.912000 1.173000  0.9742000      1.400000  
1 1 1 7  47 26 o 6.663000 0.6367000 6.313000 0.8558000 7.013000 0.9428000 -0.7004000     1.273000  
1 1 1 7  47 28 o 4.273000 0.8999000 4.314000 1.158000  4.232000 1.378000  0.8262000E-01  1.800000  
1 1 1 7  47 30 o 13.59000 0.3822000 13.78000 0.4942000 13.40000 0.5830000 0.3768000      0.7643000 
1 1 1 7  47 32 o 12.67000 0.4421000 13.24000 0.5984000 12.11000 0.6511000 1.125000       0.8843000 
1 1 1 7  47 34 o 5.048000 0.9846000 5.022000 1.460000  5.075000 1.322000  -0.5242000E-01 1.969000  
1 1 1 7  47 36 o 3.552000 0.9411000 3.230000 1.276000  3.873000 1.383000  -0.6431000     1.882000  
1 1 1 7  47 38 f 5.815000 0.9202000 6.067000 1.262000  5.563000 1.340000  0.5048000      1.840000  
1 1 1 7  47 40 o 3.389000 0.9086000 3.250000 1.277000  3.529000 1.293000  -0.2798000     1.817000  
1 1 1 7  47 42 o 3.925000 0.9562000 3.608000 1.333000  4.241000 1.371000  -0.6333000     1.912000  
1 1 1 7  47 44 f 7.520000 0.6503000 7.526000 0.9453000 7.514000 0.8932000 0.1114000E-01  1.301000  
1 1 1 7  48 1  o 12.87000 0.5360000 13.14000 0.8522000 12.61000 0.6503000 0.5266000      1.072000  
1 1 1 7  48 3  o 15.54000 0.3576000 15.55000 0.4391000 15.54000 0.5645000 0.5108000E-02  0.7151000 
1 1 1 7  48 5  o 6.212000 0.6643000 6.063000 0.8645000 6.360000 1.009000  -0.2970000     1.329000  
1 1 1 7  48 7  o 12.30000 0.4895000 12.17000 0.4972000 12.43000 0.8434000 -0.2623000     0.9791000 
1 1 1 7  48 9  o 21.49000 0.3790000 20.80000 0.3878000 22.17000 0.6514000 -1.366000      0.7581000 
1 1 1 7  48 11 o 4.757000 0.8346000 4.603000 1.123000  4.911000 1.235000  -0.3079000     1.669000  
1 1 1 7  48 13 o 4.633000 0.8748000 5.062000 1.187000  4.203000 1.285000  0.8582000      1.750000  
1 1 1 7  48 15 o 15.94000 0.3464000 16.25000 0.4651000 15.64000 0.5136000 0.6139000      0.6929000 
1 1 1 7  48 17 o 23.74000 0.3629000 23.44000 0.4300000 24.04000 0.5847000 -0.6002000     0.7259000 
1 1 1 7  48 19 o 8.670000 0.5243000 9.045000 0.6229000 8.295000 0.8435000 0.7498000      1.049000  
1 1 1 7  48 21 o 5.370000 0.8218000 6.115000 0.9825000 4.625000 1.318000  1.490000       1.644000  
1 1 1 7  48 23 f 4.950000 0.8370000 5.444000 0.9778000 4.455000 1.359000  0.9891000      1.674000  
1 1 1 7  48 25 o 11.29000 0.4826000 11.30000 0.5093000 11.29000 0.8198000 0.1128000E-01  0.9651000 
1 1 1 7  48 27 o 9.225000 0.5458000 8.878000 0.7119000 9.571000 0.8275000 -0.6932000     1.092000  
1 1 1 7  48 29 o 7.348000 0.6163000 7.476000 0.8112000 7.221000 0.9281000 0.2547000      1.233000  
1 1 1 7  48 31 o 12.92000 0.4715000 13.42000 0.7328000 12.41000 0.5936000 1.012000       0.9430000 
1 1 1 7  48 33 o 4.704000 0.8824000 3.841000 1.277000  5.568000 1.219000  -1.726000      1.765000  
1 1 1 7  48 35 o 5.671000 0.8915000 5.169000 1.371000  6.173000 1.140000  -1.004000      1.783000  
1 1 1 7  48 37 f 3.787000 0.9986000 3.277000 1.355000  4.298000 1.467000  -1.021000      1.997000  
1 1 1 7  48 39 o 2.524000 0.8025000 2.405000 1.105000  2.642000 1.164000  -0.2371000     1.605000  
1 1 1 7  48 41 o 3.907000 0.9372000 3.504000 1.334000  4.310000 1.317000  -0.8064000     1.874000  
1 1 1 7  48 43 o 4.274000 0.9725000 3.818000 1.358000  4.731000 1.392000  -0.9136000     1.945000  
1 1 1 7  49 0  o 15.56000 0.4891000 15.56000 0.4891000 15.56000 0.4891000 0.000000       0.000000  
1 1 1 7  49 2  o 9.022000 0.5287000 8.566000 0.7070000 9.477000 0.7864000 -0.9109000     1.057000  
1 1 1 7  49 4  o 6.117000 0.7476000 4.481000 1.222000  7.753000 0.8618000 -3.273000      1.495000  
1 1 1 7  49 6  o 8.643000 0.5306000 8.751000 0.6914000 8.536000 0.8052000 0.2155000      1.061000  
1 1 1 7  49 8  o 10.41000 0.4441000 10.08000 0.5692000 10.74000 0.6820000 -0.6604000     0.8883000 
1 1 1 7  49 10 o 10.42000 0.5265000 9.856000 0.5763000 10.99000 0.8814000 -1.137000      1.053000  
1 1 1 7  49 12 o 8.872000 0.6639000 9.551000 0.6761000 8.193000 1.143000  1.358000       1.328000  
1 1 1 7  49 14 o 7.549000 0.5705000 7.975000 0.6978000 7.123000 0.9026000 0.8511000      1.141000  
1 1 1 7  49 16 o 10.80000 0.4928000 10.58000 0.6169000 11.02000 0.7688000 -0.4371000     0.9857000 
1 1 1 7  49 18 f 4.975000 0.8572000 5.353000 1.007000  4.597000 1.388000  0.7558000      1.714000  
1 1 1 7  49 20 o 12.60000 0.4185000 12.65000 0.5316000 12.56000 0.6464000 0.8571000E-01  0.8369000 
1 1 1 7  49 22 o 6.440000 0.6595000 7.096000 0.7195000 5.784000 1.105000  1.313000       1.319000  
1 1 1 7  49 24 o 6.243000 0.8344000 6.084000 0.8631000 6.403000 1.428000  -0.3185000     1.669000  
1 1 1 7  49 26 o 2.778000 0.8727000 2.533000 1.124000  3.022000 1.335000  -0.4883000     1.745000  
1 1 1 7  49 28 o 3.340000 0.8791000 2.187000 1.025000  4.494000 1.429000  -2.307000      1.758000  
1 1 1 7  49 30 o 6.345000 0.7342000 6.202000 1.023000  6.489000 1.054000  -0.2867000     1.468000  
1 1 1 7  49 32 o 3.057000 0.8664000 3.075000 1.208000  3.039000 1.243000  0.3640000E-01  1.733000  
1 1 1 7  49 34 o 3.253000 0.9213000 3.009000 1.248000  3.498000 1.355000  -0.4886000     1.843000  
1 1 1 7  49 36 o 3.823000 0.9594000 4.214000 1.329000  3.432000 1.384000  0.7815000      1.919000  
1 1 1 7  49 38 o 6.478000 0.7467000 6.750000 0.9407000 6.205000 1.160000  0.5458000      1.493000  
1 1 1 7  49 40 o 3.334000 0.8939000 3.641000 1.311000  3.028000 1.215000  0.6133000      1.788000  
1 1 1 7  49 42 o 3.239000 1.441000  3.239000 1.441000  ?        ?         ?              ?         
1 1 1 7  50 1  o 10.10000 0.4792000 10.20000 0.6252000 9.997000 0.7264000 0.2077000      0.9584000 
1 1 1 7  50 3  o 23.53000 0.3281000 22.79000 0.4285000 24.26000 0.4971000 -1.479000      0.6563000 
1 1 1 7  50 5  o 15.47000 0.3595000 15.37000 0.4777000 15.57000 0.5372000 -0.2036000     0.7189000 
1 1 1 7  50 7  o 10.86000 0.4293000 10.79000 0.5363000 10.93000 0.6704000 -0.1440000     0.8585000 
1 1 1 7  50 9  o 16.41000 0.3808000 16.14000 0.5588000 16.68000 0.5176000 -0.5396000     0.7617000 
1 1 1 7  50 11 o 3.387000 0.8937000 3.582000 1.273000  3.193000 1.255000  0.3884000      1.787000  
1 1 1 7  50 13 o 5.585000 1.004000  5.999000 0.8704000 5.172000 1.809000  0.8267000      2.007000  
1 1 1 7  50 15 o 5.689000 0.9520000 5.875000 0.9721000 5.503000 1.637000  0.3729000      1.904000  
1 1 1 7  50 17 o 17.04000 0.4306000 17.37000 0.4202000 16.71000 0.7518000 0.6592000      0.8613000 
1 1 1 7  50 19 o 10.17000 0.6244000 10.51000 0.6083000 9.820000 1.091000  0.6914000      1.249000  
1 1 1 7  50 21 o 6.086000 0.8761000 6.102000 0.8650000 6.069000 1.524000  0.3366000E-01  1.752000  
1 1 1 7  50 23 o 13.87000 0.4603000 13.56000 0.4474000 14.18000 0.8045000 -0.6159000     0.9206000 
1 1 1 7  50 25 o 8.346000 0.8657000 8.898000 0.6344000 7.794000 1.611000  1.105000       1.731000  
1 1 1 7  50 27 o 3.171000 0.8919000 2.936000 1.235000  3.406000 1.287000  -0.4701000     1.784000  
1 1 1 7  50 29 o 4.318000 0.9675000 4.101000 1.430000  4.535000 1.304000  -0.4339000     1.935000  
1 1 1 7  50 31 o 12.99000 0.4682000 13.72000 0.5611000 12.26000 0.7496000 1.461000       0.9364000 
1 1 1 7  50 33 o 5.473000 0.8999000 5.161000 1.411000  5.786000 1.117000  -0.6248000     1.800000  
1 1 1 7  50 35 o 6.121000 0.8357000 5.926000 1.275000  6.317000 1.081000  -0.3905000     1.671000  
1 1 1 7  50 37 o 3.002000 0.8722000 3.500000 1.314000  2.504000 1.147000  0.9960000      1.744000  
1 1 1 7  50 39 o 3.574000 0.9164000 4.312000 1.373000  2.836000 1.214000  1.476000       1.833000  
1 1 1 7  51 0  o 2.787000 1.188000  2.787000 1.188000  2.787000 1.188000  0.000000       0.000000  
1 1 1 7  51 2  o 11.21000 0.4346000 11.02000 0.5207000 11.39000 0.6960000 -0.3626000     0.8692000 
1 1 1 7  51 4  o 6.731000 0.6386000 6.445000 0.7923000 7.016000 1.002000  -0.5703000     1.277000  
1 1 1 7  51 6  f 17.55000 0.3400000 17.35000 0.4551000 17.76000 0.5051000 -0.4150000     0.6799000 
1 1 1 7  51 8  o 15.53000 0.3489000 15.53000 0.4552000 15.53000 0.5289000 0.1996000E-02  0.6978000 
1 1 1 7  51 10 o 10.65000 0.4575000 9.879000 0.6568000 11.42000 0.6370000 -1.545000      0.9149000 
1 1 1 7  51 12 o 8.129000 0.6126000 7.546000 0.8538000 8.713000 0.8787000 -1.167000      1.225000  
1 1 1 7  51 14 o 8.875000 0.5164000 8.661000 0.7487000 9.088000 0.7113000 -0.4266000     1.033000  
1 1 1 7  51 16 o 10.56000 0.5932000 11.39000 0.5224000 9.726000 1.065000  1.661000       1.186000  
1 1 1 7  51 18 o 13.14000 0.4996000 13.53000 0.4683000 12.74000 0.8826000 0.7878000      0.9992000 
1 1 1 7  51 20 o 7.600000 0.7729000 7.625000 0.7345000 7.576000 1.360000  0.4876000E-01  1.546000  
1 1 1 7  51 22 o 9.461000 0.5943000 10.02000 0.5807000 8.901000 1.037000  1.121000       1.189000  
1 1 1 7  51 24 o 12.51000 0.4376000 12.78000 0.5355000 12.23000 0.6922000 0.5493000      0.8752000 
1 1 1 7  51 26 o 8.653000 0.5684000 8.930000 0.8296000 8.375000 0.7771000 0.5553000      1.137000  
1 1 1 7  51 28 o 5.832000 0.7573000 5.336000 1.074000  6.329000 1.068000  -0.9926000     1.515000  
1 1 1 7  51 30 o 10.16000 0.5403000 10.15000 0.6789000 10.18000 0.8407000 -0.2726000E-01 1.081000  
1 1 1 7  51 32 f 13.79000 0.4298000 14.13000 0.6271000 13.46000 0.5878000 0.6623000      0.8595000 
1 1 1 7  51 34 o 5.147000 0.8992000 5.207000 1.251000  5.087000 1.292000  0.1197000      1.798000  
1 1 1 7  51 36 o 5.623000 0.8468000 6.011000 1.103000  5.236000 1.286000  0.7751000      1.694000  
1 1 1 7  51 38 o 2.230000 0.7524000 2.228000 1.072000  2.232000 1.056000  -0.4877000E-02 1.505000  
1 1 1 7  52 1  o 16.51000 0.3505000 16.26000 0.4105000 16.76000 0.5682000 -0.4995000     0.7010000 
1 1 1 7  52 3  o 12.04000 0.4017000 11.95000 0.4988000 12.13000 0.6298000 -0.1815000     0.8034000 
1 1 1 7  52 5  o 3.446000 0.8645000 3.236000 1.135000  3.656000 1.305000  -0.4196000     1.729000  
1 1 1 7  52 7  o 13.89000 0.3820000 14.10000 0.5096000 13.68000 0.5692000 0.4243000      0.7640000 
1 1 1 7  52 9  o 20.18000 0.3900000 20.22000 0.5165000 20.14000 0.5844000 0.7452000E-01  0.7799000 
1 1 1 7  52 11 o 21.27000 0.3568000 20.76000 0.4030000 21.78000 0.5889000 -1.017000      0.7136000 
1 1 1 7  52 13 o 9.750000 0.4735000 9.736000 0.6570000 9.765000 0.6819000 -0.2923000E-01 0.9470000 
1 1 1 7  52 15 o 7.497000 0.5822000 7.335000 0.8238000 7.660000 0.8228000 -0.3246000     1.164000  
1 1 1 7  52 17 o 9.011000 0.5905000 9.715000 0.8506000 8.306000 0.8193000 1.409000       1.181000  
1 1 1 7  52 19 o 2.571000 0.8156000 2.590000 1.140000  2.553000 1.166000  0.3755000E-01  1.631000  
1 1 1 7  52 21 o 2.943000 0.8722000 3.151000 1.251000  2.736000 1.216000  0.4148000      1.744000  
1 1 1 7  52 23 o 9.069000 0.5174000 9.168000 0.6218000 8.969000 0.8272000 0.1993000      1.035000  
1 1 1 7  52 25 o 8.783000 0.5637000 8.761000 0.6997000 8.805000 0.8839000 -0.4355000E-01 1.127000  
1 1 1 7  52 27 o 4.593000 0.8720000 5.263000 1.100000  3.924000 1.353000  1.338000       1.744000  
1 1 1 7  52 29 o 7.194000 0.6882000 6.751000 0.8768000 7.636000 1.061000  -0.8845000     1.376000  
1 1 1 7  52 31 o 6.169000 0.8029000 6.836000 0.9658000 5.502000 1.283000  1.334000       1.606000  
1 1 1 7  52 33 o 7.353000 0.6772000 7.594000 0.9103000 7.111000 1.003000  0.4828000      1.354000  
1 1 1 7  52 35 o 2.792000 0.8318000 3.351000 1.279000  2.232000 1.064000  1.119000       1.664000  
1 1 1 7  52 37 o 4.272000 0.9719000 5.001000 1.389000  3.543000 1.360000  1.458000       1.944000  
1 1 1 7  53 0  o 3.528000 1.341000  3.528000 1.341000  3.528000 1.341000  0.000000       0.000000  
1 1 1 7  53 2  o 8.582000 0.5374000 8.451000 0.7266000 8.712000 0.7920000 -0.2611000     1.075000  
1 1 1 7  53 4  o 6.919000 0.6119000 6.631000 0.8035000 7.208000 0.9230000 -0.5778000     1.224000  
1 1 1 7  53 6  o 5.119000 0.7824000 4.853000 1.027000  5.384000 1.181000  -0.5306000     1.565000  
1 1 1 7  53 8  o 4.539000 0.9955000 4.608000 1.413000  4.470000 1.402000  0.1379000      1.991000  
1 1 1 7  53 10 o 4.091000 0.8266000 5.163000 1.094000  3.019000 1.239000  2.144000       1.653000  
1 1 1 7  53 12 o 18.89000 0.3319000 18.17000 0.4694000 19.62000 0.4692000 -1.450000      0.6637000 
1 1 1 7  53 14 o 15.41000 0.3603000 15.32000 0.4968000 15.50000 0.5220000 -0.1813000     0.7206000 
1 1 1 7  53 16 o 3.059000 0.8295000 3.675000 1.243000  2.443000 1.099000  1.232000       1.659000  
1 1 1 7  53 18 o 14.58000 0.4119000 13.97000 0.5312000 15.19000 0.6296000 -1.219000      0.8238000 
1 1 1 7  53 20 o 9.295000 0.5130000 9.692000 0.6125000 8.897000 0.8232000 0.7953000      1.026000  
1 1 1 7  53 22 o 4.366000 0.9556000 4.889000 1.335000  3.844000 1.368000  1.045000       1.911000  
1 1 1 7  53 24 o 6.162000 0.8629000 6.665000 1.091000  5.659000 1.337000  1.007000       1.726000  
1 1 1 7  53 26 o 2.798000 0.8306000 2.228000 1.038000  3.368000 1.297000  -1.141000      1.661000  
1 1 1 7  53 28 o 3.632000 0.9716000 3.572000 1.309000  3.691000 1.436000  -0.1188000     1.943000  
1 1 1 7  53 30 o 4.019000 0.9038000 5.075000 1.316000  2.963000 1.240000  2.111000       1.808000  
1 1 1 7  53 32 o 3.740000 0.9695000 3.368000 1.346000  4.111000 1.396000  -0.7427000     1.939000  
1 1 1 7  53 34 o 5.694000 0.9125000 5.000000 1.368000  6.388000 1.208000  -1.388000      1.825000  
1 1 1 7  54 1  o 15.17000 0.3689000 14.39000 0.4591000 15.96000 0.5777000 -1.574000      0.7379000 
1 1 1 7  54 3  f 19.05000 0.3337000 19.01000 0.4170000 19.10000 0.5210000 -0.8893000E-01 0.6673000 
1 1 1 7  54 5  f 12.89000 0.4397000 12.67000 0.5129000 13.11000 0.7145000 -0.4392000     0.8795000 
1 1 1 7  54 7  o 4.563000 0.8833000 3.802000 1.271000  5.324000 1.227000  -1.522000      1.767000  
1 1 1 7  54 9  o 3.496000 0.8554000 3.859000 1.178000  3.134000 1.240000  0.7250000      1.711000  
1 1 1 7  54 11 o 6.297000 0.7873000 6.840000 1.156000  5.755000 1.069000  1.085000       1.575000  
1 1 1 7  54 13 o 3.632000 0.8432000 4.597000 1.244000  2.666000 1.138000  1.931000       1.686000  
1 1 1 7  54 15 o 5.850000 0.7418000 5.695000 0.9734000 6.004000 1.120000  -0.3093000     1.484000  
1 1 1 7  54 17 o 6.200000 0.7246000 6.564000 0.8849000 5.837000 1.148000  0.7266000      1.449000  
1 1 1 7  54 19 o 8.453000 0.5828000 8.757000 0.7486000 8.149000 0.8933000 0.6086000      1.166000  
1 1 1 7  54 21 o 5.324000 0.8236000 4.219000 1.204000  6.430000 1.124000  -2.211000      1.647000  
1 1 1 7  54 23 o 4.082000 0.8881000 5.046000 1.198000  3.119000 1.311000  1.927000       1.776000  
1 1 1 7  54 25 o 7.410000 0.6865000 6.635000 0.9698000 8.185000 0.9719000 -1.550000      1.373000  
1 1 1 7  54 27 o 7.295000 0.7146000 7.501000 0.9337000 7.089000 1.082000  0.4129000      1.429000  
1 1 1 7  54 29 o 7.076000 1.144000  7.312000 1.977000  6.841000 1.149000  0.4717000      2.287000  
1 1 1 7  54 31 o 3.959000 0.8807000 3.868000 1.162000  4.050000 1.324000  -0.1818000     1.761000  
1 1 1 7  54 33 o 3.431000 0.9541000 3.484000 1.298000  3.379000 1.399000  0.1049000      1.908000  
1 1 1 7  55 0  o 15.79000 0.5399000 15.79000 0.5399000 15.79000 0.5399000 0.000000       0.000000  
1 1 1 7  55 2  o 10.84000 0.5159000 9.977000 0.6106000 11.70000 0.8319000 -1.720000      1.032000  
1 1 1 7  55 4  o 4.831000 0.8908000 5.269000 1.023000  4.392000 1.459000  0.8776000      1.782000  
1 1 1 7  55 6  o 11.95000 0.4491000 11.23000 0.6254000 12.66000 0.6448000 -1.428000      0.8983000 
1 1 1 7  55 8  o 3.700000 0.8453000 2.743000 1.126000  4.657000 1.261000  -1.914000      1.691000  
1 1 1 7  55 10 o 3.443000 0.9142000 3.100000 1.281000  3.786000 1.305000  -0.6859000     1.828000  
1 1 1 7  55 12 o 3.747000 0.9093000 3.727000 1.168000  3.768000 1.394000  -0.4074000E-01 1.819000  
1 1 1 7  55 14 o 7.737000 0.6653000 7.584000 1.011000  7.889000 0.8652000 -0.3053000     1.331000  
1 1 1 7  55 16 o 2.779000 0.8422000 2.532000 1.128000  3.026000 1.251000  -0.4946000     1.684000  
1 1 1 7  55 18 o 6.276000 0.7034000 5.783000 1.015000  6.769000 0.9742000 -0.9856000     1.407000  
1 1 1 7  55 20 o 7.320000 0.6768000 7.378000 0.8833000 7.262000 1.026000  0.1161000      1.354000  
1 1 1 7  55 22 o 7.658000 0.6645000 7.456000 0.9218000 7.860000 0.9572000 -0.4035000     1.329000  
1 1 1 7  55 24 o 6.822000 0.7061000 6.450000 0.8581000 7.193000 1.122000  -0.7432000     1.412000  
1 1 1 7  55 26 o 3.302000 0.9065000 3.672000 1.307000  2.933000 1.257000  0.7392000      1.813000  
1 1 1 7  55 28 o 3.521000 1.017000  3.543000 1.473000  3.498000 1.404000  0.4457000E-01  2.034000  
1 1 1 7  55 30 o 3.818000 0.9180000 2.614000 1.138000  5.022000 1.441000  -2.409000      1.836000  
1 1 1 7  55 32 o 10.12000 1.739000  10.12000 1.739000  ?        ?         ?              ?         
1 1 1 7  56 1  o 3.817000 0.9863000 3.359000 1.348000  4.275000 1.440000  -0.9154000     1.973000  
1 1 1 7  56 3  o 10.33000 0.4764000 10.05000 0.6009000 10.60000 0.7395000 -0.5459000     0.9529000 
1 1 1 7  56 5  o 12.86000 0.4297000 12.13000 0.6024000 13.59000 0.6129000 -1.461000      0.8594000 
1 1 1 7  56 7  o 3.479000 0.8938000 2.901000 1.191000  4.058000 1.333000  -1.157000      1.788000  
1 1 1 7  56 9  o 5.216000 0.8660000 5.560000 1.084000  4.873000 1.350000  0.6871000      1.732000  
1 1 1 7  56 11 o 4.373000 0.9057000 4.367000 1.251000  4.379000 1.310000  -0.1162000E-01 1.811000  
1 1 1 7  56 13 o 3.865000 0.8738000 4.053000 1.171000  3.676000 1.297000  0.3772000      1.748000  
1 1 1 7  56 15 o 2.961000 0.8657000 2.933000 1.198000  2.990000 1.250000  -0.5743000E-01 1.731000  
1 1 1 7  56 17 o 3.646000 0.9194000 4.000000 1.274000  3.292000 1.326000  0.7073000      1.839000  
1 1 1 7  56 19 o 7.268000 0.7261000 7.106000 0.8750000 7.431000 1.159000  -0.3253000     1.452000  
1 1 1 7  56 21 o 6.372000 0.8692000 6.535000 1.211000  6.209000 1.247000  0.3256000      1.738000  
1 1 1 7  56 23 o 3.708000 0.8919000 2.888000 1.183000  4.528000 1.335000  -1.640000      1.784000  
1 1 1 7  56 25 o 3.949000 1.015000  3.742000 1.500000  4.157000 1.369000  -0.4149000     2.031000  
1 1 1 7  56 27 o 4.918000 1.081000  3.647000 1.344000  6.189000 1.693000  -2.542000      2.162000  
1 1 1 7  56 29 o 2.737000 0.8571000 2.204000 1.011000  3.269000 1.384000  -1.065000      1.714000  
1 1 1 7  57 0  o 10.12000 0.6658000 10.12000 0.6658000 10.12000 0.6658000 0.000000       0.000000  
1 1 1 7  57 2  o 3.447000 0.8279000 2.399000 1.069000  4.494000 1.265000  -2.096000      1.656000  
1 1 1 7  57 4  o 3.993000 0.9468000 5.747000 1.567000  2.240000 1.063000  3.507000       1.894000  
1 1 1 7  57 6  o 8.648000 0.6496000 8.560000 0.8978000 8.736000 0.9391000 -0.1766000     1.299000  
1 1 1 7  57 8  f 3.264000 0.8973000 3.719000 1.343000  2.809000 1.190000  0.9102000      1.795000  
1 1 1 7  57 10 o 4.601000 0.8651000 4.418000 1.187000  4.783000 1.259000  -0.3649000     1.730000  
1 1 1 7  57 12 o 4.569000 0.8684000 5.172000 1.076000  3.965000 1.363000  1.208000       1.737000  
1 1 1 7  57 14 o 10.80000 0.4461000 10.13000 0.5931000 11.47000 0.6664000 -1.333000      0.8921000 
1 1 1 7  57 16 o 5.313000 0.7814000 3.817000 1.196000  6.808000 1.005000  -2.991000      1.563000  
1 1 1 7  57 18 o 6.982000 0.6639000 6.986000 0.7553000 6.977000 1.092000  0.9077000E-02  1.328000  
1 1 1 7  57 20 o 5.135000 1.025000  3.825000 1.515000  6.445000 1.380000  -2.619000      2.050000  
1 1 1 7  57 22 o 4.770000 0.9985000 5.899000 1.308000  3.640000 1.509000  2.260000       1.997000  
1 1 1 7  57 24 o 5.462000 0.9030000 5.741000 0.9774000 5.184000 1.519000  0.5572000      1.806000  
1 1 1 7  57 26 o 4.273000 1.126000  3.160000 1.246000  5.387000 1.876000  -2.227000      2.252000  
1 1 1 7  58 1  f 3.421000 0.8673000 3.017000 1.190000  3.826000 1.262000  -0.8090000     1.735000  
1 1 1 7  58 3  o 2.677000 0.8422000 2.999000 1.268000  2.355000 1.109000  0.6444000      1.684000  
1 1 1 7  58 5  o 8.892000 0.5851000 8.963000 0.8100000 8.820000 0.8446000 0.1429000      1.170000  
1 1 1 7  58 7  o 7.721000 0.6006000 8.263000 0.7605000 7.178000 0.9297000 1.085000       1.201000  
1 1 1 7  58 9  o 6.398000 0.7232000 6.569000 1.012000  6.227000 1.034000  0.3424000      1.446000  
1 1 1 7  58 11 o 4.831000 0.9205000 5.217000 1.222000  4.445000 1.377000  0.7711000      1.841000  
1 1 1 7  58 13 o 6.160000 0.7695000 5.493000 1.119000  6.826000 1.056000  -1.333000      1.539000  
1 1 1 7  58 15 o 5.672000 0.8429000 5.779000 1.090000  5.565000 1.286000  0.2143000      1.686000  
1 1 1 7  58 17 o 7.571000 0.6495000 7.088000 0.8693000 8.055000 0.9653000 -0.9669000     1.299000  
1 1 1 7  58 19 o 5.744000 0.9095000 5.228000 1.357000  6.259000 1.211000  -1.032000      1.819000  
1 1 1 7  58 21 o 4.156000 1.053000  4.086000 1.178000  4.226000 1.745000  -0.1405000     2.106000  
1 1 1 7  58 23 o 5.798000 0.9921000 5.418000 1.031000  6.177000 1.696000  -0.7583000     1.984000  
1 1 1 7  58 25 o 4.509000 1.895000  4.509000 1.895000  ?        ?         ?              ?         
1 1 1 7  59 0  f 6.204000 1.414000  6.204000 1.414000  6.204000 1.414000  0.000000       0.000000  
1 1 1 7  59 2  o 3.094000 0.8842000 2.540000 1.140000  3.648000 1.352000  -1.108000      1.768000  
1 1 1 7  59 4  o 3.124000 0.8682000 2.315000 1.058000  3.934000 1.377000  -1.619000      1.736000  
1 1 1 7  59 6  o 6.286000 0.7871000 5.270000 1.206000  7.302000 1.012000  -2.031000      1.574000  
1 1 1 7  59 8  o 12.96000 0.4096000 13.00000 0.5005000 12.93000 0.6486000 0.7275000E-01  0.8193000 
1 1 1 7  59 10 o 6.567000 0.7118000 6.190000 0.9094000 6.943000 1.095000  -0.7522000     1.424000  
1 1 1 7  59 12 o 3.179000 0.8428000 2.243000 1.021000  4.114000 1.341000  -1.871000      1.686000  
1 1 1 7  59 14 o 4.331000 0.9019000 4.163000 1.167000  4.498000 1.375000  -0.3354000     1.804000  
1 1 1 7  59 16 o 6.538000 0.7159000 6.311000 0.9701000 6.765000 1.053000  -0.4542000     1.432000  
1 1 1 7  59 18 o 5.107000 0.9253000 5.388000 1.162000  4.826000 1.440000  0.5621000      1.851000  
1 1 1 7  59 20 o 7.511000 0.8469000 7.242000 0.7742000 7.780000 1.507000  -0.5381000     1.694000  
1 1 1 7  59 22 o 8.373000 1.828000  8.373000 1.828000  ?        ?         ?              ?         
1 1 1 7  60 1  o 6.758000 0.7341000 6.913000 0.8844000 6.604000 1.172000  0.3091000      1.468000  
1 1 1 7  60 3  o 8.364000 0.7801000 7.733000 0.8301000 8.996000 1.321000  -1.262000      1.560000  
1 1 1 7  60 5  o 7.019000 0.8134000 7.319000 0.9885000 6.718000 1.292000  0.6008000      1.627000  
1 1 1 7  60 7  o 4.314000 0.9148000 4.955000 1.143000  3.674000 1.429000  1.281000       1.830000  
1 1 1 7  60 9  o 6.984000 0.6707000 6.586000 0.8704000 7.382000 1.021000  -0.7961000     1.341000  
1 1 1 7  60 11 o 6.700000 0.6778000 6.596000 0.8502000 6.804000 1.056000  -0.2077000     1.356000  
1 1 1 7  60 13 f 4.828000 0.8460000 3.639000 1.201000  6.016000 1.192000  -2.377000      1.692000  
1 1 1 7  60 15 o 3.051000 0.8719000 2.412000 1.055000  3.690000 1.388000  -1.278000      1.744000  
1 1 1 7  60 17 o 3.745000 1.113000  3.333000 1.257000  4.157000 1.837000  -0.8236000     2.226000  
1 1 1 7  61 0  o 4.486000 1.192000  4.486000 1.192000  4.486000 1.192000  0.000000       0.000000  
1 1 1 7  61 2  o 3.484000 0.8742000 2.764000 1.152000  4.205000 1.315000  -1.441000      1.748000  
1 1 1 7  61 4  o 3.550000 0.9059000 3.697000 1.196000  3.403000 1.361000  0.2939000      1.812000  
1 1 1 7  61 6  f 3.444000 0.9353000 3.285000 1.193000  3.603000 1.441000  -0.3184000     1.871000  
1 1 1 7  61 8  o 2.958000 0.8907000 2.470000 1.084000  3.445000 1.414000  -0.9749000     1.781000  
1 1 1 7  61 10 o 5.827000 0.8682000 4.698000 1.092000  6.956000 1.350000  -2.258000      1.736000  
1 1 1 7  61 12 f 4.420000 0.9556000 3.250000 1.161000  5.590000 1.518000  -2.339000      1.911000  
1 1 1 7  61 14 o 4.821000 1.171000  5.778000 1.564000  3.864000 1.742000  1.914000       2.341000  
1 1 1 7  62 1  f 5.866000 0.6869000 4.123000 1.139000  7.609000 0.7677000 -3.486000      1.374000  
1 1 1 7  62 3  o 5.668000 0.7588000 6.130000 0.9758000 5.206000 1.162000  0.9235000      1.518000  
1 1 1 7  62 5  o 4.290000 0.9035000 4.622000 1.120000  3.958000 1.418000  0.6642000      1.807000  
1 1 1 7  62 7  o 4.820000 0.9757000 6.509000 1.405000  3.131000 1.355000  3.377000       1.951000  
1 1 1 8  0  0  o 89.63000 1.225000  89.63000 1.225000  89.63000 1.225000  0.000000       0.000000  
1 1 1 8  0  2  o 15.06000 0.2157000 15.06000 0.2157000 15.06000 0.2157000 0.000000       0.000000  
1 1 1 8  0  4  o 90.17000 0.8713000 90.17000 0.8713000 90.17000 0.8713000 0.000000       0.000000  
1 1 1 8  0  6  o 64.40000 0.7260000 64.40000 0.7260000 64.40000 0.7260000 0.000000       0.000000  
1 1 1 8  0  8  o 78.76000 0.7650000 78.76000 0.7650000 78.76000 0.7650000 0.000000       0.000000  
1 1 1 8  0  10 o 13.65000 0.2536000 13.65000 0.2536000 13.65000 0.2536000 0.000000       0.000000  
1 1 1 8  0  12 o 123.0000 1.677000  123.0000 1.677000  123.0000 1.677000  0.000000       0.000000  
1 1 1 8  0  14 o 70.01000 0.6871000 70.01000 0.6871000 70.01000 0.6871000 0.000000       0.000000  
1 1 1 8  0  16 o 19.89000 0.2922000 19.89000 0.2922000 19.89000 0.2922000 0.000000       0.000000  
1 1 1 8  0  18 o 28.74000 0.3454000 28.74000 0.3454000 28.74000 0.3454000 0.000000       0.000000  
1 1 1 8  0  20 o 7.949000 0.5321000 7.949000 0.5321000 7.949000 0.5321000 0.000000       0.000000  
1 1 1 8  0  22 o 6.493000 0.7964000 6.493000 0.7964000 6.493000 0.7964000 0.000000       0.000000  
1 1 1 8  0  24 o 67.39000 0.7814000 67.39000 0.7814000 67.39000 0.7814000 0.000000       0.000000  
1 1 1 8  0  26 o 11.32000 0.7117000 11.32000 0.7117000 11.32000 0.7117000 0.000000       0.000000  
1 1 1 8  0  28 o 4.556000 1.445000  4.556000 1.445000  4.556000 1.445000  0.000000       0.000000  
1 1 1 8  0  30 o 29.36000 0.5032000 29.36000 0.5032000 29.36000 0.5032000 0.000000       0.000000  
1 1 1 8  0  32 o 45.51000 0.5884000 45.51000 0.5884000 45.51000 0.5884000 0.000000       0.000000  
1 1 1 8  0  34 o 7.043000 1.293000  7.043000 1.293000  7.043000 1.293000  0.000000       0.000000  
1 1 1 8  0  36 o 39.29000 0.4715000 39.29000 0.4715000 39.29000 0.4715000 0.000000       0.000000  
1 1 1 8  0  38 o 13.44000 0.7890000 13.44000 0.7890000 13.44000 0.7890000 0.000000       0.000000  
1 1 1 8  0  40 o 35.59000 0.5307000 35.59000 0.5307000 35.59000 0.5307000 0.000000       0.000000  
1 1 1 8  0  42 o 7.562000 1.218000  7.562000 1.218000  7.562000 1.218000  0.000000       0.000000  
1 1 1 8  0  44 o 43.96000 0.5287000 43.96000 0.5287000 43.96000 0.5287000 0.000000       0.000000  
1 1 1 8  0  46 o 50.10000 0.5694000 50.10000 0.5694000 50.10000 0.5694000 0.000000       0.000000  
1 1 1 8  0  48 o 15.63000 0.5942000 15.63000 0.5942000 15.63000 0.5942000 0.000000       0.000000  
1 1 1 8  0  50 o 7.885000 1.191000  7.885000 1.191000  7.885000 1.191000  0.000000       0.000000  
1 1 1 8  0  52 o 11.83000 0.7471000 11.83000 0.7471000 11.83000 0.7471000 0.000000       0.000000  
1 1 1 8  0  54 o 6.402000 1.341000  6.402000 1.341000  6.402000 1.341000  0.000000       0.000000  
1 1 1 8  0  56 o 3.575000 1.391000  3.575000 1.391000  3.575000 1.391000  0.000000       0.000000  
1 1 1 8  0  58 o 15.60000 0.5557000 15.60000 0.5557000 15.60000 0.5557000 0.000000       0.000000  
1 1 1 8  0  60 o 27.35000 0.5720000 27.35000 0.5720000 27.35000 0.5720000 0.000000       0.000000  
1 1 1 8  0  62 o 4.134000 1.620000  4.134000 1.620000  4.134000 1.620000  0.000000       0.000000  
1 1 1 8  0  64 o 3.512000 1.424000  3.512000 1.424000  3.512000 1.424000  0.000000       0.000000  
1 1 1 8  0  66 o 3.452000 1.462000  3.452000 1.462000  3.452000 1.462000  0.000000       0.000000  
1 1 1 8  1  1  f 111.9000 0.7616000 112.8000 1.086000  110.9000 1.068000  1.891000       1.523000  
1 1 1 8  1  3  o 59.15000 0.4095000 58.68000 0.5746000 59.62000 0.5836000 -0.9309000     0.8190000 
1 1 1 8  1  5  o 140.7000 0.9561000 141.2000 1.357000  140.2000 1.347000  0.9960000      1.912000  
1 1 1 8  1  7  o 63.79000 0.5095000 63.71000 0.7199000 63.87000 0.7212000 -0.1542000     1.019000  
1 1 1 8  1  9  o 21.07000 0.1848000 21.02000 0.2612000 21.12000 0.2615000 -0.1030000     0.3696000 
1 1 1 8  1  11 o 64.40000 0.5482000 64.21000 0.6308000 64.60000 0.8968000 -0.3929000     1.096000  
1 1 1 8  1  13 o 48.67000 0.3749000 48.62000 0.5664000 48.73000 0.4915000 -0.1078000     0.7499000 
1 1 1 8  1  15 o 42.65000 0.3229000 42.56000 0.3947000 42.74000 0.5111000 -0.1846000     0.6458000 
1 1 1 8  1  17 o 65.98000 0.4986000 65.90000 0.7522000 66.06000 0.6548000 -0.1633000     0.9973000 
1 1 1 8  1  19 o 32.36000 0.2642000 31.95000 0.3702000 32.78000 0.3771000 -0.8233000     0.5285000 
1 1 1 8  1  21 o 56.32000 0.4052000 56.72000 0.5765000 55.92000 0.5696000 0.8034000      0.8104000 
1 1 1 8  1  23 o 82.76000 0.6661000 82.88000 0.9428000 82.64000 0.9411000 0.2314000      1.332000  
1 1 1 8  1  25 o 72.41000 0.6258000 72.62000 1.023000  72.20000 0.7212000 0.4190000      1.252000  
1 1 1 8  1  27 o 40.59000 0.5145000 39.66000 0.9134000 41.52000 0.4738000 -1.860000      1.029000  
1 1 1 8  1  29 o 47.26000 0.4671000 47.69000 0.5939000 46.83000 0.7211000 0.8668000      0.9342000 
1 1 1 8  1  31 o 50.39000 0.3863000 50.92000 0.5507000 49.86000 0.5419000 1.068000       0.7726000 
1 1 1 8  1  33 o 8.730000 0.6532000 8.509000 1.052000  8.951000 0.7751000 -0.4417000     1.306000  
1 1 1 8  1  35 o 43.54000 0.3531000 43.83000 0.5023000 43.25000 0.4963000 0.5744000      0.7062000 
1 1 1 8  1  37 o 6.057000 0.8594000 6.198000 1.095000  5.917000 1.325000  0.2807000      1.719000  
1 1 1 8  1  39 o 19.97000 0.3347000 19.97000 0.4696000 19.97000 0.4771000 0.1879000E-02  0.6695000 
1 1 1 8  1  41 o 10.13000 0.5699000 10.09000 0.7490000 10.17000 0.8590000 -0.7937000E-01 1.140000  
1 1 1 8  1  43 o 26.17000 0.3565000 26.54000 0.4761000 25.81000 0.5308000 0.7289000      0.7131000 
1 1 1 8  1  45 o 16.44000 0.4659000 16.69000 0.6104000 16.19000 0.7041000 0.5040000      0.9318000 
1 1 1 8  1  47 o 20.14000 0.3732000 20.18000 0.5336000 20.11000 0.5218000 0.7412000E-01  0.7464000 
1 1 1 8  1  49 o 23.27000 0.3715000 23.18000 0.4895000 23.36000 0.5589000 -0.1785000     0.7429000 
1 1 1 8  1  51 o 6.043000 0.8880000 6.370000 1.203000  5.717000 1.307000  0.6525000      1.776000  
1 1 1 8  1  53 o 6.084000 0.8962000 6.263000 1.244000  5.905000 1.290000  0.3573000      1.792000  
1 1 1 8  1  55 o 10.24000 0.5466000 10.07000 0.7296000 10.41000 0.8141000 -0.3365000     1.093000  
1 1 1 8  1  57 o 12.43000 0.5154000 11.79000 0.8250000 13.08000 0.6178000 -1.288000      1.031000  
1 1 1 8  1  59 o 4.915000 1.017000  4.961000 1.466000  4.869000 1.411000  0.9158000E-01  2.034000  
1 1 1 8  1  61 o 6.670000 0.9167000 5.580000 1.401000  7.761000 1.183000  -2.181000      1.833000  
1 1 1 8  1  63 o 5.600000 1.041000  5.979000 1.440000  5.220000 1.503000  0.7597000      2.082000  
1 1 1 8  1  65 o 3.963000 1.117000  4.615000 1.774000  3.311000 1.356000  1.304000       2.233000  
1 1 1 8  1  67 f 3.407000 0.9944000 4.023000 1.587000  2.792000 1.199000  1.231000       1.989000  
1 1 1 8  2  0  o 2.810000 0.5314000 2.810000 0.5314000 2.810000 0.5314000 0.000000       0.000000  
1 1 1 8  2  2  o 141.3000 0.9599000 140.9000 1.353000  141.7000 1.362000  -0.8866000     1.920000  
1 1 1 8  2  4  o 51.81000 0.3613000 51.85000 0.5115000 51.77000 0.5105000 0.8723000E-01  0.7227000 
1 1 1 8  2  6  f 30.55000 0.2463000 30.60000 0.3723000 30.50000 0.3227000 0.1028000      0.4927000 
1 1 1 8  2  8  o 60.72000 0.4550000 60.86000 0.5971000 60.57000 0.6866000 0.2808000      0.9100000 
1 1 1 8  2  10 f 39.39000 0.3091000 39.22000 0.4035000 39.57000 0.4683000 -0.3476000     0.6181000 
1 1 1 8  2  12 f 45.79000 0.3547000 45.63000 0.5349000 45.96000 0.4659000 -0.3326000     0.7093000 
1 1 1 8  2  14 o 30.57000 0.2623000 30.69000 0.3454000 30.46000 0.3949000 0.2276000      0.5247000 
1 1 1 8  2  16 o 64.18000 0.4645000 64.25000 0.5700000 64.10000 0.7336000 0.1556000      0.9291000 
1 1 1 8  2  18 o 23.54000 0.2629000 23.73000 0.3702000 23.36000 0.3734000 0.3702000      0.5258000 
1 1 1 8  2  20 o 33.48000 0.2728000 33.54000 0.3840000 33.42000 0.3877000 0.1240000      0.5457000 
1 1 1 8  2  22 f 74.95000 0.5248000 74.46000 0.7372000 75.43000 0.7470000 -0.9726000     1.050000  
1 1 1 8  2  24 o 60.20000 0.5601000 60.67000 0.8709000 59.72000 0.7047000 0.9506000      1.120000  
1 1 1 8  2  26 o 169.1000 1.192000  170.2000 1.893000  167.9000 1.448000  2.339000       2.383000  
1 1 1 8  2  28 o 29.32000 0.3799000 29.50000 0.5825000 29.15000 0.4879000 0.3527000      0.7598000 
1 1 1 8  2  30 o 17.00000 0.3873000 16.55000 0.5378000 17.45000 0.5576000 -0.8960000     0.7747000 
1 1 1 8  2  32 f 44.38000 0.4277000 44.44000 0.6973000 44.33000 0.4954000 0.1100000      0.8553000 
1 1 1 8  2  34 o 9.441000 0.5688000 9.969000 0.8246000 8.912000 0.7836000 1.057000       1.138000  
1 1 1 8  2  36 o 35.43000 0.3170000 35.24000 0.4460000 35.62000 0.4506000 -0.3753000     0.6340000 
1 1 1 8  2  38 o 29.47000 0.3550000 30.04000 0.5052000 28.90000 0.4989000 1.144000       0.7100000 
1 1 1 8  2  40 o 18.26000 0.3840000 18.46000 0.5710000 18.06000 0.5135000 0.4032000      0.7679000 
1 1 1 8  2  42 o 18.52000 0.3960000 18.47000 0.5948000 18.57000 0.5230000 -0.9376000E-01 0.7921000 
1 1 1 8  2  44 o 15.09000 0.4799000 14.56000 0.6361000 15.61000 0.7188000 -1.047000      0.9598000 
1 1 1 8  2  46 o 50.29000 0.4382000 50.05000 0.6630000 50.53000 0.5730000 -0.4754000     0.8763000 
1 1 1 8  2  48 o 17.50000 0.3984000 17.61000 0.5557000 17.39000 0.5710000 0.2164000      0.7968000 
1 1 1 8  2  50 o 24.09000 0.3646000 24.02000 0.5497000 24.16000 0.4790000 -0.1370000     0.7291000 
1 1 1 8  2  52 o 17.82000 0.4113000 17.97000 0.5838000 17.67000 0.5796000 0.2979000      0.8227000 
1 1 1 8  2  54 o 13.53000 0.4337000 13.03000 0.6223000 14.03000 0.6043000 -1.000000      0.8674000 
1 1 1 8  2  56 o 5.867000 0.9621000 6.713000 1.122000  5.022000 1.563000  1.690000       1.924000  
1 1 1 8  2  58 o 13.13000 0.4510000 13.26000 0.6266000 12.99000 0.6487000 0.2744000      0.9019000 
1 1 1 8  2  60 o 12.22000 0.6242000 13.72000 0.7111000 10.72000 1.026000  3.003000       1.248000  
1 1 1 8  2  62 o 5.586000 1.086000  5.712000 1.717000  5.460000 1.331000  0.2514000      2.173000  
1 1 1 8  2  64 o 3.495000 1.029000  3.444000 1.483000  3.546000 1.427000  -0.1022000     2.058000  
1 1 1 8  2  66 f 4.011000 1.044000  3.772000 1.568000  4.250000 1.380000  -0.4787000     2.089000  
1 1 1 8  3  1  o 37.52000 0.2689000 37.51000 0.3800000 37.54000 0.3806000 -0.2562000E-01 0.5379000 
1 1 1 8  3  3  o 55.09000 0.3827000 55.08000 0.5410000 55.11000 0.5413000 -0.2380000E-01 0.7653000 
1 1 1 8  3  5  o 76.09000 0.5649000 76.94000 0.8616000 75.25000 0.7309000 1.685000       1.130000  
1 1 1 8  3  7  o 21.60000 0.2209000 21.75000 0.2593000 21.44000 0.3576000 0.3178000      0.4417000 
1 1 1 8  3  9  o 43.70000 0.3372000 43.52000 0.4404000 43.89000 0.5108000 -0.3763000     0.6745000 
1 1 1 8  3  11 o 66.13000 0.4955000 65.83000 0.6456000 66.44000 0.7517000 -0.6148000     0.9909000 
1 1 1 8  3  13 o 45.50000 0.3386000 45.55000 0.4149000 45.45000 0.5351000 0.1014000      0.6771000 
1 1 1 8  3  15 o 12.30000 0.2500000 12.27000 0.3583000 12.33000 0.3488000 -0.5517000E-01 0.5000000 
1 1 1 8  3  17 f 79.00000 0.5476000 78.37000 0.7670000 79.63000 0.7818000 -1.264000      1.095000  
1 1 1 8  3  19 o 22.11000 0.2513000 22.21000 0.3777000 22.01000 0.3316000 0.1975000      0.5026000 
1 1 1 8  3  21 o 60.42000 0.5257000 59.88000 0.8521000 60.95000 0.6161000 -1.064000      1.051000  
1 1 1 8  3  23 o 76.15000 0.6490000 74.63000 1.044000  77.67000 0.7711000 -3.044000      1.298000  
1 1 1 8  3  25 o 31.43000 0.2973000 31.96000 0.4637000 30.89000 0.3723000 1.076000       0.5947000 
1 1 1 8  3  27 o 66.32000 0.6130000 67.50000 0.9581000 65.14000 0.7649000 2.358000       1.226000  
1 1 1 8  3  29 o 76.66000 0.5573000 76.05000 0.8738000 77.27000 0.6920000 -1.218000      1.115000  
1 1 1 8  3  31 o 14.87000 0.4023000 14.59000 0.5886000 15.15000 0.5485000 -0.5591000     0.8045000 
1 1 1 8  3  33 o 26.39000 0.3802000 26.36000 0.5841000 26.42000 0.4870000 -0.5563000E-01 0.7605000 
1 1 1 8  3  35 o 48.73000 0.3862000 48.31000 0.6021000 49.15000 0.4838000 -0.8383000     0.7724000 
1 1 1 8  3  37 o 18.21000 0.3767000 18.17000 0.5307000 18.25000 0.5348000 -0.8271000E-01 0.7535000 
1 1 1 8  3  39 o 50.27000 0.4193000 50.45000 0.6319000 50.10000 0.5512000 0.3448000      0.8385000 
1 1 1 8  3  41 o 12.40000 0.5210000 13.30000 0.6806000 11.50000 0.7890000 1.798000       1.042000  
1 1 1 8  3  43 o 10.16000 0.5730000 10.61000 0.7798000 9.703000 0.8399000 0.9057000      1.146000  
1 1 1 8  3  45 o 23.24000 0.3511000 23.60000 0.4895000 22.88000 0.5034000 0.7249000      0.7021000 
1 1 1 8  3  47 o 33.47000 0.3733000 33.03000 0.5665000 33.91000 0.4861000 -0.8844000     0.7465000 
1 1 1 8  3  49 o 22.49000 0.3683000 22.51000 0.4847000 22.46000 0.5547000 0.4208000E-01  0.7367000 
1 1 1 8  3  51 o 12.70000 0.4406000 13.12000 0.5951000 12.28000 0.6500000 0.8323000      0.8813000 
1 1 1 8  3  53 o 4.791000 0.9981000 4.035000 1.504000  5.547000 1.313000  -1.513000      1.996000  
1 1 1 8  3  55 o 14.83000 0.4392000 14.77000 0.5539000 14.89000 0.6818000 -0.1228000     0.8784000 
1 1 1 8  3  57 o 10.17000 0.6098000 10.01000 0.9431000 10.33000 0.7733000 -0.3224000     1.220000  
1 1 1 8  3  59 o 3.632000 0.9610000 3.093000 1.365000  4.171000 1.354000  -1.078000      1.922000  
1 1 1 8  3  61 o 7.702000 0.7760000 8.257000 1.215000  7.146000 0.9653000 1.111000       1.552000  
1 1 1 8  3  63 o 3.336000 0.9908000 3.676000 1.512000  2.995000 1.281000  0.6811000      1.982000  
1 1 1 8  3  65 o 5.042000 1.142000  4.994000 1.595000  5.091000 1.635000  -0.9655000E-01 2.284000  
1 1 1 8  3  67 o 4.363000 0.9806000 3.497000 1.548000  5.229000 1.205000  -1.732000      1.961000  
1 1 1 8  4  0  o 6.916000 0.2473000 6.916000 0.2473000 6.916000 0.2473000 0.000000       0.000000  
1 1 1 8  4  2  f 80.53000 0.5951000 80.40000 0.8978000 80.67000 0.7815000 -0.2727000     1.190000  
1 1 1 8  4  4  o 91.44000 0.6758000 92.07000 1.027000  90.80000 0.8792000 1.276000       1.352000  
1 1 1 8  4  6  o 63.90000 0.4760000 64.48000 0.6301000 63.33000 0.7137000 1.145000       0.9521000 
1 1 1 8  4  8  o 19.46000 0.2178000 19.53000 0.2514000 19.38000 0.3557000 0.1501000      0.4355000 
1 1 1 8  4  10 f 47.39000 0.3626000 47.74000 0.4791000 47.04000 0.5444000 0.6978000      0.7252000 
1 1 1 8  4  12 f 23.51000 0.2226000 23.53000 0.2857000 23.50000 0.3414000 0.2746000E-01  0.4451000 
1 1 1 8  4  14 o 35.75000 0.2932000 35.61000 0.3786000 35.88000 0.4477000 -0.2677000     0.5863000 
1 1 1 8  4  16 o 45.07000 0.3564000 44.73000 0.4616000 45.42000 0.5431000 -0.6926000     0.7128000 
1 1 1 8  4  18 o 15.64000 0.3002000 15.43000 0.4967000 15.86000 0.3373000 -0.4319000     0.6004000 
1 1 1 8  4  20 o 86.48000 0.6473000 87.02000 0.9821000 85.94000 0.8433000 1.080000       1.295000  
1 1 1 8  4  22 o 64.92000 0.4761000 65.51000 0.7545000 64.33000 0.5808000 1.180000       0.9521000 
1 1 1 8  4  24 o 38.51000 0.3814000 39.31000 0.6208000 37.70000 0.4434000 1.619000       0.7629000 
1 1 1 8  4  26 o 79.62000 0.6014000 79.12000 0.9024000 80.13000 0.7952000 -1.012000      1.203000  
1 1 1 8  4  28 o 26.48000 0.2941000 26.61000 0.4580000 26.35000 0.3690000 0.2574000      0.5882000 
1 1 1 8  4  30 o 23.28000 0.3418000 22.71000 0.4770000 23.85000 0.4898000 -1.142000      0.6837000 
1 1 1 8  4  32 o 8.320000 0.5783000 8.952000 0.8260000 7.689000 0.8096000 1.264000       1.157000  
1 1 1 8  4  34 o 58.73000 0.5100000 58.04000 0.8545000 59.41000 0.5571000 -1.370000      1.020000  
1 1 1 8  4  36 o 22.07000 0.3300000 22.24000 0.4848000 21.90000 0.4477000 0.3317000      0.6599000 
1 1 1 8  4  38 o 17.10000 0.4116000 17.26000 0.6846000 16.94000 0.4569000 0.3173000      0.8231000 
1 1 1 8  4  40 o 14.36000 0.4504000 15.26000 0.7428000 13.46000 0.5097000 1.793000       0.9009000 
1 1 1 8  4  42 o 16.92000 0.3903000 17.06000 0.6106000 16.79000 0.4863000 0.2657000      0.7806000 
1 1 1 8  4  44 o 35.28000 0.5603000 35.67000 0.5414000 34.90000 0.9810000 0.7684000      1.121000  
1 1 1 8  4  46 o 34.91000 0.3499000 34.33000 0.5428000 35.49000 0.4417000 -1.165000      0.6997000 
1 1 1 8  4  48 o 35.01000 0.3533000 35.34000 0.5540000 34.68000 0.4386000 0.6674000      0.7066000 
1 1 1 8  4  50 o 16.23000 0.4626000 16.24000 0.7744000 16.22000 0.5063000 0.1638000E-01  0.9253000 
1 1 1 8  4  52 o 8.598000 0.6153000 9.042000 0.9247000 8.154000 0.8121000 0.8872000      1.231000  
1 1 1 8  4  54 o 2.327000 0.7833000 2.650000 1.237000  2.003000 0.9615000 0.6476000      1.567000  
1 1 1 8  4  56 o 7.237000 0.8006000 6.227000 1.266000  8.248000 0.9804000 -2.020000      1.601000  
1 1 1 8  4  58 o 3.061000 0.9521000 2.972000 1.394000  3.150000 1.298000  -0.1782000     1.904000  
1 1 1 8  4  60 f 4.013000 1.034000  3.729000 1.495000  4.297000 1.431000  -0.5681000     2.069000  
1 1 1 8  4  62 o 5.244000 1.036000  5.750000 1.529000  4.738000 1.399000  1.013000       2.072000  
1 1 1 8  4  64 o 4.720000 1.037000  5.379000 1.609000  4.061000 1.308000  1.317000       2.074000  
1 1 1 8  4  66 o 2.921000 0.9332000 2.929000 1.336000  2.914000 1.303000  0.1476000E-01  1.866000  
1 1 1 8  5  1  o 96.51000 0.7598000 97.29000 1.083000  95.72000 1.066000  1.574000       1.520000  
1 1 1 8  5  3  o 68.42000 0.5429000 67.91000 0.7619000 68.93000 0.7736000 -1.027000      1.086000  
1 1 1 8  5  5  o 52.67000 0.3964000 52.42000 0.5174000 52.92000 0.6008000 -0.4935000     0.7929000 
1 1 1 8  5  7  o 17.12000 0.1656000 17.16000 0.2329000 17.08000 0.2356000 0.7643000E-01  0.3313000 
1 1 1 8  5  9  o 57.43000 0.4322000 57.65000 0.5686000 57.21000 0.6511000 0.4303000      0.8644000 
1 1 1 8  5  11 o 52.39000 0.3826000 52.20000 0.4652000 52.58000 0.6076000 -0.3746000     0.7653000 
1 1 1 8  5  13 o 83.06000 0.6166000 84.18000 0.8179000 81.94000 0.9230000 2.239000       1.233000  
1 1 1 8  5  15 o 30.81000 0.2538000 31.26000 0.3122000 30.37000 0.4002000 0.8899000      0.5076000 
1 1 1 8  5  17 o 87.54000 0.6974000 87.29000 0.9835000 87.78000 0.9891000 -0.4832000     1.395000  
1 1 1 8  5  19 o 70.17000 0.5062000 69.61000 0.7924000 70.72000 0.6301000 -1.110000      1.012000  
1 1 1 8  5  21 o 47.91000 0.3673000 48.59000 0.5821000 47.23000 0.4483000 1.355000       0.7347000 
1 1 1 8  5  23 o 141.8000 1.182000  140.7000 1.919000  142.9000 1.382000  -2.231000      2.364000  
1 1 1 8  5  25 o 12.86000 0.3677000 12.85000 0.5756000 12.87000 0.4577000 -0.1348000E-01 0.7354000 
1 1 1 8  5  27 o 30.89000 0.3513000 30.89000 0.5662000 30.88000 0.4160000 0.8932000E-02  0.7026000 
1 1 1 8  5  29 o 96.86000 0.7261000 97.51000 1.101000  96.22000 0.9466000 1.289000       1.452000  
1 1 1 8  5  31 o 50.76000 0.4156000 50.73000 0.6234000 50.80000 0.5498000 -0.6596000E-01 0.8312000 
1 1 1 8  5  33 o 21.56000 0.3123000 21.60000 0.4804000 21.53000 0.3993000 0.7156000E-01  0.6247000 
1 1 1 8  5  35 o 45.80000 0.4292000 45.58000 0.7231000 46.01000 0.4625000 -0.4284000     0.8584000 
1 1 1 8  5  37 o 33.20000 0.4083000 33.35000 0.4953000 33.06000 0.6493000 0.2849000      0.8167000 
1 1 1 8  5  39 o 6.972000 0.8015000 6.469000 1.311000  7.475000 0.9217000 -1.006000      1.603000  
1 1 1 8  5  41 o 25.42000 0.3420000 25.76000 0.5097000 25.08000 0.4561000 0.6746000      0.6840000 
1 1 1 8  5  43 o 24.07000 0.3610000 24.22000 0.5307000 23.92000 0.4895000 0.2978000      0.7220000 
1 1 1 8  5  45 o 12.79000 0.5106000 12.33000 0.8137000 13.24000 0.6171000 -0.9132000     1.021000  
1 1 1 8  5  47 o 24.02000 0.4088000 24.29000 0.6857000 23.75000 0.4453000 0.5381000      0.8176000 
1 1 1 8  5  49 o 4.118000 1.092000  3.872000 1.577000  4.363000 1.512000  -0.4908000     2.185000  
1 1 1 8  5  51 o 10.93000 0.6127000 10.91000 1.031000  10.95000 0.6619000 -0.4444000E-01 1.225000  
1 1 1 8  5  53 o 8.176000 0.7163000 9.480000 0.9176000 6.871000 1.100000  2.609000       1.433000  
1 1 1 8  5  55 o 16.93000 0.4672000 16.44000 0.7442000 17.41000 0.5649000 -0.9621000     0.9343000 
1 1 1 8  5  57 o 9.291000 0.6284000 8.567000 1.066000  10.01000 0.6656000 -1.447000      1.257000  
1 1 1 8  5  59 o 6.812000 0.8713000 7.944000 1.174000  5.681000 1.288000  2.263000       1.743000  
1 1 1 8  5  61 o 6.485000 1.140000  7.753000 1.871000  5.216000 1.302000  2.538000       2.279000  
1 1 1 8  5  63 o 3.701000 1.039000  3.597000 1.461000  3.805000 1.477000  -0.2073000     2.077000  
1 1 1 8  5  65 o 6.235000 0.8902000 6.503000 1.388000  5.967000 1.115000  0.5357000      1.780000  
1 1 1 8  5  67 o 6.759000 0.8923000 6.119000 1.553000  7.398000 0.8789000 -1.279000      1.785000  
1 1 1 8  6  0  o 70.04000 0.7844000 70.04000 0.7844000 70.04000 0.7844000 0.000000       0.000000  
1 1 1 8  6  2  o 88.32000 0.6515000 88.53000 0.8558000 88.12000 0.9826000 0.4074000      1.303000  
1 1 1 8  6  4  o 18.52000 0.1654000 18.50000 0.2319000 18.54000 0.2359000 -0.4075000E-01 0.3308000 
1 1 1 8  6  6  o 35.58000 0.2592000 35.72000 0.3674000 35.45000 0.3656000 0.2736000      0.5183000 
1 1 1 8  6  8  o 79.49000 0.6692000 79.26000 0.7695000 79.73000 1.095000  -0.4719000     1.338000  
1 1 1 8  6  10 o 64.12000 0.5455000 64.03000 0.6263000 64.21000 0.8932000 -0.1795000     1.091000  
1 1 1 8  6  12 o 64.94000 0.4885000 65.02000 0.6394000 64.86000 0.7387000 0.1662000      0.9770000 
1 1 1 8  6  14 o 66.93000 0.5399000 67.20000 0.7665000 66.66000 0.7606000 0.5412000      1.080000  
1 1 1 8  6  16 o 75.96000 0.5698000 75.43000 0.7392000 76.48000 0.8673000 -1.049000      1.140000  
1 1 1 8  6  18 o 118.2000 0.8085000 117.9000 1.140000  118.5000 1.146000  -0.5473000     1.617000  
1 1 1 8  6  20 o 114.9000 0.9299000 114.5000 1.568000  115.3000 1.001000  -0.7910000     1.860000  
1 1 1 8  6  22 o 39.16000 0.3208000 39.26000 0.5045000 39.05000 0.3963000 0.2014000      0.6416000 
1 1 1 8  6  24 o 66.84000 0.4901000 66.68000 0.7705000 66.99000 0.6059000 -0.3180000     0.9802000 
1 1 1 8  6  26 o 88.19000 0.7256000 88.54000 1.226000  87.84000 0.7758000 0.6974000      1.451000  
1 1 1 8  6  28 o 73.94000 0.5398000 74.43000 0.8531000 73.46000 0.6616000 0.9730000      1.080000  
1 1 1 8  6  30 o 48.41000 0.3819000 48.47000 0.5993000 48.36000 0.4735000 0.1025000      0.7637000 
1 1 1 8  6  32 o 37.66000 0.3448000 37.23000 0.5125000 38.08000 0.4614000 -0.8463000     0.6896000 
1 1 1 8  6  34 o 19.48000 0.3290000 19.53000 0.5173000 19.43000 0.4066000 0.9591000E-01  0.6579000 
1 1 1 8  6  36 o 39.26000 0.3411000 39.67000 0.5357000 38.85000 0.4225000 0.8232000      0.6823000 
1 1 1 8  6  38 o 32.02000 0.3638000 32.29000 0.6055000 31.75000 0.4036000 0.5385000      0.7277000 
1 1 1 8  6  40 f 18.75000 0.4106000 18.60000 0.6671000 18.90000 0.4790000 -0.3007000     0.8213000 
1 1 1 8  6  42 o 16.47000 0.4086000 16.24000 0.6508000 16.70000 0.4942000 -0.4549000     0.8172000 
1 1 1 8  6  44 o 13.08000 0.4854000 13.13000 0.7583000 13.02000 0.6063000 0.1142000      0.9708000 
1 1 1 8  6  46 o 30.66000 0.3433000 30.85000 0.5369000 30.47000 0.4279000 0.3738000      0.6865000 
1 1 1 8  6  48 f 32.23000 0.4185000 31.06000 0.6843000 33.40000 0.4822000 -2.341000      0.8371000 
1 1 1 8  6  50 o 8.304000 0.7628000 8.693000 1.291000  7.916000 0.8125000 0.7769000      1.526000  
1 1 1 8  6  52 o 5.439000 1.075000  5.494000 1.519000  5.385000 1.522000  0.1089000      2.150000  
1 1 1 8  6  54 o 13.79000 0.4742000 13.55000 0.7245000 14.04000 0.6120000 -0.4878000     0.9484000 
1 1 1 8  6  56 o 3.054000 0.9304000 2.756000 1.266000  3.352000 1.364000  -0.5962000     1.861000  
1 1 1 8  6  58 o 9.981000 0.5730000 10.81000 0.8639000 9.155000 0.7529000 1.653000       1.146000  
1 1 1 8  6  60 o 4.031000 0.9654000 3.245000 1.415000  4.817000 1.314000  -1.573000      1.931000  
1 1 1 8  6  62 o 4.317000 1.086000  5.162000 1.638000  3.472000 1.427000  1.690000       2.172000  
1 1 1 8  6  64 o 7.051000 0.8980000 5.811000 1.554000  8.291000 0.8999000 -2.480000      1.796000  
1 1 1 8  6  66 o 4.346000 1.005000  5.472000 1.515000  3.219000 1.321000  2.253000       2.010000  
1 1 1 8  7  1  o 66.45000 0.4578000 66.48000 0.6476000 66.42000 0.6473000 0.5338000E-01  0.9156000 
1 1 1 8  7  3  o 64.27000 0.4435000 63.71000 0.6218000 64.82000 0.6324000 -1.110000      0.8869000 
1 1 1 8  7  5  o 56.41000 0.3927000 56.71000 0.5578000 56.11000 0.5528000 0.5958000      0.7853000 
1 1 1 8  7  7  o 48.93000 0.3712000 48.90000 0.4866000 48.97000 0.5607000 -0.6898000E-01 0.7424000 
1 1 1 8  7  9  o 21.70000 0.2323000 21.80000 0.2557000 21.60000 0.3878000 0.2076000      0.4645000 
1 1 1 8  7  11 o 60.09000 0.4550000 59.67000 0.5900000 60.52000 0.6928000 -0.8505000     0.9100000 
1 1 1 8  7  13 f 37.38000 0.2901000 37.31000 0.3500000 37.44000 0.4627000 -0.1337000     0.5802000 
1 1 1 8  7  15 o 29.25000 0.2829000 29.48000 0.3006000 29.02000 0.4794000 0.4566000      0.5658000 
1 1 1 8  7  17 o 26.00000 0.2546000 25.98000 0.3285000 26.02000 0.3891000 -0.4060000E-01 0.5092000 
1 1 1 8  7  19 o 36.38000 0.2859000 36.25000 0.4002000 36.51000 0.4084000 -0.2644000     0.5718000 
1 1 1 8  7  21 o 74.18000 0.6121000 73.34000 1.027000  75.02000 0.6669000 -1.682000      1.224000  
1 1 1 8  7  23 o 19.31000 0.4023000 18.73000 0.6511000 19.90000 0.4725000 -1.161000      0.8045000 
1 1 1 8  7  25 o 95.09000 0.7100000 95.01000 1.070000  95.17000 0.9336000 -0.1594000     1.420000  
1 1 1 8  7  27 o 36.45000 0.3795000 37.05000 0.6154000 35.86000 0.4442000 1.182000       0.7590000 
1 1 1 8  7  29 o 33.00000 0.3071000 33.33000 0.4819000 32.67000 0.3807000 0.6578000      0.6141000 
1 1 1 8  7  31 o 51.41000 0.3998000 51.39000 0.6292000 51.42000 0.4936000 -0.3108000E-01 0.7997000 
1 1 1 8  7  33 o 23.15000 0.3079000 23.41000 0.4872000 22.90000 0.3766000 0.5071000      0.6158000 
1 1 1 8  7  35 o 21.86000 0.3754000 21.71000 0.6406000 22.00000 0.3915000 -0.2831000     0.7508000 
1 1 1 8  7  37 o 20.44000 0.3350000 20.38000 0.5013000 20.51000 0.4446000 -0.1312000     0.6701000 
1 1 1 8  7  39 o 21.70000 0.3859000 21.68000 0.6198000 21.71000 0.4598000 -0.2665000E-01 0.7717000 
1 1 1 8  7  41 o 46.18000 0.4791000 46.27000 0.5989000 46.09000 0.7479000 0.1844000      0.9582000 
1 1 1 8  7  43 o 5.894000 0.9544000 4.721000 1.596000  7.067000 1.047000  -2.346000      1.909000  
1 1 1 8  7  45 o 16.72000 0.4257000 17.44000 0.6282000 16.00000 0.5745000 1.445000       0.8513000 
1 1 1 8  7  47 o 40.20000 0.3873000 40.04000 0.5810000 40.36000 0.5123000 -0.3137000     0.7746000 
1 1 1 8  7  49 o 34.46000 0.3639000 34.50000 0.5429000 34.42000 0.4847000 0.7671000E-01  0.7278000 
1 1 1 8  7  51 o 20.76000 0.5301000 20.93000 0.9122000 20.59000 0.5404000 0.3330000      1.060000  
1 1 1 8  7  53 o 8.739000 0.6416000 8.905000 0.9909000 8.572000 0.8154000 0.3331000      1.283000  
1 1 1 8  7  55 o 9.326000 0.6061000 8.956000 0.9762000 9.697000 0.7187000 -0.7410000     1.212000  
1 1 1 8  7  57 o 8.976000 0.6157000 9.481000 0.9603000 8.472000 0.7707000 1.009000       1.231000  
1 1 1 8  7  59 o 12.00000 0.5735000 12.55000 0.9293000 11.44000 0.6721000 1.118000       1.147000  
1 1 1 8  7  61 o 7.289000 1.044000  7.807000 1.819000  6.770000 1.024000  1.037000       2.088000  
1 1 1 8  7  63 o 9.725000 0.7709000 10.53000 1.165000  8.918000 1.009000  1.613000       1.542000  
1 1 1 8  7  65 f 3.509000 1.021000  3.252000 1.465000  3.765000 1.421000  -0.5123000     2.041000  
1 1 1 8  8  0  o 4.915000 0.3289000 4.915000 0.3289000 4.915000 0.3289000 0.000000       0.000000  
1 1 1 8  8  2  o 48.71000 0.3414000 48.46000 0.4804000 48.96000 0.4852000 -0.4983000     0.6828000 
1 1 1 8  8  4  o 80.23000 0.5950000 80.06000 0.7762000 80.40000 0.9020000 -0.3386000     1.190000  
1 1 1 8  8  6  o 22.54000 0.1989000 22.50000 0.2633000 22.57000 0.2983000 -0.6755000E-01 0.3979000 
1 1 1 8  8  8  o 66.86000 0.7388000 66.37000 0.6461000 67.35000 1.329000  -0.9858000     1.478000  
1 1 1 8  8  10 o 59.50000 0.4825000 59.98000 0.6876000 59.03000 0.6770000 0.9491000      0.9650000 
1 1 1 8  8  12 o 20.73000 0.2117000 21.01000 0.2670000 20.44000 0.3285000 0.5623000      0.4233000 
1 1 1 8  8  14 o 60.66000 0.4409000 60.57000 0.5365000 60.75000 0.6997000 -0.1800000     0.8817000 
1 1 1 8  8  16 o 45.11000 0.3308000 45.15000 0.4672000 45.07000 0.4683000 0.8031000E-01  0.6615000 
1 1 1 8  8  18 o 188.9000 1.387000  188.6000 1.812000  189.3000 2.102000  -0.6971000     2.775000  
1 1 1 8  8  20 o 69.65000 0.5044000 69.54000 0.7933000 69.75000 0.6231000 -0.2090000     1.009000  
1 1 1 8  8  22 f 64.76000 0.5430000 64.24000 0.9109000 65.27000 0.5912000 -1.028000      1.086000  
1 1 1 8  8  24 o 37.40000 0.3332000 37.49000 0.4996000 37.31000 0.4410000 0.1798000      0.6663000 
1 1 1 8  8  26 o 29.89000 0.4549000 29.33000 0.8049000 30.45000 0.4241000 -1.125000      0.9098000 
1 1 1 8  8  28 o 25.34000 0.3018000 25.11000 0.4419000 25.58000 0.4111000 -0.4694000     0.6036000 
1 1 1 8  8  30 o 21.19000 0.3049000 20.71000 0.4772000 21.68000 0.3797000 -0.9704000     0.6098000 
1 1 1 8  8  32 o 16.44000 0.3657000 16.01000 0.5569000 16.87000 0.4741000 -0.8640000     0.7314000 
1 1 1 8  8  34 o 53.45000 0.4146000 53.73000 0.6542000 53.17000 0.5095000 0.5632000      0.8292000 
1 1 1 8  8  36 o 35.94000 0.3925000 35.16000 0.6340000 36.71000 0.4630000 -1.551000      0.7851000 
1 1 1 8  8  38 o 37.36000 0.3933000 37.02000 0.6326000 37.71000 0.4675000 -0.6905000     0.7866000 
1 1 1 8  8  40 o 13.34000 0.4559000 13.72000 0.7090000 12.95000 0.5732000 0.7624000      0.9117000 
1 1 1 8  8  42 o 25.84000 0.3526000 26.08000 0.5111000 25.59000 0.4859000 0.4851000      0.7052000 
1 1 1 8  8  44 o 25.64000 0.3436000 25.61000 0.5367000 25.68000 0.4294000 -0.7864000E-01 0.6873000 
1 1 1 8  8  46 o 10.55000 0.6144000 10.47000 0.9970000 10.64000 0.7183000 -0.1617000     1.229000  
1 1 1 8  8  48 o 24.55000 0.4485000 24.38000 0.6979000 24.73000 0.5635000 -0.3524000     0.8970000 
1 1 1 8  8  50 o 12.19000 0.5706000 12.76000 0.9348000 11.62000 0.6546000 1.137000       1.141000  
1 1 1 8  8  52 o 4.334000 0.9835000 3.732000 1.501000  4.935000 1.272000  -1.203000      1.967000  
1 1 1 8  8  54 o 3.070000 0.9251000 3.349000 1.413000  2.790000 1.194000  0.5586000      1.850000  
1 1 1 8  8  56 o 6.860000 0.7659000 7.442000 1.160000  6.279000 1.000000  1.163000       1.532000  
1 1 1 8  8  58 o 6.924000 0.8110000 6.999000 1.272000  6.848000 1.007000  0.1510000      1.622000  
1 1 1 8  8  60 o 4.394000 1.036000  4.090000 1.585000  4.699000 1.333000  -0.6095000     2.071000  
1 1 1 8  8  62 o 3.268000 0.9897000 3.444000 1.508000  3.091000 1.282000  0.3536000      1.979000  
1 1 1 8  8  64 o 6.096000 1.063000  6.473000 1.758000  5.719000 1.197000  0.7545000      2.127000  
1 1 1 8  8  66 o 6.072000 1.011000  6.301000 1.587000  5.844000 1.253000  0.4574000      2.022000  
1 1 1 8  9  1  o 72.56000 0.4990000 72.13000 0.7010000 73.00000 0.7104000 -0.8703000     0.9980000 
1 1 1 8  9  3  o 74.66000 0.5133000 74.39000 0.7233000 74.93000 0.7286000 -0.5364000     1.027000  
1 1 1 8  9  5  o 32.60000 0.3112000 32.64000 0.3870000 32.57000 0.4875000 0.6894000E-01  0.6224000 
1 1 1 8  9  7  o 82.98000 0.8064000 83.64000 1.149000  82.32000 1.132000  1.319000       1.613000  
1 1 1 8  9  9  o 38.61000 0.2926000 38.70000 0.3532000 38.52000 0.4666000 0.1880000      0.5852000 
1 1 1 8  9  11 o 41.40000 0.3122000 41.47000 0.3789000 41.33000 0.4964000 0.1400000      0.6244000 
1 1 1 8  9  13 o 83.61000 0.5946000 84.20000 0.7326000 83.03000 0.9369000 1.178000       1.189000  
1 1 1 8  9  15 o 103.2000 0.7077000 103.0000 0.9985000 103.4000 1.003000  -0.3351000     1.415000  
1 1 1 8  9  17 o 41.25000 0.3106000 41.47000 0.4399000 41.04000 0.4385000 0.4301000      0.6211000 
1 1 1 8  9  19 o 97.46000 0.6713000 97.72000 0.9505000 97.19000 0.9483000 0.5272000      1.343000  
1 1 1 8  9  21 f 53.26000 0.4006000 53.20000 0.6274000 53.32000 0.4984000 -0.1195000     0.8012000 
1 1 1 8  9  23 o 102.1000 0.9069000 101.5000 1.395000  102.6000 1.160000  -1.097000      1.814000  
1 1 1 8  9  25 f 41.80000 0.3411000 41.83000 0.5339000 41.78000 0.4246000 0.5339000E-01  0.6822000 
1 1 1 8  9  27 o 49.90000 0.4336000 49.66000 0.6051000 50.14000 0.6212000 -0.4774000     0.8672000 
1 1 1 8  9  29 o 6.677000 0.6912000 7.640000 0.9804000 5.714000 0.9746000 1.926000       1.382000  
1 1 1 8  9  31 o 45.71000 0.3670000 45.30000 0.5710000 46.13000 0.4611000 -0.8240000     0.7339000 
1 1 1 8  9  33 o 18.12000 0.3421000 18.39000 0.5013000 17.84000 0.4657000 0.5479000      0.6843000 
1 1 1 8  9  35 o 15.76000 0.3577000 15.94000 0.5623000 15.58000 0.4423000 0.3598000      0.7154000 
1 1 1 8  9  37 o 10.25000 0.4962000 9.999000 0.7800000 10.50000 0.6137000 -0.5000000     0.9925000 
1 1 1 8  9  39 o 14.68000 0.4679000 14.10000 0.8052000 15.27000 0.4770000 -1.166000      0.9359000 
1 1 1 8  9  41 o 38.03000 0.3913000 38.41000 0.5452000 37.65000 0.5613000 0.7605000      0.7825000 
1 1 1 8  9  43 o 18.63000 0.3853000 18.04000 0.5995000 19.22000 0.4843000 -1.183000      0.7707000 
1 1 1 8  9  45 o 21.67000 0.4466000 21.31000 0.5772000 22.03000 0.6817000 -0.7187000     0.8932000 
1 1 1 8  9  47 o 28.25000 0.4049000 28.20000 0.6485000 28.30000 0.4850000 -0.9900000E-01 0.8098000 
1 1 1 8  9  49 f 25.42000 0.3991000 25.15000 0.6782000 25.69000 0.4211000 -0.5360000     0.7982000 
1 1 1 8  9  51 o 14.63000 0.4320000 14.48000 0.6859000 14.79000 0.5253000 -0.3086000     0.8639000 
1 1 1 8  9  53 o 9.186000 0.6628000 9.863000 0.8913000 8.510000 0.9812000 1.353000       1.326000  
1 1 1 8  9  55 o 14.50000 0.4126000 14.48000 0.6643000 14.51000 0.4895000 -0.2953000E-01 0.8252000 
1 1 1 8  9  57 f 7.373000 0.7696000 7.005000 1.269000  7.741000 0.8708000 -0.7358000     1.539000  
1 1 1 8  9  59 o 7.443000 0.8845000 8.221000 1.420000  6.665000 1.055000  1.555000       1.769000  
1 1 1 8  9  61 o 7.462000 0.9591000 7.644000 1.584000  7.279000 1.082000  0.3651000      1.918000  
1 1 1 8  9  63 o 8.148000 0.8327000 8.405000 1.158000  7.891000 1.197000  0.5144000      1.665000  
1 1 1 8  9  65 o 3.760000 1.069000  3.782000 1.594000  3.737000 1.425000  0.4449000E-01  2.138000  
1 1 1 8  10 0  o 54.32000 0.6143000 54.32000 0.6143000 54.32000 0.6143000 0.000000       0.000000  
1 1 1 8  10 2  o 14.10000 0.1768000 14.11000 0.2492000 14.09000 0.2509000 0.1673000E-01  0.3536000 
1 1 1 8  10 4  o 17.91000 0.2410000 18.04000 0.3418000 17.77000 0.3397000 0.2732000      0.4819000 
1 1 1 8  10 6  o 26.36000 0.2762000 26.91000 0.4289000 25.80000 0.3481000 1.105000       0.5524000 
1 1 1 8  10 8  o 38.41000 0.3372000 38.70000 0.3523000 38.11000 0.5751000 0.5945000      0.6744000 
1 1 1 8  10 10 o 35.71000 0.2765000 35.86000 0.3330000 35.55000 0.4416000 0.3148000      0.5530000 
1 1 1 8  10 12 o 59.08000 0.4489000 58.87000 0.5813000 59.28000 0.6841000 -0.4100000     0.8977000 
1 1 1 8  10 14 o 107.7000 0.7372000 109.0000 1.055000  106.3000 1.030000  2.655000       1.474000  
1 1 1 8  10 16 o 77.56000 0.5382000 77.38000 0.7586000 77.74000 0.7635000 -0.3561000     1.076000  
1 1 1 8  10 18 o 94.23000 0.7022000 94.36000 0.9189000 94.11000 1.062000  0.2459000      1.404000  
1 1 1 8  10 20 o 49.98000 0.3676000 49.84000 0.5165000 50.13000 0.5233000 -0.2980000     0.7352000 
1 1 1 8  10 22 o 74.94000 0.8618000 75.46000 1.495000  74.41000 0.8582000 1.050000       1.724000  
1 1 1 8  10 24 o 65.87000 0.4835000 65.67000 0.7590000 66.07000 0.5990000 -0.3951000     0.9669000 
1 1 1 8  10 26 o 58.34000 0.5470000 58.48000 0.8424000 58.21000 0.6980000 0.2655000      1.094000  
1 1 1 8  10 28 o 11.46000 0.4200000 11.07000 0.6674000 11.85000 0.5101000 -0.7746000     0.8400000 
1 1 1 8  10 30 o 57.60000 0.4373000 58.21000 0.6908000 56.99000 0.5365000 1.221000       0.8746000 
1 1 1 8  10 32 o 17.55000 0.3262000 17.49000 0.5003000 17.60000 0.4186000 -0.1112000     0.6523000 
1 1 1 8  10 34 o 34.21000 0.3204000 34.20000 0.5021000 34.22000 0.3981000 -0.2002000E-01 0.6408000 
1 1 1 8  10 36 o 43.04000 0.4281000 42.84000 0.6932000 43.23000 0.5026000 -0.3971000     0.8562000 
1 1 1 8  10 38 o 21.56000 0.3690000 22.23000 0.6116000 20.89000 0.4129000 1.346000       0.7379000 
1 1 1 8  10 40 o 24.21000 0.3945000 24.38000 0.6489000 24.03000 0.4487000 0.3464000      0.7889000 
1 1 1 8  10 42 o 39.45000 0.3571000 39.64000 0.5556000 39.27000 0.4488000 0.3662000      0.7142000 
1 1 1 8  10 44 o 31.41000 0.3574000 31.19000 0.5391000 31.63000 0.4695000 -0.4323000     0.7148000 
1 1 1 8  10 46 o 10.07000 0.6515000 9.924000 0.9952000 10.21000 0.8411000 -0.2873000     1.303000  
1 1 1 8  10 48 o 27.08000 0.3650000 27.38000 0.5468000 26.79000 0.4836000 0.5985000      0.7300000 
1 1 1 8  10 50 f 20.18000 0.5333000 20.70000 0.9347000 19.67000 0.5137000 1.030000       1.067000  
1 1 1 8  10 52 o 5.758000 0.9159000 6.738000 1.343000  4.777000 1.246000  1.962000       1.832000  
1 1 1 8  10 54 o 8.226000 0.6762000 7.657000 1.106000  8.794000 0.7786000 -1.137000      1.352000  
1 1 1 8  10 56 o 5.369000 0.9785000 6.378000 1.450000  4.360000 1.314000  2.019000       1.957000  
1 1 1 8  10 58 o 4.199000 0.9818000 3.463000 1.414000  4.936000 1.362000  -1.473000      1.964000  
1 1 1 8  10 60 o 6.126000 1.224000  7.942000 2.055000  4.309000 1.329000  3.633000       2.447000  
1 1 1 8  10 62 o 4.272000 1.049000  5.183000 1.617000  3.360000 1.335000  1.823000       2.097000  
1 1 1 8  10 64 o 3.862000 1.034000  3.901000 1.592000  3.824000 1.319000  0.7743000E-01  2.068000  
1 1 1 8  10 66 o 7.630000 0.8461000 8.947000 1.205000  6.312000 1.188000  2.636000       1.692000  
1 1 1 8  11 1  o 32.31000 0.2552000 32.49000 0.3382000 32.14000 0.3822000 0.3580000      0.5103000 
1 1 1 8  11 3  o 28.37000 0.2593000 28.54000 0.3672000 28.19000 0.3662000 0.3596000      0.5186000 
1 1 1 8  11 5  o 51.32000 0.4201000 51.38000 0.5940000 51.26000 0.5943000 0.1203000      0.8403000 
1 1 1 8  11 7  o 42.10000 0.3996000 42.15000 0.5028000 42.05000 0.6213000 0.9649000E-01  0.7993000 
1 1 1 8  11 9  o 60.09000 0.4343000 60.28000 0.5298000 59.91000 0.6884000 0.3639000      0.8687000 
1 1 1 8  11 11 o 53.29000 0.4080000 53.56000 0.5320000 53.01000 0.6187000 0.5556000      0.8159000 
1 1 1 8  11 13 o 33.86000 0.2608000 33.67000 0.3661000 34.05000 0.3715000 -0.3846000     0.5216000 
1 1 1 8  11 15 o 77.10000 0.5347000 77.10000 0.7550000 77.09000 0.7574000 0.8713000E-02  1.069000  
1 1 1 8  11 17 o 53.94000 0.3873000 54.43000 0.5502000 53.45000 0.5451000 0.9827000      0.7745000 
1 1 1 8  11 19 o 120.9000 0.8950000 120.5000 1.165000  121.3000 1.359000  -0.8812000     1.790000  
1 1 1 8  11 21 o 66.63000 0.5092000 66.29000 0.6621000 66.96000 0.7738000 -0.6763000     1.018000  
1 1 1 8  11 23 o 67.77000 0.5693000 67.61000 0.9589000 67.92000 0.6140000 -0.3073000     1.139000  
1 1 1 8  11 25 o 26.31000 0.3333000 26.07000 0.5301000 26.55000 0.4041000 -0.4761000     0.6665000 
1 1 1 8  11 27 o 16.49000 0.3345000 17.01000 0.5218000 15.98000 0.4185000 1.025000       0.6689000 
1 1 1 8  11 29 o 35.74000 0.3761000 36.10000 0.6047000 35.38000 0.4474000 0.7175000      0.7522000 
1 1 1 8  11 31 o 48.69000 0.3852000 48.87000 0.6036000 48.51000 0.4788000 0.3637000      0.7704000 
1 1 1 8  11 33 o 14.36000 0.3890000 14.42000 0.5814000 14.30000 0.5171000 0.1226000      0.7780000 
1 1 1 8  11 35 f 27.65000 0.3183000 27.93000 0.4731000 27.37000 0.4258000 0.5557000      0.6365000 
1 1 1 8  11 37 o 30.30000 0.4983000 31.37000 0.8617000 29.24000 0.5007000 2.139000       0.9966000 
1 1 1 8  11 39 o 40.18000 0.3997000 39.97000 0.6647000 40.39000 0.4440000 -0.4114000     0.7994000 
1 1 1 8  11 41 o 24.29000 0.3749000 24.11000 0.5215000 24.47000 0.5387000 -0.3636000     0.7497000 
1 1 1 8  11 43 o 28.19000 0.3910000 28.52000 0.6360000 27.85000 0.4549000 0.6784000      0.7820000 
1 1 1 8  11 45 o 22.32000 0.3679000 22.10000 0.5794000 22.53000 0.4534000 -0.4355000     0.7358000 
1 1 1 8  11 47 o 16.39000 0.4160000 16.88000 0.6484000 15.90000 0.5214000 0.9802000      0.8321000 
1 1 1 8  11 49 o 7.580000 1.021000  6.532000 1.732000  8.628000 1.081000  -2.096000      2.042000  
1 1 1 8  11 51 o 11.51000 0.5234000 11.70000 0.8589000 11.32000 0.5983000 0.3836000      1.047000  
1 1 1 8  11 53 o 5.084000 0.8921000 3.527000 1.443000  6.641000 1.050000  -3.113000      1.784000  
1 1 1 8  11 55 o 9.571000 0.5847000 9.634000 0.9618000 9.507000 0.6653000 0.1273000      1.169000  
1 1 1 8  11 57 o 4.425000 0.9824000 5.380000 1.466000  3.469000 1.309000  1.910000       1.965000  
1 1 1 8  11 59 o 7.788000 0.7252000 8.380000 1.132000  7.196000 0.9068000 1.184000       1.450000  
1 1 1 8  11 61 o 3.818000 1.058000  4.169000 1.639000  3.467000 1.338000  0.7019000      2.116000  
1 1 1 8  11 63 o 3.734000 1.046000  4.379000 1.607000  3.090000 1.340000  1.289000       2.093000  
1 1 1 8  11 65 f 5.156000 1.043000  5.634000 1.672000  4.678000 1.247000  0.9552000      2.086000  
1 1 1 8  12 0  o 28.42000 0.4703000 28.42000 0.4703000 28.42000 0.4703000 0.000000       0.000000  
1 1 1 8  12 2  o 14.76000 0.1774000 14.66000 0.2344000 14.85000 0.2663000 -0.1880000     0.3548000 
1 1 1 8  12 4  o 55.95000 0.4553000 57.07000 0.6550000 54.82000 0.6325000 2.243000       0.9106000 
1 1 1 8  12 6  o 87.03000 0.6914000 86.90000 0.9761000 87.15000 0.9795000 -0.2450000     1.383000  
1 1 1 8  12 8  o 41.51000 0.3972000 41.54000 0.4987000 41.49000 0.6184000 0.4388000E-01  0.7944000 
1 1 1 8  12 10 o 35.03000 0.2753000 34.97000 0.3272000 35.10000 0.4428000 -0.1299000     0.5506000 
1 1 1 8  12 12 o 11.75000 0.1979000 11.67000 0.2850000 11.84000 0.2746000 -0.1721000     0.3958000 
1 1 1 8  12 14 o 96.00000 0.6600000 95.21000 0.9251000 96.79000 0.9416000 -1.573000      1.320000  
1 1 1 8  12 16 o 72.98000 0.5088000 72.68000 0.7160000 73.27000 0.7231000 -0.5836000     1.018000  
1 1 1 8  12 18 o 86.66000 0.6001000 86.98000 0.8504000 86.35000 0.8470000 0.6343000      1.200000  
1 1 1 8  12 20 o 46.94000 0.4318000 47.56000 0.5005000 46.32000 0.7037000 1.245000       0.8635000 
1 1 1 8  12 22 o 98.27000 0.8261000 96.93000 1.333000  99.62000 0.9764000 -2.692000      1.652000  
1 1 1 8  12 24 o 41.30000 0.3939000 40.82000 0.6336000 41.77000 0.4681000 -0.9497000     0.7877000 
1 1 1 8  12 26 o 48.85000 0.3978000 47.77000 0.5828000 49.93000 0.5415000 -2.164000      0.7956000 
1 1 1 8  12 28 o 41.91000 0.3442000 42.10000 0.5391000 41.72000 0.4282000 0.3782000      0.6885000 
1 1 1 8  12 30 o 44.69000 0.3601000 44.71000 0.5612000 44.68000 0.4513000 0.3339000E-01  0.7201000 
1 1 1 8  12 32 o 41.89000 0.3458000 41.32000 0.5365000 42.45000 0.4363000 -1.128000      0.6915000 
1 1 1 8  12 34 o 18.01000 0.3494000 18.12000 0.5286000 17.89000 0.4570000 0.2357000      0.6988000 
1 1 1 8  12 36 o 13.98000 0.4026000 13.65000 0.6154000 14.30000 0.5193000 -0.6479000     0.8052000 
1 1 1 8  12 38 o 37.32000 0.4989000 37.75000 0.9030000 36.88000 0.4246000 0.8695000      0.9978000 
1 1 1 8  12 40 o 38.24000 0.3610000 37.95000 0.5378000 38.52000 0.4818000 -0.5730000     0.7221000 
1 1 1 8  12 42 o 33.42000 0.3375000 33.12000 0.5311000 33.72000 0.4165000 -0.6081000     0.6749000 
1 1 1 8  12 44 o 17.09000 0.4030000 17.79000 0.6106000 16.39000 0.5260000 1.406000       0.8059000 
1 1 1 8  12 46 o 5.044000 1.053000  4.200000 1.630000  5.889000 1.334000  -1.689000      2.106000  
1 1 1 8  12 48 o 15.08000 0.4336000 14.66000 0.6889000 15.50000 0.5266000 -0.8352000     0.8671000 
1 1 1 8  12 50 o 6.540000 1.135000  7.288000 2.039000  5.792000 0.9979000 1.497000       2.270000  
1 1 1 8  12 52 f 7.468000 0.7536000 7.704000 1.072000  7.232000 1.060000  0.4714000      1.507000  
1 1 1 8  12 54 o 8.444000 0.6534000 8.803000 0.9943000 8.086000 0.8480000 0.7166000      1.307000  
1 1 1 8  12 56 o 6.211000 0.8501000 7.014000 1.201000  5.407000 1.203000  1.607000       1.700000  
1 1 1 8  12 58 o 4.119000 1.088000  4.014000 1.554000  4.224000 1.522000  -0.2095000     2.175000  
1 1 1 8  12 60 o 7.159000 0.8496000 5.302000 1.489000  9.015000 0.8181000 -3.713000      1.699000  
1 1 1 8  12 62 o 8.191000 0.8138000 9.878000 1.013000  6.504000 1.274000  3.374000       1.628000  
1 1 1 8  12 64 o 9.939000 0.6379000 10.32000 1.017000  9.561000 0.7700000 0.7566000      1.276000  
1 1 1 8  12 66 o 5.750000 1.172000  6.027000 1.622000  5.473000 1.692000  0.5539000      2.345000  
1 1 1 8  13 1  o 29.87000 0.2292000 30.11000 0.3251000 29.62000 0.3232000 0.4941000      0.4585000 
1 1 1 8  13 3  o 61.72000 0.5605000 62.39000 0.8783000 61.06000 0.6966000 1.328000       1.121000  
1 1 1 8  13 5  o 125.7000 0.9899000 125.0000 1.393000  126.3000 1.407000  -1.280000      1.980000  
1 1 1 8  13 7  o 84.31000 0.7508000 85.20000 0.9593000 83.42000 1.155000  1.786000       1.502000  
1 1 1 8  13 9  o 15.76000 0.2626000 15.70000 0.3994000 15.82000 0.3411000 -0.1173000     0.5252000 
1 1 1 8  13 11 o 54.57000 0.4173000 54.25000 0.6277000 54.90000 0.5500000 -0.6444000     0.8346000 
1 1 1 8  13 13 o 45.18000 0.3301000 45.62000 0.4695000 44.74000 0.4641000 0.8751000      0.6602000 
1 1 1 8  13 15 o 81.92000 0.5672000 81.87000 0.8010000 81.96000 0.8032000 -0.8556000E-01 1.134000  
1 1 1 8  13 17 o 100.8000 0.6932000 101.0000 0.9814000 100.6000 0.9794000 0.3859000      1.386000  
1 1 1 8  13 19 o 95.31000 0.8046000 95.90000 0.9346000 94.71000 1.310000  1.189000       1.609000  
1 1 1 8  13 21 o 50.91000 0.4344000 50.19000 0.6057000 51.63000 0.6229000 -1.443000      0.8689000 
1 1 1 8  13 23 o 80.01000 0.6854000 79.95000 1.117000  80.07000 0.7942000 -0.1276000     1.371000  
1 1 1 8  13 25 o 62.15000 0.5444000 61.60000 0.8772000 62.71000 0.6449000 -1.110000      1.089000  
1 1 1 8  13 27 o 48.00000 0.3768000 48.04000 0.5897000 47.95000 0.4692000 0.8847000E-01  0.7536000 
1 1 1 8  13 29 o 15.12000 0.4235000 14.87000 0.7372000 15.36000 0.4171000 -0.4927000     0.8470000 
1 1 1 8  13 31 o 35.55000 0.3170000 35.58000 0.4920000 35.52000 0.3998000 0.5838000E-01  0.6340000 
1 1 1 8  13 33 o 15.97000 0.3557000 15.37000 0.5613000 16.57000 0.4371000 -1.200000      0.7115000 
1 1 1 8  13 35 o 9.746000 0.5920000 10.35000 0.7860000 9.141000 0.8855000 1.210000       1.184000  
1 1 1 8  13 37 o 21.86000 0.5079000 22.16000 0.9316000 21.57000 0.4051000 0.5854000      1.016000  
1 1 1 8  13 39 o 29.85000 0.4057000 29.79000 0.6142000 29.91000 0.5302000 -0.1130000     0.8114000 
1 1 1 8  13 41 o 17.82000 0.4029000 17.05000 0.6259000 18.59000 0.5076000 -1.542000      0.8059000 
1 1 1 8  13 43 o 16.31000 0.4094000 16.08000 0.6614000 16.53000 0.4828000 -0.4585000     0.8188000 
1 1 1 8  13 45 o 16.29000 0.4264000 15.95000 0.6882000 16.63000 0.5037000 -0.6847000     0.8528000 
1 1 1 8  13 47 o 5.155000 1.076000  5.876000 1.514000  4.435000 1.529000  1.441000       2.152000  
1 1 1 8  13 49 o 18.93000 0.5617000 19.46000 1.024000  18.40000 0.4631000 1.061000       1.123000  
1 1 1 8  13 51 o 8.434000 0.6984000 8.262000 1.085000  8.607000 0.8801000 -0.3450000     1.397000  
1 1 1 8  13 53 o 9.492000 0.6533000 10.25000 0.8826000 8.730000 0.9633000 1.524000       1.307000  
1 1 1 8  13 55 o 3.915000 1.000000  4.334000 1.491000  3.497000 1.334000  0.8373000      2.001000  
1 1 1 8  13 57 o 8.009000 0.7199000 8.427000 1.131000  7.590000 0.8916000 0.8375000      1.440000  
1 1 1 8  13 59 o 10.41000 0.7371000 11.31000 1.179000  9.517000 0.8850000 1.789000       1.474000  
1 1 1 8  13 61 o 5.304000 1.112000  5.793000 1.682000  4.814000 1.454000  0.9787000      2.223000  
1 1 1 8  13 63 o 4.829000 1.078000  4.624000 1.626000  5.034000 1.416000  -0.4102000     2.156000  
1 1 1 8  13 65 o 3.737000 1.047000  3.875000 1.649000  3.600000 1.289000  0.2755000      2.093000  
1 1 1 8  14 0  o 21.16000 0.2605000 21.16000 0.2605000 21.16000 0.2605000 0.000000       0.000000  
1 1 1 8  14 2  o 58.40000 0.4212000 57.71000 0.6625000 59.09000 0.5201000 -1.381000      0.8423000 
1 1 1 8  14 4  o 60.94000 0.5565000 61.52000 0.8703000 60.37000 0.6939000 1.154000       1.113000  
1 1 1 8  14 6  o 60.14000 0.5495000 60.02000 0.6898000 60.26000 0.8556000 -0.2360000     1.099000  
1 1 1 8  14 8  o 78.45000 0.6286000 77.93000 0.8827000 78.98000 0.8951000 -1.054000      1.257000  
1 1 1 8  14 10 o 70.41000 0.5677000 70.27000 0.7995000 70.54000 0.8062000 -0.2656000     1.135000  
1 1 1 8  14 12 o 56.44000 0.4002000 56.03000 0.5613000 56.86000 0.5706000 -0.8303000     0.8004000 
1 1 1 8  14 14 o 82.93000 0.6215000 83.77000 0.9469000 82.08000 0.8054000 1.689000       1.243000  
1 1 1 8  14 16 o 41.68000 0.3146000 41.28000 0.4396000 42.09000 0.4501000 -0.8070000     0.6291000 
1 1 1 8  14 18 o 67.69000 0.5140000 67.92000 0.6756000 67.46000 0.7749000 0.4634000      1.028000  
1 1 1 8  14 20 o 60.22000 0.5013000 60.00000 0.7014000 60.43000 0.7164000 -0.4205000     1.003000  
1 1 1 8  14 22 f 63.38000 0.4891000 63.27000 0.7342000 63.50000 0.6463000 -0.2277000     0.9781000 
1 1 1 8  14 24 o 22.69000 0.4381000 22.42000 0.7704000 22.96000 0.4174000 -0.5327000     0.8762000 
1 1 1 8  14 26 o 22.11000 0.3106000 22.08000 0.4603000 22.14000 0.4173000 -0.6748000E-01 0.6213000 
1 1 1 8  14 28 o 26.93000 0.3082000 26.69000 0.4473000 27.17000 0.4241000 -0.4828000     0.6163000 
1 1 1 8  14 30 o 14.62000 0.3580000 14.56000 0.5602000 14.67000 0.4458000 -0.1177000     0.7159000 
1 1 1 8  14 32 o 46.33000 0.3710000 46.29000 0.5786000 46.37000 0.4646000 -0.8047000E-01 0.7420000 
1 1 1 8  14 34 o 30.88000 0.3709000 29.92000 0.5896000 31.83000 0.4503000 -1.909000      0.7419000 
1 1 1 8  14 36 o 13.67000 0.4376000 13.63000 0.6727000 13.71000 0.5599000 -0.8434000E-01 0.8752000 
1 1 1 8  14 38 o 11.75000 0.7421000 11.24000 1.331000  12.26000 0.6567000 -1.017000      1.484000  
1 1 1 8  14 40 o 40.65000 0.3749000 40.67000 0.5624000 40.64000 0.4960000 0.2903000E-01  0.7499000 
1 1 1 8  14 42 o 24.86000 0.3381000 25.01000 0.5303000 24.72000 0.4196000 0.2855000      0.6762000 
1 1 1 8  14 44 o 22.79000 0.3531000 22.49000 0.5635000 23.09000 0.4256000 -0.6007000     0.7062000 
1 1 1 8  14 46 o 24.60000 0.3462000 24.06000 0.5459000 25.13000 0.4260000 -1.065000      0.6925000 
1 1 1 8  14 48 o 27.37000 0.3538000 27.17000 0.5362000 27.57000 0.4618000 -0.3975000     0.7077000 
1 1 1 8  14 50 o 3.206000 0.9998000 3.491000 1.584000  2.921000 1.221000  0.5694000      2.000000  
1 1 1 8  14 52 o 9.717000 0.5914000 10.05000 0.9538000 9.385000 0.6996000 0.6644000      1.183000  
1 1 1 8  14 54 o 3.323000 0.9741000 2.863000 1.293000  3.783000 1.457000  -0.9202000     1.948000  
1 1 1 8  14 56 f 3.514000 0.9635000 3.220000 1.398000  3.809000 1.326000  -0.5889000     1.927000  
1 1 1 8  14 58 o 9.523000 0.6489000 9.442000 1.041000  9.605000 0.7754000 -0.1630000     1.298000  
1 1 1 8  14 60 f 4.195000 0.9890000 3.816000 1.483000  4.573000 1.309000  -0.7570000     1.978000  
1 1 1 8  14 62 o 4.129000 1.052000  4.225000 1.622000  4.033000 1.341000  0.1923000      2.105000  
1 1 1 8  14 64 o 4.624000 1.077000  4.035000 1.705000  5.213000 1.317000  -1.179000      2.154000  
1 1 1 8  15 1  o 87.25000 0.6472000 87.42000 0.9818000 87.08000 0.8435000 0.3397000      1.294000  
1 1 1 8  15 3  o 75.38000 0.5386000 75.48000 0.8534000 75.28000 0.6571000 0.2025000      1.077000  
1 1 1 8  15 5  o 127.3000 1.005000  127.5000 1.424000  127.1000 1.417000  0.4814000      2.009000  
1 1 1 8  15 7  o 23.22000 0.3998000 23.83000 0.6554000 22.61000 0.4582000 1.225000       0.7997000 
1 1 1 8  15 9  o 119.6000 0.9451000 118.0000 1.318000  121.2000 1.355000  -3.191000      1.890000  
1 1 1 8  15 11 o 10.45000 0.2150000 10.74000 0.3064000 10.17000 0.3018000 0.5636000      0.4301000 
1 1 1 8  15 13 f 104.1000 0.7143000 102.7000 0.9972000 105.4000 1.023000  -2.734000      1.429000  
1 1 1 8  15 15 o 89.16000 0.6165000 88.37000 0.8638000 89.94000 0.8799000 -1.569000      1.233000  
1 1 1 8  15 17 o 16.32000 0.2628000 16.68000 0.3573000 15.96000 0.3854000 0.7173000      0.5255000 
1 1 1 8  15 19 o 108.1000 0.7430000 107.6000 1.045000  108.5000 1.056000  -0.9109000     1.486000  
1 1 1 8  15 21 o 74.83000 0.6073000 75.01000 0.8595000 74.66000 0.8583000 0.3484000      1.215000  
1 1 1 8  15 23 o 97.64000 0.7318000 98.26000 1.112000  97.02000 0.9512000 1.244000       1.464000  
1 1 1 8  15 25 o 32.20000 0.3107000 31.15000 0.4513000 33.25000 0.4273000 -2.097000      0.6215000 
1 1 1 8  15 27 o 17.72000 0.3139000 18.45000 0.4796000 16.98000 0.4052000 1.464000       0.6278000 
1 1 1 8  15 29 o 8.483000 0.5611000 8.419000 0.8865000 8.546000 0.6879000 -0.1266000     1.122000  
1 1 1 8  15 31 o 19.26000 0.3045000 19.59000 0.4717000 18.92000 0.3851000 0.6770000      0.6090000 
1 1 1 8  15 33 f 28.16000 0.3046000 28.50000 0.4812000 27.82000 0.3737000 0.6810000      0.6093000 
1 1 1 8  15 35 o 37.78000 0.3960000 38.45000 0.6388000 37.11000 0.4682000 1.344000       0.7920000 
1 1 1 8  15 37 o 32.46000 0.4502000 ?        ?         32.46000 0.4502000 ?              ?         
1 1 1 8  15 39 o 19.17000 0.3716000 18.66000 0.6046000 19.68000 0.4323000 -1.016000      0.7433000 
1 1 1 8  15 41 o 13.07000 0.4857000 13.45000 0.7595000 12.69000 0.6055000 0.7638000      0.9714000 
1 1 1 8  15 43 o 29.60000 0.3900000 29.34000 0.6608000 29.85000 0.4144000 -0.5005000     0.7800000 
1 1 1 8  15 45 o 12.53000 0.5232000 12.63000 0.8262000 12.42000 0.6421000 0.2108000      1.046000  
1 1 1 8  15 47 o 2.443000 0.8333000 2.728000 1.286000  2.158000 1.060000  0.5701000      1.667000  
1 1 1 8  15 49 o 14.56000 0.5127000 14.72000 0.8935000 14.40000 0.5033000 0.3186000      1.025000  
1 1 1 8  15 51 f 19.40000 0.3580000 19.14000 0.5644000 19.67000 0.4407000 -0.5299000     0.7161000 
1 1 1 8  15 53 o 15.42000 0.4360000 15.24000 0.6661000 15.60000 0.5628000 -0.3584000     0.8721000 
1 1 1 8  15 55 o 8.505000 0.6486000 8.313000 1.067000  8.697000 0.7376000 -0.3842000     1.297000  
1 1 1 8  15 57 o 7.687000 0.7981000 7.560000 1.275000  7.813000 0.9600000 -0.2533000     1.596000  
1 1 1 8  15 59 o 6.462000 1.018000  6.957000 1.730000  5.966000 1.074000  0.9905000      2.036000  
1 1 1 8  15 61 o 9.758000 0.8531000 10.44000 1.508000  9.078000 0.7978000 1.359000       1.706000  
1 1 1 8  15 63 o 4.241000 1.142000  4.462000 1.786000  4.020000 1.424000  0.4424000      2.284000  
1 1 1 8  15 65 o 8.048000 0.7557000 9.318000 1.160000  6.779000 0.9689000 2.539000       1.511000  
1 1 1 8  16 0  o 99.91000 0.9674000 99.91000 0.9674000 99.91000 0.9674000 0.000000       0.000000  
1 1 1 8  16 2  o 81.80000 0.6098000 81.25000 0.9185000 82.35000 0.8025000 -1.099000      1.220000  
1 1 1 8  16 4  o 49.30000 0.3655000 49.76000 0.5844000 48.83000 0.4392000 0.9327000      0.7311000 
1 1 1 8  16 6  o 80.36000 0.7218000 79.61000 0.9004000 81.12000 1.128000  -1.508000      1.444000  
1 1 1 8  16 8  o 89.44000 0.7138000 90.61000 1.022000  88.27000 0.9971000 2.342000       1.428000  
1 1 1 8  16 10 o 47.46000 0.4522000 46.94000 0.5564000 47.98000 0.7131000 -1.043000      0.9044000 
1 1 1 8  16 12 o 46.70000 0.3697000 47.60000 0.5660000 45.80000 0.4759000 1.802000       0.7395000 
1 1 1 8  16 14 o 104.3000 0.7169000 103.5000 1.005000  105.1000 1.023000  -1.677000      1.434000  
1 1 1 8  16 16 o 52.76000 0.4132000 52.77000 0.5406000 52.74000 0.6250000 0.2965000E-01  0.8264000 
1 1 1 8  16 18 o 122.3000 0.9076000 123.5000 1.381000  121.2000 1.177000  2.295000       1.815000  
1 1 1 8  16 20 o 22.38000 0.4628000 22.50000 0.4262000 22.26000 0.8216000 0.2439000      0.9256000 
1 1 1 8  16 22 o 58.42000 0.4244000 58.45000 0.5984000 58.39000 0.6020000 0.5993000E-01  0.8488000 
1 1 1 8  16 24 o 46.51000 0.5710000 47.69000 1.027000  45.32000 0.4998000 2.361000       1.142000  
1 1 1 8  16 26 o 31.26000 0.2983000 31.20000 0.4629000 31.31000 0.3764000 -0.1025000     0.5966000 
1 1 1 8  16 28 o 42.84000 0.3493000 43.42000 0.5497000 42.27000 0.4312000 1.149000       0.6987000 
1 1 1 8  16 30 o 9.289000 0.5192000 8.874000 0.8487000 9.704000 0.5981000 -0.8304000     1.038000  
1 1 1 8  16 32 o 20.16000 0.3613000 19.93000 0.5760000 20.39000 0.4363000 -0.4566000     0.7226000 
1 1 1 8  16 34 o 27.57000 0.3976000 27.41000 0.4798000 27.73000 0.6341000 -0.3174000     0.7952000 
1 1 1 8  16 36 o 13.62000 0.4388000 12.97000 0.7190000 14.28000 0.5031000 -1.312000      0.8775000 
1 1 1 8  16 38 o 69.99000 0.5967000 69.63000 1.003000  70.34000 0.6464000 -0.7101000     1.193000  
1 1 1 8  16 40 o 42.56000 0.3866000 42.24000 0.5757000 42.87000 0.5161000 -0.6290000     0.7732000 
1 1 1 8  16 42 o 3.730000 1.047000  3.638000 1.557000  3.822000 1.401000  -0.1837000     2.095000  
1 1 1 8  16 44 o 37.19000 0.3522000 37.17000 0.5506000 37.20000 0.4393000 -0.3111000E-01 0.7043000 
1 1 1 8  16 46 o 30.50000 0.3573000 30.52000 0.5394000 30.49000 0.4687000 0.2913000E-01  0.7146000 
1 1 1 8  16 48 o 15.34000 0.4152000 14.73000 0.6751000 15.96000 0.4834000 -1.230000      0.8303000 
1 1 1 8  16 50 o 16.62000 0.5753000 17.03000 1.037000  16.22000 0.4985000 0.8121000      1.151000  
1 1 1 8  16 52 o 15.02000 0.4139000 15.26000 0.6515000 14.78000 0.5107000 0.4805000      0.8278000 
1 1 1 8  16 54 o 18.03000 0.3655000 18.16000 0.5685000 17.89000 0.4596000 0.2763000      0.7311000 
1 1 1 8  16 56 o 4.060000 0.9836000 5.232000 1.562000  2.888000 1.196000  2.343000       1.967000  
1 1 1 8  16 58 o 6.479000 0.9927000 5.790000 1.535000  7.168000 1.260000  -1.379000      1.985000  
1 1 1 8  16 60 o 6.689000 0.8670000 7.006000 1.284000  6.373000 1.165000  0.6326000      1.734000  
1 1 1 8  16 62 f 8.076000 0.8306000 7.471000 1.395000  8.682000 0.9025000 -1.210000      1.661000  
1 1 1 8  16 64 o 8.335000 0.7732000 8.326000 1.361000  8.343000 0.7350000 -0.1624000E-01 1.546000  
1 1 1 8  17 1  o 58.33000 0.4104000 58.02000 0.5776000 58.64000 0.5832000 -0.6204000     0.8208000 
1 1 1 8  17 3  o 35.08000 0.2653000 34.78000 0.3765000 35.39000 0.3740000 -0.6086000     0.5307000 
1 1 1 8  17 5  o 102.2000 0.7582000 102.0000 1.144000  102.5000 0.9957000 -0.5021000     1.516000  
1 1 1 8  17 7  o 31.39000 0.3015000 31.30000 0.4220000 31.49000 0.4307000 -0.1907000     0.6030000 
1 1 1 8  17 9  o 42.78000 0.4190000 42.53000 0.6472000 43.02000 0.5322000 -0.4916000     0.8380000 
1 1 1 8  17 11 o 85.30000 0.6398000 84.92000 0.8313000 85.68000 0.9727000 -0.7633000     1.280000  
1 1 1 8  17 13 o 111.7000 0.8857000 111.2000 1.247000  112.3000 1.258000  -1.114000      1.771000  
1 1 1 8  17 15 o 108.7000 0.8077000 107.4000 1.044000  109.9000 1.233000  -2.449000      1.615000  
1 1 1 8  17 17 o 22.19000 0.2928000 22.41000 0.3469000 21.97000 0.4718000 0.4304000      0.5856000 
1 1 1 8  17 19 o 27.50000 0.3692000 27.73000 0.5772000 27.28000 0.4604000 0.4438000      0.7383000 
1 1 1 8  17 21 o 22.48000 0.3663000 22.18000 0.4417000 22.77000 0.5844000 -0.5825000     0.7325000 
1 1 1 8  17 23 o 47.48000 0.3891000 46.68000 0.5775000 48.28000 0.5215000 -1.608000      0.7781000 
1 1 1 8  17 25 o 25.95000 0.2856000 26.43000 0.4413000 25.46000 0.3627000 0.9700000      0.5712000 
1 1 1 8  17 27 o 95.06000 0.6807000 94.76000 1.070000  95.36000 0.8417000 -0.5977000     1.361000  
1 1 1 8  17 29 o 23.42000 0.3122000 22.99000 0.4641000 23.85000 0.4178000 -0.8673000     0.6244000 
1 1 1 8  17 31 o 12.31000 0.4448000 12.80000 0.7199000 11.82000 0.5228000 0.9819000      0.8897000 
1 1 1 8  17 33 o 26.36000 0.3223000 26.56000 0.4807000 26.16000 0.4294000 0.3995000      0.6446000 
1 1 1 8  17 35 o 30.85000 0.3355000 30.45000 0.4951000 31.24000 0.4529000 -0.7862000     0.6710000 
1 1 1 8  17 37 o 26.76000 0.4713000 26.00000 0.8548000 27.52000 0.3972000 -1.516000      0.9426000 
1 1 1 8  17 39 o 40.66000 0.3613000 40.85000 0.5674000 40.47000 0.4474000 0.3789000      0.7226000 
1 1 1 8  17 41 o 21.91000 0.3591000 21.71000 0.5817000 22.11000 0.4212000 -0.3928000     0.7182000 
1 1 1 8  17 43 o 22.35000 0.3543000 22.66000 0.5601000 22.05000 0.4341000 0.6103000      0.7086000 
1 1 1 8  17 45 o 33.31000 0.3449000 33.70000 0.5416000 32.91000 0.4270000 0.7951000      0.6897000 
1 1 1 8  17 47 o 12.90000 0.4810000 12.60000 0.7744000 13.20000 0.5709000 -0.5941000     0.9621000 
1 1 1 8  17 49 o 6.290000 0.9493000 5.862000 1.571000  6.718000 1.067000  -0.8557000     1.899000  
1 1 1 8  17 51 o 10.07000 0.5611000 9.924000 0.9059000 10.22000 0.6622000 -0.2953000     1.122000  
1 1 1 8  17 53 o 13.97000 0.4075000 14.26000 0.6429000 13.69000 0.5008000 0.5752000      0.8149000 
1 1 1 8  17 55 o 9.456000 0.5810000 9.422000 0.9627000 9.490000 0.6508000 -0.6857000E-01 1.162000  
1 1 1 8  17 57 o 2.996000 0.9350000 2.996000 1.376000  2.995000 1.267000  0.5097000E-03  1.870000  
1 1 1 8  17 59 o 9.669000 0.7904000 10.06000 0.9468000 9.275000 1.266000  0.7885000      1.581000  
1 1 1 8  17 61 o 12.02000 0.8376000 10.95000 1.575000  13.08000 0.5715000 -2.132000      1.675000  
1 1 1 8  17 63 o 8.097000 0.8094000 8.084000 1.328000  8.111000 0.9254000 -0.2696000E-01 1.619000  
1 1 1 8  18 0  o 21.31000 0.3493000 21.31000 0.3493000 21.31000 0.3493000 0.000000       0.000000  
1 1 1 8  18 2  o 115.6000 0.7901000 115.3000 1.115000  115.8000 1.120000  -0.5738000     1.580000  
1 1 1 8  18 4  o 60.33000 0.4592000 61.17000 0.7021000 59.48000 0.5920000 1.696000       0.9184000 
1 1 1 8  18 6  o 135.7000 0.9576000 136.0000 1.515000  135.5000 1.171000  0.4352000      1.915000  
1 1 1 8  18 8  o 40.98000 0.3048000 41.37000 0.4334000 40.59000 0.4288000 0.7757000      0.6097000 
1 1 1 8  18 10 o 26.38000 0.3115000 25.61000 0.5224000 27.15000 0.3394000 -1.540000      0.6230000 
1 1 1 8  18 12 o 76.39000 0.5328000 75.77000 0.7472000 77.01000 0.7598000 -1.239000      1.066000  
1 1 1 8  18 14 o 107.9000 0.8007000 107.6000 1.045000  108.3000 1.213000  -0.6970000     1.601000  
1 1 1 8  18 16 o 32.97000 0.4191000 33.64000 0.5986000 32.31000 0.5865000 1.330000       0.8381000 
1 1 1 8  18 18 o 91.95000 0.7764000 91.86000 1.263000  92.05000 0.9028000 -0.1910000     1.553000  
1 1 1 8  18 20 o 41.17000 0.4278000 40.57000 0.5239000 41.76000 0.6765000 -1.187000      0.8557000 
1 1 1 8  18 22 o 37.38000 0.3335000 37.65000 0.5022000 37.10000 0.4391000 0.5469000      0.6671000 
1 1 1 8  18 24 o 13.20000 0.4405000 13.21000 0.6773000 13.18000 0.5634000 0.2699000E-01  0.8810000 
1 1 1 8  18 26 o 52.20000 0.4035000 52.35000 0.6317000 52.06000 0.5022000 0.2928000      0.8071000 
1 1 1 8  18 28 o 17.68000 0.3645000 17.48000 0.5875000 17.88000 0.4316000 -0.3993000     0.7290000 
1 1 1 8  18 30 o 21.15000 0.3006000 20.61000 0.4668000 21.69000 0.3789000 -1.082000      0.6012000 
1 1 1 8  18 32 o 39.97000 0.3870000 40.03000 0.5313000 39.90000 0.5628000 0.1373000      0.7739000 
1 1 1 8  18 34 o 18.47000 0.3378000 17.84000 0.5421000 19.10000 0.4030000 -1.256000      0.6755000 
1 1 1 8  18 36 o 18.46000 0.5124000 17.40000 0.9167000 19.52000 0.4582000 -2.123000      1.025000  
1 1 1 8  18 38 o 20.11000 0.4032000 20.06000 0.6770000 20.17000 0.4381000 -0.1093000     0.8064000 
1 1 1 8  18 40 o 21.67000 0.3665000 21.45000 0.5520000 21.88000 0.4821000 -0.4369000     0.7329000 
1 1 1 8  18 42 f 20.71000 0.3677000 20.89000 0.5788000 20.53000 0.4538000 0.3633000      0.7355000 
1 1 1 8  18 44 o 22.47000 0.3557000 22.39000 0.5713000 22.55000 0.4240000 -0.1609000     0.7114000 
1 1 1 8  18 46 o 17.58000 0.4138000 18.05000 0.6224000 17.12000 0.5454000 0.9207000      0.8275000 
1 1 1 8  18 48 o 18.48000 0.4518000 18.34000 0.7068000 18.63000 0.5631000 -0.2843000     0.9037000 
1 1 1 8  18 50 o 6.480000 0.8972000 7.263000 1.389000  5.697000 1.137000  1.566000       1.794000  
1 1 1 8  18 52 o 5.373000 0.9925000 5.486000 1.457000  5.259000 1.348000  0.2267000      1.985000  
1 1 1 8  18 54 o 9.498000 0.5570000 10.06000 0.8684000 8.935000 0.6976000 1.126000       1.114000  
1 1 1 8  18 56 o 7.059000 0.8297000 7.404000 1.237000  6.715000 1.106000  0.6899000      1.659000  
1 1 1 8  18 58 o 4.832000 1.120000  4.776000 1.825000  4.888000 1.299000  -0.1116000     2.240000  
1 1 1 8  18 60 o 3.166000 0.9740000 3.502000 1.502000  2.830000 1.240000  0.6725000      1.948000  
1 1 1 8  18 62 o 3.366000 0.9836000 4.379000 1.643000  2.353000 1.082000  2.025000       1.967000  
1 1 1 8  18 64 o 6.460000 0.9459000 7.355000 1.503000  5.565000 1.149000  1.790000       1.892000  
1 1 1 8  19 1  o 37.63000 0.3046000 37.41000 0.4021000 37.85000 0.4577000 -0.4403000     0.6093000 
1 1 1 8  19 3  o 76.51000 0.5309000 76.53000 0.7526000 76.49000 0.7489000 0.3954000E-01  1.062000  
1 1 1 8  19 5  o 68.32000 0.5166000 68.38000 0.7844000 68.26000 0.6725000 0.1163000      1.033000  
1 1 1 8  19 7  o 60.16000 0.4260000 59.99000 0.5999000 60.32000 0.6051000 -0.3385000     0.8521000 
1 1 1 8  19 9  o 134.3000 0.9193000 132.8000 1.286000  135.8000 1.314000  -3.000000      1.839000  
1 1 1 8  19 11 o 172.6000 1.443000  172.1000 1.658000  173.1000 2.362000  -1.019000      2.886000  
1 1 1 8  19 13 o 26.74000 0.2949000 27.04000 0.4401000 26.44000 0.3926000 0.6007000      0.5898000 
1 1 1 8  19 15 o 90.24000 0.6252000 90.24000 0.8837000 90.24000 0.8847000 -0.5722000E-03 1.250000  
1 1 1 8  19 17 o 60.05000 0.5230000 59.76000 0.8455000 60.35000 0.6156000 -0.5943000     1.046000  
1 1 1 8  19 19 o 28.98000 0.4117000 29.59000 0.5929000 28.37000 0.5712000 1.226000       0.8233000 
1 1 1 8  19 21 o 21.31000 0.3072000 21.39000 0.3779000 21.23000 0.4844000 0.1606000      0.6144000 
1 1 1 8  19 23 o 38.36000 0.3629000 37.57000 0.5006000 39.15000 0.5254000 -1.575000      0.7257000 
1 1 1 8  19 25 o 69.55000 0.6085000 69.77000 0.9921000 69.32000 0.7049000 0.4534000      1.217000  
1 1 1 8  19 27 o 57.85000 0.4973000 57.34000 0.8304000 58.36000 0.5475000 -1.015000      0.9946000 
1 1 1 8  19 29 o 32.03000 0.3056000 32.63000 0.4774000 31.44000 0.3817000 1.191000       0.6112000 
1 1 1 8  19 31 o 16.15000 0.3491000 16.79000 0.5222000 15.51000 0.4634000 1.277000       0.6982000 
1 1 1 8  19 33 o 17.02000 0.3606000 16.86000 0.5515000 17.18000 0.4648000 -0.3276000     0.7212000 
1 1 1 8  19 35 o 22.64000 0.3636000 22.25000 0.5005000 23.03000 0.5276000 -0.7745000     0.7272000 
1 1 1 8  19 37 o 39.08000 0.3503000 38.90000 0.5449000 39.26000 0.4405000 -0.3551000     0.7007000 
1 1 1 8  19 39 o 14.71000 0.4204000 14.55000 0.6686000 14.87000 0.5098000 -0.3203000     0.8408000 
1 1 1 8  19 41 o 23.05000 0.3482000 23.09000 0.5511000 23.01000 0.4257000 0.8207000E-01  0.6964000 
1 1 1 8  19 43 o 25.61000 0.3403000 25.50000 0.5350000 25.72000 0.4209000 -0.2209000     0.6807000 
1 1 1 8  19 45 o 32.19000 0.3786000 31.62000 0.5352000 32.77000 0.5357000 -1.142000      0.7572000 
1 1 1 8  19 47 o 30.64000 0.3876000 31.10000 0.6533000 30.19000 0.4171000 0.9145000      0.7751000 
1 1 1 8  19 49 o 15.85000 0.3983000 14.71000 0.6485000 16.98000 0.4627000 -2.269000      0.7966000 
1 1 1 8  19 51 o 12.92000 0.5449000 12.47000 0.9310000 13.38000 0.5665000 -0.9079000     1.090000  
1 1 1 8  19 53 o 7.516000 0.7026000 7.473000 1.099000  7.560000 0.8752000 -0.8651000E-01 1.405000  
1 1 1 8  19 55 o 10.97000 0.5403000 10.71000 0.9060000 11.24000 0.5891000 -0.5343000     1.081000  
1 1 1 8  19 57 o 9.946000 0.7285000 9.801000 1.261000  10.09000 0.7298000 -0.2917000     1.457000  
1 1 1 8  19 59 o 4.913000 1.032000  5.479000 1.507000  4.347000 1.410000  1.132000       2.064000  
1 1 1 8  19 61 o 3.904000 0.9406000 2.928000 1.377000  4.881000 1.281000  -1.953000      1.881000  
1 1 1 8  19 63 o 7.118000 1.077000  6.958000 1.606000  7.279000 1.436000  -0.3210000     2.155000  
1 1 1 8  20 0  o 13.48000 0.4011000 13.48000 0.4011000 13.48000 0.4011000 0.000000       0.000000  
1 1 1 8  20 2  o 62.66000 0.4419000 62.35000 0.6238000 62.97000 0.6262000 -0.6248000     0.8839000 
1 1 1 8  20 4  o 70.73000 0.5343000 71.10000 0.8131000 70.36000 0.6935000 0.7364000      1.069000  
1 1 1 8  20 6  o 30.88000 0.2626000 30.74000 0.3198000 31.02000 0.4167000 -0.2848000     0.5252000 
1 1 1 8  20 8  o 69.00000 0.5236000 68.74000 0.6832000 69.25000 0.7936000 -0.5154000     1.047000  
1 1 1 8  20 10 f 113.6000 0.8416000 113.9000 1.106000  113.3000 1.269000  0.6114000      1.683000  
1 1 1 8  20 12 o 57.27000 0.4118000 57.30000 0.5814000 57.25000 0.5834000 0.5546000E-01  0.8236000 
1 1 1 8  20 14 o 44.80000 0.3384000 44.82000 0.4777000 44.77000 0.4795000 0.5842000E-01  0.6768000 
1 1 1 8  20 16 o 86.72000 0.7355000 86.97000 1.199000  86.47000 0.8516000 0.4964000      1.471000  
1 1 1 8  20 18 o 12.03000 0.3153000 11.81000 0.4420000 12.24000 0.4496000 -0.4351000     0.6305000 
1 1 1 8  20 20 o 29.46000 0.3032000 28.85000 0.3762000 30.07000 0.4757000 -1.226000      0.6064000 
1 1 1 8  20 22 o 73.22000 0.6663000 73.61000 0.8492000 72.83000 1.027000  0.7859000      1.333000  
1 1 1 8  20 24 f 71.92000 0.6301000 72.19000 1.033000  71.65000 0.7220000 0.5440000      1.260000  
1 1 1 8  20 26 o 77.26000 0.5636000 77.76000 0.8897000 76.75000 0.6922000 1.006000       1.127000  
1 1 1 8  20 28 o 12.37000 0.3972000 11.98000 0.6347000 12.76000 0.4778000 -0.7814000     0.7945000 
1 1 1 8  20 30 o 21.07000 0.3180000 20.84000 0.4768000 21.30000 0.4209000 -0.4632000     0.6360000 
1 1 1 8  20 32 o 39.24000 0.3559000 39.22000 0.5283000 39.26000 0.4770000 -0.4551000E-01 0.7118000 
1 1 1 8  20 34 o 6.885000 0.8135000 5.679000 1.391000  8.092000 0.8434000 -2.413000      1.627000  
1 1 1 8  20 36 o 10.62000 0.7297000 12.02000 1.259000  9.212000 0.7383000 2.810000       1.459000  
1 1 1 8  20 38 o 14.65000 0.5012000 14.42000 0.8649000 14.89000 0.5066000 -0.4651000     1.002000  
1 1 1 8  20 40 o 15.31000 0.4281000 15.67000 0.6708000 14.96000 0.5321000 0.7071000      0.8563000 
1 1 1 8  20 42 o 21.87000 0.3629000 21.53000 0.5726000 22.21000 0.4461000 -0.6844000     0.7259000 
1 1 1 8  20 44 o 22.55000 0.3997000 22.01000 0.5563000 23.09000 0.5740000 -1.078000      0.7994000 
1 1 1 8  20 46 o 16.96000 0.3822000 17.42000 0.5767000 16.51000 0.5018000 0.9163000      0.7644000 
1 1 1 8  20 48 o 24.85000 0.3544000 25.48000 0.5349000 24.23000 0.4649000 1.253000       0.7087000 
1 1 1 8  20 50 o 13.60000 0.4264000 13.24000 0.6906000 13.95000 0.5002000 -0.7156000     0.8527000 
1 1 1 8  20 52 o 17.87000 0.3955000 17.69000 0.6004000 18.04000 0.5151000 -0.3472000     0.7911000 
1 1 1 8  20 54 f 7.114000 0.8002000 6.242000 1.382000  7.987000 0.8069000 -1.745000      1.600000  
1 1 1 8  20 56 o 8.349000 0.9275000 7.332000 1.616000  9.366000 0.9103000 -2.034000      1.855000  
1 1 1 8  20 58 o 9.864000 0.6878000 10.26000 0.9873000 9.469000 0.9579000 0.7885000      1.376000  
1 1 1 8  20 60 f 4.591000 1.018000  4.497000 1.552000  4.685000 1.317000  -0.1886000     2.036000  
1 1 1 8  20 62 o 9.642000 0.7973000 9.036000 1.423000  10.25000 0.7207000 -1.210000      1.595000  
1 1 1 8  21 1  o 97.64000 0.6720000 98.62000 0.9597000 96.65000 0.9408000 1.967000       1.344000  
1 1 1 8  21 3  o 63.36000 0.5182000 63.24000 0.7322000 63.47000 0.7335000 -0.2303000     1.036000  
1 1 1 8  21 5  o 34.21000 0.4400000 34.97000 0.3496000 33.44000 0.8077000 1.529000       0.8801000 
1 1 1 8  21 7  o 82.08000 0.6155000 82.69000 0.8124000 81.47000 0.9247000 1.222000       1.231000  
1 1 1 8  21 9  o 59.22000 0.4994000 58.23000 0.5262000 60.21000 0.8489000 -1.980000      0.9988000 
1 1 1 8  21 11 o 61.30000 0.4383000 61.18000 0.6182000 61.42000 0.6216000 -0.2472000     0.8766000 
1 1 1 8  21 13 o 38.01000 0.3238000 37.94000 0.4275000 38.08000 0.4865000 -0.1369000     0.6476000 
1 1 1 8  21 15 o 70.32000 0.6049000 70.92000 0.9870000 69.72000 0.6997000 1.204000       1.210000  
1 1 1 8  21 17 o 47.82000 0.3607000 47.48000 0.5057000 48.16000 0.5143000 -0.6874000     0.7213000 
1 1 1 8  21 19 o 44.63000 0.3677000 44.98000 0.4864000 44.28000 0.5515000 0.7010000      0.7353000 
1 1 1 8  21 21 f 32.34000 0.3888000 32.59000 0.4638000 32.10000 0.6242000 0.4840000      0.7776000 
1 1 1 8  21 23 o 25.78000 0.2729000 25.74000 0.3807000 25.83000 0.3912000 -0.8768000E-01 0.5458000 
1 1 1 8  21 25 o 40.48000 0.3770000 40.55000 0.5343000 40.41000 0.5319000 0.1332000      0.7539000 
1 1 1 8  21 27 f 48.59000 0.3819000 48.49000 0.5947000 48.69000 0.4791000 -0.1988000     0.7637000 
1 1 1 8  21 29 o 24.00000 0.3036000 24.46000 0.4539000 23.53000 0.4034000 0.9276000      0.6073000 
1 1 1 8  21 31 o 29.29000 0.3053000 29.43000 0.4725000 29.15000 0.3867000 0.2876000      0.6106000 
1 1 1 8  21 33 o 10.29000 0.5329000 10.72000 0.7875000 9.864000 0.7181000 0.8567000      1.066000  
1 1 1 8  21 35 o 16.26000 0.5847000 15.84000 1.033000  16.69000 0.5475000 -0.8527000     1.169000  
1 1 1 8  21 37 o 4.798000 1.035000  5.165000 1.587000  4.430000 1.328000  0.7355000      2.069000  
1 1 1 8  21 39 o 6.225000 1.084000  6.808000 1.647000  5.643000 1.410000  1.165000       2.168000  
1 1 1 8  21 41 o 9.809000 0.6176000 10.31000 0.9800000 9.305000 0.7518000 1.008000       1.235000  
1 1 1 8  21 43 o 11.83000 0.5646000 10.79000 0.9763000 12.86000 0.5673000 -2.073000      1.129000  
1 1 1 8  21 45 o 17.76000 0.3851000 17.96000 0.6020000 17.55000 0.4803000 0.4068000      0.7701000 
1 1 1 8  21 47 o 23.29000 0.3861000 23.65000 0.6448000 22.93000 0.4247000 0.7206000      0.7721000 
1 1 1 8  21 49 o 8.915000 0.6603000 9.559000 1.125000  8.271000 0.6912000 1.288000       1.321000  
1 1 1 8  21 51 o 14.66000 0.4870000 14.16000 0.8359000 15.17000 0.4999000 -1.001000      0.9740000 
1 1 1 8  21 53 o 13.38000 0.4483000 12.49000 0.7113000 14.27000 0.5460000 -1.784000      0.8967000 
1 1 1 8  21 55 o 3.949000 1.105000  3.725000 1.519000  4.173000 1.604000  -0.4477000     2.210000  
1 1 1 8  21 57 o 4.503000 1.101000  4.308000 1.703000  4.698000 1.395000  -0.3903000     2.201000  
1 1 1 8  21 59 o 7.588000 0.7713000 7.615000 1.217000  7.560000 0.9475000 0.5530000E-01  1.543000  
1 1 1 8  21 61 o 5.754000 0.9560000 6.720000 1.437000  4.787000 1.261000  1.933000       1.912000  
1 1 1 8  21 63 o 5.527000 1.030000  5.538000 1.755000  5.515000 1.078000  0.2296000E-01  2.060000  
1 1 1 8  22 0  o 61.03000 0.6143000 61.03000 0.6143000 61.03000 0.6143000 0.000000       0.000000  
1 1 1 8  22 2  o 28.59000 0.2716000 28.83000 0.4181000 28.34000 0.3469000 0.4902000      0.5433000 
1 1 1 8  22 4  o 60.25000 0.4287000 60.10000 0.6075000 60.41000 0.6052000 -0.3065000     0.8574000 
1 1 1 8  22 6  o 40.53000 0.3604000 40.97000 0.3953000 40.09000 0.6026000 0.8804000      0.7207000 
1 1 1 8  22 8  o 37.72000 0.4759000 38.01000 0.3759000 37.42000 0.8745000 0.5909000      0.9519000 
1 1 1 8  22 10 o 75.30000 0.5420000 76.32000 0.6749000 74.27000 0.8482000 2.049000       1.084000  
1 1 1 8  22 12 o 113.8000 0.8430000 114.7000 1.114000  112.9000 1.265000  1.821000       1.686000  
1 1 1 8  22 14 o 37.55000 0.5304000 37.78000 0.8513000 37.33000 0.6330000 0.4505000      1.061000  
1 1 1 8  22 16 o 12.04000 0.2925000 11.76000 0.4126000 12.31000 0.4146000 -0.5569000     0.5850000 
1 1 1 8  22 18 o 18.66000 0.3019000 18.32000 0.3675000 19.00000 0.4791000 -0.6834000     0.6038000 
1 1 1 8  22 20 o 28.01000 0.3722000 27.66000 0.4349000 28.36000 0.6043000 -0.6992000     0.7445000 
1 1 1 8  22 22 o 53.57000 0.4289000 53.49000 0.6443000 53.64000 0.5663000 -0.1485000     0.8579000 
1 1 1 8  22 24 o 42.57000 0.3689000 42.36000 0.5574000 42.78000 0.4832000 -0.4203000     0.7377000 
1 1 1 8  22 26 o 18.30000 0.2871000 18.50000 0.4301000 18.09000 0.3804000 0.4034000      0.5742000 
1 1 1 8  22 28 o 9.016000 0.5217000 8.909000 0.7331000 9.123000 0.7425000 -0.2139000     1.043000  
1 1 1 8  22 30 o 39.09000 0.3367000 39.37000 0.5245000 38.80000 0.4223000 0.5718000      0.6733000 
1 1 1 8  22 32 o 6.161000 0.8573000 6.853000 1.108000  5.470000 1.309000  1.383000       1.715000  
1 1 1 8  22 34 o 10.78000 0.5310000 11.07000 0.8401000 10.49000 0.6495000 0.5784000      1.062000  
1 1 1 8  22 36 o 21.11000 0.3779000 21.02000 0.5586000 21.19000 0.5092000 -0.1699000     0.7559000 
1 1 1 8  22 38 o 20.00000 0.3611000 20.54000 0.5614000 19.47000 0.4544000 1.069000       0.7223000 
1 1 1 8  22 40 o 12.56000 0.5077000 12.27000 0.8161000 12.86000 0.6043000 -0.5906000     1.015000  
1 1 1 8  22 42 f 31.54000 0.3421000 31.54000 0.5348000 31.54000 0.4268000 -0.3187000E-02 0.6842000 
1 1 1 8  22 44 o 17.16000 0.4026000 17.02000 0.6109000 17.29000 0.5246000 -0.2666000     0.8052000 
1 1 1 8  22 46 o 11.91000 0.5956000 11.51000 1.015000  12.32000 0.6238000 -0.8057000     1.191000  
1 1 1 8  22 48 o 20.84000 0.3620000 20.81000 0.5468000 20.87000 0.4746000 -0.6188000E-01 0.7241000 
1 1 1 8  22 50 f 9.759000 0.5934000 9.406000 0.9640000 10.11000 0.6923000 -0.7059000     1.187000  
1 1 1 8  22 52 o 22.78000 0.3538000 22.00000 0.5395000 23.56000 0.4580000 -1.553000      0.7077000 
1 1 1 8  22 54 o 7.335000 0.7282000 7.935000 1.126000  6.734000 0.9239000 1.201000       1.456000  
1 1 1 8  22 56 o 3.627000 0.9978000 4.277000 1.552000  2.978000 1.254000  1.299000       1.996000  
1 1 1 8  22 58 o 3.821000 1.041000  4.395000 1.620000  3.247000 1.308000  1.149000       2.082000  
1 1 1 8  22 60 o 4.049000 1.081000  4.071000 1.637000  4.028000 1.412000  0.4288000E-01  2.161000  
1 1 1 8  22 62 o 6.033000 1.110000  6.571000 1.781000  5.494000 1.325000  1.077000       2.220000  
1 1 1 8  23 1  o 59.96000 0.4628000 59.50000 0.6969000 60.41000 0.6092000 -0.9170000     0.9256000 
1 1 1 8  23 3  o 201.6000 1.480000  201.7000 1.939000  201.6000 2.238000  0.7764000E-01  2.961000  
1 1 1 8  23 5  o 47.71000 0.4164000 47.16000 0.4420000 48.26000 0.7059000 -1.094000      0.8329000 
1 1 1 8  23 7  o 14.40000 0.2701000 14.10000 0.3775000 14.70000 0.3863000 -0.5958000     0.5402000 
1 1 1 8  23 9  o 144.9000 1.025000  143.6000 1.243000  146.3000 1.631000  -2.665000      2.051000  
1 1 1 8  23 11 o 115.0000 0.9677000 114.9000 1.117000  115.2000 1.581000  -0.3034000     1.935000  
1 1 1 8  23 13 o 15.44000 0.2722000 14.85000 0.3834000 16.03000 0.3866000 -1.185000      0.5445000 
1 1 1 8  23 15 o 41.65000 0.3590000 41.24000 0.4547000 42.05000 0.5558000 -0.8079000     0.7181000 
1 1 1 8  23 17 o 66.00000 0.5429000 66.51000 0.7718000 65.49000 0.7637000 1.023000       1.086000  
1 1 1 8  23 19 o 5.946000 0.6295000 5.782000 0.8213000 6.111000 0.9543000 -0.3291000     1.259000  
1 1 1 8  23 21 o 30.34000 0.3814000 29.98000 0.4471000 30.70000 0.6181000 -0.7195000     0.7629000 
1 1 1 8  23 23 o 51.76000 0.3889000 51.86000 0.5462000 51.67000 0.5537000 0.1906000      0.7778000 
1 1 1 8  23 25 o 30.83000 0.3203000 31.10000 0.4900000 30.56000 0.4125000 0.5381000      0.6405000 
1 1 1 8  23 27 o 4.075000 0.8723000 4.527000 1.318000  3.623000 1.143000  0.9036000      1.745000  
1 1 1 8  23 29 o 15.78000 0.3193000 16.03000 0.4892000 15.54000 0.4104000 0.4914000      0.6385000 
1 1 1 8  23 31 o 25.64000 0.3280000 25.75000 0.4522000 25.54000 0.4753000 0.2060000      0.6560000 
1 1 1 8  23 33 o 19.30000 0.3344000 19.70000 0.5260000 18.91000 0.4130000 0.7934000      0.6687000 
1 1 1 8  23 35 f 23.32000 0.3906000 23.03000 0.6234000 23.62000 0.4710000 -0.5915000     0.7813000 
1 1 1 8  23 37 o 21.08000 0.3483000 20.53000 0.5416000 21.63000 0.4383000 -1.107000      0.6967000 
1 1 1 8  23 39 o 29.26000 0.4021000 28.81000 0.6468000 29.71000 0.4779000 -0.9018000     0.8042000 
1 1 1 8  23 41 o 23.93000 0.3444000 24.14000 0.5389000 23.71000 0.4291000 0.4250000      0.6888000 
1 1 1 8  23 43 o 9.463000 0.6005000 9.995000 0.9369000 8.931000 0.7515000 1.065000       1.201000  
1 1 1 8  23 45 o 6.454000 0.8426000 6.080000 1.353000  6.828000 1.005000  -0.7481000     1.685000  
1 1 1 8  23 47 o 8.606000 0.6332000 8.761000 1.008000  8.451000 0.7663000 0.3096000      1.266000  
1 1 1 8  23 49 o 3.080000 0.9540000 4.002000 1.604000  2.158000 1.034000  1.844000       1.908000  
1 1 1 8  23 51 o 11.90000 0.5618000 11.62000 0.9646000 12.18000 0.5763000 -0.5570000     1.124000  
1 1 1 8  23 53 o 9.036000 0.5975000 9.051000 0.9415000 9.020000 0.7359000 0.3069000E-01  1.195000  
1 1 1 8  23 55 o 12.93000 0.5019000 13.10000 0.7949000 12.76000 0.6131000 0.3387000      1.004000  
1 1 1 8  23 57 o 4.549000 1.052000  4.247000 1.591000  4.851000 1.377000  -0.6040000     2.104000  
1 1 1 8  23 59 o 8.557000 0.7043000 9.565000 1.080000  7.549000 0.9038000 2.015000       1.409000  
1 1 1 8  23 61 o 2.986000 0.9057000 2.761000 1.301000  3.211000 1.260000  -0.4502000     1.811000  
1 1 1 8  24 0  o 33.08000 0.4396000 33.08000 0.4396000 33.08000 0.4396000 0.000000       0.000000  
1 1 1 8  24 2  o 21.81000 0.3343000 21.92000 0.4846000 21.71000 0.4607000 0.2153000      0.6686000 
1 1 1 8  24 4  o 56.28000 0.4377000 56.74000 0.5748000 55.81000 0.6603000 0.9318000      0.8755000 
1 1 1 8  24 6  o 75.93000 0.6137000 76.13000 0.8698000 75.74000 0.8660000 0.3899000      1.227000  
1 1 1 8  24 8  o 48.06000 0.4498000 47.15000 0.4964000 48.97000 0.7502000 -1.818000      0.8995000 
1 1 1 8  24 10 o 14.70000 0.2755000 14.40000 0.3964000 15.01000 0.3828000 -0.6067000     0.5510000 
1 1 1 8  24 12 o 63.96000 0.4917000 64.82000 0.6512000 63.11000 0.7370000 1.706000       0.9835000 
1 1 1 8  24 14 o 41.46000 0.3874000 41.78000 0.4605000 41.13000 0.6231000 0.6534000      0.7748000 
1 1 1 8  24 16 o 46.25000 0.3639000 45.78000 0.4437000 46.71000 0.5768000 -0.9267000     0.7278000 
1 1 1 8  24 18 o 44.70000 0.3715000 44.29000 0.4817000 45.11000 0.5656000 -0.8253000     0.7429000 
1 1 1 8  24 20 o 59.80000 0.5681000 59.68000 0.7056000 59.91000 0.8906000 -0.2335000     1.136000  
1 1 1 8  24 22 o 36.51000 0.3070000 36.30000 0.4297000 36.72000 0.4384000 -0.4192000     0.6139000 
1 1 1 8  24 24 o 33.68000 0.3228000 33.58000 0.4897000 33.77000 0.4207000 -0.1841000     0.6456000 
1 1 1 8  24 26 o 25.85000 0.3133000 25.97000 0.3918000 25.74000 0.4890000 0.2262000      0.6266000 
1 1 1 8  24 28 o 12.81000 0.4042000 13.60000 0.5547000 12.02000 0.5880000 1.579000       0.8084000 
1 1 1 8  24 30 o 22.84000 0.2997000 22.72000 0.4615000 22.96000 0.3823000 -0.2384000     0.5993000 
1 1 1 8  24 32 f 17.85000 0.3376000 18.02000 0.5235000 17.68000 0.4264000 0.3414000      0.6752000 
1 1 1 8  24 34 o 13.93000 0.6133000 13.74000 1.094000  14.13000 0.5545000 -0.3938000     1.227000  
1 1 1 8  24 36 o 19.94000 0.3773000 20.61000 0.5444000 19.28000 0.5225000 1.334000       0.7546000 
1 1 1 8  24 38 o 4.251000 1.101000  4.475000 1.616000  4.026000 1.495000  0.4497000      2.201000  
1 1 1 8  24 40 o 14.01000 0.4658000 13.73000 0.7555000 14.29000 0.5450000 -0.5565000     0.9316000 
1 1 1 8  24 42 o 17.47000 0.4051000 17.49000 0.6072000 17.46000 0.5366000 0.3064000E-01  0.8103000 
1 1 1 8  24 44 o 8.697000 0.6242000 8.835000 0.9469000 8.559000 0.8135000 0.2761000      1.248000  
1 1 1 8  24 46 o 19.30000 0.4136000 20.17000 0.6888000 18.43000 0.4581000 1.738000       0.8272000 
1 1 1 8  24 48 o 3.173000 0.9127000 3.047000 1.347000  3.300000 1.232000  -0.2538000     1.825000  
1 1 1 8  24 50 o 14.85000 0.4898000 14.70000 0.7896000 15.00000 0.5796000 -0.2984000     0.9795000 
1 1 1 8  24 52 o 17.97000 0.4271000 17.78000 0.7072000 18.17000 0.4790000 -0.3899000     0.8541000 
1 1 1 8  24 54 o 11.39000 0.5276000 11.69000 0.7865000 11.09000 0.7034000 0.5990000      1.055000  
1 1 1 8  24 56 o 5.380000 1.116000  5.911000 1.831000  4.850000 1.276000  1.061000       2.232000  
1 1 1 8  24 58 o 3.869000 1.061000  3.689000 1.547000  4.050000 1.453000  -0.3608000     2.122000  
1 1 1 8  24 60 o 4.575000 1.063000  4.150000 1.654000  5.001000 1.337000  -0.8507000     2.127000  
1 1 1 8  24 62 o 3.932000 1.122000  3.161000 1.454000  4.704000 1.709000  -1.543000      2.244000  
1 1 1 8  25 1  o 56.54000 0.5016000 57.08000 0.8243000 56.01000 0.5719000 1.064000       1.003000  
1 1 1 8  25 3  o 74.39000 0.6032000 73.27000 0.8397000 75.50000 0.8661000 -2.237000      1.206000  
1 1 1 8  25 5  o 36.63000 0.3727000 37.02000 0.4787000 36.24000 0.5714000 0.7805000      0.7455000 
1 1 1 8  25 7  o 83.39000 0.6283000 82.71000 0.8143000 84.07000 0.9570000 -1.364000      1.257000  
1 1 1 8  25 9  o 66.89000 0.5131000 66.57000 0.6658000 67.22000 0.7809000 -0.6551000     1.026000  
1 1 1 8  25 11 o 37.95000 0.3513000 38.13000 0.3850000 37.76000 0.5877000 0.3723000      0.7026000 
1 1 1 8  25 13 o 48.11000 0.3708000 48.25000 0.4579000 47.97000 0.5833000 0.2785000      0.7415000 
1 1 1 8  25 15 o 44.71000 0.3531000 44.40000 0.4323000 45.01000 0.5584000 -0.6077000     0.7062000 
1 1 1 8  25 17 o 39.17000 0.3648000 39.17000 0.3997000 39.17000 0.6104000 0.4082000E-03  0.7296000 
1 1 1 8  25 19 o 58.27000 0.6910000 57.70000 0.5939000 58.85000 1.248000  -1.156000      1.382000  
1 1 1 8  25 21 o 48.31000 0.4301000 48.78000 0.5987000 47.84000 0.6177000 0.9403000      0.8603000 
1 1 1 8  25 23 o 41.76000 0.3333000 41.96000 0.4697000 41.56000 0.4729000 0.3957000      0.6665000 
1 1 1 8  25 25 o 37.87000 0.3449000 37.73000 0.5193000 38.00000 0.4541000 -0.2690000     0.6898000 
1 1 1 8  25 27 o 27.52000 0.3143000 27.61000 0.4442000 27.43000 0.4449000 0.1828000      0.6287000 
1 1 1 8  25 29 o 34.64000 0.3178000 34.91000 0.4927000 34.37000 0.4015000 0.5469000      0.6356000 
1 1 1 8  25 31 o 25.35000 0.3101000 25.48000 0.4758000 25.21000 0.3977000 0.2750000      0.6201000 
1 1 1 8  25 33 o 33.73000 0.4668000 33.80000 0.8346000 33.66000 0.4185000 0.1397000      0.9336000 
1 1 1 8  25 35 o 28.47000 0.3315000 28.34000 0.5182000 28.60000 0.4134000 -0.2613000     0.6630000 
1 1 1 8  25 37 o 25.45000 0.3949000 24.94000 0.6458000 25.97000 0.4547000 -1.036000      0.7899000 
1 1 1 8  25 39 o 14.27000 0.5431000 14.97000 0.9099000 13.56000 0.5930000 1.412000       1.086000  
1 1 1 8  25 41 o 6.774000 0.8788000 6.705000 1.279000  6.843000 1.205000  -0.1377000     1.758000  
1 1 1 8  25 43 o 24.87000 0.3430000 24.80000 0.5143000 24.94000 0.4539000 -0.1410000     0.6859000 
1 1 1 8  25 45 o 5.990000 0.9802000 6.152000 1.586000  5.828000 1.153000  0.3237000      1.960000  
1 1 1 8  25 47 o 8.385000 0.6681000 7.413000 1.176000  9.357000 0.6337000 -1.944000      1.336000  
1 1 1 8  25 49 o 3.215000 0.9494000 2.951000 1.322000  3.478000 1.363000  -0.5273000     1.899000  
1 1 1 8  25 51 o 6.612000 0.8305000 6.296000 1.378000  6.928000 0.9279000 -0.6319000     1.661000  
1 1 1 8  25 53 o 12.36000 0.5307000 12.92000 0.6983000 11.81000 0.7994000 1.102000       1.061000  
1 1 1 8  25 55 o 8.702000 0.8129000 9.216000 1.289000  8.187000 0.9911000 1.029000       1.626000  
1 1 1 8  25 57 o 4.096000 1.045000  4.212000 1.590000  3.980000 1.355000  0.2311000      2.089000  
1 1 1 8  25 59 o 3.537000 1.013000  3.980000 1.575000  3.093000 1.273000  0.8868000      2.025000  
1 1 1 8  25 61 f 3.403000 0.9873000 3.550000 1.461000  3.257000 1.328000  0.2931000      1.975000  
1 1 1 8  26 0  o 10.25000 0.5832000 10.25000 0.5832000 10.25000 0.5832000 0.000000       0.000000  
1 1 1 8  26 2  o 91.04000 0.6821000 91.66000 1.036000  90.43000 0.8874000 1.236000       1.364000  
1 1 1 8  26 4  o 85.74000 0.6450000 85.78000 0.8443000 85.69000 0.9752000 0.8892000E-01  1.290000  
1 1 1 8  26 6  o 76.29000 0.5783000 75.93000 0.7512000 76.66000 0.8794000 -0.7326000     1.157000  
1 1 1 8  26 8  o 122.1000 1.023000  122.9000 1.191000  121.3000 1.663000  1.551000       2.046000  
1 1 1 8  26 10 o 50.14000 0.4773000 50.61000 0.6114000 49.66000 0.7330000 0.9472000      0.9545000 
1 1 1 8  26 12 o 19.31000 0.2794000 19.87000 0.4022000 18.75000 0.3879000 1.116000       0.5588000 
1 1 1 8  26 14 o 37.24000 0.3125000 37.35000 0.3861000 37.13000 0.4914000 0.2227000      0.6249000 
1 1 1 8  26 16 o 44.88000 0.4139000 44.81000 0.4844000 44.95000 0.6712000 -0.1398000     0.8277000 
1 1 1 8  26 18 o 8.642000 0.4075000 8.570000 0.5059000 8.714000 0.6390000 -0.1435000     0.8151000 
1 1 1 8  26 20 o 41.16000 0.4173000 40.36000 0.4586000 41.96000 0.6974000 -1.602000      0.8347000 
1 1 1 8  26 22 o 34.22000 0.3181000 34.06000 0.4125000 34.38000 0.4844000 -0.3184000     0.6362000 
1 1 1 8  26 24 o 45.24000 0.3839000 45.11000 0.5822000 45.36000 0.5006000 -0.2471000     0.7678000 
1 1 1 8  26 26 o 40.16000 0.3290000 40.40000 0.4617000 39.93000 0.4688000 0.4636000      0.6579000 
1 1 1 8  26 28 o 42.32000 0.3533000 42.44000 0.5511000 42.20000 0.4423000 0.2371000      0.7066000 
1 1 1 8  26 30 o 27.96000 0.3163000 27.96000 0.4696000 27.97000 0.4239000 -0.9157000E-02 0.6326000 
1 1 1 8  26 32 o 21.50000 0.3252000 21.69000 0.5025000 21.31000 0.4130000 0.3793000      0.6504000 
1 1 1 8  26 34 o 34.00000 0.4260000 33.89000 0.6306000 34.11000 0.5730000 -0.2227000     0.8520000 
1 1 1 8  26 36 o 36.96000 0.3697000 36.72000 0.5453000 37.21000 0.4994000 -0.4855000     0.7395000 
1 1 1 8  26 38 o 17.68000 0.4101000 17.52000 0.6108000 17.83000 0.5473000 -0.3064000     0.8201000 
1 1 1 8  26 40 o 16.31000 0.5073000 15.60000 0.8052000 17.03000 0.6175000 -1.434000      1.015000  
1 1 1 8  26 42 o 21.80000 0.3875000 21.48000 0.5447000 22.13000 0.5512000 -0.6510000     0.7750000 
1 1 1 8  26 44 o 9.615000 0.5802000 8.994000 0.9243000 10.24000 0.7014000 -1.241000      1.160000  
1 1 1 8  26 46 o 7.547000 0.7951000 8.611000 1.277000  6.483000 0.9474000 2.128000       1.590000  
1 1 1 8  26 48 o 13.01000 0.4856000 13.42000 0.7907000 12.61000 0.5639000 0.8093000      0.9712000 
1 1 1 8  26 50 o 6.204000 0.8451000 6.437000 1.373000  5.971000 0.9855000 0.4658000      1.690000  
1 1 1 8  26 52 o 10.66000 0.6382000 10.89000 1.035000  10.44000 0.7468000 0.4455000      1.276000  
1 1 1 8  26 54 o 6.201000 0.9233000 7.764000 1.082000  4.638000 1.496000  3.126000       1.847000  
1 1 1 8  26 56 o 5.608000 0.9257000 4.244000 1.575000  6.973000 0.9731000 -2.729000      1.851000  
1 1 1 8  26 58 o 3.884000 1.002000  3.853000 1.551000  3.915000 1.270000  -0.6174000E-01 2.005000  
1 1 1 8  26 60 o 3.904000 1.069000  3.907000 1.637000  3.902000 1.376000  0.4885000E-02  2.138000  
1 1 1 8  27 1  o 28.24000 0.2871000 29.03000 0.3717000 27.44000 0.4376000 1.587000       0.5741000 
1 1 1 8  27 3  o 28.47000 0.2987000 28.18000 0.4113000 28.75000 0.4333000 -0.5726000     0.5974000 
1 1 1 8  27 5  o 82.37000 0.6225000 81.55000 0.8052000 83.19000 0.9496000 -1.641000      1.245000  
1 1 1 8  27 7  o 75.17000 0.6438000 75.76000 0.7523000 74.59000 1.045000  1.175000       1.288000  
1 1 1 8  27 9  o 35.59000 0.3228000 35.44000 0.4266000 35.74000 0.4845000 -0.3088000     0.6455000 
1 1 1 8  27 11 o 42.07000 0.3362000 42.30000 0.4157000 41.84000 0.5284000 0.4608000      0.6723000 
1 1 1 8  27 13 o 74.11000 0.6171000 73.79000 0.6600000 74.42000 1.043000  -0.6345000     1.234000  
1 1 1 8  27 15 o 43.97000 0.4080000 43.79000 0.4772000 44.16000 0.6620000 -0.3667000     0.8160000 
1 1 1 8  27 17 o 50.58000 0.3912000 49.94000 0.4738000 51.22000 0.6227000 -1.280000      0.7825000 
1 1 1 8  27 19 o 59.52000 0.5350000 60.20000 0.6187000 58.83000 0.8731000 1.365000       1.070000  
1 1 1 8  27 21 o 20.89000 0.3513000 20.56000 0.3416000 21.22000 0.6139000 -0.6569000     0.7026000 
1 1 1 8  27 23 o 47.67000 0.4251000 47.62000 0.4619000 47.73000 0.7139000 -0.1115000     0.8503000 
1 1 1 8  27 25 o 31.92000 0.3435000 32.26000 0.4961000 31.58000 0.4752000 0.6753000      0.6870000 
1 1 1 8  27 27 o 25.93000 0.2903000 25.50000 0.4483000 26.37000 0.3689000 -0.8691000     0.5806000 
1 1 1 8  27 29 o 44.65000 0.3838000 44.99000 0.5755000 44.32000 0.5081000 0.6646000      0.7677000 
1 1 1 8  27 31 o 32.68000 0.3210000 32.45000 0.4942000 32.92000 0.4097000 -0.4632000     0.6419000 
1 1 1 8  27 33 o 37.42000 0.3860000 37.61000 0.6364000 37.24000 0.4371000 0.3685000      0.7721000 
1 1 1 8  27 35 o 32.57000 0.3381000 32.64000 0.5205000 32.51000 0.4316000 0.1263000      0.6761000 
1 1 1 8  27 37 o 37.88000 0.3729000 38.31000 0.5557000 37.46000 0.4973000 0.8534000      0.7457000 
1 1 1 8  27 39 o 32.50000 0.4040000 33.25000 0.6620000 31.74000 0.4634000 1.508000       0.8080000 
1 1 1 8  27 41 o 21.85000 0.3534000 21.73000 0.5555000 21.96000 0.4371000 -0.2306000     0.7069000 
1 1 1 8  27 43 o 14.53000 0.5028000 14.96000 0.8077000 14.09000 0.5990000 0.8666000      1.006000  
1 1 1 8  27 45 f 7.126000 0.9283000 7.030000 1.567000  7.222000 0.9966000 -0.1916000     1.857000  
1 1 1 8  27 47 f 10.55000 0.5552000 10.57000 0.8820000 10.52000 0.6744000 0.5894000E-01  1.110000  
1 1 1 8  27 49 o 8.390000 0.6916000 7.418000 1.177000  9.362000 0.7276000 -1.945000      1.383000  
1 1 1 8  27 51 o 6.397000 0.9325000 6.809000 1.349000  5.986000 1.288000  0.8231000      1.865000  
1 1 1 8  27 53 o 11.02000 0.5212000 11.68000 0.7812000 10.36000 0.6903000 1.322000       1.042000  
1 1 1 8  27 55 o 11.56000 0.5005000 11.61000 0.7901000 11.50000 0.6147000 0.1057000      1.001000  
1 1 1 8  27 57 o 5.501000 0.9947000 5.504000 1.556000  5.498000 1.239000  0.6276000E-02  1.989000  
1 1 1 8  27 59 o 3.848000 1.044000  4.005000 1.567000  3.690000 1.381000  0.3153000      2.089000  
1 1 1 8  28 0  o 60.99000 0.8634000 60.99000 0.8634000 60.99000 0.8634000 0.000000       0.000000  
1 1 1 8  28 2  o 32.41000 0.5133000 31.64000 0.5487000 33.19000 0.8676000 -1.544000      1.027000  
1 1 1 8  28 4  o 27.22000 0.4496000 27.01000 0.4046000 27.43000 0.8031000 -0.4203000     0.8993000 
1 1 1 8  28 6  o 45.43000 0.3607000 45.13000 0.4374000 45.72000 0.5736000 -0.5876000     0.7214000 
1 1 1 8  28 8  o 57.95000 0.4341000 58.06000 0.5333000 57.84000 0.6850000 0.2220000      0.8682000 
1 1 1 8  28 10 o 44.54000 0.3981000 44.66000 0.4352000 44.42000 0.6669000 0.2392000      0.7963000 
1 1 1 8  28 12 o 52.71000 0.4546000 52.75000 0.4936000 52.68000 0.7636000 0.7093000E-01  0.9093000 
1 1 1 8  28 14 o 52.30000 0.4982000 52.72000 0.6499000 51.88000 0.7552000 0.8435000      0.9964000 
1 1 1 8  28 16 f 6.454000 0.5273000 6.628000 0.6382000 6.280000 0.8396000 0.3482000      1.055000  
1 1 1 8  28 18 o 29.46000 0.3515000 29.48000 0.3865000 29.44000 0.5872000 0.3489000E-01  0.7030000 
1 1 1 8  28 20 o 18.43000 0.3517000 18.95000 0.3439000 17.90000 0.6136000 1.048000       0.7034000 
1 1 1 8  28 22 o 34.39000 0.3485000 33.62000 0.3754000 35.15000 0.5873000 -1.530000      0.6971000 
1 1 1 8  28 24 o 37.06000 0.3412000 37.24000 0.4557000 36.88000 0.5078000 0.3601000      0.6823000 
1 1 1 8  28 26 o 26.30000 0.2885000 26.06000 0.3591000 26.55000 0.4517000 -0.4923000     0.5771000 
1 1 1 8  28 28 o 10.57000 0.4195000 10.19000 0.5925000 10.94000 0.5938000 -0.7430000     0.8389000 
1 1 1 8  28 30 o 7.320000 0.6739000 7.727000 0.9728000 6.913000 0.9329000 0.8144000      1.348000  
1 1 1 8  28 32 o 8.457000 0.7948000 9.688000 1.292000  7.225000 0.9252000 2.463000       1.590000  
1 1 1 8  28 34 o 27.75000 0.3255000 27.67000 0.4999000 27.83000 0.4171000 -0.1591000     0.6510000 
1 1 1 8  28 36 o 15.19000 0.4822000 15.48000 0.6432000 14.90000 0.7185000 0.5771000      0.9643000 
1 1 1 8  28 38 o 14.78000 0.4365000 15.15000 0.6667000 14.41000 0.5636000 0.7397000      0.8731000 
1 1 1 8  28 40 o 7.262000 0.7484000 7.054000 1.189000  7.470000 0.9093000 -0.4163000     1.497000  
1 1 1 8  28 42 o 10.24000 0.5830000 10.66000 0.8655000 9.806000 0.7812000 0.8582000      1.166000  
1 1 1 8  28 44 o 13.83000 0.5094000 13.18000 0.8861000 14.49000 0.5026000 -1.309000      1.019000  
1 1 1 8  28 46 o 12.85000 0.5335000 12.77000 0.8911000 12.93000 0.5869000 -0.1607000     1.067000  
1 1 1 8  28 48 o 17.30000 0.4293000 16.89000 0.7095000 17.72000 0.4837000 -0.8278000     0.8587000 
1 1 1 8  28 50 o 6.965000 0.8102000 6.763000 1.335000  7.168000 0.9184000 -0.4053000     1.620000  
1 1 1 8  28 52 o 7.712000 0.9442000 6.708000 1.698000  8.717000 0.8273000 -2.009000      1.888000  
1 1 1 8  28 54 o 6.197000 0.9743000 4.658000 1.761000  7.737000 0.8339000 -3.078000      1.949000  
1 1 1 8  28 56 o 10.70000 0.5616000 11.01000 0.8532000 10.39000 0.7305000 0.6211000      1.123000  
1 1 1 8  28 58 o 6.724000 0.9312000 5.866000 1.596000  7.581000 0.9594000 -1.715000      1.862000  
1 1 1 8  28 60 o 10.52000 0.6645000 11.34000 0.9775000 9.698000 0.9002000 1.644000       1.329000  
1 1 1 8  29 1  o 48.40000 0.4202000 47.30000 0.5860000 49.50000 0.6023000 -2.199000      0.8403000 
1 1 1 8  29 3  f 41.99000 0.3857000 41.49000 0.4104000 42.49000 0.6531000 -1.008000      0.7713000 
1 1 1 8  29 5  o 32.53000 0.4639000 33.06000 0.3604000 32.00000 0.8550000 1.051000       0.9279000 
1 1 1 8  29 7  o 22.24000 0.2883000 22.21000 0.3341000 22.27000 0.4698000 -0.6516000E-01 0.5765000 
1 1 1 8  29 9  o 3.796000 0.8134000 3.963000 1.076000  3.629000 1.221000  0.3338000      1.627000  
1 1 1 8  29 11 o 23.14000 0.2846000 22.74000 0.3296000 23.54000 0.4640000 -0.8046000     0.5691000 
1 1 1 8  29 13 o 23.32000 0.2660000 23.57000 0.3343000 23.07000 0.4138000 0.4928000      0.5320000 
1 1 1 8  29 15 o 69.86000 0.5374000 70.95000 0.7185000 68.76000 0.7995000 2.189000       1.075000  
1 1 1 8  29 17 o 51.79000 0.4842000 51.02000 0.5441000 52.56000 0.8010000 -1.546000      0.9683000 
1 1 1 8  29 19 o 50.32000 0.4586000 50.06000 0.4789000 50.58000 0.7822000 -0.5187000     0.9172000 
1 1 1 8  29 21 o 9.137000 0.4700000 9.060000 0.5379000 9.215000 0.7708000 -0.1548000     0.9399000 
1 1 1 8  29 23 f 20.30000 0.2838000 20.21000 0.3450000 20.39000 0.4508000 -0.1829000     0.5676000 
1 1 1 8  29 25 o 37.67000 0.3270000 37.45000 0.4028000 37.89000 0.5154000 -0.4350000     0.6541000 
1 1 1 8  29 27 o 18.21000 0.3180000 17.84000 0.4203000 18.58000 0.4775000 -0.7367000     0.6361000 
1 1 1 8  29 29 f 12.02000 0.4199000 12.55000 0.5788000 11.48000 0.6085000 1.073000       0.8398000 
1 1 1 8  29 31 o 15.26000 0.5016000 16.37000 0.7166000 14.16000 0.7020000 2.213000       1.003000  
1 1 1 8  29 33 o 17.80000 0.3825000 18.17000 0.4734000 17.43000 0.6008000 0.7424000      0.7649000 
1 1 1 8  29 35 o 13.10000 0.4627000 12.45000 0.7048000 13.75000 0.5998000 -1.307000      0.9255000 
1 1 1 8  29 37 o 24.47000 0.3298000 25.03000 0.5109000 23.92000 0.4172000 1.107000       0.6596000 
1 1 1 8  29 39 o 9.414000 0.6812000 9.554000 1.165000  9.275000 0.7064000 0.2789000      1.362000  
1 1 1 8  29 41 o 10.06000 0.6903000 10.75000 1.009000  9.366000 0.9425000 1.387000       1.381000  
1 1 1 8  29 43 o 4.344000 0.9919000 3.522000 1.535000  5.167000 1.257000  -1.645000      1.984000  
1 1 1 8  29 45 o 8.214000 0.6453000 7.830000 1.043000  8.599000 0.7607000 -0.7682000     1.291000  
1 1 1 8  29 47 o 5.382000 0.9516000 7.074000 1.371000  3.691000 1.319000  3.383000       1.903000  
1 1 1 8  29 49 f 10.31000 0.7430000 9.321000 1.278000  11.30000 0.7591000 -1.978000      1.486000  
1 1 1 8  29 51 o 5.274000 1.118000  5.549000 1.817000  5.000000 1.304000  0.5494000      2.237000  
1 1 1 8  29 53 o 13.34000 0.4708000 12.42000 0.7717000 14.26000 0.5396000 -1.843000      0.9416000 
1 1 1 8  29 55 o 3.197000 0.9443000 3.627000 1.459000  2.767000 1.199000  0.8598000      1.889000  
1 1 1 8  29 57 o 2.751000 0.8724000 2.993000 1.336000  2.509000 1.122000  0.4837000      1.745000  
1 1 1 8  29 59 o 12.09000 0.5911000 12.51000 1.015000  11.67000 0.6067000 0.8402000      1.182000  
1 1 1 8  30 0  o 4.120000 1.355000  4.120000 1.355000  4.120000 1.355000  0.000000       0.000000  
1 1 1 8  30 2  o 33.60000 0.3086000 32.98000 0.3934000 34.23000 0.4755000 -1.243000      0.6171000 
1 1 1 8  30 4  o 23.72000 0.2725000 23.96000 0.3283000 23.49000 0.4350000 0.4732000      0.5449000 
1 1 1 8  30 6  o 75.43000 0.6357000 74.99000 0.6691000 75.87000 1.081000  -0.8802000     1.271000  
1 1 1 8  30 8  o 67.25000 0.4947000 68.22000 0.6162000 66.28000 0.7742000 1.942000       0.9895000 
1 1 1 8  30 10 o 34.53000 0.3201000 34.30000 0.4191000 34.76000 0.4841000 -0.4639000     0.6403000 
1 1 1 8  30 12 o 33.16000 0.2956000 33.26000 0.3675000 33.06000 0.4632000 0.2019000      0.5913000 
1 1 1 8  30 14 o 13.02000 0.3026000 12.64000 0.3918000 13.40000 0.4612000 -0.7617000     0.6052000 
1 1 1 8  30 16 o 22.61000 0.3426000 22.74000 0.3356000 22.48000 0.5974000 0.2594000      0.6852000 
1 1 1 8  30 18 o 26.75000 0.3439000 27.00000 0.3427000 26.50000 0.5963000 0.5045000      0.6877000 
1 1 1 8  30 20 o 15.33000 0.3310000 14.54000 0.3908000 16.13000 0.5343000 -1.591000      0.6620000 
1 1 1 8  30 22 o 9.704000 0.4156000 9.043000 0.5479000 10.36000 0.6250000 -1.322000      0.8311000 
1 1 1 8  30 24 o 22.18000 0.3063000 22.73000 0.4114000 21.62000 0.4540000 1.105000       0.6127000 
1 1 1 8  30 26 o 30.41000 0.3032000 30.47000 0.3733000 30.35000 0.4779000 0.1177000      0.6064000 
1 1 1 8  30 28 o 23.07000 0.3197000 22.96000 0.4766000 23.18000 0.4261000 -0.2213000     0.6393000 
1 1 1 8  30 30 o 3.786000 0.9503000 3.908000 1.351000  3.663000 1.337000  0.2451000      1.901000  
1 1 1 8  30 32 o 14.46000 0.3945000 13.93000 0.5729000 14.98000 0.5426000 -1.056000      0.7891000 
1 1 1 8  30 34 o 17.50000 0.3523000 16.84000 0.4949000 18.16000 0.5015000 -1.322000      0.7046000 
1 1 1 8  30 36 f 13.27000 0.5513000 13.03000 0.6159000 13.51000 0.9146000 -0.4825000     1.103000  
1 1 1 8  30 38 o 6.096000 0.8530000 5.818000 1.217000  6.374000 1.196000  -0.5558000     1.706000  
1 1 1 8  30 40 o 8.527000 0.8755000 8.239000 1.245000  8.814000 1.231000  -0.5749000     1.751000  
1 1 1 8  30 42 o 7.378000 0.6827000 7.964000 0.8928000 6.792000 1.033000  1.173000       1.365000  
1 1 1 8  30 44 o 13.06000 0.4650000 12.76000 0.7116000 13.36000 0.5987000 -0.5946000     0.9300000 
1 1 1 8  30 46 o 16.18000 0.4110000 16.17000 0.6282000 16.20000 0.5301000 -0.3411000E-01 0.8220000 
1 1 1 8  30 48 o 9.961000 0.5551000 10.16000 0.8575000 9.759000 0.7053000 0.4041000      1.110000  
1 1 1 8  30 50 o 10.67000 0.6137000 11.14000 0.8261000 10.19000 0.9079000 0.9423000      1.227000  
1 1 1 8  30 52 o 17.85000 0.5067000 17.81000 0.7806000 17.89000 0.6461000 -0.8046000E-01 1.013000  
1 1 1 8  30 54 o 2.912000 0.9052000 3.571000 1.463000  2.254000 1.067000  1.317000       1.810000  
1 1 1 8  30 56 o 4.978000 0.9172000 3.528000 1.364000  6.429000 1.226000  -2.901000      1.834000  
1 1 1 8  30 58 o 2.779000 0.8607000 2.619000 1.175000  2.939000 1.258000  -0.3202000     1.721000  
1 1 1 8  31 1  o 29.44000 0.3263000 29.57000 0.4668000 29.32000 0.4560000 0.2507000      0.6526000 
1 1 1 8  31 3  o 44.03000 0.4012000 44.21000 0.4327000 43.86000 0.6757000 0.3483000      0.8024000 
1 1 1 8  31 5  o 37.94000 0.3627000 38.32000 0.3950000 37.57000 0.6085000 0.7490000      0.7255000 
1 1 1 8  31 7  o 7.702000 0.6630000 6.802000 0.6806000 8.602000 1.138000  -1.800000      1.326000  
1 1 1 8  31 9  o 27.72000 0.3409000 27.60000 0.3482000 27.83000 0.5861000 -0.2315000     0.6818000 
1 1 1 8  31 11 o 9.314000 0.5563000 9.388000 0.5012000 9.240000 0.9933000 0.1477000      1.113000  
1 1 1 8  31 13 o 44.79000 0.4345000 44.69000 0.4892000 44.89000 0.7182000 -0.1955000     0.8690000 
1 1 1 8  31 15 o 45.71000 0.4465000 45.95000 0.5107000 45.48000 0.7326000 0.4648000      0.8931000 
1 1 1 8  31 17 o 7.917000 0.6251000 7.571000 0.6624000 8.262000 1.060000  -0.6908000     1.250000  
1 1 1 8  31 19 o 45.54000 0.4140000 44.83000 0.4436000 46.25000 0.6992000 -1.421000      0.8281000 
1 1 1 8  31 21 o 17.36000 0.2966000 16.71000 0.3793000 18.00000 0.4560000 -1.295000      0.5931000 
1 1 1 8  31 23 f 38.89000 0.4306000 38.69000 0.5318000 39.10000 0.6773000 -0.4044000     0.8611000 
1 1 1 8  31 25 o 37.54000 0.3321000 38.06000 0.4118000 37.01000 0.5212000 1.048000       0.6643000 
1 1 1 8  31 27 o 18.03000 0.3342000 18.52000 0.4224000 17.54000 0.5179000 0.9759000      0.6683000 
1 1 1 8  31 29 o 25.40000 0.3008000 25.33000 0.4232000 25.46000 0.4277000 -0.1322000     0.6017000 
1 1 1 8  31 31 o 8.089000 0.6600000 7.909000 1.031000  8.268000 0.8239000 -0.3590000     1.320000  
1 1 1 8  31 33 o 16.98000 0.3542000 17.20000 0.4918000 16.76000 0.5099000 0.4372000      0.7084000 
1 1 1 8  31 35 o 14.67000 0.4385000 14.54000 0.5642000 14.80000 0.6714000 -0.2540000     0.8770000 
1 1 1 8  31 37 o 11.79000 0.4546000 10.87000 0.6660000 12.72000 0.6190000 -1.854000      0.9092000 
1 1 1 8  31 39 o 8.810000 0.6757000 9.748000 0.8374000 7.871000 1.061000  1.876000       1.351000  
1 1 1 8  31 41 o 12.62000 0.4325000 12.61000 0.6343000 12.63000 0.5881000 -0.2649000E-01 0.8650000 
1 1 1 8  31 43 o 7.001000 0.7266000 6.350000 1.146000  7.652000 0.8940000 -1.302000      1.453000  
1 1 1 8  31 45 o 16.25000 0.3716000 16.03000 0.5322000 16.48000 0.5187000 -0.4461000     0.7432000 
1 1 1 8  31 47 o 4.726000 0.9560000 3.944000 1.427000  5.509000 1.273000  -1.565000      1.912000  
1 1 1 8  31 49 o 8.471000 0.8047000 9.023000 0.8397000 7.920000 1.373000  1.103000       1.609000  
1 1 1 8  31 51 o 10.53000 0.6021000 10.40000 0.7941000 10.66000 0.9052000 -0.2573000     1.204000  
1 1 1 8  31 53 o 4.242000 1.002000  4.553000 1.412000  3.931000 1.421000  0.6225000      2.003000  
1 1 1 8  31 55 o 3.908000 1.039000  4.885000 1.648000  2.931000 1.265000  1.954000       2.078000  
1 1 1 8  31 57 o 6.876000 0.8412000 7.690000 1.271000  6.061000 1.102000  1.629000       1.682000  
1 1 1 8  32 0  o 17.41000 0.3969000 17.41000 0.3969000 17.41000 0.3969000 0.000000       0.000000  
1 1 1 8  32 2  f 66.76000 0.5172000 66.67000 0.6765000 66.85000 0.7825000 -0.1822000     1.034000  
1 1 1 8  32 4  o 60.31000 0.4517000 61.35000 0.5621000 59.26000 0.7073000 2.098000       0.9034000 
1 1 1 8  32 6  o 102.2000 0.8648000 102.3000 0.9993000 102.1000 1.412000  0.2096000      1.730000  
1 1 1 8  32 8  o 52.96000 0.4726000 53.46000 0.5035000 52.46000 0.8000000 0.9993000      0.9453000 
1 1 1 8  32 10 o 43.60000 0.4308000 43.49000 0.4906000 43.71000 0.7083000 -0.2167000     0.8616000 
1 1 1 8  32 12 o 10.82000 0.5240000 10.61000 0.5237000 11.03000 0.9078000 -0.4150000     1.048000  
1 1 1 8  32 14 o 37.21000 0.3818000 37.63000 0.3952000 36.78000 0.6534000 0.8551000      0.7636000 
1 1 1 8  32 16 o 34.08000 0.3808000 33.69000 0.4223000 34.48000 0.6337000 -0.7834000     0.7615000 
1 1 1 8  32 18 o 34.14000 0.3428000 34.41000 0.3790000 33.87000 0.5714000 0.5327000      0.6856000 
1 1 1 8  32 20 o 62.63000 0.4701000 62.53000 0.5765000 62.72000 0.7427000 -0.1940000     0.9402000 
1 1 1 8  32 22 o 5.331000 0.8713000 6.267000 1.148000  4.396000 1.311000  1.871000       1.743000  
1 1 1 8  32 24 o 30.56000 0.3062000 30.83000 0.3782000 30.29000 0.4817000 0.5313000      0.6124000 
1 1 1 8  32 26 o 3.634000 0.9391000 2.845000 1.191000  4.423000 1.453000  -1.578000      1.878000  
1 1 1 8  32 28 o 28.56000 0.3007000 28.65000 0.4185000 28.48000 0.4320000 0.1723000      0.6014000 
1 1 1 8  32 30 o 20.13000 0.3737000 20.55000 0.5855000 19.72000 0.4646000 0.8279000      0.7475000 
1 1 1 8  32 32 o 27.26000 0.3167000 27.34000 0.4444000 27.18000 0.4514000 0.1593000      0.6334000 
1 1 1 8  32 34 o 11.51000 0.5226000 11.84000 0.6019000 11.17000 0.8545000 0.6672000      1.045000  
1 1 1 8  32 36 o 11.06000 0.5748000 11.07000 0.7791000 11.04000 0.8453000 0.2966000E-01  1.150000  
1 1 1 8  32 38 o 24.94000 0.3364000 25.08000 0.4355000 24.81000 0.5129000 0.2764000      0.6729000 
1 1 1 8  32 40 o 16.01000 0.3991000 15.91000 0.6144000 16.10000 0.5095000 -0.1840000     0.7981000 
1 1 1 8  32 42 o 6.325000 0.8504000 6.280000 1.349000  6.370000 1.036000  -0.9004000E-01 1.701000  
1 1 1 8  32 44 o 8.527000 0.5946000 9.636000 0.7457000 7.417000 0.9263000 2.219000       1.189000  
1 1 1 8  32 46 o 5.375000 0.9305000 6.392000 1.265000  4.357000 1.365000  2.035000       1.861000  
1 1 1 8  32 48 o 7.668000 0.7372000 6.799000 1.078000  8.536000 1.006000  -1.737000      1.474000  
1 1 1 8  32 50 o 3.170000 0.9447000 3.794000 1.461000  2.546000 1.199000  1.248000       1.889000  
1 1 1 8  32 52 o 5.012000 1.189000  5.440000 1.872000  4.584000 1.467000  0.8555000      2.378000  
1 1 1 8  32 54 o 3.404000 0.9605000 3.864000 1.474000  2.944000 1.232000  0.9195000      1.921000  
1 1 1 8  32 56 o 7.586000 0.7392000 6.787000 1.245000  8.384000 0.7974000 -1.597000      1.478000  
1 1 1 8  33 1  o 31.60000 0.2942000 31.52000 0.3573000 31.67000 0.4675000 -0.1489000     0.5884000 
1 1 1 8  33 3  o 21.14000 0.2877000 20.82000 0.3760000 21.46000 0.4354000 -0.6358000     0.5753000 
1 1 1 8  33 5  o 34.25000 0.3085000 33.97000 0.3724000 34.52000 0.4918000 -0.5411000     0.6169000 
1 1 1 8  33 7  o 51.23000 0.3974000 50.96000 0.4837000 51.49000 0.6306000 -0.5255000     0.7948000 
1 1 1 8  33 9  o 48.27000 0.4459000 47.97000 0.5123000 48.57000 0.7299000 -0.5955000     0.8917000 
1 1 1 8  33 11 o 32.38000 0.3159000 32.25000 0.4145000 32.52000 0.4768000 -0.2732000     0.6318000 
1 1 1 8  33 13 o 36.65000 0.3810000 36.79000 0.3924000 36.51000 0.6532000 0.2758000      0.7620000 
1 1 1 8  33 15 o 28.07000 0.3025000 28.07000 0.3997000 28.08000 0.4542000 -0.1206000E-01 0.6051000 
1 1 1 8  33 17 o 17.14000 0.3525000 17.89000 0.4329000 16.39000 0.5564000 1.497000       0.7050000 
1 1 1 8  33 19 o 32.76000 0.3043000 32.88000 0.3781000 32.64000 0.4769000 0.2388000      0.6086000 
1 1 1 8  33 21 o 19.04000 0.3087000 18.41000 0.4001000 19.67000 0.4702000 -1.264000      0.6174000 
1 1 1 8  33 23 o 23.03000 0.3165000 23.00000 0.4346000 23.06000 0.4603000 -0.5735000E-01 0.6331000 
1 1 1 8  33 25 o 19.95000 0.3114000 20.64000 0.3873000 19.26000 0.4878000 1.384000       0.6229000 
1 1 1 8  33 27 o 5.586000 0.8753000 5.708000 1.005000  5.464000 1.433000  0.2444000      1.751000  
1 1 1 8  33 29 o 7.473000 0.7913000 6.940000 1.293000  8.007000 0.9119000 -1.067000      1.583000  
1 1 1 8  33 31 f 19.01000 0.3304000 19.06000 0.4582000 18.97000 0.4761000 0.8966000E-01  0.6608000 
1 1 1 8  33 33 o 12.90000 0.4597000 12.68000 0.6018000 13.12000 0.6952000 -0.4415000     0.9195000 
1 1 1 8  33 35 o 15.52000 0.4173000 15.16000 0.5299000 15.88000 0.6448000 -0.7228000     0.8346000 
1 1 1 8  33 37 o 11.48000 0.4795000 11.42000 0.6314000 11.54000 0.7218000 -0.1173000     0.9590000 
1 1 1 8  33 39 o 7.349000 0.7139000 7.497000 1.030000  7.201000 0.9885000 0.2966000      1.428000  
1 1 1 8  33 41 f 7.813000 0.7120000 7.324000 1.175000  8.302000 0.8049000 -0.9779000     1.424000  
1 1 1 8  33 43 o 12.29000 0.4286000 12.66000 0.6099000 11.91000 0.6025000 0.7487000      0.8573000 
1 1 1 8  33 45 o 9.316000 0.5663000 9.732000 0.7965000 8.900000 0.8051000 0.8326000      1.133000  
1 1 1 8  33 47 o 5.056000 1.011000  4.279000 1.445000  5.832000 1.415000  -1.553000      2.023000  
1 1 1 8  33 49 o 13.04000 0.7534000 11.79000 0.8013000 14.30000 1.276000  -2.509000      1.507000  
1 1 1 8  33 51 o 11.52000 0.5051000 11.14000 0.6928000 11.91000 0.7353000 -0.7684000     1.010000  
1 1 1 8  33 53 o 12.94000 0.4483000 12.69000 0.6463000 13.20000 0.6215000 -0.5144000     0.8966000 
1 1 1 8  33 55 o 9.124000 0.5921000 9.475000 0.8568000 8.773000 0.8174000 0.7020000      1.184000  
1 1 1 8  33 57 o 8.989000 0.9515000 8.909000 1.497000  9.068000 1.174000  -0.1587000     1.903000  
1 1 1 8  34 0  o 43.05000 0.4760000 43.05000 0.4760000 43.05000 0.4760000 0.000000       0.000000  
1 1 1 8  34 2  o 55.64000 0.4233000 56.00000 0.5198000 55.28000 0.6682000 0.7235000      0.8466000 
1 1 1 8  34 4  o 26.92000 0.2976000 27.09000 0.3903000 26.74000 0.4495000 0.3565000      0.5953000 
1 1 1 8  34 6  o 26.64000 0.2954000 26.46000 0.3906000 26.81000 0.4432000 -0.3554000     0.5908000 
1 1 1 8  34 8  o 29.43000 0.2896000 29.04000 0.3557000 29.81000 0.4570000 -0.7672000     0.5791000 
1 1 1 8  34 10 o 32.26000 0.3413000 32.34000 0.4914000 32.17000 0.4738000 0.1675000      0.6827000 
1 1 1 8  34 12 o 40.80000 0.3934000 40.63000 0.4585000 40.98000 0.6395000 -0.3510000     0.7869000 
1 1 1 8  34 14 o 23.83000 0.3210000 23.64000 0.4007000 24.01000 0.5015000 -0.3722000     0.6419000 
1 1 1 8  34 16 o 31.61000 0.2992000 31.58000 0.3723000 31.64000 0.4684000 -0.6493000E-01 0.5983000 
1 1 1 8  34 18 o 54.12000 0.4418000 53.37000 0.5766000 54.86000 0.6696000 -1.486000      0.8836000 
1 1 1 8  34 20 o 45.86000 0.3867000 45.25000 0.4983000 46.47000 0.5915000 -1.226000      0.7734000 
1 1 1 8  34 22 o 36.63000 0.3471000 36.16000 0.4635000 37.09000 0.5166000 -0.9290000     0.6941000 
1 1 1 8  34 24 o 9.726000 0.5085000 9.789000 0.6205000 9.663000 0.8057000 0.1263000      1.017000  
1 1 1 8  34 26 o 16.59000 0.3476000 16.54000 0.4224000 16.63000 0.5522000 -0.8690000E-01 0.6952000 
1 1 1 8  34 28 o 28.50000 0.3703000 28.48000 0.5935000 28.52000 0.4432000 -0.3931000E-01 0.7407000 
1 1 1 8  34 30 o 19.73000 0.3261000 19.50000 0.4580000 19.97000 0.4644000 -0.4689000     0.6522000 
1 1 1 8  34 32 o 9.006000 0.6658000 9.173000 0.9212000 8.839000 0.9615000 0.3344000      1.332000  
1 1 1 8  34 34 o 21.15000 0.3148000 21.75000 0.4298000 20.54000 0.4600000 1.210000       0.6296000 
1 1 1 8  34 36 o 12.17000 0.5091000 12.09000 0.6061000 12.25000 0.8182000 -0.1615000     1.018000  
1 1 1 8  34 38 o 15.08000 0.4071000 15.15000 0.5996000 15.00000 0.5510000 0.1480000      0.8143000 
1 1 1 8  34 40 o 3.601000 0.9545000 3.432000 1.391000  3.770000 1.307000  -0.3376000     1.909000  
1 1 1 8  34 42 f 11.73000 0.4582000 11.55000 0.6765000 11.91000 0.6182000 -0.3611000     0.9164000 
1 1 1 8  34 44 o 3.664000 0.9460000 3.490000 1.352000  3.838000 1.324000  -0.3484000     1.892000  
1 1 1 8  34 46 o 11.77000 0.4867000 11.35000 0.6710000 12.19000 0.7050000 -0.8418000     0.9733000 
1 1 1 8  34 48 o 15.80000 0.3841000 15.72000 0.5515000 15.89000 0.5348000 -0.1643000     0.7683000 
1 1 1 8  34 50 o 4.167000 1.017000  4.128000 1.379000  4.207000 1.496000  -0.7841000E-01 2.034000  
1 1 1 8  34 52 o 3.873000 0.9599000 3.579000 1.327000  4.168000 1.387000  -0.5895000     1.920000  
1 1 1 8  34 54 o 2.922000 0.8806000 2.719000 1.204000  3.125000 1.285000  -0.4059000     1.761000  
1 1 1 8  34 56 o 6.070000 0.9246000 7.376000 1.003000  4.765000 1.554000  2.611000       1.849000  
1 1 1 8  35 1  o 30.46000 0.2924000 30.51000 0.3522000 30.41000 0.4669000 0.1037000      0.5848000 
1 1 1 8  35 3  o 20.72000 0.2836000 21.02000 0.3433000 20.41000 0.4515000 0.6159000      0.5672000 
1 1 1 8  35 5  o 33.58000 0.3226000 33.39000 0.4230000 33.76000 0.4871000 -0.3711000     0.6451000 
1 1 1 8  35 7  o 30.89000 0.3137000 30.62000 0.4097000 31.15000 0.4752000 -0.5252000     0.6274000 
1 1 1 8  35 9  o 29.14000 0.3050000 29.02000 0.4080000 29.25000 0.4536000 -0.2248000     0.6101000 
1 1 1 8  35 11 o 27.33000 0.3006000 27.23000 0.3948000 27.43000 0.4535000 -0.1981000     0.6013000 
1 1 1 8  35 13 o 18.73000 0.3242000 18.32000 0.4205000 19.14000 0.4936000 -0.8167000     0.6484000 
1 1 1 8  35 15 o 35.42000 0.3669000 35.54000 0.4332000 35.30000 0.5923000 0.2407000      0.7339000 
1 1 1 8  35 17 o 28.51000 0.2988000 28.32000 0.3749000 28.69000 0.4654000 -0.3751000     0.5976000 
1 1 1 8  35 19 o 2.763000 0.8494000 2.501000 1.100000  3.025000 1.295000  -0.5243000     1.699000  
1 1 1 8  35 21 o 9.973000 0.4922000 9.627000 0.7076000 10.32000 0.6843000 -0.6912000     0.9843000 
1 1 1 8  35 23 o 14.69000 0.3547000 14.34000 0.4486000 15.05000 0.5495000 -0.7085000     0.7094000 
1 1 1 8  35 25 o 26.67000 0.3266000 26.98000 0.4332000 26.36000 0.4889000 0.6284000      0.6532000 
1 1 1 8  35 27 o 39.48000 0.3673000 39.25000 0.4832000 39.71000 0.5534000 -0.4626000     0.7346000 
1 1 1 8  35 29 o 19.99000 0.3235000 19.88000 0.4405000 20.10000 0.4738000 -0.2160000     0.6469000 
1 1 1 8  35 31 o 5.609000 0.8290000 6.606000 0.9075000 4.612000 1.388000  1.994000       1.658000  
1 1 1 8  35 33 o 8.083000 0.6719000 8.978000 0.7460000 7.189000 1.118000  1.788000       1.344000  
1 1 1 8  35 35 o 8.225000 0.5680000 9.198000 0.7146000 7.252000 0.8832000 1.946000       1.136000  
1 1 1 8  35 37 o 5.829000 0.8548000 6.256000 1.233000  5.402000 1.184000  0.8539000      1.710000  
1 1 1 8  35 39 o 8.783000 0.5541000 9.247000 0.8197000 8.320000 0.7458000 0.9273000      1.108000  
1 1 1 8  35 41 o 7.214000 0.6844000 7.420000 0.9858000 7.008000 0.9497000 0.4123000      1.369000  
1 1 1 8  35 43 o 14.35000 0.3929000 14.74000 0.5600000 13.95000 0.5512000 0.7966000      0.7858000 
1 1 1 8  35 45 o 3.937000 0.9539000 4.279000 1.397000  3.594000 1.299000  0.6849000      1.908000  
1 1 1 8  35 47 o 5.811000 0.8791000 4.811000 1.367000  6.811000 1.106000  -2.000000      1.758000  
1 1 1 8  35 49 o 8.192000 0.6384000 7.785000 0.9941000 8.599000 0.8014000 -0.8140000     1.277000  
1 1 1 8  35 51 o 7.852000 0.6927000 7.093000 1.099000  8.611000 0.8438000 -1.518000      1.385000  
1 1 1 8  35 53 o 4.269000 1.057000  4.256000 1.582000  4.281000 1.402000  -0.2552000E-01 2.114000  
1 1 1 8  35 55 o 3.885000 0.8844000 5.210000 1.340000  2.560000 1.155000  2.650000       1.769000  
1 1 1 8  36 0  o 22.21000 0.3856000 22.21000 0.3856000 22.21000 0.3856000 0.000000       0.000000  
1 1 1 8  36 2  o 23.51000 0.2859000 23.32000 0.3407000 23.70000 0.4592000 -0.3799000     0.5718000 
1 1 1 8  36 4  o 23.26000 0.2879000 22.55000 0.3463000 23.97000 0.4601000 -1.422000      0.5758000 
1 1 1 8  36 6  o 22.93000 0.2843000 22.91000 0.3488000 22.95000 0.4491000 -0.3815000E-01 0.5686000 
1 1 1 8  36 8  o 33.09000 0.3491000 33.32000 0.5044000 32.86000 0.4828000 0.4550000      0.6982000 
1 1 1 8  36 10 o 30.80000 0.3329000 31.08000 0.4739000 30.51000 0.4676000 0.5676000      0.6658000 
1 1 1 8  36 12 o 7.068000 0.6227000 6.463000 0.9508000 7.674000 0.8042000 -1.211000      1.245000  
1 1 1 8  36 14 o 37.68000 0.3298000 37.68000 0.4103000 37.69000 0.5163000 -0.7553000E-02 0.6595000 
1 1 1 8  36 16 o 17.23000 0.3128000 17.83000 0.4077000 16.64000 0.4746000 1.188000       0.6256000 
1 1 1 8  36 18 o 36.81000 0.3702000 37.23000 0.5308000 36.40000 0.5162000 0.8258000      0.7404000 
1 1 1 8  36 20 o 44.74000 0.3909000 44.50000 0.5182000 44.97000 0.5853000 -0.4709000     0.7817000 
1 1 1 8  36 22 o 23.60000 0.3096000 23.43000 0.3787000 23.76000 0.4899000 -0.3203000     0.6192000 
1 1 1 8  36 24 o 32.33000 0.3312000 32.38000 0.4354000 32.28000 0.4991000 0.9837000E-01  0.6623000 
1 1 1 8  36 26 o 13.81000 0.4288000 13.17000 0.5952000 14.45000 0.6173000 -1.282000      0.8575000 
1 1 1 8  36 28 o 10.61000 0.6618000 11.50000 0.7550000 9.716000 1.087000  1.780000       1.324000  
1 1 1 8  36 30 o 14.12000 0.3865000 14.71000 0.4884000 13.52000 0.5993000 1.188000       0.7731000 
1 1 1 8  36 32 f 19.75000 0.3517000 19.93000 0.4415000 19.58000 0.5475000 0.3500000      0.7033000 
1 1 1 8  36 34 o 11.18000 0.4100000 11.96000 0.5536000 10.40000 0.6048000 1.563000       0.8199000 
1 1 1 8  36 36 f 12.74000 0.4249000 12.67000 0.5657000 12.82000 0.6343000 -0.1412000     0.8499000 
1 1 1 8  36 38 o 11.13000 0.4265000 10.90000 0.6144000 11.36000 0.5915000 -0.4590000     0.8529000 
1 1 1 8  36 40 o 3.856000 0.9203000 3.920000 1.306000  3.793000 1.297000  0.1269000      1.841000  
1 1 1 8  36 42 o 11.91000 0.4415000 12.53000 0.6004000 11.30000 0.6474000 1.232000       0.8830000 
1 1 1 8  36 44 o 9.047000 0.5642000 8.429000 0.8700000 9.664000 0.7187000 -1.236000      1.128000  
1 1 1 8  36 46 o 8.523000 0.6306000 8.208000 0.8923000 8.838000 0.8914000 -0.6295000     1.261000  
1 1 1 8  36 48 o 2.923000 0.9272000 3.062000 1.352000  2.784000 1.270000  0.2781000      1.854000  
1 1 1 8  36 50 o 3.928000 1.010000  3.247000 1.414000  4.610000 1.442000  -1.363000      2.020000  
1 1 1 8  36 52 o 5.442000 0.9231000 5.334000 1.339000  5.550000 1.271000  -0.2159000     1.846000  
1 1 1 8  36 54 o 4.645000 0.9394000 3.483000 1.419000  5.807000 1.231000  -2.325000      1.879000  
1 1 1 8  37 1  o 12.57000 0.3703000 11.99000 0.4353000 13.14000 0.5992000 -1.145000      0.7406000 
1 1 1 8  37 3  o 32.82000 0.3104000 32.15000 0.3715000 33.49000 0.4974000 -1.337000      0.6208000 
1 1 1 8  37 5  o 20.06000 0.2943000 19.86000 0.3599000 20.25000 0.4659000 -0.3822000     0.5887000 
1 1 1 8  37 7  o 52.13000 0.4264000 52.40000 0.5616000 51.86000 0.6417000 0.5417000      0.8527000 
1 1 1 8  37 9  o 8.766000 0.5317000 8.587000 0.6897000 8.945000 0.8095000 -0.3573000     1.063000  
1 1 1 8  37 11 o 57.62000 0.4630000 57.36000 0.6081000 57.88000 0.6984000 -0.5196000     0.9261000 
1 1 1 8  37 13 o 50.06000 0.4197000 49.80000 0.5541000 50.33000 0.6306000 -0.5299000     0.8394000 
1 1 1 8  37 15 o 16.85000 0.3623000 16.69000 0.5285000 17.01000 0.4957000 -0.3202000     0.7246000 
1 1 1 8  37 17 o 15.52000 0.3764000 15.83000 0.5294000 15.21000 0.5353000 0.6176000      0.7529000 
1 1 1 8  37 19 o 23.88000 0.3587000 24.65000 0.4498000 23.11000 0.5590000 1.541000       0.7175000 
1 1 1 8  37 21 o 16.53000 0.3571000 17.36000 0.4511000 15.70000 0.5537000 1.662000       0.7142000 
1 1 1 8  37 23 o 15.17000 0.4087000 15.78000 0.5608000 14.56000 0.5947000 1.220000       0.8175000 
1 1 1 8  37 25 o 17.75000 0.4053000 18.28000 0.5967000 17.23000 0.5486000 1.056000       0.8106000 
1 1 1 8  37 27 o 14.33000 0.4131000 14.35000 0.5467000 14.31000 0.6194000 0.4319000E-01  0.8261000 
1 1 1 8  37 29 o 9.131000 0.5299000 8.525000 0.7601000 9.738000 0.7386000 -1.213000      1.060000  
1 1 1 8  37 31 o 13.34000 0.4119000 13.05000 0.5181000 13.63000 0.6404000 -0.5790000     0.8237000 
1 1 1 8  37 33 o 26.72000 0.3256000 27.10000 0.4267000 26.35000 0.4919000 0.7453000      0.6512000 
1 1 1 8  37 35 o 7.987000 0.6385000 8.189000 0.7563000 7.784000 1.029000  0.4044000      1.277000  
1 1 1 8  37 37 o 6.136000 0.7300000 6.210000 1.040000  6.062000 1.024000  0.1474000      1.460000  
1 1 1 8  37 39 o 9.622000 0.5901000 9.742000 0.9695000 9.502000 0.6731000 0.2397000      1.180000  
1 1 1 8  37 41 o 5.971000 0.8087000 5.240000 1.273000  6.703000 0.9972000 -1.463000      1.617000  
1 1 1 8  37 43 o 11.10000 0.4612000 11.07000 0.6819000 11.14000 0.6211000 -0.6916000E-01 0.9224000 
1 1 1 8  37 45 o 7.148000 0.7002000 6.440000 1.055000  7.856000 0.9204000 -1.416000      1.400000  
1 1 1 8  37 47 o 4.549000 1.033000  4.422000 1.467000  4.676000 1.454000  -0.2534000     2.065000  
1 1 1 8  37 49 o 6.667000 0.8710000 6.761000 1.401000  6.573000 1.036000  0.1879000      1.742000  
1 1 1 8  37 51 o 5.730000 0.9612000 6.091000 1.373000  5.369000 1.346000  0.7215000      1.922000  
1 1 1 8  37 53 o 8.410000 0.7347000 8.939000 1.106000  7.880000 0.9670000 1.058000       1.469000  
1 1 1 8  38 0  o 24.07000 0.4036000 24.07000 0.4036000 24.07000 0.4036000 0.000000       0.000000  
1 1 1 8  38 2  o 50.34000 0.4182000 50.48000 0.5504000 50.20000 0.6298000 0.2835000      0.8364000 
1 1 1 8  38 4  o 57.50000 0.4425000 57.46000 0.5392000 57.54000 0.7018000 -0.8065000E-01 0.8850000 
1 1 1 8  38 6  o 10.06000 0.4436000 10.85000 0.6257000 9.274000 0.6289000 1.572000       0.8872000 
1 1 1 8  38 8  o 11.67000 0.4395000 11.84000 0.4932000 11.50000 0.7276000 0.3350000      0.8789000 
1 1 1 8  38 10 o 38.43000 0.3358000 38.86000 0.4202000 38.00000 0.5240000 0.8575000      0.6717000 
1 1 1 8  38 12 o 44.44000 0.3860000 43.77000 0.5078000 45.12000 0.5816000 -1.349000      0.7721000 
1 1 1 8  38 14 o 18.18000 0.3555000 18.79000 0.5218000 17.57000 0.4829000 1.223000       0.7110000 
1 1 1 8  38 16 o 17.21000 0.3498000 17.62000 0.4812000 16.81000 0.5079000 0.8025000      0.6996000 
1 1 1 8  38 18 o 22.32000 0.3066000 22.40000 0.3884000 22.24000 0.4746000 0.1632000      0.6133000 
1 1 1 8  38 20 o 44.15000 0.3930000 43.23000 0.5151000 45.07000 0.5938000 -1.846000      0.7861000 
1 1 1 8  38 22 o 25.02000 0.3817000 24.81000 0.4958000 25.22000 0.5804000 -0.4139000     0.7634000 
1 1 1 8  38 24 o 37.65000 0.4397000 38.52000 0.5428000 36.78000 0.6918000 1.742000       0.8793000 
1 1 1 8  38 26 o 16.74000 0.3684000 16.98000 0.4782000 16.49000 0.5606000 0.4879000      0.7369000 
1 1 1 8  38 28 o 14.11000 0.4078000 14.28000 0.5267000 13.94000 0.6226000 0.3390000      0.8155000 
1 1 1 8  38 30 o 24.01000 0.3323000 24.14000 0.4205000 23.87000 0.5147000 0.2661000      0.6646000 
1 1 1 8  38 32 o 21.58000 0.3191000 21.38000 0.4096000 21.79000 0.4894000 -0.4107000     0.6382000 
1 1 1 8  38 34 o 13.75000 0.3683000 13.81000 0.5007000 13.69000 0.5404000 0.1208000      0.7367000 
1 1 1 8  38 36 o 20.64000 0.3194000 20.66000 0.4451000 20.62000 0.4582000 0.4107000E-01  0.6387000 
1 1 1 8  38 38 o 15.46000 0.3689000 15.33000 0.5529000 15.60000 0.4883000 -0.2733000     0.7377000 
1 1 1 8  38 40 o 3.582000 0.9292000 3.355000 1.309000  3.809000 1.319000  -0.4541000     1.858000  
1 1 1 8  38 42 o 4.915000 0.9123000 5.292000 1.317000  4.538000 1.263000  0.7534000      1.825000  
1 1 1 8  38 44 o 10.75000 0.4963000 9.717000 0.7489000 11.77000 0.6514000 -2.056000      0.9926000 
1 1 1 8  38 46 o 7.686000 0.6932000 7.224000 1.125000  8.149000 0.8101000 -0.9246000     1.386000  
1 1 1 8  38 48 o 10.39000 0.5348000 9.669000 0.8390000 11.11000 0.6633000 -1.438000      1.070000  
1 1 1 8  38 50 o 7.041000 0.7859000 7.484000 0.9963000 6.598000 1.216000  0.8860000      1.572000  
1 1 1 8  38 52 o 5.351000 0.8584000 4.156000 1.393000  6.547000 1.003000  -2.391000      1.717000  
1 1 1 8  39 1  o 61.77000 0.4694000 61.50000 0.5698000 62.03000 0.7462000 -0.5344000     0.9389000 
1 1 1 8  39 3  o 37.58000 0.3333000 37.57000 0.4092000 37.59000 0.5261000 -0.2057000E-01 0.6665000 
1 1 1 8  39 5  o 13.87000 0.4075000 14.08000 0.5232000 13.66000 0.6247000 0.4175000      0.8149000 
1 1 1 8  39 7  o 10.64000 0.4392000 10.56000 0.5584000 10.73000 0.6781000 -0.1749000     0.8784000 
1 1 1 8  39 9  o 8.146000 0.5424000 8.456000 0.6780000 7.836000 0.8468000 0.6200000      1.085000  
1 1 1 8  39 11 o 9.871000 0.4622000 9.684000 0.6236000 10.06000 0.6823000 -0.3737000     0.9244000 
1 1 1 8  39 13 o 11.38000 0.4188000 11.63000 0.5637000 11.12000 0.6196000 0.5040000      0.8376000 
1 1 1 8  39 15 o 16.73000 0.3297000 17.07000 0.4253000 16.40000 0.5038000 0.6652000      0.6593000 
1 1 1 8  39 17 o 26.46000 0.3077000 26.47000 0.3868000 26.44000 0.4787000 0.3290000E-01  0.6154000 
1 1 1 8  39 19 o 30.27000 0.3338000 31.17000 0.4580000 29.36000 0.4857000 1.811000       0.6676000 
1 1 1 8  39 21 o 26.54000 0.4190000 26.51000 0.5275000 26.56000 0.6512000 -0.4979000E-01 0.8381000 
1 1 1 8  39 23 o 34.11000 0.3469000 33.34000 0.4474000 34.88000 0.5302000 -1.538000      0.6937000 
1 1 1 8  39 25 o 18.13000 0.3978000 17.32000 0.4748000 18.94000 0.6383000 -1.625000      0.7955000 
1 1 1 8  39 27 o 5.766000 0.8199000 5.430000 1.089000  6.103000 1.226000  -0.6731000     1.640000  
1 1 1 8  39 29 o 16.46000 0.3634000 15.89000 0.4831000 17.03000 0.5431000 -1.136000      0.7269000 
1 1 1 8  39 31 o 21.92000 0.3442000 21.36000 0.4875000 22.48000 0.4861000 -1.120000      0.6885000 
1 1 1 8  39 33 o 7.379000 0.5872000 7.339000 0.7828000 7.418000 0.8754000 -0.7933000E-01 1.174000  
1 1 1 8  39 35 f 18.87000 0.3711000 18.65000 0.4944000 19.09000 0.5536000 -0.4344000     0.7422000 
1 1 1 8  39 37 o 2.919000 0.8541000 3.139000 1.253000  2.698000 1.161000  0.4410000      1.708000  
1 1 1 8  39 39 o 19.83000 0.3577000 20.10000 0.5422000 19.57000 0.4669000 0.5282000      0.7155000 
1 1 1 8  39 41 o 10.61000 0.4675000 10.62000 0.6916000 10.59000 0.6293000 0.2623000E-01  0.9350000 
1 1 1 8  39 43 o 4.679000 0.9050000 3.888000 1.369000  5.470000 1.185000  -1.582000      1.810000  
1 1 1 8  39 45 o 7.203000 0.7844000 7.275000 1.061000  7.131000 1.156000  0.1434000      1.569000  
1 1 1 8  39 47 f 3.297000 0.9428000 3.550000 1.403000  3.044000 1.260000  0.5066000      1.886000  
1 1 1 8  39 49 o 7.273000 0.7105000 7.010000 1.066000  7.536000 0.9393000 -0.5262000     1.421000  
1 1 1 8  39 51 o 9.505000 0.5456000 9.235000 0.8069000 9.776000 0.7345000 -0.5409000     1.091000  
1 1 1 8  40 0  o 2.829000 1.178000  2.829000 1.178000  2.829000 1.178000  0.000000       0.000000  
1 1 1 8  40 2  o 19.84000 0.3482000 19.63000 0.3867000 20.05000 0.5791000 -0.4203000     0.6963000 
1 1 1 8  40 4  o 7.104000 0.7589000 6.516000 1.020000  7.692000 1.124000  -1.175000      1.518000  
1 1 1 8  40 6  o 20.44000 0.3368000 20.30000 0.4017000 20.59000 0.5407000 -0.2910000     0.6736000 
1 1 1 8  40 8  o 38.15000 0.3392000 37.90000 0.4143000 38.40000 0.5371000 -0.5026000     0.6783000 
1 1 1 8  40 10 o 37.37000 0.3757000 37.50000 0.5286000 37.24000 0.5339000 0.2690000      0.7513000 
1 1 1 8  40 12 o 4.909000 0.8509000 5.429000 1.071000  4.388000 1.322000  1.041000       1.702000  
1 1 1 8  40 14 o 7.354000 0.6568000 8.122000 0.7567000 6.586000 1.074000  1.536000       1.314000  
1 1 1 8  40 16 o 10.58000 0.4542000 10.35000 0.5835000 10.81000 0.6962000 -0.4636000     0.9084000 
1 1 1 8  40 18 o 4.963000 0.9806000 6.203000 1.375000  3.724000 1.399000  2.479000       1.961000  
1 1 1 8  40 20 o 25.04000 0.3290000 24.45000 0.4473000 25.63000 0.4826000 -1.186000      0.6580000 
1 1 1 8  40 22 o 6.658000 0.7860000 7.436000 0.9700000 5.881000 1.237000  1.556000       1.572000  
1 1 1 8  40 24 o 9.815000 0.5385000 9.783000 0.6858000 9.847000 0.8304000 -0.6394000E-01 1.077000  
1 1 1 8  40 26 f 10.32000 0.5208000 10.75000 0.5412000 9.888000 0.8900000 0.8667000      1.042000  
1 1 1 8  40 28 o 17.57000 0.3710000 17.52000 0.4282000 17.63000 0.6059000 -0.1035000     0.7420000 
1 1 1 8  40 30 o 10.13000 0.4816000 9.713000 0.6583000 10.55000 0.7032000 -0.8402000     0.9633000 
1 1 1 8  40 32 o 7.506000 0.5640000 6.905000 0.8213000 8.106000 0.7733000 -1.200000      1.128000  
1 1 1 8  40 34 o 5.720000 0.8494000 5.092000 1.215000  6.348000 1.188000  -1.256000      1.699000  
1 1 1 8  40 36 o 6.613000 0.6399000 6.745000 0.8524000 6.481000 0.9547000 0.2639000      1.280000  
1 1 1 8  40 38 o 4.188000 0.8463000 3.347000 1.229000  5.029000 1.164000  -1.682000      1.693000  
1 1 1 8  40 40 o 6.475000 0.7478000 6.344000 1.094000  6.606000 1.020000  -0.2617000     1.496000  
1 1 1 8  40 42 o 6.492000 0.7023000 6.444000 1.034000  6.541000 0.9505000 -0.9701000E-01 1.405000  
1 1 1 8  40 44 o 4.381000 0.9831000 4.479000 1.293000  4.283000 1.481000  0.1964000      1.966000  
1 1 1 8  40 46 o 3.557000 0.9513000 2.778000 1.244000  4.336000 1.440000  -1.558000      1.903000  
1 1 1 8  40 48 o 4.414000 1.001000  4.915000 1.512000  3.913000 1.313000  1.002000       2.003000  
1 1 1 8  40 50 o 4.532000 0.9623000 5.130000 1.300000  3.934000 1.419000  1.195000       1.925000  
1 1 1 8  41 1  o 42.45000 0.4226000 43.11000 0.4958000 41.78000 0.6846000 1.328000       0.8452000 
1 1 1 8  41 3  o 29.42000 0.3539000 29.54000 0.5031000 29.31000 0.4979000 0.2273000      0.7078000 
1 1 1 8  41 5  o 6.150000 0.8028000 5.520000 1.191000  6.779000 1.077000  -1.259000      1.606000  
1 1 1 8  41 7  o 17.82000 0.3431000 17.74000 0.4721000 17.90000 0.4978000 -0.1632000     0.6861000 
1 1 1 8  41 9  o 19.35000 0.3913000 19.21000 0.6062000 19.50000 0.4951000 -0.2939000     0.7827000 
1 1 1 8  41 11 o 22.96000 0.3273000 22.99000 0.4423000 22.93000 0.4825000 0.5956000E-01  0.6546000 
1 1 1 8  41 13 o 20.03000 0.3716000 20.29000 0.5562000 19.77000 0.4929000 0.5135000      0.7432000 
1 1 1 8  41 15 o 13.43000 0.3962000 13.79000 0.5426000 13.08000 0.5774000 0.7031000      0.7924000 
1 1 1 8  41 17 o 10.27000 0.6147000 9.145000 0.7617000 11.39000 0.9650000 -2.240000      1.229000  
1 1 1 8  41 19 o 6.531000 0.7115000 6.952000 0.8598000 6.109000 1.134000  0.8435000      1.423000  
1 1 1 8  41 21 o 22.24000 0.3347000 22.30000 0.4472000 22.17000 0.4980000 0.1253000      0.6694000 
1 1 1 8  41 23 f 19.60000 0.3374000 19.61000 0.4589000 19.59000 0.4946000 0.2249000E-01  0.6747000 
1 1 1 8  41 25 o 8.265000 0.7124000 8.095000 0.6792000 8.435000 1.252000  -0.3400000     1.425000  
1 1 1 8  41 27 o 10.05000 0.4981000 10.59000 0.5273000 9.504000 0.8451000 1.086000       0.9961000 
1 1 1 8  41 29 o 4.604000 0.8832000 3.846000 1.229000  5.361000 1.269000  -1.515000      1.766000  
1 1 1 8  41 31 o 17.08000 0.3380000 17.33000 0.4658000 16.83000 0.4900000 0.5024000      0.6761000 
1 1 1 8  41 33 o 8.881000 0.5161000 8.450000 0.7057000 9.311000 0.7532000 -0.8617000     1.032000  
1 1 1 8  41 35 o 11.21000 0.4034000 11.19000 0.5476000 11.23000 0.5926000 -0.4252000E-01 0.8069000 
1 1 1 8  41 37 o 16.76000 0.3362000 16.54000 0.4971000 16.98000 0.4526000 -0.4417000     0.6723000 
1 1 1 8  41 39 o 7.022000 0.7262000 7.495000 1.064000  6.550000 0.9892000 0.9452000      1.452000  
1 1 1 8  41 41 o 4.146000 0.9441000 4.201000 1.371000  4.091000 1.298000  0.1106000      1.888000  
1 1 1 8  41 43 o 2.691000 0.8435000 2.900000 1.223000  2.482000 1.162000  0.4173000      1.687000  
1 1 1 8  41 45 o 4.162000 0.9859000 3.939000 1.406000  4.384000 1.383000  -0.4443000     1.972000  
1 1 1 8  41 47 o 3.765000 1.006000  4.344000 1.556000  3.186000 1.275000  1.158000       2.012000  
1 1 1 8  41 49 o 3.078000 0.8787000 3.250000 1.275000  2.907000 1.210000  0.3427000      1.757000  
1 1 1 8  42 0  o 33.42000 0.4465000 33.42000 0.4465000 33.42000 0.4465000 0.000000       0.000000  
1 1 1 8  42 2  o 28.75000 0.3371000 28.23000 0.4403000 29.28000 0.5107000 -1.049000      0.6743000 
1 1 1 8  42 4  o 4.032000 0.9716000 3.296000 1.303000  4.769000 1.441000  -1.473000      1.943000  
1 1 1 8  42 6  o 22.34000 0.3389000 22.53000 0.4764000 22.16000 0.4823000 0.3733000      0.6779000 
1 1 1 8  42 8  o 31.96000 0.3964000 32.12000 0.6081000 31.80000 0.5087000 0.3126000      0.7928000 
1 1 1 8  42 10 f 14.87000 0.3797000 14.74000 0.5257000 15.00000 0.5479000 -0.2528000     0.7593000 
1 1 1 8  42 12 o 7.688000 0.6661000 7.112000 1.002000  8.265000 0.8780000 -1.153000      1.332000  
1 1 1 8  42 14 o 7.183000 0.8546000 7.538000 0.7832000 6.828000 1.519000  0.7098000      1.709000  
1 1 1 8  42 16 o 24.88000 0.3085000 24.58000 0.3862000 25.18000 0.4812000 -0.5968000     0.6170000 
1 1 1 8  42 18 o 16.48000 0.3376000 16.36000 0.4253000 16.59000 0.5246000 -0.2284000     0.6753000 
1 1 1 8  42 20 o 10.56000 0.4556000 11.03000 0.5863000 10.08000 0.6976000 0.9477000      0.9113000 
1 1 1 8  42 22 o 9.320000 0.4988000 8.519000 0.6804000 10.12000 0.7295000 -1.601000      0.9975000 
1 1 1 8  42 24 o 9.426000 0.6356000 9.786000 0.5952000 9.065000 1.123000  0.7209000      1.271000  
1 1 1 8  42 26 o 11.56000 0.4364000 11.90000 0.4848000 11.21000 0.7258000 0.6975000      0.8728000 
1 1 1 8  42 28 o 20.05000 0.3324000 19.80000 0.4183000 20.29000 0.5167000 -0.4909000     0.6648000 
1 1 1 8  42 30 o 9.026000 0.4857000 9.033000 0.6472000 9.019000 0.7243000 0.1370000E-01  0.9713000 
1 1 1 8  42 32 o 7.276000 0.6220000 7.373000 0.8403000 7.180000 0.9174000 0.1931000      1.244000  
1 1 1 8  42 34 o 7.205000 0.6980000 6.866000 0.9735000 7.544000 1.001000  -0.6778000     1.396000  
1 1 1 8  42 36 o 3.194000 0.9028000 3.189000 1.302000  3.199000 1.251000  -0.9642000E-02 1.806000  
1 1 1 8  42 38 o 4.638000 0.9186000 4.292000 1.351000  4.983000 1.245000  -0.6911000     1.837000  
1 1 1 8  42 40 o 4.251000 0.9135000 4.413000 1.222000  4.089000 1.358000  0.3236000      1.827000  
1 1 1 8  42 42 o 9.853000 0.5392000 9.383000 0.7346000 10.32000 0.7896000 -0.9394000     1.078000  
1 1 1 8  42 44 o 3.342000 0.9566000 3.258000 1.353000  3.426000 1.353000  -0.1672000     1.913000  
1 1 1 8  42 46 o 3.782000 0.9138000 3.815000 1.264000  3.749000 1.320000  0.6626000E-01  1.828000  
1 1 1 8  42 48 o 2.292000 0.7572000 2.593000 1.166000  1.992000 0.9664000 0.6006000      1.514000  
1 1 1 8  43 1  o 22.27000 0.3430000 21.96000 0.4570000 22.59000 0.5115000 -0.6308000     0.6860000 
1 1 1 8  43 3  o 21.45000 0.3306000 21.26000 0.4306000 21.65000 0.5018000 -0.3890000     0.6612000 
1 1 1 8  43 5  o 19.50000 0.3387000 18.79000 0.4578000 20.20000 0.4993000 -1.407000      0.6774000 
1 1 1 8  43 7  o 37.81000 0.3832000 38.19000 0.5403000 37.43000 0.5435000 0.7575000      0.7664000 
1 1 1 8  43 9  o 35.06000 0.3327000 35.42000 0.4172000 34.70000 0.5185000 0.7169000      0.6655000 
1 1 1 8  43 11 o 28.23000 0.3895000 29.10000 0.4408000 27.35000 0.6423000 1.750000       0.7790000 
1 1 1 8  43 13 o 18.58000 0.3284000 19.00000 0.4196000 18.15000 0.5054000 0.8421000      0.6569000 
1 1 1 8  43 15 o 30.06000 0.3144000 30.47000 0.3951000 29.64000 0.4892000 0.8306000      0.6289000 
1 1 1 8  43 17 o 5.808000 0.7750000 6.300000 0.8937000 5.315000 1.266000  0.9854000      1.550000  
1 1 1 8  43 19 o 4.977000 0.8573000 4.170000 1.251000  5.784000 1.173000  -1.615000      1.715000  
1 1 1 8  43 21 o 11.41000 0.4439000 11.75000 0.5010000 11.08000 0.7330000 0.6748000      0.8879000 
1 1 1 8  43 23 o 16.03000 0.4277000 15.39000 0.4374000 16.68000 0.7351000 -1.287000      0.8554000 
1 1 1 8  43 25 o 26.83000 0.3269000 26.97000 0.4345000 26.69000 0.4886000 0.2781000      0.6539000 
1 1 1 8  43 27 o 30.61000 0.3343000 30.56000 0.4284000 30.66000 0.5133000 -0.9838000E-01 0.6686000 
1 1 1 8  43 29 o 15.68000 0.3400000 15.34000 0.4539000 16.02000 0.5064000 -0.6726000     0.6801000 
1 1 1 8  43 31 o 10.41000 0.4448000 10.50000 0.5917000 10.32000 0.6642000 0.1798000      0.8895000 
1 1 1 8  43 33 o 16.45000 0.3767000 16.98000 0.4636000 15.92000 0.5939000 1.061000       0.7534000 
1 1 1 8  43 35 o 3.578000 0.9220000 3.273000 1.321000  3.882000 1.287000  -0.6090000     1.844000  
1 1 1 8  43 37 o 7.796000 0.5769000 7.921000 0.8052000 7.672000 0.8264000 0.2487000      1.154000  
1 1 1 8  43 39 o 10.22000 0.6001000 9.691000 0.8489000 10.76000 0.8484000 -1.066000      1.200000  
1 1 1 8  43 41 o 4.943000 0.8742000 3.187000 1.253000  6.699000 1.219000  -3.512000      1.748000  
1 1 1 8  43 43 o 4.078000 0.9437000 4.953000 1.376000  3.203000 1.292000  1.750000       1.887000  
1 1 1 8  43 45 o 5.712000 0.8528000 5.903000 1.108000  5.521000 1.296000  0.3825000      1.706000  
1 1 1 8  43 47 o 8.183000 0.6138000 7.536000 0.9152000 8.829000 0.8181000 -1.293000      1.228000  
1 1 1 8  44 0  o 3.986000 1.535000  3.986000 1.535000  3.986000 1.535000  0.000000       0.000000  
1 1 1 8  44 2  o 7.442000 0.6778000 7.286000 0.8649000 7.597000 1.044000  -0.3112000     1.356000  
1 1 1 8  44 4  o 14.60000 0.3775000 14.02000 0.4866000 15.17000 0.5772000 -1.147000      0.7549000 
1 1 1 8  44 6  o 12.39000 0.4299000 12.02000 0.5932000 12.77000 0.6223000 -0.7466000     0.8598000 
1 1 1 8  44 8  o 7.059000 0.9037000 8.122000 0.8471000 5.996000 1.596000  2.126000       1.807000  
1 1 1 8  44 10 o 8.710000 0.5435000 9.328000 0.6615000 8.092000 0.8624000 1.236000       1.087000  
1 1 1 8  44 12 o 20.70000 0.3436000 20.93000 0.4539000 20.47000 0.5159000 0.4668000      0.6872000 
1 1 1 8  44 14 o 26.33000 0.3092000 26.00000 0.3854000 26.66000 0.4836000 -0.6611000     0.6184000 
1 1 1 8  44 16 o 33.30000 0.3256000 33.38000 0.4027000 33.22000 0.5117000 0.1568000      0.6511000 
1 1 1 8  44 18 o 15.21000 0.3772000 14.83000 0.4772000 15.59000 0.5842000 -0.7601000     0.7543000 
1 1 1 8  44 20 o 5.900000 0.7542000 5.987000 0.9008000 5.813000 1.210000  0.1738000      1.508000  
1 1 1 8  44 22 o 18.89000 0.3728000 19.13000 0.4461000 18.64000 0.5973000 0.4907000      0.7455000 
1 1 1 8  44 24 o 9.080000 0.4856000 8.604000 0.6267000 9.557000 0.7420000 -0.9524000     0.9712000 
1 1 1 8  44 26 o 9.419000 0.5182000 9.265000 0.6963000 9.574000 0.7675000 -0.3090000     1.036000  
1 1 1 8  44 28 o 13.50000 0.3923000 13.10000 0.5021000 13.90000 0.6030000 -0.7947000     0.7847000 
1 1 1 8  44 30 o 9.197000 0.4927000 9.353000 0.6410000 9.041000 0.7486000 0.3122000      0.9855000 
1 1 1 8  44 32 o 7.371000 0.5917000 7.861000 0.7744000 6.881000 0.8947000 0.9797000      1.183000  
1 1 1 8  44 34 o 7.036000 0.7694000 7.424000 0.9795000 6.648000 1.187000  0.7753000      1.539000  
1 1 1 8  44 36 o 5.149000 0.8676000 5.219000 1.258000  5.080000 1.195000  0.1387000      1.735000  
1 1 1 8  44 38 o 6.204000 0.8766000 6.047000 1.245000  6.361000 1.234000  -0.3137000     1.753000  
1 1 1 8  44 40 o 3.338000 0.9568000 3.452000 1.276000  3.225000 1.426000  0.2273000      1.914000  
1 1 1 8  44 42 o 3.993000 0.9934000 4.054000 1.354000  3.931000 1.454000  0.1233000      1.987000  
1 1 1 8  44 44 o 3.637000 0.9198000 2.609000 1.156000  4.664000 1.431000  -2.055000      1.840000  
1 1 1 8  44 46 o 7.920000 0.6333000 8.304000 0.7735000 7.536000 1.003000  0.7679000      1.267000  
1 1 1 8  45 1  o 11.41000 0.7542000 10.31000 0.5764000 12.52000 1.394000  -2.208000      1.508000  
1 1 1 8  45 3  o 25.75000 0.3496000 25.98000 0.3886000 25.53000 0.5813000 0.4574000      0.6992000 
1 1 1 8  45 5  o 21.50000 0.5357000 20.82000 0.5200000 22.17000 0.9367000 -1.346000      1.071000  
1 1 1 8  45 7  o 16.22000 0.3826000 15.97000 0.4332000 16.47000 0.6308000 -0.4971000     0.7652000 
1 1 1 8  45 9  o 8.289000 0.5866000 8.416000 0.6929000 8.161000 0.9468000 0.2545000      1.173000  
1 1 1 8  45 11 o 13.54000 0.3979000 12.93000 0.4969000 14.15000 0.6215000 -1.224000      0.7957000 
1 1 1 8  45 13 o 13.37000 0.3927000 12.79000 0.5085000 13.95000 0.5986000 -1.158000      0.7854000 
1 1 1 8  45 15 o 13.04000 0.4044000 12.82000 0.5409000 13.25000 0.6014000 -0.4330000     0.8089000 
1 1 1 8  45 17 o 14.64000 0.3907000 14.61000 0.4861000 14.67000 0.6118000 -0.6358000E-01 0.7814000 
1 1 1 8  45 19 o 11.02000 0.4194000 11.01000 0.5293000 11.03000 0.6506000 -0.1623000E-01 0.8387000 
1 1 1 8  45 21 o 7.954000 0.6180000 7.647000 0.7787000 8.261000 0.9599000 -0.6135000     1.236000  
1 1 1 8  45 23 o 6.063000 0.7114000 6.255000 0.8312000 5.872000 1.155000  0.3828000      1.423000  
1 1 1 8  45 25 o 7.595000 0.6002000 8.220000 0.6897000 6.970000 0.9824000 1.249000       1.200000  
1 1 1 8  45 27 o 6.544000 0.6864000 6.513000 0.7690000 6.574000 1.137000  -0.6177000E-01 1.373000  
1 1 1 8  45 29 o 3.369000 0.8895000 3.290000 1.226000  3.448000 1.289000  -0.1585000     1.779000  
1 1 1 8  45 31 o 10.32000 0.4757000 10.44000 0.6464000 10.20000 0.6980000 0.2387000      0.9513000 
1 1 1 8  45 33 o 12.84000 0.4455000 11.99000 0.5406000 13.68000 0.7083000 -1.693000      0.8911000 
1 1 1 8  45 35 o 7.610000 0.6024000 7.737000 0.8288000 7.483000 0.8744000 0.2539000      1.205000  
1 1 1 8  45 37 o 9.639000 0.6000000 8.616000 1.000000  10.66000 0.6627000 -2.047000      1.200000  
1 1 1 8  45 39 o 10.01000 0.5855000 8.784000 0.9003000 11.23000 0.7490000 -2.442000      1.171000  
1 1 1 8  45 41 o 4.360000 0.9505000 3.896000 1.327000  4.824000 1.361000  -0.9284000     1.901000  
1 1 1 8  45 43 o 5.171000 0.9522000 4.552000 1.327000  5.789000 1.366000  -1.237000      1.904000  
1 1 1 8  45 45 o 5.933000 0.8576000 5.674000 1.149000  6.191000 1.274000  -0.5170000     1.715000  
1 1 1 8  46 0  o 30.39000 0.4389000 30.39000 0.4389000 30.39000 0.4389000 0.000000       0.000000  
1 1 1 8  46 2  o 14.73000 0.4709000 14.81000 0.4951000 14.64000 0.8011000 0.1717000      0.9418000 
1 1 1 8  46 4  o 7.756000 0.6522000 8.314000 0.7645000 7.198000 1.057000  1.116000       1.304000  
1 1 1 8  46 6  o 23.59000 0.3577000 23.35000 0.4246000 23.84000 0.5757000 -0.4823000     0.7153000 
1 1 1 8  46 8  o 27.29000 0.3484000 26.90000 0.3887000 27.68000 0.5783000 -0.7887000     0.6968000 
1 1 1 8  46 10 o 17.78000 0.3465000 17.47000 0.4094000 18.09000 0.5592000 -0.6154000     0.6930000 
1 1 1 8  46 12 o 3.933000 0.8988000 4.049000 1.185000  3.818000 1.351000  0.2310000      1.798000  
1 1 1 8  46 14 o 8.057000 0.5185000 8.261000 0.6681000 7.854000 0.7930000 0.4069000      1.037000  
1 1 1 8  46 16 f 21.78000 0.3175000 21.93000 0.4288000 21.63000 0.4683000 0.2998000      0.6349000 
1 1 1 8  46 18 o 7.004000 0.5957000 7.755000 0.6958000 6.252000 0.9671000 1.503000       1.191000  
1 1 1 8  46 20 o 12.47000 0.3983000 12.18000 0.5340000 12.76000 0.5912000 -0.5816000     0.7967000 
1 1 1 8  46 22 o 11.66000 0.4015000 11.42000 0.5091000 11.91000 0.6210000 -0.4890000     0.8030000 
1 1 1 8  46 24 o 3.841000 0.8887000 3.992000 1.179000  3.689000 1.330000  0.3033000      1.777000  
1 1 1 8  46 26 o 6.171000 0.7333000 6.931000 0.7688000 5.410000 1.249000  1.522000       1.467000  
1 1 1 8  46 28 o 11.67000 0.3980000 11.18000 0.5557000 12.16000 0.5698000 -0.9817000     0.7959000 
1 1 1 8  46 30 o 19.74000 0.3426000 19.60000 0.4792000 19.88000 0.4897000 -0.2797000     0.6852000 
1 1 1 8  46 32 o 15.91000 0.4004000 15.46000 0.4814000 16.37000 0.6401000 -0.9121000     0.8009000 
1 1 1 8  46 34 o 8.344000 0.5931000 8.558000 0.7744000 8.129000 0.8987000 0.4290000      1.186000  
1 1 1 8  46 36 o 9.558000 0.5534000 8.359000 0.8105000 10.76000 0.7536000 -2.399000      1.107000  
1 1 1 8  46 38 o 6.928000 0.9028000 6.196000 1.508000  7.660000 0.9925000 -1.464000      1.806000  
1 1 1 8  46 40 o 4.319000 0.8927000 5.403000 1.235000  3.235000 1.289000  2.168000       1.785000  
1 1 1 8  46 42 o 4.702000 1.033000  4.984000 1.427000  4.421000 1.495000  0.5627000      2.067000  
1 1 1 8  46 44 o 2.322000 0.7669000 2.267000 1.072000  2.377000 1.097000  -0.1102000     1.534000  
1 1 1 8  47 1  o 9.446000 0.6674000 9.225000 1.066000  9.667000 0.8028000 -0.4421000     1.335000  
1 1 1 8  47 3  o 7.098000 0.7793000 6.815000 0.8367000 7.380000 1.315000  -0.5651000     1.559000  
1 1 1 8  47 5  o 13.95000 0.3567000 13.53000 0.4711000 14.36000 0.5358000 -0.8247000     0.7135000 
1 1 1 8  47 7  o 8.056000 0.5369000 7.544000 0.7499000 8.568000 0.7686000 -1.024000      1.074000  
1 1 1 8  47 9  o 10.76000 0.4152000 10.18000 0.5556000 11.34000 0.6172000 -1.151000      0.8304000 
1 1 1 8  47 11 o 2.782000 0.8028000 2.971000 1.157000  2.592000 1.113000  0.3787000      1.606000  
1 1 1 8  47 13 o 21.72000 0.3294000 21.77000 0.3829000 21.68000 0.5362000 0.8698000E-01  0.6589000 
1 1 1 8  47 15 o 22.14000 0.3256000 22.56000 0.4373000 21.71000 0.4826000 0.8526000      0.6512000 
1 1 1 8  47 17 o 13.73000 0.3877000 13.74000 0.4354000 13.73000 0.6417000 0.3496000E-02  0.7755000 
1 1 1 8  47 19 o 3.821000 0.8831000 3.098000 1.193000  4.544000 1.302000  -1.446000      1.766000  
1 1 1 8  47 21 o 4.901000 0.8028000 4.666000 1.037000  5.137000 1.226000  -0.4716000     1.606000  
1 1 1 8  47 23 f 4.790000 0.8596000 5.106000 1.003000  4.474000 1.396000  0.6321000      1.719000  
1 1 1 8  47 25 o 18.81000 0.3224000 19.40000 0.4015000 18.22000 0.5046000 1.180000       0.6448000 
1 1 1 8  47 27 f 7.493000 0.7070000 6.901000 0.7555000 8.084000 1.195000  -1.183000      1.414000  
1 1 1 8  47 29 o 6.007000 0.7601000 6.221000 0.9809000 5.793000 1.161000  0.4284000      1.520000  
1 1 1 8  47 31 o 9.568000 0.5570000 9.118000 0.6760000 10.02000 0.8856000 -0.8984000     1.114000  
1 1 1 8  47 33 o 6.534000 0.7191000 6.135000 1.027000  6.933000 1.006000  -0.7986000     1.438000  
1 1 1 8  47 35 f 5.988000 0.8463000 5.792000 1.234000  6.184000 1.159000  -0.3919000     1.693000  
1 1 1 8  47 37 o 4.519000 1.065000  5.320000 1.583000  3.717000 1.425000  1.603000       2.130000  
1 1 1 8  47 39 o 3.742000 0.9266000 3.869000 1.286000  3.615000 1.334000  0.2538000      1.853000  
1 1 1 8  47 41 o 6.127000 0.8689000 6.046000 1.225000  6.208000 1.232000  -0.1622000     1.738000  
1 1 1 8  47 43 o 3.259000 0.9279000 3.261000 1.323000  3.257000 1.302000  0.4717000E-02  1.856000  
1 1 1 8  48 0  o 24.00000 0.4939000 24.00000 0.4939000 24.00000 0.4939000 0.000000       0.000000  
1 1 1 8  48 2  o 7.979000 0.6081000 8.409000 0.6672000 7.550000 1.017000  0.8583000      1.216000  
1 1 1 8  48 4  o 5.770000 0.8891000 6.790000 0.8700000 4.750000 1.551000  2.039000       1.778000  
1 1 1 8  48 6  o 3.502000 0.9595000 2.609000 1.086000  4.395000 1.582000  -1.786000      1.919000  
1 1 1 8  48 8  o 5.401000 0.7669000 5.370000 0.9913000 5.433000 1.171000  -0.6355000E-01 1.534000  
1 1 1 8  48 10 o 11.34000 0.4032000 11.56000 0.5187000 11.13000 0.6176000 0.4351000      0.8065000 
1 1 1 8  48 12 o 10.12000 0.4357000 10.62000 0.5442000 9.613000 0.6805000 1.006000       0.8713000 
1 1 1 8  48 14 o 6.308000 0.6973000 6.496000 0.9482000 6.120000 1.023000  0.3762000      1.395000  
1 1 1 8  48 16 o 15.50000 0.3659000 15.10000 0.4298000 15.89000 0.5921000 -0.7886000     0.7317000 
1 1 1 8  48 18 f 5.330000 0.7963000 6.663000 0.9011000 3.997000 1.313000  2.666000       1.593000  
1 1 1 8  48 20 o 17.23000 0.3459000 17.01000 0.4525000 17.44000 0.5232000 -0.4228000     0.6917000 
1 1 1 8  48 22 o 3.935000 0.8344000 4.692000 1.072000  3.177000 1.279000  1.515000       1.669000  
1 1 1 8  48 24 o 11.18000 0.4201000 10.85000 0.4958000 11.51000 0.6783000 -0.6593000     0.8402000 
1 1 1 8  48 26 o 3.116000 0.8497000 3.331000 1.167000  2.902000 1.235000  0.4288000      1.699000  
1 1 1 8  48 28 o 7.126000 0.7036000 6.188000 1.172000  8.063000 0.7793000 -1.875000      1.407000  
1 1 1 8  48 30 o 4.142000 0.9775000 4.161000 1.312000  4.123000 1.450000  0.3827000E-01  1.955000  
1 1 1 8  48 32 o 6.023000 0.9054000 7.172000 0.8751000 4.875000 1.585000  2.297000       1.811000  
1 1 1 8  48 34 o 5.263000 0.8784000 4.884000 1.255000  5.642000 1.230000  -0.7580000     1.757000  
1 1 1 8  48 36 o 4.838000 0.9690000 4.884000 1.295000  4.791000 1.442000  0.9296000E-01  1.938000  
1 1 1 8  48 38 o 3.219000 0.8900000 2.689000 1.140000  3.749000 1.367000  -1.060000      1.780000  
1 1 1 8  48 40 o 5.076000 0.9469000 4.229000 1.405000  5.923000 1.270000  -1.694000      1.894000  
1 1 1 8  48 42 o 4.940000 0.9409000 4.078000 1.455000  5.802000 1.194000  -1.724000      1.882000  
1 1 1 8  49 1  o 3.671000 0.9205000 3.822000 1.251000  3.521000 1.351000  0.3008000      1.841000  
1 1 1 8  49 3  o 7.531000 0.5795000 6.800000 0.7656000 8.262000 0.8701000 -1.462000      1.159000  
1 1 1 8  49 5  o 3.413000 0.8719000 3.269000 1.156000  3.557000 1.306000  -0.2884000     1.744000  
1 1 1 8  49 7  o 23.49000 0.3860000 23.24000 0.4375000 23.74000 0.6361000 -0.5026000     0.7720000 
1 1 1 8  49 9  o 17.28000 0.3435000 16.79000 0.4654000 17.76000 0.5053000 -0.9634000     0.6870000 
1 1 1 8  49 11 o 4.617000 0.8107000 4.221000 1.167000  5.014000 1.125000  -0.7928000     1.621000  
1 1 1 8  49 13 o 8.674000 0.5802000 9.175000 0.7016000 8.172000 0.9242000 1.003000       1.160000  
1 1 1 8  49 15 o 9.278000 0.4738000 8.167000 0.6913000 10.39000 0.6482000 -2.221000      0.9476000 
1 1 1 8  49 17 o 6.368000 0.7326000 7.016000 0.8898000 5.721000 1.164000  1.295000       1.465000  
1 1 1 8  49 19 f 22.03000 0.3268000 21.40000 0.4235000 22.66000 0.4978000 -1.267000      0.6536000 
1 1 1 8  49 21 o 8.586000 0.5165000 8.850000 0.6192000 8.322000 0.8268000 0.5284000      1.033000  
1 1 1 8  49 23 o 12.76000 0.3914000 12.69000 0.4551000 12.83000 0.6369000 -0.1364000     0.7828000 
1 1 1 8  49 25 o 16.62000 0.3480000 16.58000 0.4203000 16.67000 0.5547000 -0.8771000E-01 0.6959000 
1 1 1 8  49 27 o 5.347000 0.7883000 5.657000 0.8815000 5.038000 1.307000  0.6194000      1.577000  
1 1 1 8  49 29 o 7.053000 0.8438000 7.176000 0.9051000 6.930000 1.424000  0.2457000      1.688000  
1 1 1 8  49 31 o 7.959000 0.8308000 8.143000 1.243000  7.775000 1.103000  0.3679000      1.662000  
1 1 1 8  49 33 o 3.524000 0.9110000 3.532000 1.254000  3.515000 1.322000  0.1742000E-01  1.822000  
1 1 1 8  49 35 o 3.493000 0.9370000 3.953000 1.340000  3.032000 1.310000  0.9214000      1.874000  
1 1 1 8  49 37 o 5.667000 0.8429000 4.141000 1.399000  7.194000 0.9401000 -3.053000      1.686000  
1 1 1 8  49 39 o 4.043000 0.9993000 3.841000 1.390000  4.245000 1.436000  -0.4040000     1.999000  
1 1 1 8  49 41 o 3.894000 0.9679000 4.076000 1.331000  3.712000 1.406000  0.3641000      1.936000  
1 1 1 8  50 0  o 2.649000 1.140000  2.649000 1.140000  2.649000 1.140000  0.000000       0.000000  
1 1 1 8  50 2  o 3.099000 0.8884000 2.547000 1.114000  3.650000 1.384000  -1.103000      1.777000  
1 1 1 8  50 4  o 16.48000 0.3386000 16.08000 0.4124000 16.87000 0.5371000 -0.7900000     0.6772000 
1 1 1 8  50 6  o 14.95000 0.3452000 14.75000 0.4208000 15.15000 0.5474000 -0.3985000     0.6905000 
1 1 1 8  50 8  o 9.989000 0.5543000 9.755000 0.5821000 10.22000 0.9436000 -0.4682000     1.109000  
1 1 1 8  50 10 o 12.26000 0.5206000 12.43000 0.4974000 12.09000 0.9147000 0.3395000      1.041000  
1 1 1 8  50 12 o 13.78000 0.4594000 13.03000 0.6186000 14.53000 0.6795000 -1.498000      0.9189000 
1 1 1 8  50 14 o 11.11000 0.4095000 11.03000 0.5177000 11.19000 0.6346000 -0.1558000     0.8190000 
1 1 1 8  50 16 o 11.87000 0.4174000 11.86000 0.5865000 11.88000 0.5940000 -0.2150000E-01 0.8347000 
1 1 1 8  50 18 f 4.341000 0.9416000 4.566000 1.332000  4.115000 1.331000  0.4512000      1.883000  
1 1 1 8  50 20 o 7.433000 0.6018000 7.172000 0.7736000 7.695000 0.9221000 -0.5232000     1.204000  
1 1 1 8  50 22 o 6.399000 0.7054000 7.120000 0.7209000 5.678000 1.213000  1.442000       1.411000  
1 1 1 8  50 24 o 11.69000 0.4199000 11.96000 0.4843000 11.41000 0.6862000 0.5574000      0.8399000 
1 1 1 8  50 26 o 7.572000 0.5977000 7.361000 0.7452000 7.782000 0.9346000 -0.4211000     1.195000  
1 1 1 8  50 28 o 5.493000 0.8730000 5.320000 1.166000  5.666000 1.300000  -0.3456000     1.746000  
1 1 1 8  50 30 o 12.00000 0.5764000 11.47000 0.6754000 12.53000 0.9341000 -1.060000      1.153000  
1 1 1 8  50 32 o 11.52000 0.4768000 11.36000 0.7051000 11.68000 0.6420000 -0.3226000     0.9536000 
1 1 1 8  50 34 o 8.573000 0.5836000 7.735000 0.8163000 9.410000 0.8343000 -1.675000      1.167000  
1 1 1 8  50 36 o 5.752000 0.9077000 5.790000 1.335000  5.713000 1.230000  0.7620000E-01  1.815000  
1 1 1 8  50 38 o 3.409000 0.9330000 3.425000 1.277000  3.393000 1.361000  0.3228000E-01  1.866000  
1 1 1 8  50 40 o 3.789000 1.125000  3.689000 1.412000  3.889000 1.751000  -0.2001000     2.249000  
1 1 1 8  51 1  o 6.965000 0.6184000 7.476000 0.7699000 6.453000 0.9680000 1.023000       1.237000  
1 1 1 8  51 3  o 11.63000 0.4435000 11.45000 0.5774000 11.81000 0.6732000 -0.3538000     0.8869000 
1 1 1 8  51 5  o 5.142000 0.7562000 3.800000 1.154000  6.483000 0.9773000 -2.683000      1.512000  
1 1 1 8  51 7  o 9.215000 0.4615000 8.746000 0.5940000 9.685000 0.7066000 -0.9391000     0.9231000 
1 1 1 8  51 9  o 5.488000 1.036000  6.010000 0.9007000 4.965000 1.865000  1.044000       2.071000  
1 1 1 8  51 11 o 6.770000 1.144000  6.865000 0.9078000 6.674000 2.101000  0.1915000      2.289000  
1 1 1 8  51 13 o 12.24000 0.3668000 12.66000 0.4892000 11.82000 0.5467000 0.8380000      0.7336000 
1 1 1 8  51 15 o 21.33000 0.3601000 21.31000 0.5288000 21.35000 0.4888000 -0.4485000E-01 0.7201000 
1 1 1 8  51 17 o 15.49000 0.3621000 15.42000 0.4833000 15.56000 0.5393000 -0.1379000     0.7241000 
1 1 1 8  51 19 o 2.804000 0.8283000 2.352000 1.050000  3.255000 1.282000  -0.9029000     1.657000  
1 1 1 8  51 21 o 5.443000 0.7843000 4.873000 1.059000  6.014000 1.157000  -1.141000      1.569000  
1 1 1 8  51 23 o 3.619000 0.8617000 4.407000 1.201000  2.831000 1.236000  1.576000       1.723000  
1 1 1 8  51 25 o 8.415000 0.6882000 9.816000 0.5838000 7.015000 1.247000  2.801000       1.376000  
1 1 1 8  51 27 o 6.632000 0.8499000 6.311000 0.9813000 6.953000 1.388000  -0.6418000     1.700000  
1 1 1 8  51 29 o 3.021000 0.9322000 2.852000 1.218000  3.189000 1.411000  -0.3374000     1.864000  
1 1 1 8  51 31 o 5.619000 0.8901000 6.490000 1.180000  4.749000 1.333000  1.741000       1.780000  
1 1 1 8  51 33 o 5.382000 0.8548000 5.566000 1.211000  5.199000 1.206000  0.3665000      1.710000  
1 1 1 8  51 35 o 3.188000 0.8941000 2.656000 1.153000  3.721000 1.367000  -1.065000      1.788000  
1 1 1 8  51 37 o 10.18000 0.6215000 10.14000 0.8648000 10.22000 0.8927000 -0.8212000E-01 1.243000  
1 1 1 8  52 0  o 7.875000 0.7735000 7.875000 0.7735000 7.875000 0.7735000 0.000000       0.000000  
1 1 1 8  52 2  o 10.30000 0.4684000 10.09000 0.5932000 10.51000 0.7250000 -0.4157000     0.9367000 
1 1 1 8  52 4  o 13.24000 0.3812000 12.80000 0.4987000 13.69000 0.5768000 -0.8923000     0.7625000 
1 1 1 8  52 6  o 2.864000 0.8238000 2.929000 1.131000  2.799000 1.198000  0.1300000      1.648000  
1 1 1 8  52 8  o 3.657000 0.8492000 2.286000 1.023000  5.029000 1.356000  -2.743000      1.698000  
1 1 1 8  52 10 o 3.969000 0.9263000 4.025000 1.282000  3.913000 1.337000  0.1119000      1.853000  
1 1 1 8  52 12 o 9.554000 0.6262000 10.21000 0.5841000 8.897000 1.108000  1.312000       1.252000  
1 1 1 8  52 14 o 6.578000 0.8417000 7.134000 0.9344000 6.022000 1.400000  1.112000       1.683000  
1 1 1 8  52 16 o 4.854000 0.8147000 5.086000 1.111000  4.622000 1.192000  0.4647000      1.629000  
1 1 1 8  52 18 o 11.44000 0.4259000 11.54000 0.5399000 11.34000 0.6588000 0.1992000      0.8518000 
1 1 1 8  52 20 o 14.28000 0.3948000 14.48000 0.5229000 14.07000 0.5918000 0.4060000      0.7897000 
1 1 1 8  52 22 o 6.641000 0.7760000 5.325000 1.090000  7.958000 1.105000  -2.633000      1.552000  
1 1 1 8  52 24 o 7.493000 0.5683000 8.153000 0.7044000 6.832000 0.8919000 1.321000       1.137000  
1 1 1 8  52 26 o 6.541000 0.8879000 7.112000 0.7569000 5.970000 1.606000  1.142000       1.776000  
1 1 1 8  52 28 f 4.582000 1.077000  3.884000 1.353000  5.279000 1.676000  -1.395000      2.154000  
1 1 1 8  52 30 o 4.194000 0.8829000 3.305000 1.275000  5.084000 1.222000  -1.779000      1.766000  
1 1 1 8  52 32 o 8.281000 0.6285000 8.458000 0.9272000 8.104000 0.8487000 0.3536000      1.257000  
1 1 1 8  52 34 o 8.273000 0.6720000 8.800000 0.8079000 7.747000 1.074000  1.053000       1.344000  
1 1 1 8  52 36 o 3.326000 0.9853000 3.468000 1.375000  3.185000 1.411000  0.2831000      1.971000  
1 1 1 8  53 1  o 11.10000 0.4105000 10.67000 0.5801000 11.54000 0.5810000 -0.8688000     0.8210000 
1 1 1 8  53 3  o 9.032000 0.4735000 8.793000 0.5786000 9.272000 0.7496000 -0.4793000     0.9469000 
1 1 1 8  53 5  o 7.187000 0.6999000 7.486000 0.7758000 6.887000 1.165000  0.5997000      1.400000  
1 1 1 8  53 7  o 5.895000 0.7513000 6.365000 0.9246000 5.425000 1.185000  0.9397000      1.503000  
1 1 1 8  53 9  o 16.39000 0.3571000 16.14000 0.5090000 16.63000 0.5010000 -0.4919000     0.7142000 
1 1 1 8  53 11 o 18.26000 0.3374000 18.79000 0.4599000 17.72000 0.4937000 1.078000       0.6747000 
1 1 1 8  53 13 o 10.21000 0.4570000 10.30000 0.6140000 10.12000 0.6770000 0.1852000      0.9140000 
1 1 1 8  53 15 o 3.560000 0.9017000 3.956000 1.185000  3.163000 1.359000  0.7933000      1.803000  
1 1 1 8  53 17 o 7.884000 0.7156000 8.166000 0.7210000 7.601000 1.236000  0.5651000      1.431000  
1 1 1 8  53 19 o 3.735000 0.9324000 3.973000 1.212000  3.496000 1.417000  0.4770000      1.865000  
1 1 1 8  53 21 o 6.547000 0.9280000 6.547000 0.8714000 6.547000 1.639000  0.3657000E-03  1.856000  
1 1 1 8  53 23 o 5.545000 0.9480000 4.915000 1.091000  6.175000 1.550000  -1.260000      1.896000  
1 1 1 8  53 25 o 9.934000 0.6171000 9.694000 0.7045000 10.17000 1.013000  -0.4790000     1.234000  
1 1 1 8  53 27 o 10.46000 0.7949000 9.641000 1.297000  11.28000 0.9191000 -1.640000      1.590000  
1 1 1 8  53 29 o 6.461000 0.8805000 7.018000 1.284000  5.904000 1.205000  1.114000       1.761000  
1 1 1 8  53 31 o 5.297000 0.8969000 6.363000 1.009000  4.231000 1.483000  2.132000       1.794000  
1 1 1 8  53 33 o 5.131000 0.9471000 4.570000 1.282000  5.692000 1.394000  -1.122000      1.894000  
1 1 1 8  53 35 o 4.213000 1.209000  3.603000 1.535000  4.824000 1.867000  -1.221000      2.417000  
1 1 1 8  54 0  o 5.428000 1.212000  5.428000 1.212000  5.428000 1.212000  0.000000       0.000000  
1 1 1 8  54 2  o 3.082000 0.8832000 2.868000 1.200000  3.295000 1.297000  -0.4267000     1.766000  
1 1 1 8  54 4  o 8.756000 0.5120000 8.896000 0.5987000 8.617000 0.8308000 0.2784000      1.024000  
1 1 1 8  54 6  o 15.81000 0.3663000 15.61000 0.4555000 16.02000 0.5739000 -0.4046000     0.7327000 
1 1 1 8  54 8  o 4.373000 0.9001000 3.933000 1.350000  4.813000 1.191000  -0.8802000     1.800000  
1 1 1 8  54 10 o 3.653000 0.8881000 3.293000 1.221000  4.014000 1.290000  -0.7214000     1.776000  
1 1 1 8  54 12 o 10.73000 0.4703000 10.96000 0.6362000 10.51000 0.6927000 0.4469000      0.9405000 
1 1 1 8  54 14 o 3.910000 0.8705000 4.351000 1.181000  3.469000 1.279000  0.8820000      1.741000  
1 1 1 8  54 16 o 4.452000 0.8425000 4.778000 1.122000  4.125000 1.257000  0.6531000      1.685000  
1 1 1 8  54 18 o 5.797000 0.9531000 5.304000 1.248000  6.289000 1.441000  -0.9848000     1.906000  
1 1 1 8  54 20 o 6.455000 0.8786000 7.281000 0.7466000 5.628000 1.591000  1.654000       1.757000  
1 1 1 8  54 22 o 7.047000 0.8612000 7.069000 0.7802000 7.026000 1.536000  0.4302000E-01  1.722000  
1 1 1 8  54 24 o 6.970000 0.8322000 7.265000 0.7127000 6.674000 1.504000  0.5911000      1.664000  
1 1 1 8  54 26 o 4.493000 1.022000  4.862000 1.328000  4.125000 1.554000  0.7373000      2.044000  
1 1 1 8  54 28 o 4.922000 0.8618000 6.322000 0.9521000 3.522000 1.437000  2.800000       1.724000  
1 1 1 8  54 30 o 5.335000 0.9122000 6.367000 0.9863000 4.302000 1.535000  2.065000       1.824000  
1 1 1 8  54 32 o 3.736000 0.9541000 3.515000 1.318000  3.956000 1.380000  -0.4415000     1.908000  
1 1 1 8  55 1  o 11.79000 0.4959000 11.02000 0.7924000 12.57000 0.5965000 -1.557000      0.9918000 
1 1 1 8  55 3  o 9.079000 0.5519000 8.352000 0.8908000 9.805000 0.6518000 -1.452000      1.104000  
1 1 1 8  55 5  o 6.408000 0.6809000 5.570000 0.9577000 7.246000 0.9681000 -1.676000      1.362000  
1 1 1 8  55 7  o 7.064000 0.6959000 6.639000 1.115000  7.489000 0.8337000 -0.8501000     1.392000  
1 1 1 8  55 9  o 4.291000 0.8647000 4.530000 1.166000  4.051000 1.277000  0.4792000      1.729000  
1 1 1 8  55 11 o 3.035000 0.8565000 3.111000 1.203000  2.959000 1.219000  0.1524000      1.713000  
1 1 1 8  55 13 o 7.519000 0.6109000 8.390000 0.6911000 6.647000 1.007000  1.743000       1.222000  
1 1 1 8  55 15 o 5.111000 0.8740000 4.811000 1.277000  5.411000 1.194000  -0.6004000     1.748000  
1 1 1 8  55 17 o 4.365000 0.9010000 4.474000 1.213000  4.257000 1.332000  0.2169000      1.802000  
1 1 1 8  55 19 o 3.055000 0.8550000 3.080000 1.189000  3.030000 1.229000  0.4998000E-01  1.710000  
1 1 1 8  55 21 o 4.828000 0.9053000 5.365000 1.154000  4.291000 1.395000  1.073000       1.811000  
1 1 1 8  55 23 o 2.952000 0.8868000 2.589000 1.124000  3.315000 1.372000  -0.7264000     1.774000  
1 1 1 8  55 25 o 6.738000 0.7040000 4.490000 1.098000  8.985000 0.8810000 -4.495000      1.408000  
1 1 1 8  55 27 o 3.991000 1.000000  2.406000 1.098000  5.576000 1.672000  -3.170000      2.000000  
1 1 1 8  55 29 o 4.354000 0.9786000 4.460000 1.250000  4.248000 1.506000  0.2123000      1.957000  
1 1 1 8  55 31 o 4.890000 1.221000  3.564000 1.408000  6.216000 1.995000  -2.653000      2.441000  
1 1 1 8  56 0  o 2.437000 1.111000  2.437000 1.111000  2.437000 1.111000  0.000000       0.000000  
1 1 1 8  56 2  o 3.294000 0.8357000 2.577000 1.136000  4.012000 1.226000  -1.435000      1.671000  
1 1 1 8  56 4  o 4.072000 0.9659000 3.370000 1.418000  4.774000 1.312000  -1.404000      1.932000  
1 1 1 8  56 6  o 9.046000 0.6739000 8.173000 1.127000  9.920000 0.7387000 -1.747000      1.348000  
1 1 1 8  56 8  o 7.748000 0.5901000 8.522000 0.7426000 6.975000 0.9174000 1.547000       1.180000  
1 1 1 8  56 10 o 7.731000 0.8102000 6.740000 1.419000  8.721000 0.7817000 -1.981000      1.620000  
1 1 1 8  56 12 o 11.20000 0.5021000 11.34000 0.7329000 11.05000 0.6865000 0.2955000      1.004000  
1 1 1 8  56 14 o 11.18000 0.4511000 10.71000 0.6181000 11.65000 0.6574000 -0.9358000     0.9023000 
1 1 1 8  56 16 o 4.153000 0.8863000 3.246000 1.255000  5.061000 1.252000  -1.815000      1.773000  
1 1 1 8  56 18 o 7.633000 0.6533000 7.709000 0.8938000 7.557000 0.9530000 0.1523000      1.307000  
1 1 1 8  56 20 o 5.777000 0.8467000 6.086000 1.046000  5.467000 1.331000  0.6197000      1.693000  
1 1 1 8  56 22 o 5.156000 0.9767000 4.462000 1.266000  5.849000 1.488000  -1.386000      1.953000  
1 1 1 8  56 24 o 4.596000 1.051000  3.140000 1.145000  6.053000 1.762000  -2.914000      2.101000  
1 1 1 8  56 26 f 3.995000 1.035000  2.826000 1.155000  5.164000 1.719000  -2.338000      2.071000  
1 1 1 8  56 28 o 10.61000 0.5226000 11.25000 0.6665000 9.973000 0.8051000 1.280000       1.045000  
1 1 1 8  57 1  o 5.714000 0.8271000 5.885000 1.231000  5.542000 1.104000  0.3425000      1.654000  
1 1 1 8  57 3  o 5.470000 0.8385000 5.842000 1.183000  5.097000 1.189000  0.7453000      1.677000  
1 1 1 8  57 5  o 9.166000 0.5318000 8.635000 0.7561000 9.697000 0.7481000 -1.061000      1.064000  
1 1 1 8  57 7  o 4.045000 0.9176000 3.825000 1.255000  4.265000 1.339000  -0.4397000     1.835000  
1 1 1 8  57 9  o 3.576000 0.8864000 2.907000 1.204000  4.246000 1.301000  -1.339000      1.773000  
1 1 1 8  57 11 o 5.701000 0.7622000 5.614000 0.9785000 5.788000 1.169000  -0.1738000     1.524000  
1 1 1 8  57 13 o 3.544000 0.9018000 2.935000 1.198000  4.153000 1.348000  -1.218000      1.804000  
1 1 1 8  57 15 o 7.576000 0.6218000 7.473000 0.8109000 7.679000 0.9429000 -0.2067000     1.244000  
1 1 1 8  57 17 o 4.351000 0.8885000 3.269000 1.221000  5.432000 1.292000  -2.163000      1.777000  
1 1 1 8  57 19 o 4.474000 0.9191000 4.290000 1.235000  4.659000 1.361000  -0.3689000     1.838000  
1 1 1 8  57 21 o 3.314000 1.074000  2.307000 1.052000  4.321000 1.873000  -2.015000      2.148000  
1 1 1 8  57 23 o 2.894000 0.9318000 2.328000 1.067000  3.461000 1.528000  -1.133000      1.864000  
1 1 1 8  57 25 o 5.146000 1.073000  3.747000 1.301000  6.546000 1.707000  -2.799000      2.146000  
1 1 1 8  57 27 o 6.700000 2.045000  6.700000 2.045000  ?        ?         ?              ?         
1 1 1 8  58 0  o 8.912000 0.8120000 8.912000 0.8120000 8.912000 0.8120000 0.000000       0.000000  
1 1 1 8  58 2  o 4.875000 0.8402000 3.438000 1.283000  6.311000 1.085000  -2.872000      1.680000  
1 1 1 8  58 4  o 5.051000 0.8699000 4.672000 1.388000  5.430000 1.049000  -0.7578000     1.740000  
1 1 1 8  58 6  o 4.020000 0.8746000 5.030000 1.245000  3.011000 1.229000  2.019000       1.749000  
1 1 1 8  58 8  o 9.620000 0.5258000 9.361000 0.7182000 9.878000 0.7682000 -0.5169000     1.052000  
1 1 1 8  58 10 o 6.522000 0.7027000 6.897000 0.8062000 6.146000 1.151000  0.7513000      1.405000  
1 1 1 8  58 12 o 9.042000 0.5389000 9.383000 0.6205000 8.702000 0.8812000 0.6806000      1.078000  
1 1 1 8  58 14 o 7.593000 0.6517000 7.699000 0.8988000 7.487000 0.9438000 0.2121000      1.303000  
1 1 1 8  58 16 o 10.43000 0.5054000 11.24000 0.6431000 9.626000 0.7798000 1.610000       1.011000  
1 1 1 8  58 18 o 12.50000 0.4546000 12.37000 0.5785000 12.62000 0.7014000 -0.2520000     0.9092000 
1 1 1 8  58 20 o 5.670000 1.113000  5.680000 1.074000  5.659000 1.949000  0.2104000E-01  2.225000  
1 1 1 8  58 22 o 4.788000 0.9486000 3.244000 1.164000  6.332000 1.498000  -3.088000      1.897000  
1 1 1 8  58 24 o 5.510000 1.239000  4.795000 1.345000  6.226000 2.080000  -1.431000      2.477000  
1 1 1 8  59 1  o 4.634000 0.8587000 4.797000 1.242000  4.472000 1.186000  0.3253000      1.717000  
1 1 1 8  59 3  o 7.432000 0.8234000 7.118000 1.430000  7.745000 0.8163000 -0.6265000     1.647000  
1 1 1 8  59 5  o 3.106000 0.9131000 2.703000 1.175000  3.509000 1.398000  -0.8060000     1.826000  
1 1 1 8  59 7  o 4.431000 0.9670000 4.390000 1.252000  4.472000 1.474000  -0.8139000E-01 1.934000  
1 1 1 8  59 9  o 3.796000 0.9419000 3.932000 1.222000  3.659000 1.433000  0.2730000      1.884000  
1 1 1 8  59 11 o 2.985000 0.8783000 2.711000 1.142000  3.260000 1.335000  -0.5492000     1.757000  
1 1 1 8  59 13 o 4.276000 0.8564000 5.004000 1.105000  3.548000 1.309000  1.456000       1.713000  
1 1 1 8  59 15 o 2.902000 0.8499000 2.509000 1.108000  3.295000 1.289000  -0.7862000     1.700000  
1 1 1 8  59 17 o 4.352000 1.287000  4.352000 1.287000  ?        ?         ?              ?         
1 1 1 8  59 19 o 4.608000 1.181000  4.070000 1.316000  5.146000 1.960000  -1.076000      2.361000  
1 1 1 8  59 21 o 3.784000 1.162000  3.708000 1.528000  3.859000 1.753000  -0.1506000     2.325000  
1 1 1 8  60 0  f 8.374000 0.8837000 8.374000 0.8837000 8.374000 0.8837000 0.000000       0.000000  
1 1 1 8  60 2  o 3.846000 0.9751000 4.949000 1.565000  2.742000 1.164000  2.206000       1.950000  
1 1 1 8  60 4  o 7.597000 0.5876000 8.097000 0.7905000 7.098000 0.8697000 0.9990000      1.175000  
1 1 1 8  60 6  o 3.550000 0.9379000 4.403000 1.449000  2.696000 1.191000  1.707000       1.876000  
1 1 1 8  60 8  o 3.381000 0.8619000 3.763000 1.178000  2.998000 1.259000  0.7649000      1.724000  
1 1 1 8  60 10 o 2.406000 0.7709000 2.114000 0.9792000 2.698000 1.191000  -0.5837000     1.542000  
1 1 1 8  60 12 o 6.069000 0.8194000 6.256000 0.8734000 5.881000 1.387000  0.3752000      1.639000  
1 1 1 8  60 14 o 5.859000 1.116000  5.138000 1.055000  6.580000 1.967000  -1.442000      2.232000  
1 1 1 8  60 16 o 5.084000 1.065000  4.428000 1.095000  5.740000 1.826000  -1.312000      2.129000  
1 1 1 8  61 1  o 2.922000 0.8087000 3.125000 1.156000  2.720000 1.131000  0.4051000      1.617000  
1 1 1 8  61 3  o 6.460000 0.6864000 6.518000 0.8760000 6.403000 1.057000  0.1148000      1.373000  
1 1 1 8  61 5  o 9.211000 0.6118000 10.70000 0.9666000 7.718000 0.7502000 2.987000       1.224000  
1 1 1 8  61 7  o 5.309000 0.7688000 5.085000 0.9521000 5.532000 1.207000  -0.4472000     1.538000  
1 1 1 8  61 9  o 3.211000 0.8767000 3.161000 1.165000  3.262000 1.311000  -0.1004000     1.753000  
1 1 1 8  61 11 o 4.724000 0.8861000 4.972000 1.049000  4.477000 1.428000  0.4947000      1.772000  
1 1 1 8  61 13 o 4.592000 1.884000  4.592000 1.884000  ?        ?         ?              ?         
1 1 1 8  62 0  o 2.911000 1.175000  2.911000 1.175000  2.911000 1.175000  0.000000       0.000000  
1 1 1 8  62 2  o 3.743000 0.8846000 3.910000 1.215000  3.575000 1.286000  0.3357000      1.769000  
1 1 1 8  62 4  o 4.899000 0.9473000 5.774000 1.117000  4.024000 1.530000  1.750000       1.895000  
1 1 1 8  62 6  o 3.695000 1.660000  ?        ?         3.695000 1.660000  ?              ?         
1 1 1 9  0  1  o 73.45000 0.7144000 73.45000 0.7144000 73.45000 0.7144000 0.000000       0.000000  
1 1 1 9  0  3  o 131.4000 1.264000  131.4000 1.264000  131.4000 1.264000  0.000000       0.000000  
1 1 1 9  0  5  o 59.48000 0.6744000 59.48000 0.6744000 59.48000 0.6744000 0.000000       0.000000  
1 1 1 9  0  7  o 90.58000 0.8773000 90.58000 0.8773000 90.58000 0.8773000 0.000000       0.000000  
1 1 1 9  0  9  o 17.67000 0.2530000 17.67000 0.2530000 17.67000 0.2530000 0.000000       0.000000  
1 1 1 9  0  11 o 16.86000 0.3833000 16.86000 0.3833000 16.86000 0.3833000 0.000000       0.000000  
1 1 1 9  0  13 o 83.76000 0.8156000 83.76000 0.8156000 83.76000 0.8156000 0.000000       0.000000  
1 1 1 9  0  15 o 16.28000 0.2974000 16.28000 0.2974000 16.28000 0.2974000 0.000000       0.000000  
1 1 1 9  0  17 o 111.0000 1.241000  111.0000 1.241000  111.0000 1.241000  0.000000       0.000000  
1 1 1 9  0  19 o 67.32000 0.6699000 67.32000 0.6699000 67.32000 0.6699000 0.000000       0.000000  
1 1 1 9  0  21 o 22.37000 0.3559000 22.37000 0.3559000 22.37000 0.3559000 0.000000       0.000000  
1 1 1 9  0  23 o 53.09000 0.6391000 53.09000 0.6391000 53.09000 0.6391000 0.000000       0.000000  
1 1 1 9  0  25 o 16.61000 0.6542000 16.61000 0.6542000 16.61000 0.6542000 0.000000       0.000000  
1 1 1 9  0  27 f 56.71000 0.8396000 56.71000 0.8396000 56.71000 0.8396000 0.000000       0.000000  
1 1 1 9  0  29 o 102.1000 1.152000  102.1000 1.152000  102.1000 1.152000  0.000000       0.000000  
1 1 1 9  0  31 o 52.12000 0.5564000 52.12000 0.5564000 52.12000 0.5564000 0.000000       0.000000  
1 1 1 9  0  33 f 9.147000 0.7887000 9.147000 0.7887000 9.147000 0.7887000 0.000000       0.000000  
1 1 1 9  0  35 o 26.70000 0.4060000 26.70000 0.4060000 26.70000 0.4060000 0.000000       0.000000  
1 1 1 9  0  37 o 36.35000 0.5274000 36.35000 0.5274000 36.35000 0.5274000 0.000000       0.000000  
1 1 1 9  0  39 o 23.50000 0.4419000 23.50000 0.4419000 23.50000 0.4419000 0.000000       0.000000  
1 1 1 9  0  41 o 40.42000 0.4946000 40.42000 0.4946000 40.42000 0.4946000 0.000000       0.000000  
1 1 1 9  0  43 o 57.19000 0.6165000 57.19000 0.6165000 57.19000 0.6165000 0.000000       0.000000  
1 1 1 9  0  45 o 24.18000 0.5861000 24.18000 0.5861000 24.18000 0.5861000 0.000000       0.000000  
1 1 1 9  0  47 o 17.14000 0.6707000 17.14000 0.6707000 17.14000 0.6707000 0.000000       0.000000  
1 1 1 9  0  49 o 3.409000 1.478000  3.409000 1.478000  3.409000 1.478000  0.000000       0.000000  
1 1 1 9  0  51 o 2.535000 1.174000  2.535000 1.174000  2.535000 1.174000  0.000000       0.000000  
1 1 1 9  0  53 o 15.13000 0.5585000 15.13000 0.5585000 15.13000 0.5585000 0.000000       0.000000  
1 1 1 9  0  55 f 6.057000 1.181000  6.057000 1.181000  6.057000 1.181000  0.000000       0.000000  
1 1 1 9  0  57 o 13.57000 0.7052000 13.57000 0.7052000 13.57000 0.7052000 0.000000       0.000000  
1 1 1 9  0  59 o 3.826000 1.508000  3.826000 1.508000  3.826000 1.508000  0.000000       0.000000  
1 1 1 9  0  61 o 15.35000 0.5814000 15.35000 0.5814000 15.35000 0.5814000 0.000000       0.000000  
1 1 1 9  0  63 o 3.715000 1.460000  3.715000 1.460000  3.715000 1.460000  0.000000       0.000000  
1 1 1 9  0  65 o 4.531000 1.615000  4.531000 1.615000  4.531000 1.615000  0.000000       0.000000  
1 1 1 9  0  67 o 3.956000 1.522000  3.956000 1.522000  3.956000 1.522000  0.000000       0.000000  
1 1 1 9  1  0  o 47.74000 0.4748000 47.74000 0.4748000 47.74000 0.4748000 0.000000       0.000000  
1 1 1 9  1  2  o 46.04000 0.3250000 46.35000 0.4629000 45.72000 0.4563000 0.6294000      0.6500000 
1 1 1 9  1  4  o 36.32000 0.2859000 36.37000 0.4326000 36.26000 0.3738000 0.1106000      0.5717000 
1 1 1 9  1  6  o 43.23000 0.3328000 43.12000 0.4348000 43.34000 0.5040000 -0.2250000     0.6656000 
1 1 1 9  1  8  o 65.51000 0.4537000 65.58000 0.6425000 65.44000 0.6407000 0.1428000      0.9073000 
1 1 1 9  1  10 o 78.19000 0.6616000 77.40000 0.7551000 78.97000 1.087000  -1.577000      1.323000  
1 1 1 9  1  12 o 62.74000 0.4725000 62.43000 0.7115000 63.05000 0.6219000 -0.6124000     0.9450000 
1 1 1 9  1  14 o 25.77000 0.2214000 25.56000 0.3127000 25.98000 0.3134000 -0.4210000     0.4427000 
1 1 1 9  1  16 o 11.75000 0.2620000 11.92000 0.3331000 11.59000 0.4045000 0.3336000      0.5240000 
1 1 1 9  1  18 o 64.92000 0.4575000 64.74000 0.6445000 65.10000 0.6495000 -0.3628000     0.9150000 
1 1 1 9  1  20 o 29.34000 0.2588000 29.38000 0.3655000 29.29000 0.3666000 0.8491000E-01  0.5177000 
1 1 1 9  1  22 o 164.6000 1.373000  164.6000 2.242000  164.6000 1.586000  0.4257000E-02  2.746000  
1 1 1 9  1  24 o 34.10000 0.2951000 33.82000 0.4149000 34.39000 0.4197000 -0.5655000     0.5902000 
1 1 1 9  1  26 o 115.9000 1.027000  117.0000 1.315000  114.8000 1.578000  2.205000       2.054000  
1 1 1 9  1  28 o 40.48000 0.3806000 40.72000 0.5422000 40.23000 0.5342000 0.4839000      0.7611000 
1 1 1 9  1  30 o 17.60000 0.3350000 17.01000 0.4644000 18.19000 0.4830000 -1.182000      0.6701000 
1 1 1 9  1  32 o 57.87000 0.4932000 58.55000 0.7038000 57.19000 0.6910000 1.354000       0.9863000 
1 1 1 9  1  34 o 40.40000 0.3440000 40.13000 0.5387000 40.67000 0.4281000 -0.5420000     0.6881000 
1 1 1 9  1  36 o 38.82000 0.3382000 38.80000 0.5305000 38.85000 0.4196000 -0.5188000E-01 0.6764000 
1 1 1 9  1  38 o 10.97000 0.4847000 11.90000 0.7417000 10.05000 0.6241000 1.843000       0.9694000 
1 1 1 9  1  40 o 23.91000 0.3774000 23.08000 0.6132000 24.75000 0.4401000 -1.670000      0.7548000 
1 1 1 9  1  42 o 31.86000 0.3482000 31.53000 0.5159000 32.20000 0.4677000 -0.6690000     0.6963000 
1 1 1 9  1  44 o 33.75000 0.3606000 33.53000 0.5383000 33.97000 0.4799000 -0.4443000     0.7211000 
1 1 1 9  1  46 o 19.91000 0.4137000 20.48000 0.6216000 19.35000 0.5459000 1.128000       0.8273000 
1 1 1 9  1  48 o 32.53000 0.3345000 32.54000 0.4726000 32.52000 0.4734000 0.1561000E-01  0.6689000 
1 1 1 9  1  50 o 34.59000 0.3363000 34.76000 0.4793000 34.42000 0.4718000 0.3403000      0.6726000 
1 1 1 9  1  52 o 21.37000 0.3767000 20.81000 0.5305000 21.94000 0.5350000 -1.122000      0.7534000 
1 1 1 9  1  54 o 17.23000 0.4017000 17.35000 0.5866000 17.10000 0.5489000 0.2478000      0.8033000 
1 1 1 9  1  56 o 14.10000 0.4452000 14.56000 0.6598000 13.63000 0.5978000 0.9372000      0.8904000 
1 1 1 9  1  58 o 4.710000 1.034000  4.482000 1.624000  4.938000 1.282000  -0.4558000     2.069000  
1 1 1 9  1  60 o 10.24000 0.7110000 10.29000 1.194000  10.19000 0.7723000 0.1066000      1.422000  
1 1 1 9  1  62 o 3.551000 1.053000  3.242000 1.411000  3.859000 1.565000  -0.6172000     2.107000  
1 1 1 9  1  64 o 4.154000 1.126000  4.193000 1.518000  4.116000 1.664000  0.7657000E-01  2.252000  
1 1 1 9  1  66 o 3.724000 1.028000  3.206000 1.342000  4.242000 1.559000  -1.036000      2.057000  
1 1 1 9  2  1  o 51.67000 0.3615000 51.75000 0.5117000 51.58000 0.5107000 0.1726000      0.7229000 
1 1 1 9  2  3  o 47.82000 0.3636000 47.85000 0.5497000 47.79000 0.4761000 0.6481000E-01  0.7272000 
1 1 1 9  2  5  o 27.05000 0.2109000 26.94000 0.2973000 27.15000 0.2992000 -0.2044000     0.4218000 
1 1 1 9  2  7  o 44.75000 0.3904000 44.47000 0.4478000 45.03000 0.6396000 -0.5602000     0.7808000 
1 1 1 9  2  9  o 25.72000 0.2534000 25.66000 0.2948000 25.78000 0.4122000 -0.1197000     0.5068000 
1 1 1 9  2  11 o 39.45000 0.3129000 39.50000 0.4733000 39.40000 0.4094000 0.9748000E-01  0.6258000 
1 1 1 9  2  13 o 19.08000 0.2148000 18.96000 0.3255000 19.20000 0.2802000 -0.2397000     0.4295000 
1 1 1 9  2  15 o 35.76000 0.2961000 35.51000 0.3851000 36.01000 0.4498000 -0.5012000     0.5921000 
1 1 1 9  2  17 o 58.64000 0.4311000 57.88000 0.5200000 59.40000 0.6877000 -1.527000      0.8622000 
1 1 1 9  2  19 o 82.44000 0.5723000 82.52000 0.8096000 82.37000 0.8093000 0.1542000      1.145000  
1 1 1 9  2  21 o 56.44000 0.4400000 57.27000 0.6706000 55.61000 0.5700000 1.655000       0.8801000 
1 1 1 9  2  23 o 78.67000 0.6359000 78.63000 0.8973000 78.70000 0.9013000 -0.7836000E-01 1.272000  
1 1 1 9  2  25 o 131.6000 0.9010000 132.0000 1.277000  131.2000 1.271000  0.8236000      1.802000  
1 1 1 9  2  27 o 29.20000 0.4063000 29.37000 0.5639000 29.02000 0.5851000 0.3529000      0.8126000 
1 1 1 9  2  29 o 48.90000 0.4792000 48.80000 0.6072000 49.00000 0.7415000 -0.2075000     0.9584000 
1 1 1 9  2  31 o 60.04000 0.4742000 60.09000 0.7145000 59.98000 0.6237000 0.1129000      0.9484000 
1 1 1 9  2  33 o 42.87000 0.4065000 42.92000 0.6840000 42.82000 0.4395000 0.9955000E-01  0.8131000 
1 1 1 9  2  35 o 27.63000 0.3091000 27.96000 0.4833000 27.30000 0.3855000 0.6597000      0.6182000 
1 1 1 9  2  37 o 9.623000 0.6921000 8.759000 1.184000  10.49000 0.7163000 -1.728000      1.384000  
1 1 1 9  2  39 o 44.20000 0.3715000 44.39000 0.5855000 44.01000 0.4574000 0.3776000      0.7430000 
1 1 1 9  2  41 o 40.35000 0.4004000 40.00000 0.5578000 40.70000 0.5746000 -0.7061000     0.8008000 
1 1 1 9  2  43 o 28.59000 0.3487000 28.22000 0.5199000 28.95000 0.4648000 -0.7226000     0.6974000 
1 1 1 9  2  45 f 35.82000 0.3699000 36.33000 0.5530000 35.30000 0.4915000 1.027000       0.7399000 
1 1 1 9  2  47 o 12.77000 0.5320000 12.02000 0.8795000 13.53000 0.5987000 -1.507000      1.064000  
1 1 1 9  2  49 o 4.891000 1.156000  5.246000 1.777000  4.536000 1.480000  0.7098000      2.313000  
1 1 1 9  2  51 o 13.33000 0.4770000 14.09000 0.7634000 12.58000 0.5723000 1.508000       0.9541000 
1 1 1 9  2  53 o 9.664000 0.5695000 10.17000 0.8598000 9.156000 0.7469000 1.016000       1.139000  
1 1 1 9  2  55 o 12.00000 0.4810000 12.28000 0.7057000 11.72000 0.6536000 0.5555000      0.9619000 
1 1 1 9  2  57 f 13.21000 0.5497000 12.84000 0.9528000 13.57000 0.5486000 -0.7311000     1.099000  
1 1 1 9  2  59 o 3.427000 0.9766000 4.056000 1.519000  2.798000 1.227000  1.258000       1.953000  
1 1 1 9  2  61 o 4.195000 1.091000  4.236000 1.670000  4.155000 1.405000  0.8151000E-01  2.182000  
1 1 1 9  2  63 o 9.621000 0.6531000 10.40000 0.9676000 8.843000 0.8775000 1.557000       1.306000  
1 1 1 9  2  65 o 6.890000 0.9610000 6.953000 1.388000  6.826000 1.330000  0.1268000      1.922000  
1 1 1 9  2  67 o 5.746000 1.202000  6.498000 1.824000  4.994000 1.565000  1.504000       2.404000  
1 1 1 9  3  0  o 51.80000 0.5906000 51.80000 0.5906000 51.80000 0.5906000 0.000000       0.000000  
1 1 1 9  3  2  o 25.37000 0.2282000 25.33000 0.3221000 25.42000 0.3234000 -0.9325000E-01 0.4564000 
1 1 1 9  3  4  o 83.38000 0.6168000 83.50000 0.8093000 83.26000 0.9310000 0.2433000      1.234000  
1 1 1 9  3  6  o 27.59000 0.2615000 27.45000 0.3016000 27.74000 0.4272000 -0.2871000     0.5229000 
1 1 1 9  3  8  o 19.65000 0.1816000 19.65000 0.2561000 19.65000 0.2576000 0.3342000E-02  0.3633000 
1 1 1 9  3  10 o 47.18000 0.3628000 46.87000 0.4724000 47.49000 0.5509000 -0.6222000     0.7257000 
1 1 1 9  3  12 o 130.8000 0.8910000 130.3000 1.255000  131.3000 1.265000  -1.030000      1.782000  
1 1 1 9  3  14 o 79.90000 0.6374000 79.66000 0.8979000 80.14000 0.9049000 -0.4791000     1.275000  
1 1 1 9  3  16 o 21.14000 0.2589000 21.04000 0.2715000 21.25000 0.4409000 -0.2048000     0.5177000 
1 1 1 9  3  18 o 66.05000 0.5363000 66.59000 0.7639000 65.52000 0.7528000 1.069000       1.073000  
1 1 1 9  3  20 o 97.81000 0.6744000 98.06000 0.9555000 97.56000 0.9521000 0.5010000      1.349000  
1 1 1 9  3  22 o 40.96000 0.3451000 41.25000 0.5200000 40.67000 0.4538000 0.5831000      0.6901000 
1 1 1 9  3  24 o 18.13000 0.2919000 18.38000 0.4075000 17.88000 0.4181000 0.5078000      0.5839000 
1 1 1 9  3  26 o 30.62000 0.4097000 30.29000 0.5702000 30.96000 0.5885000 -0.6709000     0.8195000 
1 1 1 9  3  28 o 43.15000 0.3703000 43.19000 0.5573000 43.11000 0.4877000 0.7637000E-01  0.7406000 
1 1 1 9  3  30 o 29.91000 0.3879000 30.52000 0.4783000 29.31000 0.6108000 1.206000       0.7758000 
1 1 1 9  3  32 o 42.25000 0.3519000 41.53000 0.5442000 42.97000 0.4463000 -1.439000      0.7038000 
1 1 1 9  3  34 o 25.17000 0.3586000 24.99000 0.6053000 25.35000 0.3847000 -0.3587000     0.7172000 
1 1 1 9  3  36 o 22.50000 0.3551000 22.53000 0.5971000 22.46000 0.3846000 0.6128000E-01  0.7102000 
1 1 1 9  3  38 o 33.33000 0.3239000 33.37000 0.5064000 33.28000 0.4041000 0.9675000E-01  0.6479000 
1 1 1 9  3  40 o 21.98000 0.3802000 21.32000 0.6008000 22.64000 0.4661000 -1.323000      0.7604000 
1 1 1 9  3  42 o 22.41000 0.3440000 22.49000 0.5346000 22.33000 0.4330000 0.1538000      0.6879000 
1 1 1 9  3  44 o 23.64000 0.3889000 23.20000 0.5373000 24.09000 0.5625000 -0.8921000     0.7779000 
1 1 1 9  3  46 o 37.66000 0.4105000 37.68000 0.6884000 37.64000 0.4473000 0.4211000E-01  0.8210000 
1 1 1 9  3  48 o 9.759000 0.6300000 10.68000 0.9163000 8.839000 0.8649000 1.840000       1.260000  
1 1 1 9  3  50 f 5.700000 0.9715000 6.122000 1.440000  5.278000 1.304000  0.8438000      1.943000  
1 1 1 9  3  52 o 11.90000 0.5038000 11.81000 0.7724000 11.99000 0.6471000 -0.1752000     1.008000  
1 1 1 9  3  54 o 8.891000 0.6136000 9.040000 0.9473000 8.742000 0.7801000 0.2977000      1.227000  
1 1 1 9  3  56 o 2.870000 0.8608000 2.526000 1.196000  3.213000 1.238000  -0.6864000     1.722000  
1 1 1 9  3  58 o 11.44000 0.6170000 10.97000 1.082000  11.92000 0.5930000 -0.9584000     1.234000  
1 1 1 9  3  60 o 14.87000 0.5066000 15.48000 0.8135000 14.27000 0.6041000 1.206000       1.013000  
1 1 1 9  3  62 o 6.157000 1.041000  5.861000 1.600000  6.453000 1.331000  -0.5914000     2.082000  
1 1 1 9  3  64 o 5.685000 0.9931000 5.933000 1.490000  5.437000 1.313000  0.4964000      1.986000  
1 1 1 9  3  66 f 4.020000 0.9860000 3.399000 1.495000  4.640000 1.286000  -1.242000      1.972000  
1 1 1 9  4  1  o 128.9000 1.012000  128.3000 1.425000  129.5000 1.438000  -1.227000      2.024000  
1 1 1 9  4  3  o 69.54000 0.5172000 69.67000 0.6792000 69.41000 0.7802000 0.2594000      1.034000  
1 1 1 9  4  5  o 27.21000 0.2269000 27.61000 0.3019000 26.82000 0.3389000 0.7916000      0.4538000 
1 1 1 9  4  7  o 61.50000 0.4621000 61.06000 0.5994000 61.93000 0.7035000 -0.8775000     0.9242000 
1 1 1 9  4  9  o 72.87000 0.5442000 72.23000 0.7047000 73.51000 0.8294000 -1.284000      1.088000  
1 1 1 9  4  11 o 68.41000 0.5126000 68.45000 0.7757000 68.37000 0.6704000 0.8012000E-01  1.025000  
1 1 1 9  4  13 o 30.99000 0.2644000 31.29000 0.3465000 30.69000 0.3994000 0.5952000      0.5288000 
1 1 1 9  4  15 o 94.82000 0.7043000 94.53000 0.9192000 95.10000 1.067000  -0.5660000     1.409000  
1 1 1 9  4  17 o 123.4000 0.8713000 123.2000 1.065000  123.6000 1.379000  -0.3357000     1.743000  
1 1 1 9  4  19 o 51.72000 0.4594000 51.58000 0.7462000 51.86000 0.5361000 -0.2761000     0.9188000 
1 1 1 9  4  21 o 53.35000 0.3896000 53.70000 0.5502000 52.99000 0.5517000 0.7164000      0.7792000 
1 1 1 9  4  23 o 57.06000 0.4789000 57.29000 0.6747000 56.83000 0.6798000 0.4527000      0.9578000 
1 1 1 9  4  25 o 69.43000 0.4930000 69.84000 0.6975000 69.02000 0.6968000 0.8183000      0.9860000 
1 1 1 9  4  27 o 44.68000 0.3763000 43.96000 0.5584000 45.41000 0.5045000 -1.458000      0.7526000 
1 1 1 9  4  29 o 35.92000 0.3215000 35.96000 0.5022000 35.87000 0.4016000 0.8434000E-01  0.6430000 
1 1 1 9  4  31 o 12.71000 0.4320000 12.96000 0.6187000 12.46000 0.6032000 0.5034000      0.8641000 
1 1 1 9  4  33 o 7.308000 0.8147000 7.344000 1.152000  7.272000 1.153000  0.7201000E-01  1.629000  
1 1 1 9  4  35 o 44.28000 0.3646000 43.75000 0.5684000 44.80000 0.4567000 -1.042000      0.7292000 
1 1 1 9  4  37 o 31.59000 0.3991000 31.01000 0.5997000 32.17000 0.5266000 -1.161000      0.7981000 
1 1 1 9  4  39 o 36.30000 0.3783000 35.54000 0.6261000 37.05000 0.4248000 -1.509000      0.7566000 
1 1 1 9  4  41 o 31.34000 0.3452000 31.66000 0.5173000 31.02000 0.4571000 0.6368000      0.6903000 
1 1 1 9  4  43 o 14.49000 0.4367000 14.45000 0.6833000 14.54000 0.5441000 -0.8902000E-01 0.8735000 
1 1 1 9  4  45 o 11.49000 0.5535000 11.69000 0.8479000 11.29000 0.7118000 0.4047000      1.107000  
1 1 1 9  4  47 o 24.72000 0.4123000 24.25000 0.6991000 25.19000 0.4372000 -0.9373000     0.8246000 
1 1 1 9  4  49 o 15.08000 0.4449000 14.49000 0.6834000 15.66000 0.5699000 -1.174000      0.8899000 
1 1 1 9  4  51 o 9.746000 0.6435000 8.819000 1.107000  10.67000 0.6572000 -1.854000      1.287000  
1 1 1 9  4  53 o 15.53000 0.4214000 15.98000 0.6161000 15.08000 0.5751000 0.9051000      0.8428000 
1 1 1 9  4  55 o 9.158000 0.6591000 8.646000 0.9915000 9.671000 0.8687000 -1.025000      1.318000  
1 1 1 9  4  57 o 11.72000 0.4927000 11.59000 0.7886000 11.85000 0.5909000 -0.2539000     0.9854000 
1 1 1 9  4  59 o 4.083000 1.132000  4.511000 1.742000  3.656000 1.445000  0.8549000      2.263000  
1 1 1 9  4  61 o 3.408000 1.026000  3.832000 1.633000  2.983000 1.243000  0.8488000      2.052000  
1 1 1 9  4  63 o 11.99000 0.5752000 11.08000 0.9037000 12.90000 0.7120000 -1.817000      1.150000  
1 1 1 9  4  65 o 7.963000 0.8643000 7.555000 1.327000  8.372000 1.108000  -0.8162000     1.729000  
1 1 1 9  5  0  o 14.87000 0.2217000 14.87000 0.2217000 14.87000 0.2217000 0.000000       0.000000  
1 1 1 9  5  2  o 41.85000 0.2982000 41.88000 0.4217000 41.82000 0.4217000 0.5950000E-01  0.5963000 
1 1 1 9  5  4  o 31.14000 0.2337000 30.74000 0.3266000 31.54000 0.3344000 -0.7998000     0.4674000 
1 1 1 9  5  6  o 26.79000 0.2108000 26.69000 0.2958000 26.89000 0.3003000 -0.1958000     0.4215000 
1 1 1 9  5  8  o 31.07000 0.2537000 30.92000 0.3328000 31.21000 0.3829000 -0.2819000     0.5073000 
1 1 1 9  5  10 o 55.35000 0.4192000 55.53000 0.6346000 55.16000 0.5480000 0.3698000      0.8385000 
1 1 1 9  5  12 o 72.82000 0.5829000 72.48000 0.8201000 73.17000 0.8286000 -0.6905000     1.166000  
1 1 1 9  5  14 o 24.53000 0.2589000 24.08000 0.3660000 24.98000 0.3662000 -0.8996000     0.5177000 
1 1 1 9  5  16 o 52.57000 0.4076000 52.77000 0.5349000 52.38000 0.6153000 0.3823000      0.8153000 
1 1 1 9  5  18 o 70.87000 0.5125000 70.87000 0.6269000 70.88000 0.8109000 -0.4028000E-02 1.025000  
1 1 1 9  5  20 o 110.7000 0.8214000 110.8000 1.241000  110.6000 1.077000  0.1643000      1.643000  
1 1 1 9  5  22 o 42.77000 0.3812000 42.95000 0.5314000 42.59000 0.5467000 0.3590000      0.7624000 
1 1 1 9  5  24 o 95.96000 0.6860000 96.25000 1.085000  95.67000 0.8399000 0.5746000      1.372000  
1 1 1 9  5  26 o 22.29000 0.3764000 22.29000 0.5645000 22.29000 0.4982000 -0.2014000E-02 0.7529000 
1 1 1 9  5  28 f 74.55000 0.5430000 73.95000 0.8508000 75.15000 0.6749000 -1.203000      1.086000  
1 1 1 9  5  30 o 57.50000 0.4381000 57.50000 0.6881000 57.49000 0.5424000 0.5447000E-02  0.8762000 
1 1 1 9  5  32 o 40.34000 0.3445000 40.16000 0.5397000 40.51000 0.4281000 -0.3463000     0.6889000 
1 1 1 9  5  34 o 25.35000 0.3682000 24.96000 0.6242000 25.74000 0.3908000 -0.7859000     0.7364000 
1 1 1 9  5  36 o 13.53000 0.4330000 13.37000 0.6434000 13.68000 0.5797000 -0.3159000     0.8660000 
1 1 1 9  5  38 o 40.93000 0.3535000 40.88000 0.5537000 40.97000 0.4395000 -0.8674000E-01 0.7069000 
1 1 1 9  5  40 o 32.55000 0.3618000 31.43000 0.4967000 33.67000 0.5261000 -2.242000      0.7235000 
1 1 1 9  5  42 o 47.63000 0.3913000 47.17000 0.6096000 48.08000 0.4908000 -0.9052000     0.7826000 
1 1 1 9  5  44 o 28.03000 0.3535000 28.01000 0.5236000 28.06000 0.4749000 -0.5120000E-01 0.7069000 
1 1 1 9  5  46 o 10.53000 0.6101000 10.16000 0.9887000 10.90000 0.7152000 -0.7320000     1.220000  
1 1 1 9  5  48 o 12.05000 0.5137000 12.40000 0.8157000 11.71000 0.6246000 0.6978000      1.027000  
1 1 1 9  5  50 o 6.539000 0.9389000 6.709000 1.548000  6.368000 1.064000  0.3408000      1.878000  
1 1 1 9  5  52 o 7.351000 0.8364000 8.098000 1.142000  6.603000 1.222000  1.495000       1.673000  
1 1 1 9  5  54 o 20.00000 0.3569000 20.36000 0.5600000 19.63000 0.4425000 0.7386000      0.7137000 
1 1 1 9  5  56 o 6.580000 0.9481000 6.545000 1.324000  6.614000 1.358000  -0.6903000E-01 1.896000  
1 1 1 9  5  58 o 7.990000 0.8611000 8.336000 1.451000  7.644000 0.9278000 0.6919000      1.722000  
1 1 1 9  5  60 o 4.269000 1.100000  4.729000 1.715000  3.809000 1.378000  0.9200000      2.200000  
1 1 1 9  5  62 f 7.924000 0.8132000 8.771000 1.156000  7.077000 1.144000  1.694000       1.626000  
1 1 1 9  5  64 o 2.504000 0.8506000 2.804000 1.328000  2.204000 1.063000  0.6002000      1.701000  
1 1 1 9  5  66 o 3.228000 0.9957000 3.530000 1.525000  2.927000 1.281000  0.6033000      1.991000  
1 1 1 9  6  1  o 13.13000 0.1741000 13.34000 0.2150000 12.92000 0.2739000 0.4152000      0.3482000 
1 1 1 9  6  3  o 58.54000 0.4068000 57.94000 0.5697000 59.15000 0.5808000 -1.208000      0.8135000 
1 1 1 9  6  5  o 25.23000 0.2011000 25.04000 0.2819000 25.43000 0.2869000 -0.3918000     0.4022000 
1 1 1 9  6  7  o 74.00000 0.6236000 74.21000 0.7227000 73.79000 1.016000  0.4210000      1.247000  
1 1 1 9  6  9  o 38.30000 0.3015000 38.44000 0.4546000 38.17000 0.3961000 0.2774000      0.6030000 
1 1 1 9  6  11 o 77.59000 0.6594000 78.31000 1.084000  76.87000 0.7507000 1.432000       1.319000  
1 1 1 9  6  13 o 102.7000 0.7262000 103.3000 0.8961000 102.1000 1.143000  1.199000       1.452000  
1 1 1 9  6  15 o 17.74000 0.2216000 17.67000 0.2577000 17.80000 0.3605000 -0.1299000     0.4431000 
1 1 1 9  6  17 o 75.20000 0.5654000 75.29000 0.7398000 75.11000 0.8552000 0.1780000      1.131000  
1 1 1 9  6  19 o 51.77000 0.3895000 51.68000 0.4736000 51.86000 0.6186000 -0.1843000     0.7791000 
1 1 1 9  6  21 o 36.03000 0.3206000 35.62000 0.4769000 36.44000 0.4288000 -0.8256000     0.6413000 
1 1 1 9  6  23 o 67.15000 0.5158000 66.48000 0.7709000 67.81000 0.6854000 -1.322000      1.032000  
1 1 1 9  6  25 o 23.08000 0.2969000 23.39000 0.4378000 22.77000 0.4012000 0.6244000      0.5938000 
1 1 1 9  6  27 o 34.48000 0.3300000 34.05000 0.4936000 34.92000 0.4381000 -0.8745000     0.6600000 
1 1 1 9  6  29 o 35.62000 0.3358000 35.24000 0.4957000 36.00000 0.4531000 -0.7680000     0.6716000 
1 1 1 9  6  31 o 17.65000 0.3568000 17.70000 0.5256000 17.59000 0.4826000 0.1039000      0.7136000 
1 1 1 9  6  33 o 4.475000 0.9508000 5.371000 1.400000  3.579000 1.287000  1.792000       1.902000  
1 1 1 9  6  35 o 48.72000 0.4472000 48.89000 0.7544000 48.54000 0.4804000 0.3523000      0.8944000 
1 1 1 9  6  37 o 16.07000 0.4419000 16.31000 0.6626000 15.83000 0.5849000 0.4819000      0.8838000 
1 1 1 9  6  39 o 32.28000 0.3782000 32.12000 0.6086000 32.44000 0.4491000 -0.3226000     0.7564000 
1 1 1 9  6  41 o 36.64000 0.3444000 37.09000 0.5358000 36.19000 0.4329000 0.9007000      0.6889000 
1 1 1 9  6  43 o 35.40000 0.3611000 34.81000 0.5354000 36.00000 0.4848000 -1.192000      0.7223000 
1 1 1 9  6  45 o 24.17000 0.3755000 23.82000 0.5656000 24.51000 0.4939000 -0.6917000     0.7509000 
1 1 1 9  6  47 o 18.47000 0.4024000 18.16000 0.6335000 18.79000 0.4965000 -0.6290000     0.8049000 
1 1 1 9  6  49 o 15.30000 0.4336000 15.45000 0.6722000 15.14000 0.5478000 0.3084000      0.8671000 
1 1 1 9  6  51 o 17.76000 0.4234000 18.15000 0.6986000 17.37000 0.4785000 0.7802000      0.8467000 
1 1 1 9  6  53 o 13.93000 0.4400000 14.10000 0.6891000 13.76000 0.5475000 0.3409000      0.8801000 
1 1 1 9  6  55 o 15.28000 0.4783000 15.22000 0.7720000 15.35000 0.5650000 -0.1268000     0.9567000 
1 1 1 9  6  57 o 8.551000 0.6826000 8.609000 1.081000  8.494000 0.8333000 0.1144000      1.365000  
1 1 1 9  6  59 o 9.495000 0.7168000 9.175000 1.183000  9.816000 0.8105000 -0.6413000     1.434000  
1 1 1 9  6  61 o 4.306000 1.038000  4.694000 1.566000  3.919000 1.362000  0.7748000      2.075000  
1 1 1 9  6  63 f 6.596000 0.9796000 6.422000 1.584000  6.771000 1.152000  -0.3487000     1.959000  
1 1 1 9  6  65 o 7.914000 0.8610000 6.893000 1.472000  8.935000 0.8930000 -2.042000      1.722000  
1 1 1 9  7  0  o 67.96000 0.6627000 67.96000 0.6627000 67.96000 0.6627000 0.000000       0.000000  
1 1 1 9  7  2  o 64.36000 0.4454000 63.62000 0.6224000 65.10000 0.6374000 -1.484000      0.8909000 
1 1 1 9  7  4  o 22.38000 0.1989000 22.18000 0.2610000 22.57000 0.3001000 -0.3915000     0.3977000 
1 1 1 9  7  6  o 41.06000 0.3379000 40.95000 0.4762000 41.17000 0.4796000 -0.2207000     0.6758000 
1 1 1 9  7  8  o 7.217000 0.2468000 7.269000 0.3414000 7.166000 0.3565000 0.1034000      0.4936000 
1 1 1 9  7  10 o 105.1000 0.7757000 106.0000 1.025000  104.2000 1.165000  1.891000       1.551000  
1 1 1 9  7  12 o 155.0000 1.137000  156.6000 1.506000  153.4000 1.705000  3.191000       2.275000  
1 1 1 9  7  14 o 161.5000 1.134000  161.9000 1.392000  161.1000 1.791000  0.7328000      2.268000  
1 1 1 9  7  16 o 51.79000 0.3858000 51.68000 0.4688000 51.89000 0.6128000 -0.2084000     0.7716000 
1 1 1 9  7  18 o 68.62000 0.4981000 68.19000 0.6034000 69.05000 0.7926000 -0.8666000     0.9961000 
1 1 1 9  7  20 o 29.07000 0.3066000 29.30000 0.4387000 28.84000 0.4283000 0.4636000      0.6131000 
1 1 1 9  7  22 o 84.66000 0.7184000 83.95000 1.163000  85.37000 0.8441000 -1.423000      1.437000  
1 1 1 9  7  24 o 70.96000 0.5420000 71.50000 0.8215000 70.43000 0.7072000 1.074000       1.084000  
1 1 1 9  7  26 o 56.76000 0.5080000 57.09000 0.8258000 56.43000 0.5919000 0.6633000      1.016000  
1 1 1 9  7  28 o 13.80000 0.3969000 14.19000 0.5799000 13.41000 0.5420000 0.7790000      0.7937000 
1 1 1 9  7  30 o 36.48000 0.3256000 36.98000 0.5117000 35.98000 0.4029000 0.9957000      0.6512000 
1 1 1 9  7  32 o 34.43000 0.3352000 34.80000 0.5028000 34.06000 0.4434000 0.7340000      0.6703000 
1 1 1 9  7  34 o 5.991000 0.8041000 5.951000 1.269000  6.031000 0.9879000 -0.7950000E-01 1.608000  
1 1 1 9  7  36 o 47.78000 0.4028000 46.96000 0.5948000 48.60000 0.5434000 -1.642000      0.8056000 
1 1 1 9  7  38 o 40.30000 0.3515000 40.50000 0.5522000 40.11000 0.4352000 0.3840000      0.7031000 
1 1 1 9  7  40 o 35.01000 0.3505000 34.46000 0.5168000 35.56000 0.4738000 -1.100000      0.7011000 
1 1 1 9  7  42 o 46.30000 0.4062000 46.35000 0.6050000 46.25000 0.5422000 0.9286000E-01  0.8124000 
1 1 1 9  7  44 o 40.61000 0.3639000 40.44000 0.5667000 40.77000 0.4567000 -0.3266000     0.7278000 
1 1 1 9  7  46 o 3.536000 1.030000  4.090000 1.598000  2.982000 1.301000  1.108000       2.061000  
1 1 1 9  7  48 o 25.87000 0.4090000 26.09000 0.6645000 25.65000 0.4772000 0.4492000      0.8181000 
1 1 1 9  7  50 o 15.15000 0.4833000 15.29000 0.8125000 15.02000 0.5236000 0.2666000      0.9667000 
1 1 1 9  7  52 o 3.584000 0.9600000 2.850000 1.301000  4.318000 1.412000  -1.468000      1.920000  
1 1 1 9  7  54 o 4.265000 0.9755000 3.339000 1.426000  5.191000 1.332000  -1.853000      1.951000  
1 1 1 9  7  56 o 6.728000 0.8411000 6.001000 1.435000  7.455000 0.8780000 -1.454000      1.682000  
1 1 1 9  7  58 o 4.629000 0.9585000 5.937000 1.406000  3.321000 1.303000  2.616000       1.917000  
1 1 1 9  7  60 o 7.340000 0.9207000 7.064000 1.592000  7.615000 0.9249000 -0.5505000     1.841000  
1 1 1 9  7  62 o 4.059000 1.090000  4.628000 1.601000  3.489000 1.480000  1.140000       2.181000  
1 1 1 9  7  64 o 4.949000 1.084000  4.604000 1.696000  5.293000 1.350000  -0.6882000     2.168000  
1 1 1 9  7  66 f 3.359000 0.9823000 3.415000 1.482000  3.304000 1.289000  0.1115000      1.965000  
1 1 1 9  8  1  o 25.15000 0.2238000 24.95000 0.3139000 25.35000 0.3190000 -0.4055000     0.4476000 
1 1 1 9  8  3  o 68.18000 0.5415000 68.71000 0.7712000 67.65000 0.7603000 1.057000       1.083000  
1 1 1 9  8  5  o 66.77000 0.5313000 66.90000 0.7527000 66.63000 0.7501000 0.2690000      1.063000  
1 1 1 9  8  7  o 69.31000 0.6228000 69.11000 0.7823000 69.51000 0.9693000 -0.4087000     1.246000  
1 1 1 9  8  9  o 100.2000 0.6855000 99.55000 0.9630000 100.8000 0.9758000 -1.225000      1.371000  
1 1 1 9  8  11 o 89.67000 0.6651000 90.49000 0.8781000 88.84000 0.9991000 1.649000       1.330000  
1 1 1 9  8  13 o 46.24000 0.3478000 46.19000 0.4220000 46.28000 0.5530000 -0.8216000E-01 0.6956000 
1 1 1 9  8  15 o 40.60000 0.3137000 40.40000 0.3790000 40.80000 0.5000000 -0.3944000     0.6274000 
1 1 1 9  8  17 o 45.19000 0.3633000 45.07000 0.4700000 45.32000 0.5541000 -0.2514000     0.7266000 
1 1 1 9  8  19 o 65.33000 0.4769000 65.89000 0.5867000 64.77000 0.7519000 1.119000       0.9538000 
1 1 1 9  8  21 o 91.53000 0.7819000 92.95000 1.289000  90.11000 0.8852000 2.840000       1.564000  
1 1 1 9  8  23 o 120.1000 0.8902000 121.0000 1.352000  119.1000 1.158000  1.894000       1.780000  
1 1 1 9  8  25 o 64.21000 0.4758000 64.62000 0.7515000 63.79000 0.5839000 0.8309000      0.9517000 
1 1 1 9  8  27 o 30.92000 0.3128000 30.56000 0.4651000 31.27000 0.4183000 -0.7039000     0.6256000 
1 1 1 9  8  29 o 28.34000 0.3117000 28.47000 0.4591000 28.21000 0.4217000 0.2636000      0.6233000 
1 1 1 9  8  31 o 40.27000 0.3386000 40.46000 0.5285000 40.08000 0.4234000 0.3769000      0.6772000 
1 1 1 9  8  33 o 10.52000 0.4723000 10.61000 0.7517000 10.44000 0.5721000 0.1763000      0.9447000 
1 1 1 9  8  35 o 21.49000 0.3158000 22.18000 0.4901000 20.81000 0.3983000 1.368000       0.6315000 
1 1 1 9  8  37 o 23.93000 0.3657000 24.38000 0.6106000 23.47000 0.4029000 0.9127000      0.7315000 
1 1 1 9  8  39 o 23.37000 0.3644000 24.23000 0.6026000 22.51000 0.4101000 1.727000       0.7289000 
1 1 1 9  8  41 o 15.05000 0.4782000 16.17000 0.6169000 13.93000 0.7309000 2.248000       0.9565000 
1 1 1 9  8  43 o 41.31000 0.3684000 41.14000 0.5726000 41.48000 0.4636000 -0.3356000     0.7367000 
1 1 1 9  8  45 o 21.59000 0.3714000 21.28000 0.5573000 21.91000 0.4911000 -0.6269000     0.7428000 
1 1 1 9  8  47 o 7.054000 0.9027000 6.059000 1.551000  8.049000 0.9241000 -1.990000      1.805000  
1 1 1 9  8  49 o 12.50000 0.5069000 12.32000 0.8273000 12.67000 0.5861000 -0.3490000     1.014000  
1 1 1 9  8  51 o 11.63000 0.6393000 11.08000 1.048000  12.18000 0.7328000 -1.097000      1.279000  
1 1 1 9  8  53 o 23.37000 0.3608000 23.53000 0.5270000 23.20000 0.4929000 0.3362000      0.7216000 
1 1 1 9  8  55 o 6.649000 0.8213000 6.914000 1.275000  6.384000 1.036000  0.5294000      1.643000  
1 1 1 9  8  57 o 5.438000 0.9759000 5.403000 1.485000  5.472000 1.267000  -0.6845000E-01 1.952000  
1 1 1 9  8  59 o 6.325000 0.9728000 6.165000 1.684000  6.485000 0.9739000 -0.3195000     1.946000  
1 1 1 9  8  61 o 4.854000 1.004000  4.818000 1.602000  4.890000 1.211000  -0.7141000E-01 2.008000  
1 1 1 9  8  63 o 7.578000 0.8706000 8.316000 1.133000  6.841000 1.322000  1.475000       1.741000  
1 1 1 9  8  65 o 4.349000 1.086000  4.496000 1.648000  4.203000 1.414000  0.2931000      2.171000  
1 1 1 9  9  0  o 11.31000 0.2393000 11.31000 0.2393000 11.31000 0.2393000 0.000000       0.000000  
1 1 1 9  9  2  o 52.55000 0.4227000 52.09000 0.5926000 53.02000 0.6030000 -0.9318000     0.8454000 
1 1 1 9  9  4  o 55.54000 0.5017000 55.05000 0.7703000 56.04000 0.6429000 -0.9916000     1.003000  
1 1 1 9  9  6  o 41.88000 0.3007000 41.89000 0.4250000 41.87000 0.4255000 0.2213000E-01  0.6014000 
1 1 1 9  9  8  o 67.23000 0.5044000 66.79000 0.6557000 67.67000 0.7666000 -0.8757000     1.009000  
1 1 1 9  9  10 o 61.10000 0.4413000 61.24000 0.5394000 60.96000 0.6985000 0.2746000      0.8825000 
1 1 1 9  9  12 o 111.6000 0.7871000 112.6000 0.9734000 110.7000 1.237000  1.969000       1.574000  
1 1 1 9  9  14 o 167.4000 1.175000  167.7000 1.442000  167.0000 1.855000  0.6633000      2.350000  
1 1 1 9  9  16 o 38.01000 0.3025000 37.83000 0.3623000 38.20000 0.4845000 -0.3697000     0.6050000 
1 1 1 9  9  18 o 52.72000 0.4691000 53.46000 0.5440000 51.99000 0.7644000 1.475000       0.9383000 
1 1 1 9  9  20 o 39.14000 0.3364000 39.26000 0.5114000 39.01000 0.4371000 0.2541000      0.6728000 
1 1 1 9  9  22 f 119.9000 1.344000  120.3000 2.330000  119.5000 1.341000  0.7613000      2.689000  
1 1 1 9  9  24 o 116.7000 0.8264000 115.6000 1.296000  117.9000 1.026000  -2.354000      1.653000  
1 1 1 9  9  26 o 45.14000 0.4503000 45.51000 0.6919000 44.77000 0.5765000 0.7382000      0.9006000 
1 1 1 9  9  28 o 56.54000 0.4273000 56.20000 0.6677000 56.89000 0.5332000 -0.6885000     0.8545000 
1 1 1 9  9  30 o 9.859000 0.4796000 9.842000 0.7419000 9.876000 0.6080000 -0.3408000E-01 0.9592000 
1 1 1 9  9  32 o 36.43000 0.3230000 37.02000 0.5048000 35.85000 0.4032000 1.162000       0.6461000 
1 1 1 9  9  34 o 38.73000 0.3357000 39.17000 0.5268000 38.28000 0.4163000 0.8898000      0.6715000 
1 1 1 9  9  36 f 10.81000 0.6379000 9.449000 1.132000  12.18000 0.5885000 -2.731000      1.276000  
1 1 1 9  9  38 o 3.993000 1.040000  4.321000 1.529000  3.665000 1.409000  0.6566000      2.079000  
1 1 1 9  9  40 o 10.15000 0.5931000 10.37000 0.8857000 9.931000 0.7891000 0.4391000      1.186000  
1 1 1 9  9  42 o 56.52000 0.4434000 57.00000 0.6992000 56.04000 0.5453000 0.9635000      0.8867000 
1 1 1 9  9  44 o 37.45000 0.3541000 37.51000 0.5550000 37.38000 0.4400000 0.1263000      0.7083000 
1 1 1 9  9  46 o 13.45000 0.4902000 13.69000 0.7216000 13.21000 0.6637000 0.4821000      0.9805000 
1 1 1 9  9  48 o 22.17000 0.4111000 21.80000 0.5885000 22.53000 0.5741000 -0.7329000     0.8221000 
1 1 1 9  9  50 o 13.73000 0.6518000 14.11000 1.140000  13.36000 0.6325000 0.7582000      1.304000  
1 1 1 9  9  52 o 10.74000 0.5470000 10.61000 0.8508000 10.87000 0.6878000 -0.2540000     1.094000  
1 1 1 9  9  54 o 3.375000 0.9640000 3.625000 1.452000  3.124000 1.268000  0.5003000      1.928000  
1 1 1 9  9  56 o 5.090000 0.9851000 5.429000 1.487000  4.751000 1.292000  0.6788000      1.970000  
1 1 1 9  9  58 o 8.534000 0.7076000 9.016000 1.024000  8.052000 0.9765000 0.9631000      1.415000  
1 1 1 9  9  60 o 7.110000 1.001000  7.619000 1.757000  6.601000 0.9617000 1.018000       2.003000  
1 1 1 9  9  62 o 3.765000 1.062000  3.966000 1.590000  3.565000 1.408000  0.4012000      2.124000  
1 1 1 9  9  64 o 8.359000 0.7100000 9.382000 1.070000  7.335000 0.9337000 2.048000       1.420000  
1 1 1 9  9  66 f 5.158000 1.025000  5.953000 1.622000  4.363000 1.254000  1.590000       2.050000  
1 1 1 9  10 1  o 27.12000 0.2104000 27.24000 0.2985000 27.00000 0.2965000 0.2363000      0.4207000 
1 1 1 9  10 3  o 23.04000 0.2108000 22.92000 0.2679000 23.16000 0.3255000 -0.2416000     0.4216000 
1 1 1 9  10 5  o 47.77000 0.3383000 47.59000 0.4763000 47.95000 0.4806000 -0.3588000     0.6766000 
1 1 1 9  10 7  o 10.25000 0.1671000 10.39000 0.2218000 10.11000 0.2500000 0.2783000      0.3342000 
1 1 1 9  10 9  o 40.34000 0.3196000 39.92000 0.4074000 40.76000 0.4926000 -0.8452000     0.6393000 
1 1 1 9  10 11 o 81.54000 0.6083000 81.01000 0.7884000 82.08000 0.9266000 -1.073000      1.217000  
1 1 1 9  10 13 o 99.05000 0.7015000 99.65000 0.8633000 98.45000 1.106000  1.201000       1.403000  
1 1 1 9  10 15 o 21.54000 0.2411000 21.49000 0.3090000 21.60000 0.3703000 -0.1157000     0.4823000 
1 1 1 9  10 17 o 47.39000 0.3481000 47.03000 0.4871000 47.74000 0.4973000 -0.7103000     0.6961000 
1 1 1 9  10 19 o 59.72000 0.4631000 59.75000 0.6027000 59.70000 0.7034000 0.5436000E-01  0.9263000 
1 1 1 9  10 21 o 104.6000 0.8313000 104.2000 1.171000  104.9000 1.180000  -0.6947000     1.663000  
1 1 1 9  10 23 o 53.61000 0.4656000 52.81000 0.7780000 54.41000 0.5116000 -1.592000      0.9312000 
1 1 1 9  10 25 o 41.80000 0.4264000 41.33000 0.6487000 42.27000 0.5537000 -0.9432000     0.8529000 
1 1 1 9  10 27 o 23.26000 0.2937000 23.42000 0.4580000 23.09000 0.3679000 0.3295000      0.5875000 
1 1 1 9  10 29 o 28.29000 0.2964000 28.68000 0.4638000 27.90000 0.3693000 0.7791000      0.5929000 
1 1 1 9  10 31 o 23.50000 0.2972000 23.25000 0.4603000 23.75000 0.3760000 -0.5007000     0.5943000 
1 1 1 9  10 33 o 23.14000 0.3151000 23.33000 0.4673000 22.96000 0.4229000 0.3728000      0.6303000 
1 1 1 9  10 35 o 13.15000 0.4105000 14.02000 0.5890000 12.28000 0.5719000 1.743000       0.8210000 
1 1 1 9  10 37 o 26.91000 0.4919000 26.58000 0.8818000 27.23000 0.4364000 -0.6430000     0.9839000 
1 1 1 9  10 39 o 28.33000 0.3201000 28.36000 0.4932000 28.30000 0.4082000 0.5598000E-01  0.6402000 
1 1 1 9  10 41 o 27.23000 0.3347000 27.17000 0.5271000 27.29000 0.4126000 -0.1144000     0.6694000 
1 1 1 9  10 43 o 30.82000 0.3355000 31.59000 0.5245000 30.06000 0.4185000 1.533000       0.6710000 
1 1 1 9  10 45 o 21.15000 0.4309000 20.46000 0.5872000 21.84000 0.6307000 -1.377000      0.8617000 
1 1 1 9  10 47 o 28.98000 0.4252000 28.93000 0.6496000 29.04000 0.5489000 -0.1098000     0.8504000 
1 1 1 9  10 49 o 25.51000 0.4014000 24.92000 0.6813000 26.11000 0.4246000 -1.194000      0.8028000 
1 1 1 9  10 51 o 13.91000 0.4474000 14.30000 0.7151000 13.52000 0.5377000 0.7798000      0.8948000 
1 1 1 9  10 53 o 4.514000 0.9907000 5.329000 1.485000  3.699000 1.312000  1.629000       1.981000  
1 1 1 9  10 55 o 4.202000 0.9830000 5.045000 1.532000  3.360000 1.232000  1.684000       1.966000  
1 1 1 9  10 57 o 3.240000 0.9512000 3.347000 1.437000  3.133000 1.247000  0.2139000      1.902000  
1 1 1 9  10 59 o 8.487000 0.7144000 8.276000 1.200000  8.698000 0.7756000 -0.4215000     1.429000  
1 1 1 9  10 61 o 9.727000 0.6276000 10.30000 0.9434000 9.151000 0.8280000 1.152000       1.255000  
1 1 1 9  10 63 o 4.638000 1.056000  5.310000 1.592000  3.965000 1.386000  1.344000       2.111000  
1 1 1 9  10 65 o 3.646000 0.9949000 5.074000 1.690000  2.217000 1.051000  2.857000       1.990000  
1 1 1 9  11 0  o 63.77000 0.8965000 63.77000 0.8965000 63.77000 0.8965000 0.000000       0.000000  
1 1 1 9  11 2  o 21.76000 0.1838000 21.54000 0.2587000 21.97000 0.2611000 -0.4249000     0.3676000 
1 1 1 9  11 4  o 73.93000 0.5518000 74.38000 0.7254000 73.48000 0.8316000 0.9004000      1.104000  
1 1 1 9  11 6  o 88.84000 0.7061000 89.34000 1.004000  88.35000 0.9927000 0.9893000      1.412000  
1 1 1 9  11 8  o 127.4000 0.9396000 127.9000 1.236000  127.0000 1.415000  0.8989000      1.879000  
1 1 1 9  11 10 o 58.55000 0.4260000 58.35000 0.5157000 58.75000 0.6781000 -0.3975000     0.8520000 
1 1 1 9  11 12 o 108.4000 0.7651000 109.6000 0.9473000 107.2000 1.202000  2.392000       1.530000  
1 1 1 9  11 14 o 82.73000 0.5914000 82.94000 0.7242000 82.52000 0.9352000 0.4198000      1.183000  
1 1 1 9  11 16 o 61.36000 0.4344000 61.37000 0.6136000 61.36000 0.6150000 0.1046000E-01  0.8687000 
1 1 1 9  11 18 o 24.32000 0.2448000 24.41000 0.3428000 24.23000 0.3495000 0.1833000      0.4895000 
1 1 1 9  11 20 o 47.64000 0.4103000 48.03000 0.5855000 47.24000 0.5749000 0.7926000      0.8205000 
1 1 1 9  11 22 f 99.41000 0.7414000 100.1000 0.9768000 98.73000 1.116000  1.355000       1.483000  
1 1 1 9  11 24 f 41.84000 0.3547000 42.37000 0.5354000 41.32000 0.4654000 1.051000       0.7094000 
1 1 1 9  11 26 o 11.34000 0.4099000 11.24000 0.6367000 11.43000 0.5165000 -0.1876000     0.8199000 
1 1 1 9  11 28 o 52.73000 0.4051000 52.51000 0.6327000 52.95000 0.5059000 -0.4352000     0.8101000 
1 1 1 9  11 30 o 43.86000 0.3579000 43.74000 0.5593000 43.98000 0.4466000 -0.2464000     0.7157000 
1 1 1 9  11 32 o 42.49000 0.3504000 42.47000 0.5462000 42.50000 0.4392000 -0.3086000E-01 0.7009000 
1 1 1 9  11 34 o 33.44000 0.3315000 33.46000 0.4888000 33.42000 0.4479000 0.4337000E-01  0.6630000 
1 1 1 9  11 36 o 17.66000 0.3491000 17.16000 0.5189000 18.16000 0.4670000 -1.004000      0.6982000 
1 1 1 9  11 38 o 18.23000 0.3896000 18.24000 0.6498000 18.21000 0.4302000 0.3683000E-01  0.7793000 
1 1 1 9  11 40 o 36.69000 0.3837000 36.70000 0.5396000 36.68000 0.5458000 0.1352000E-01  0.7675000 
1 1 1 9  11 42 o 18.97000 0.3817000 18.05000 0.6072000 19.88000 0.4626000 -1.829000      0.7633000 
1 1 1 9  11 44 o 9.779000 0.6519000 10.14000 0.9518000 9.418000 0.8911000 0.7225000      1.304000  
1 1 1 9  11 46 o 19.35000 0.4860000 19.08000 0.5890000 19.63000 0.7732000 -0.5535000     0.9720000 
1 1 1 9  11 48 o 27.98000 0.3422000 28.51000 0.5354000 27.45000 0.4263000 1.063000       0.6844000 
1 1 1 9  11 50 o 20.79000 0.5279000 19.51000 0.9372000 22.06000 0.4862000 -2.554000      1.056000  
1 1 1 9  11 52 o 17.00000 0.4269000 17.62000 0.5886000 16.38000 0.6185000 1.241000       0.8538000 
1 1 1 9  11 54 o 11.34000 0.4919000 11.35000 0.7655000 11.33000 0.6181000 0.2688000E-01  0.9839000 
1 1 1 9  11 56 o 3.509000 0.9619000 3.438000 1.436000  3.580000 1.280000  -0.1417000     1.924000  
1 1 1 9  11 58 o 4.704000 1.092000  5.445000 1.568000  3.963000 1.522000  1.481000       2.185000  
1 1 1 9  11 60 o 4.064000 1.116000  4.216000 1.719000  3.912000 1.424000  0.3035000      2.233000  
1 1 1 9  11 62 o 3.449000 1.033000  3.519000 1.508000  3.379000 1.411000  0.1394000      2.066000  
1 1 1 9  11 64 f 3.779000 1.011000  3.683000 1.510000  3.876000 1.345000  -0.1924000     2.022000  
1 1 1 9  11 66 o 7.872000 1.361000  7.264000 2.157000  8.480000 1.660000  -1.217000      2.721000  
1 1 1 9  12 1  o 58.79000 0.4097000 58.64000 0.5777000 58.94000 0.5811000 -0.2989000     0.8194000 
1 1 1 9  12 3  o 22.42000 0.2657000 22.53000 0.4310000 22.31000 0.3109000 0.2264000      0.5314000 
1 1 1 9  12 5  f 50.61000 0.4177000 50.26000 0.5872000 50.96000 0.5943000 -0.7064000     0.8355000 
1 1 1 9  12 7  o 14.02000 0.3016000 13.99000 0.4072000 14.06000 0.4451000 -0.7027000E-01 0.6033000 
1 1 1 9  12 9  o 39.06000 0.3404000 39.48000 0.4867000 38.63000 0.4760000 0.8518000      0.6808000 
1 1 1 9  12 11 f 85.75000 0.6388000 86.26000 0.8403000 85.25000 0.9623000 1.009000       1.278000  
1 1 1 9  12 13 o 63.59000 0.4627000 63.13000 0.5580000 64.05000 0.7381000 -0.9136000     0.9253000 
1 1 1 9  12 15 o 88.80000 0.6127000 88.79000 0.8656000 88.81000 0.8674000 -0.2622000E-01 1.225000  
1 1 1 9  12 17 o 82.62000 0.5736000 83.26000 0.8158000 81.98000 0.8067000 1.279000       1.147000  
1 1 1 9  12 19 o 53.81000 0.4790000 54.03000 0.5529000 53.58000 0.7824000 0.4471000      0.9581000 
1 1 1 9  12 21 o 85.54000 0.6871000 85.90000 0.9734000 85.17000 0.9700000 0.7307000      1.374000  
1 1 1 9  12 23 o 60.20000 0.4733000 60.75000 0.7226000 59.65000 0.6115000 1.099000       0.9466000 
1 1 1 9  12 25 o 21.14000 0.3347000 21.68000 0.5258000 20.60000 0.4144000 1.084000       0.6694000 
1 1 1 9  12 27 o 33.02000 0.3784000 33.59000 0.5762000 32.45000 0.4906000 1.143000       0.7568000 
1 1 1 9  12 29 o 4.128000 0.9188000 5.223000 1.391000  3.033000 1.201000  2.190000       1.838000  
1 1 1 9  12 31 o 15.08000 0.3465000 15.41000 0.5283000 14.74000 0.4485000 0.6698000      0.6930000 
1 1 1 9  12 33 o 15.95000 0.3445000 15.90000 0.5360000 15.99000 0.4329000 -0.8630000E-01 0.6890000 
1 1 1 9  12 35 o 38.24000 0.3535000 38.02000 0.5227000 38.47000 0.4762000 -0.4516000     0.7071000 
1 1 1 9  12 37 o 15.13000 0.5853000 14.94000 1.072000  15.31000 0.4706000 -0.3742000     1.171000  
1 1 1 9  12 39 o 18.02000 0.3817000 17.54000 0.5720000 18.50000 0.5055000 -0.9559000     0.7633000 
1 1 1 9  12 41 f 18.66000 0.3781000 19.11000 0.6029000 18.21000 0.4564000 0.9002000      0.7561000 
1 1 1 9  12 43 o 29.33000 0.3921000 28.86000 0.6256000 29.81000 0.4730000 -0.9515000     0.7843000 
1 1 1 9  12 45 o 22.88000 0.3828000 22.48000 0.5935000 23.28000 0.4835000 -0.7984000     0.7656000 
1 1 1 9  12 47 o 29.31000 0.3831000 29.31000 0.5299000 29.32000 0.5534000 -0.1095000E-01 0.7662000 
1 1 1 9  12 49 o 10.60000 0.6059000 9.213000 1.039000  11.99000 0.6246000 -2.773000      1.212000  
1 1 1 9  12 51 o 8.655000 0.6775000 9.323000 0.9527000 7.988000 0.9634000 1.335000       1.355000  
1 1 1 9  12 53 o 7.439000 0.7325000 7.323000 1.206000  7.556000 0.8312000 -0.2323000     1.465000  
1 1 1 9  12 55 o 3.354000 0.9192000 4.210000 1.458000  2.497000 1.120000  1.713000       1.838000  
1 1 1 9  12 57 o 3.608000 0.9846000 3.827000 1.542000  3.389000 1.225000  0.4385000      1.969000  
1 1 1 9  12 59 o 9.640000 0.7700000 9.738000 1.353000  9.541000 0.7351000 0.1968000      1.540000  
1 1 1 9  12 61 o 6.517000 0.9682000 6.245000 1.604000  6.789000 1.084000  -0.5437000     1.936000  
1 1 1 9  12 63 o 3.442000 0.9934000 3.379000 1.456000  3.506000 1.352000  -0.1266000     1.987000  
1 1 1 9  12 65 o 7.685000 0.8981000 8.846000 1.474000  6.523000 1.026000  2.322000       1.796000  
1 1 1 9  13 0  o 76.31000 0.7439000 76.31000 0.7439000 76.31000 0.7439000 0.000000       0.000000  
1 1 1 9  13 2  o 11.86000 0.1630000 12.17000 0.2324000 11.56000 0.2286000 0.6098000      0.3260000 
1 1 1 9  13 4  o 69.35000 0.5572000 69.19000 0.7858000 69.51000 0.7903000 -0.3208000     1.114000  
1 1 1 9  13 6  o 73.97000 0.7303000 74.00000 1.032000  73.94000 1.033000  0.6123000E-01  1.461000  
1 1 1 9  13 8  o 102.5000 0.8135000 102.9000 1.153000  102.2000 1.148000  0.6393000      1.627000  
1 1 1 9  13 10 o 31.29000 0.3320000 30.67000 0.5121000 31.91000 0.4226000 -1.239000      0.6640000 
1 1 1 9  13 12 o 100.3000 0.7129000 99.82000 0.8659000 100.7000 1.133000  -0.8947000     1.426000  
1 1 1 9  13 14 o 35.09000 0.2756000 35.77000 0.3942000 34.42000 0.3852000 1.349000       0.5512000 
1 1 1 9  13 16 o 51.15000 0.3709000 51.86000 0.5289000 50.44000 0.5200000 1.425000       0.7417000 
1 1 1 9  13 18 o 38.24000 0.3226000 38.41000 0.4249000 38.06000 0.4856000 0.3574000      0.6453000 
1 1 1 9  13 20 o 44.10000 0.4375000 43.08000 0.5343000 45.12000 0.6930000 -2.037000      0.8751000 
1 1 1 9  13 22 o 41.43000 0.3263000 42.32000 0.4650000 40.54000 0.4580000 1.780000       0.6527000 
1 1 1 9  13 24 o 68.88000 0.7856000 70.43000 1.414000  67.33000 0.6849000 3.109000       1.571000  
1 1 1 9  13 26 o 58.64000 0.4950000 59.86000 0.7036000 57.42000 0.6964000 2.445000       0.9900000 
1 1 1 9  13 28 o 7.759000 0.5810000 7.775000 0.9169000 7.743000 0.7138000 0.3142000E-01  1.162000  
1 1 1 9  13 30 o 15.47000 0.3494000 15.01000 0.5505000 15.92000 0.4305000 -0.9093000     0.6988000 
1 1 1 9  13 32 o 23.14000 0.2945000 22.99000 0.4564000 23.29000 0.3721000 -0.3019000     0.5889000 
1 1 1 9  13 34 o 41.33000 0.3662000 41.20000 0.5446000 41.46000 0.4898000 -0.2586000     0.7324000 
1 1 1 9  13 36 o 33.31000 0.3652000 33.32000 0.6078000 33.30000 0.4051000 0.1257000E-01  0.7304000 
1 1 1 9  13 38 o 27.43000 0.4946000 26.50000 0.8787000 28.36000 0.4545000 -1.859000      0.9893000 
1 1 1 9  13 40 o 24.86000 0.3479000 24.52000 0.5216000 25.20000 0.4605000 -0.6882000     0.6958000 
1 1 1 9  13 42 o 13.00000 0.5339000 13.52000 0.8972000 12.48000 0.5789000 1.043000       1.068000  
1 1 1 9  13 44 o 46.02000 0.3889000 46.42000 0.6129000 45.62000 0.4789000 0.7966000      0.7778000 
1 1 1 9  13 46 o 11.23000 0.5808000 10.43000 0.9858000 12.04000 0.6143000 -1.606000      1.162000  
1 1 1 9  13 48 o 18.54000 0.3923000 18.67000 0.5880000 18.40000 0.5193000 0.2752000      0.7845000 
1 1 1 9  13 50 o 9.555000 0.7243000 10.41000 1.034000  8.701000 1.014000  1.707000       1.449000  
1 1 1 9  13 52 o 12.51000 0.4943000 12.39000 0.7745000 12.64000 0.6144000 -0.2488000     0.9886000 
1 1 1 9  13 54 o 8.542000 0.5876000 8.869000 0.8957000 8.216000 0.7609000 0.6533000      1.175000  
1 1 1 9  13 56 o 20.11000 0.3712000 20.16000 0.5900000 20.05000 0.4506000 0.1105000      0.7424000 
1 1 1 9  13 58 o 3.460000 0.9946000 3.738000 1.474000  3.182000 1.336000  0.5561000      1.989000  
1 1 1 9  13 60 o 6.428000 1.029000  7.523000 1.640000  5.333000 1.243000  2.191000       2.058000  
1 1 1 9  13 62 o 5.701000 1.037000  6.926000 1.483000  4.476000 1.451000  2.450000       2.075000  
1 1 1 9  13 64 o 4.467000 1.093000  4.924000 1.694000  4.010000 1.382000  0.9138000      2.186000  
1 1 1 9  14 1  o 81.39000 0.5603000 80.83000 0.7873000 81.94000 0.7975000 -1.115000      1.121000  
1 1 1 9  14 3  o 87.80000 0.6255000 88.66000 0.9970000 86.94000 0.7555000 1.721000       1.251000  
1 1 1 9  14 5  o 97.79000 0.7766000 98.23000 1.102000  97.36000 1.095000  0.8712000      1.553000  
1 1 1 9  14 7  o 68.90000 0.8369000 69.51000 0.9758000 68.28000 1.360000  1.232000       1.674000  
1 1 1 9  14 9  o 19.10000 0.2870000 19.38000 0.4101000 18.81000 0.4016000 0.5674000      0.5740000 
1 1 1 9  14 11 o 84.35000 0.6035000 83.97000 0.7327000 84.74000 0.9592000 -0.7695000     1.207000  
1 1 1 9  14 13 o 65.28000 0.4587000 64.36000 0.6391000 66.20000 0.6581000 -1.836000      0.9173000 
1 1 1 9  14 15 o 127.6000 0.8723000 126.6000 1.223000  128.6000 1.244000  -2.012000      1.745000  
1 1 1 9  14 17 o 43.62000 0.3533000 43.96000 0.4667000 43.28000 0.5305000 0.6848000      0.7066000 
1 1 1 9  14 19 o 29.71000 0.3608000 29.58000 0.5588000 29.85000 0.4566000 -0.2713000     0.7217000 
1 1 1 9  14 21 o 109.9000 0.9300000 109.4000 1.064000  110.4000 1.525000  -0.9409000     1.860000  
1 1 1 9  14 23 o 12.81000 0.4299000 12.84000 0.6516000 12.78000 0.5611000 0.5884000E-01  0.8599000 
1 1 1 9  14 25 o 63.26000 0.5361000 63.92000 0.9040000 62.60000 0.5765000 1.326000       1.072000  
1 1 1 9  14 27 o 31.70000 0.2999000 31.92000 0.4617000 31.48000 0.3829000 0.4382000      0.5999000 
1 1 1 9  14 29 o 66.21000 0.4921000 67.05000 0.7787000 65.36000 0.6019000 1.690000       0.9842000 
1 1 1 9  14 31 o 37.23000 0.3262000 37.61000 0.5125000 36.84000 0.4037000 0.7749000      0.6524000 
1 1 1 9  14 33 o 15.04000 0.3592000 15.57000 0.5542000 14.50000 0.4572000 1.076000       0.7185000 
1 1 1 9  14 35 o 7.717000 0.7637000 7.995000 1.028000  7.439000 1.130000  0.5562000      1.527000  
1 1 1 9  14 37 o 28.66000 0.3745000 27.62000 0.6032000 29.70000 0.4442000 -2.086000      0.7491000 
1 1 1 9  14 39 o 29.62000 0.3872000 30.18000 0.6282000 29.06000 0.4526000 1.128000       0.7743000 
1 1 1 9  14 41 o 28.43000 0.3359000 28.93000 0.5270000 27.93000 0.4165000 0.9939000      0.6717000 
1 1 1 9  14 43 o 14.39000 0.4618000 14.87000 0.7357000 13.91000 0.5585000 0.9636000      0.9236000 
1 1 1 9  14 45 o 10.40000 0.5744000 11.24000 0.8446000 9.553000 0.7786000 1.689000       1.149000  
1 1 1 9  14 47 o 27.23000 0.3483000 27.10000 0.5277000 27.36000 0.4548000 -0.2608000     0.6966000 
1 1 1 9  14 49 o 15.87000 0.5998000 15.02000 1.096000  16.73000 0.4890000 -1.703000      1.200000  
1 1 1 9  14 51 o 23.24000 0.3435000 23.49000 0.5394000 23.00000 0.4255000 0.4915000      0.6870000 
1 1 1 9  14 53 o 15.09000 0.4189000 15.31000 0.6358000 14.87000 0.5456000 0.4325000      0.8379000 
1 1 1 9  14 55 o 5.151000 0.9717000 5.927000 1.465000  4.374000 1.278000  1.553000       1.943000  
1 1 1 9  14 57 o 5.682000 0.9678000 5.766000 1.521000  5.597000 1.197000  0.1692000      1.936000  
1 1 1 9  14 59 o 10.59000 0.7632000 9.625000 1.291000  11.57000 0.8145000 -1.940000      1.526000  
1 1 1 9  14 61 o 6.442000 1.102000  6.384000 1.860000  6.499000 1.183000  -0.1149000     2.204000  
1 1 1 9  14 63 o 4.421000 1.071000  5.005000 1.566000  3.837000 1.463000  1.168000       2.143000  
1 1 1 9  14 65 o 5.493000 1.081000  5.234000 1.750000  5.751000 1.270000  -0.5163000     2.162000  
1 1 1 9  15 0  o 18.30000 0.3195000 18.30000 0.3195000 18.30000 0.3195000 0.000000       0.000000  
1 1 1 9  15 2  f 13.14000 0.1900000 13.05000 0.3196000 13.23000 0.2057000 -0.1781000     0.3801000 
1 1 1 9  15 4  o 63.57000 0.5164000 62.48000 0.7171000 64.66000 0.7433000 -2.184000      1.033000  
1 1 1 9  15 6  f 73.08000 0.6585000 73.92000 0.8403000 72.25000 1.014000  1.670000       1.317000  
1 1 1 9  15 8  o 107.2000 0.8501000 106.8000 1.198000  107.6000 1.207000  -0.8001000     1.700000  
1 1 1 9  15 10 o 74.37000 0.9012000 74.15000 1.467000  74.60000 1.046000  -0.4506000     1.802000  
1 1 1 9  15 12 o 70.33000 0.5335000 69.73000 0.6884000 70.92000 0.8153000 -1.196000      1.067000  
1 1 1 9  15 14 o 48.29000 0.3805000 48.36000 0.4992000 48.21000 0.5743000 0.1499000      0.7609000 
1 1 1 9  15 16 f 26.32000 0.2635000 26.64000 0.3520000 25.99000 0.3922000 0.6509000      0.5270000 
1 1 1 9  15 18 o 21.25000 0.2692000 21.64000 0.4058000 20.86000 0.3537000 0.7777000      0.5383000 
1 1 1 9  15 20 o 129.8000 1.088000  130.4000 1.262000  129.1000 1.773000  1.311000       2.176000  
1 1 1 9  15 22 o 17.30000 0.3220000 16.98000 0.4055000 17.62000 0.5004000 -0.6337000     0.6441000 
1 1 1 9  15 24 o 47.28000 0.4694000 46.23000 0.7194000 48.34000 0.6031000 -2.109000      0.9388000 
1 1 1 9  15 26 o 70.82000 0.5198000 71.42000 0.8211000 70.21000 0.6378000 1.212000       1.040000  
1 1 1 9  15 28 o 32.15000 0.3021000 31.83000 0.4623000 32.47000 0.3889000 -0.6381000     0.6042000 
1 1 1 9  15 30 o 56.10000 0.4272000 55.55000 0.6632000 56.65000 0.5386000 -1.099000      0.8544000 
1 1 1 9  15 32 o 34.28000 0.3181000 34.45000 0.4918000 34.12000 0.4036000 0.3286000      0.6362000 
1 1 1 9  15 34 o 39.08000 0.4319000 39.41000 0.6674000 38.76000 0.5484000 0.6519000      0.8638000 
1 1 1 9  15 36 o 23.65000 0.3742000 23.65000 0.6017000 23.66000 0.4451000 -0.1125000E-01 0.7484000 
1 1 1 9  15 38 o 54.47000 0.6468000 54.85000 1.179000  54.10000 0.5316000 0.7526000      1.294000  
1 1 1 9  15 40 o 26.32000 0.3487000 26.46000 0.5311000 26.18000 0.4521000 0.2767000      0.6975000 
1 1 1 9  15 42 o 42.61000 0.3746000 42.96000 0.5874000 42.25000 0.4649000 0.7169000      0.7491000 
1 1 1 9  15 44 o 16.65000 0.4182000 16.95000 0.6619000 16.35000 0.5113000 0.6002000      0.8364000 
1 1 1 9  15 46 o 24.28000 0.3632000 24.61000 0.5590000 23.95000 0.4639000 0.6558000      0.7265000 
1 1 1 9  15 48 o 9.000000 0.6476000 8.343000 1.019000  9.657000 0.8000000 -1.314000      1.295000  
1 1 1 9  15 50 o 8.630000 0.7925000 10.47000 1.112000  6.786000 1.129000  3.688000       1.585000  
1 1 1 9  15 52 o 17.13000 0.3854000 17.45000 0.5879000 16.81000 0.4984000 0.6384000      0.7707000 
1 1 1 9  15 54 o 12.52000 0.5399000 12.28000 0.7771000 12.76000 0.7498000 -0.4785000     1.080000  
1 1 1 9  15 56 o 8.786000 0.6463000 8.807000 1.084000  8.765000 0.7040000 0.4229000E-01  1.293000  
1 1 1 9  15 58 o 3.836000 0.9414000 2.713000 1.246000  4.960000 1.412000  -2.247000      1.883000  
1 1 1 9  15 60 o 5.325000 1.134000  6.547000 1.791000  4.103000 1.391000  2.445000       2.268000  
1 1 1 9  15 62 o 6.372000 0.9707000 6.030000 1.482000  6.715000 1.254000  -0.6844000     1.941000  
1 1 1 9  15 64 o 10.56000 0.6039000 11.02000 1.006000  10.09000 0.6685000 0.9333000      1.208000  
1 1 1 9  16 1  o 90.61000 0.6429000 90.41000 1.016000  90.82000 0.7883000 -0.4087000     1.286000  
1 1 1 9  16 3  o 86.43000 0.6142000 85.81000 0.9672000 87.06000 0.7574000 -1.252000      1.228000  
1 1 1 9  16 5  o 75.46000 0.6066000 75.08000 0.8526000 75.84000 0.8631000 -0.7612000     1.213000  
1 1 1 9  16 7  o 8.598000 0.3706000 8.020000 0.5392000 9.176000 0.5086000 -1.156000      0.7412000 
1 1 1 9  16 9  o 111.0000 0.9837000 110.5000 1.519000  111.5000 1.250000  -1.016000      1.967000  
1 1 1 9  16 11 o 75.42000 0.6096000 75.34000 0.8603000 75.51000 0.8640000 -0.1688000     1.219000  
1 1 1 9  16 13 o 22.27000 0.3144000 22.19000 0.3509000 22.35000 0.5217000 -0.1589000     0.6288000 
1 1 1 9  16 15 o 67.15000 0.5118000 66.42000 0.6620000 67.88000 0.7807000 -1.457000      1.024000  
1 1 1 9  16 17 o 40.16000 0.3351000 39.44000 0.4966000 40.89000 0.4501000 -1.445000      0.6702000 
1 1 1 9  16 19 o 22.54000 0.3261000 22.66000 0.4570000 22.42000 0.4653000 0.2409000      0.6522000 
1 1 1 9  16 21 o 47.19000 0.3906000 47.28000 0.5049000 47.09000 0.5960000 0.1988000      0.7812000 
1 1 1 9  16 23 o 33.13000 0.3132000 33.92000 0.4124000 32.34000 0.4714000 1.588000       0.6263000 
1 1 1 9  16 25 o 40.30000 0.3874000 40.52000 0.6520000 40.09000 0.4188000 0.4329000      0.7749000 
1 1 1 9  16 27 o 20.59000 0.2951000 20.78000 0.4560000 20.40000 0.3746000 0.3885000      0.5902000 
1 1 1 9  16 29 o 43.78000 0.3574000 44.46000 0.5613000 43.10000 0.4425000 1.361000       0.7147000 
1 1 1 9  16 31 o 19.58000 0.3092000 19.58000 0.4742000 19.58000 0.3970000 -0.5234000E-02 0.6184000 
1 1 1 9  16 33 o 75.15000 0.5779000 76.39000 0.8804000 73.91000 0.7487000 2.474000       1.156000  
1 1 1 9  16 35 o 22.04000 0.3750000 22.26000 0.5989000 21.83000 0.4513000 0.4227000      0.7499000 
1 1 1 9  16 37 f 33.03000 0.3920000 33.40000 0.6382000 32.66000 0.4554000 0.7409000      0.7840000 
1 1 1 9  16 39 o 33.32000 0.3735000 34.21000 0.5342000 32.42000 0.5220000 1.793000       0.7469000 
1 1 1 9  16 41 o 25.78000 0.3473000 25.72000 0.5490000 25.85000 0.4255000 -0.1298000     0.6946000 
1 1 1 9  16 43 o 28.25000 0.3351000 28.20000 0.5281000 28.29000 0.4127000 -0.9160000E-01 0.6702000 
1 1 1 9  16 45 o 31.73000 0.3474000 31.77000 0.5450000 31.70000 0.4311000 0.7205000E-01  0.6949000 
1 1 1 9  16 47 o 14.09000 0.4618000 13.64000 0.7363000 14.53000 0.5576000 -0.8933000     0.9236000 
1 1 1 9  16 49 o 9.610000 0.7152000 9.535000 1.223000  9.684000 0.7421000 -0.1494000     1.430000  
1 1 1 9  16 51 o 5.464000 1.031000  5.280000 1.728000  5.647000 1.126000  -0.3661000     2.063000  
1 1 1 9  16 53 f 9.322000 0.5867000 9.991000 0.8555000 8.653000 0.8031000 1.338000       1.173000  
1 1 1 9  16 55 o 6.275000 0.8771000 6.308000 1.443000  6.242000 0.9969000 0.6632000E-01  1.754000  
1 1 1 9  16 57 o 4.705000 0.9655000 4.004000 1.511000  5.405000 1.202000  -1.402000      1.931000  
1 1 1 9  16 59 o 3.067000 0.9602000 3.011000 1.379000  3.124000 1.337000  -0.1137000     1.920000  
1 1 1 9  16 61 o 7.087000 1.023000  7.883000 1.655000  6.290000 1.203000  1.593000       2.046000  
1 1 1 9  16 63 o 7.282000 0.8304000 7.543000 1.279000  7.022000 1.060000  0.5215000      1.661000  
1 1 1 9  17 0  o 129.8000 1.253000  129.8000 1.253000  129.8000 1.253000  0.000000       0.000000  
1 1 1 9  17 2  o 91.92000 0.6527000 91.60000 1.030000  92.23000 0.8016000 -0.6238000     1.305000  
1 1 1 9  17 4  o 79.96000 0.5726000 80.06000 0.9074000 79.85000 0.6986000 0.2083000      1.145000  
1 1 1 9  17 6  o 122.0000 1.080000  121.6000 1.358000  122.4000 1.679000  -0.7901000     2.160000  
1 1 1 9  17 8  o 114.8000 0.9090000 115.1000 1.290000  114.4000 1.282000  0.7760000      1.818000  
1 1 1 9  17 10 o 60.15000 0.4973000 59.54000 0.6949000 60.77000 0.7116000 -1.223000      0.9946000 
1 1 1 9  17 12 o 63.97000 0.4881000 63.25000 0.7305000 64.68000 0.6477000 -1.429000      0.9763000 
1 1 1 9  17 14 o 129.2000 0.9545000 129.1000 1.250000  129.3000 1.443000  -0.1682000     1.909000  
1 1 1 9  17 16 o 35.42000 0.5375000 35.89000 0.8823000 34.96000 0.6142000 0.9361000      1.075000  
1 1 1 9  17 18 o 40.86000 0.3428000 41.05000 0.5171000 40.67000 0.4502000 0.3731000      0.6856000 
1 1 1 9  17 20 o 80.00000 0.6053000 79.43000 0.7855000 80.56000 0.9213000 -1.129000      1.211000  
1 1 1 9  17 22 f 62.23000 0.4830000 63.59000 0.6432000 60.88000 0.7206000 2.712000       0.9659000 
1 1 1 9  17 24 o 22.76000 0.2875000 22.72000 0.3641000 22.79000 0.4449000 -0.6117000E-01 0.5750000 
1 1 1 9  17 26 o 58.94000 0.4440000 59.30000 0.6978000 58.58000 0.5493000 0.7221000      0.8880000 
1 1 1 9  17 28 o 32.47000 0.3028000 32.66000 0.4677000 32.28000 0.3846000 0.3815000      0.6055000 
1 1 1 9  17 30 o 22.89000 0.2944000 22.83000 0.4570000 22.94000 0.3713000 -0.1047000     0.5888000 
1 1 1 9  17 32 o 53.26000 0.4627000 54.25000 0.6607000 52.28000 0.6480000 1.975000       0.9254000 
1 1 1 9  17 34 o 13.49000 0.3972000 13.50000 0.6193000 13.48000 0.4976000 0.2657000E-01  0.7945000 
1 1 1 9  17 36 o 37.19000 0.5048000 37.54000 0.8928000 36.84000 0.4714000 0.7035000      1.010000  
1 1 1 9  17 38 o 31.71000 0.3883000 32.46000 0.6576000 30.96000 0.4131000 1.495000       0.7766000 
1 1 1 9  17 40 o 22.72000 0.3570000 22.75000 0.5707000 22.70000 0.4290000 0.5103000E-01  0.7139000 
1 1 1 9  17 42 o 26.20000 0.3456000 26.96000 0.5437000 25.44000 0.4267000 1.519000       0.6912000 
1 1 1 9  17 44 o 16.01000 0.4201000 16.23000 0.6684000 15.78000 0.5092000 0.4459000      0.8402000 
1 1 1 9  17 46 o 3.361000 0.9950000 3.871000 1.535000  2.852000 1.267000  1.019000       1.990000  
1 1 1 9  17 48 o 18.02000 0.4525000 18.03000 0.7559000 18.02000 0.4976000 0.1137000E-01  0.9050000 
1 1 1 9  17 50 o 19.04000 0.3766000 19.36000 0.5874000 18.71000 0.4714000 0.6524000      0.7531000 
1 1 1 9  17 52 o 7.287000 0.7324000 6.934000 1.133000  7.640000 0.9285000 -0.7060000     1.465000  
1 1 1 9  17 54 o 5.636000 0.9180000 5.897000 1.414000  5.374000 1.171000  0.5232000      1.836000  
1 1 1 9  17 56 o 4.632000 1.035000  4.404000 1.600000  4.859000 1.312000  -0.4542000     2.069000  
1 1 1 9  17 58 o 13.12000 0.7647000 13.18000 1.383000  13.07000 0.6538000 0.1169000      1.529000  
1 1 1 9  17 60 o 5.747000 1.018000  4.273000 1.767000  7.220000 1.011000  -2.946000      2.036000  
1 1 1 9  17 62 o 8.534000 0.7097000 9.268000 1.027000  7.800000 0.9794000 1.468000       1.419000  
1 1 1 9  17 64 o 8.297000 0.7493000 10.22000 1.101000  6.370000 1.016000  3.854000       1.499000  
1 1 1 9  18 1  o 162.0000 1.103000  161.0000 1.549000  162.9000 1.569000  -1.932000      2.205000  
1 1 1 9  18 3  o 25.40000 0.2395000 25.17000 0.3720000 25.63000 0.3018000 -0.4603000     0.4790000 
1 1 1 9  18 5  o 39.58000 0.3802000 39.82000 0.4934000 39.34000 0.5785000 0.4852000      0.7604000 
1 1 1 9  18 7  o 44.11000 0.3830000 43.35000 0.5310000 44.87000 0.5521000 -1.525000      0.7660000 
1 1 1 9  18 9  o 104.0000 0.9246000 103.3000 1.426000  104.7000 1.178000  -1.397000      1.849000  
1 1 1 9  18 11 o 99.22000 0.8841000 99.54000 1.122000  98.91000 1.366000  0.6343000      1.768000  
1 1 1 9  18 13 o 100.3000 0.7467000 99.69000 0.9720000 100.9000 1.134000  -1.199000      1.493000  
1 1 1 9  18 15 o 80.96000 0.6084000 80.67000 0.9159000 81.25000 0.8012000 -0.5804000     1.217000  
1 1 1 9  18 17 o 65.16000 0.5916000 64.82000 0.9081000 65.51000 0.7585000 -0.6950000     1.183000  
1 1 1 9  18 19 o 85.19000 0.6854000 84.91000 0.9662000 85.47000 0.9723000 -0.5684000     1.371000  
1 1 1 9  18 21 o 24.46000 0.3530000 23.72000 0.3727000 25.21000 0.5996000 -1.494000      0.7060000 
1 1 1 9  18 23 o 25.42000 0.2923000 26.09000 0.4371000 24.76000 0.3883000 1.324000       0.5847000 
1 1 1 9  18 25 o 43.15000 0.3715000 43.47000 0.5657000 42.84000 0.4817000 0.6293000      0.7430000 
1 1 1 9  18 27 o 11.15000 0.4223000 11.06000 0.6589000 11.24000 0.5283000 -0.1800000     0.8445000 
1 1 1 9  18 29 o 16.32000 0.3266000 17.02000 0.5004000 15.62000 0.4200000 1.400000       0.6533000 
1 1 1 9  18 31 o 37.28000 0.3819000 37.27000 0.6116000 37.29000 0.4574000 -0.1731000E-01 0.7637000 
1 1 1 9  18 33 o 59.98000 0.4773000 60.26000 0.7183000 59.71000 0.6288000 0.5506000      0.9546000 
1 1 1 9  18 35 o 47.16000 0.4823000 47.18000 0.7322000 47.15000 0.6280000 0.2156000E-01  0.9647000 
1 1 1 9  18 37 o 5.041000 0.9764000 6.364000 1.423000  3.717000 1.337000  2.647000       1.953000  
1 1 1 9  18 39 o 3.173000 0.9800000 2.944000 1.394000  3.403000 1.378000  -0.4585000     1.960000  
1 1 1 9  18 41 o 29.04000 0.3556000 30.00000 0.5421000 28.08000 0.4603000 1.928000       0.7112000 
1 1 1 9  18 43 o 17.95000 0.3930000 17.86000 0.6286000 18.04000 0.4720000 -0.1717000     0.7861000 
1 1 1 9  18 45 o 20.56000 0.4146000 20.45000 0.5946000 20.67000 0.5780000 -0.2209000     0.8292000 
1 1 1 9  18 47 o 13.60000 0.4566000 13.28000 0.7509000 13.92000 0.5196000 -0.6433000     0.9132000 
1 1 1 9  18 49 o 12.59000 0.5314000 12.20000 0.9084000 12.98000 0.5517000 -0.7763000     1.063000  
1 1 1 9  18 51 o 2.510000 0.8447000 3.025000 1.395000  1.995000 0.9532000 1.029000       1.689000  
1 1 1 9  18 53 o 10.17000 0.5664000 9.554000 0.9409000 10.79000 0.6308000 -1.233000      1.133000  
1 1 1 9  18 55 o 11.76000 0.5341000 11.41000 0.8734000 12.10000 0.6150000 -0.6893000     1.068000  
1 1 1 9  18 57 o 3.585000 1.014000  3.096000 1.408000  4.074000 1.459000  -0.9776000     2.028000  
1 1 1 9  18 59 o 7.282000 0.9513000 7.866000 1.327000  6.697000 1.364000  1.169000       1.903000  
1 1 1 9  18 61 o 4.664000 1.060000  4.199000 1.624000  5.129000 1.363000  -0.9302000     2.121000  
1 1 1 9  18 63 o 4.836000 1.058000  5.232000 1.634000  4.439000 1.344000  0.7927000      2.115000  
1 1 1 9  19 0  o 68.67000 0.6787000 68.67000 0.6787000 68.67000 0.6787000 0.000000       0.000000  
1 1 1 9  19 2  f 51.39000 0.3690000 51.15000 0.5213000 51.63000 0.5225000 -0.4791000     0.7381000 
1 1 1 9  19 4  o 80.84000 0.6062000 81.36000 0.9236000 80.33000 0.7854000 1.028000       1.212000  
1 1 1 9  19 6  o 115.7000 0.8590000 116.3000 1.303000  115.1000 1.119000  1.193000       1.718000  
1 1 1 9  19 8  o 68.53000 0.6291000 69.14000 0.9821000 67.92000 0.7866000 1.214000       1.258000  
1 1 1 9  19 10 o 62.66000 0.5809000 62.44000 0.7301000 62.88000 0.9036000 -0.4397000     1.162000  
1 1 1 9  19 12 o 96.37000 0.6657000 96.63000 0.9433000 96.12000 0.9397000 0.5085000      1.331000  
1 1 1 9  19 14 o 39.78000 0.4466000 38.97000 0.6029000 40.59000 0.6590000 -1.621000      0.8932000 
1 1 1 9  19 16 o 45.24000 0.4091000 45.27000 0.6596000 45.22000 0.4840000 0.5162000E-01  0.8181000 
1 1 1 9  19 18 o 44.42000 0.3760000 44.13000 0.4781000 44.70000 0.5804000 -0.5762000     0.7519000 
1 1 1 9  19 20 o 34.86000 0.2950000 34.67000 0.4131000 35.04000 0.4213000 -0.3686000     0.5901000 
1 1 1 9  19 22 o 24.37000 0.4667000 24.08000 0.4290000 24.67000 0.8290000 -0.5869000     0.9335000 
1 1 1 9  19 24 o 76.22000 0.5387000 76.24000 0.7597000 76.21000 0.7639000 0.2782000E-01  1.077000  
1 1 1 9  19 26 o 21.49000 0.2921000 21.61000 0.4467000 21.37000 0.3767000 0.2434000      0.5843000 
1 1 1 9  19 28 o 32.47000 0.3613000 33.44000 0.5802000 31.51000 0.4307000 1.935000       0.7226000 
1 1 1 9  19 30 o 20.65000 0.3222000 20.02000 0.4798000 21.28000 0.4301000 -1.264000      0.6443000 
1 1 1 9  19 32 f 21.51000 0.3174000 21.75000 0.4926000 21.28000 0.4005000 0.4693000      0.6349000 
1 1 1 9  19 34 o 32.87000 0.3376000 32.65000 0.5059000 33.08000 0.4471000 -0.4245000     0.6752000 
1 1 1 9  19 36 o 29.58000 0.3828000 30.10000 0.6114000 29.06000 0.4609000 1.039000       0.7656000 
1 1 1 9  19 38 f 12.29000 0.4955000 13.39000 0.7141000 11.20000 0.6872000 2.194000       0.9911000 
1 1 1 9  19 40 o 4.468000 0.9916000 3.708000 1.544000  5.228000 1.245000  -1.521000      1.983000  
1 1 1 9  19 42 o 25.29000 0.3438000 25.49000 0.5345000 25.09000 0.4325000 0.3981000      0.6876000 
1 1 1 9  19 44 o 34.69000 0.3489000 34.51000 0.5489000 34.87000 0.4309000 -0.3613000     0.6978000 
1 1 1 9  19 46 o 28.67000 0.3348000 29.08000 0.5191000 28.26000 0.4231000 0.8193000      0.6696000 
1 1 1 9  19 48 o 8.369000 0.6952000 9.186000 1.022000  7.551000 0.9423000 1.635000       1.390000  
1 1 1 9  19 50 o 15.67000 0.3939000 15.65000 0.6302000 15.69000 0.4729000 -0.4172000E-01 0.7879000 
1 1 1 9  19 52 o 4.725000 0.9894000 5.857000 1.468000  3.593000 1.327000  2.265000       1.979000  
1 1 1 9  19 54 o 11.81000 0.4981000 11.92000 0.7818000 11.71000 0.6176000 0.2151000      0.9963000 
1 1 1 9  19 56 o 8.532000 0.8331000 9.223000 1.215000  7.842000 1.140000  1.381000       1.666000  
1 1 1 9  19 58 o 4.242000 1.071000  5.058000 1.634000  3.427000 1.384000  1.631000       2.141000  
1 1 1 9  19 60 o 5.364000 1.142000  5.950000 1.820000  4.779000 1.379000  1.171000       2.284000  
1 1 1 9  19 62 o 4.185000 1.075000  3.888000 1.616000  4.481000 1.418000  -0.5935000     2.150000  
1 1 1 9  20 1  o 141.5000 0.9654000 141.9000 1.368000  141.2000 1.362000  0.6271000      1.931000  
1 1 1 9  20 3  o 25.32000 0.2773000 25.32000 0.4004000 25.32000 0.3837000 -0.7328000E-02 0.5546000 
1 1 1 9  20 5  o 44.98000 0.4196000 45.14000 0.4750000 44.82000 0.6918000 0.3210000      0.8392000 
1 1 1 9  20 7  o 47.65000 0.4046000 48.35000 0.5863000 46.95000 0.5578000 1.400000       0.8093000 
1 1 1 9  20 9  o 34.77000 0.3781000 34.64000 0.4715000 34.91000 0.5912000 -0.2626000     0.7562000 
1 1 1 9  20 11 o 27.85000 0.2824000 28.13000 0.4441000 27.58000 0.3490000 0.5493000      0.5648000 
1 1 1 9  20 13 o 86.73000 0.6507000 87.29000 0.9885000 86.16000 0.8465000 1.124000       1.301000  
1 1 1 9  20 15 f 51.85000 0.5943000 51.24000 1.056000  52.46000 0.5451000 -1.221000      1.189000  
1 1 1 9  20 17 o 40.90000 0.3197000 40.57000 0.4488000 41.24000 0.4554000 -0.6672000     0.6394000 
1 1 1 9  20 19 o 28.33000 0.3468000 28.38000 0.3760000 28.29000 0.5828000 0.9044000E-01  0.6936000 
1 1 1 9  20 21 o 15.14000 0.5325000 16.10000 0.4066000 14.18000 0.9842000 1.921000       1.065000  
1 1 1 9  20 23 o 26.57000 0.2762000 26.88000 0.3881000 26.25000 0.3930000 0.6338000      0.5524000 
1 1 1 9  20 25 o 40.68000 0.4655000 41.09000 0.6753000 40.28000 0.6410000 0.8157000      0.9311000 
1 1 1 9  20 27 o 29.66000 0.3347000 29.94000 0.5548000 29.39000 0.3746000 0.5466000      0.6694000 
1 1 1 9  20 29 o 30.49000 0.3010000 30.81000 0.4659000 30.18000 0.3812000 0.6307000      0.6020000 
1 1 1 9  20 31 o 41.95000 0.3515000 41.73000 0.5466000 42.16000 0.4421000 -0.4301000     0.7030000 
1 1 1 9  20 33 o 43.92000 0.3802000 43.89000 0.5671000 43.95000 0.5067000 -0.5863000E-01 0.7604000 
1 1 1 9  20 35 o 11.10000 0.7047000 11.69000 1.258000  10.51000 0.6350000 1.186000       1.409000  
1 1 1 9  20 37 o 23.08000 0.3350000 23.11000 0.5286000 23.05000 0.4115000 0.6247000E-01  0.6699000 
1 1 1 9  20 39 o 4.693000 1.104000  5.050000 1.771000  4.337000 1.319000  0.7128000      2.208000  
1 1 1 9  20 41 o 17.12000 0.4018000 17.35000 0.6135000 16.88000 0.5192000 0.4696000      0.8037000 
1 1 1 9  20 43 o 10.54000 0.5785000 11.14000 0.9069000 9.935000 0.7184000 1.209000       1.157000  
1 1 1 9  20 45 o 22.00000 0.3534000 22.18000 0.5452000 21.83000 0.4498000 0.3525000      0.7068000 
1 1 1 9  20 47 o 5.361000 1.075000  5.038000 1.780000  5.683000 1.205000  -0.6453000     2.150000  
1 1 1 9  20 49 o 13.54000 0.5222000 13.84000 0.8362000 13.25000 0.6256000 0.5814000      1.044000  
1 1 1 9  20 51 o 6.581000 0.9077000 5.436000 1.605000  7.726000 0.8480000 -2.290000      1.815000  
1 1 1 9  20 53 o 5.448000 0.9359000 6.272000 1.373000  4.623000 1.272000  1.650000       1.872000  
1 1 1 9  20 55 o 6.606000 0.8977000 6.708000 1.402000  6.503000 1.121000  0.2045000      1.795000  
1 1 1 9  20 57 o 6.310000 1.031000  5.552000 1.857000  7.069000 0.8969000 -1.518000      2.063000  
1 1 1 9  20 59 o 10.52000 0.6264000 10.63000 0.9941000 10.41000 0.7626000 0.2256000      1.253000  
1 1 1 9  20 61 o 5.656000 1.015000  7.059000 1.444000  4.253000 1.426000  2.806000       2.029000  
1 1 1 9  20 63 o 3.764000 1.060000  3.829000 1.568000  3.700000 1.426000  0.1292000      2.120000  
1 1 1 9  21 0  o 38.01000 0.4149000 38.01000 0.4149000 38.01000 0.4149000 0.000000       0.000000  
1 1 1 9  21 2  o 81.41000 0.5646000 81.34000 0.7982000 81.49000 0.7989000 -0.1546000     1.129000  
1 1 1 9  21 4  o 27.96000 0.2673000 27.75000 0.4174000 28.18000 0.3340000 -0.4270000     0.5345000 
1 1 1 9  21 6  o 54.49000 0.4208000 54.88000 0.5631000 54.10000 0.6254000 0.7795000      0.8416000 
1 1 1 9  21 8  o 130.2000 1.150000  128.5000 1.763000  132.0000 1.477000  -3.510000      2.300000  
1 1 1 9  21 10 o 93.16000 0.6958000 92.67000 1.047000  93.65000 0.9165000 -0.9793000     1.392000  
1 1 1 9  21 12 o 120.4000 0.8918000 119.0000 1.334000  121.8000 1.184000  -2.775000      1.784000  
1 1 1 9  21 14 o 56.12000 0.4377000 57.09000 0.6652000 55.15000 0.5691000 1.935000       0.8754000 
1 1 1 9  21 16 o 14.55000 0.2537000 14.25000 0.3545000 14.86000 0.3631000 -0.6040000     0.5075000 
1 1 1 9  21 18 o 17.01000 0.2853000 16.76000 0.4014000 17.26000 0.4056000 -0.4937000     0.5707000 
1 1 1 9  21 20 o 15.38000 0.2936000 15.01000 0.3819000 15.75000 0.4461000 -0.7356000     0.5872000 
1 1 1 9  21 22 o 52.15000 0.4526000 51.44000 0.6238000 52.86000 0.6560000 -1.422000      0.9052000 
1 1 1 9  21 24 o 63.94000 0.5327000 63.78000 0.7490000 64.11000 0.7578000 -0.3326000     1.065000  
1 1 1 9  21 26 o 52.76000 0.4309000 52.67000 0.6507000 52.85000 0.5650000 -0.1868000     0.8618000 
1 1 1 9  21 28 o 21.45000 0.3374000 21.89000 0.5397000 21.00000 0.4049000 0.8855000      0.6747000 
1 1 1 9  21 30 o 24.82000 0.2977000 24.76000 0.4634000 24.88000 0.3738000 -0.1229000     0.5953000 
1 1 1 9  21 32 o 8.684000 0.5898000 9.235000 0.8766000 8.132000 0.7894000 1.103000       1.180000  
1 1 1 9  21 34 o 12.77000 0.5131000 11.76000 0.8867000 13.79000 0.5164000 -2.030000      1.026000  
1 1 1 9  21 36 o 19.63000 0.3854000 19.29000 0.5761000 19.97000 0.5122000 -0.6800000     0.7708000 
1 1 1 9  21 38 o 20.50000 0.3741000 19.85000 0.5709000 21.14000 0.4836000 -1.291000      0.7482000 
1 1 1 9  21 40 o 16.01000 0.4123000 15.59000 0.6607000 16.43000 0.4935000 -0.8435000     0.8247000 
1 1 1 9  21 42 o 45.05000 0.3876000 44.91000 0.6051000 45.19000 0.4846000 -0.2842000     0.7752000 
1 1 1 9  21 44 o 26.47000 0.3543000 26.39000 0.5285000 26.55000 0.4719000 -0.1598000     0.7085000 
1 1 1 9  21 46 f 8.855000 0.6492000 8.846000 0.9865000 8.864000 0.8443000 -0.1796000E-01 1.298000  
1 1 1 9  21 48 o 11.25000 0.5795000 12.83000 0.8982000 9.680000 0.7325000 3.150000       1.159000  
1 1 1 9  21 50 o 5.705000 0.9247000 5.805000 1.522000  5.604000 1.051000  0.2010000      1.849000  
1 1 1 9  21 52 o 10.10000 0.6298000 9.751000 1.072000  10.45000 0.6619000 -0.7012000     1.260000  
1 1 1 9  21 54 o 15.05000 0.4453000 15.52000 0.6854000 14.58000 0.5686000 0.9338000      0.8906000 
1 1 1 9  21 56 o 3.357000 0.9640000 3.219000 1.415000  3.494000 1.309000  -0.2742000     1.928000  
1 1 1 9  21 58 o 5.599000 1.002000  5.719000 1.562000  5.479000 1.257000  0.2405000      2.005000  
1 1 1 9  21 60 o 6.797000 1.060000  7.168000 1.728000  6.426000 1.228000  0.7421000      2.120000  
1 1 1 9  21 62 f 5.030000 1.121000  6.158000 1.779000  3.901000 1.362000  2.257000       2.241000  
1 1 1 9  22 1  o 52.34000 0.4079000 51.71000 0.5313000 52.97000 0.6190000 -1.260000      0.8158000 
1 1 1 9  22 3  o 112.4000 0.8905000 111.3000 1.249000  113.6000 1.270000  -2.332000      1.781000  
1 1 1 9  22 5  o 49.90000 0.4165000 50.46000 0.6017000 49.34000 0.5761000 1.120000       0.8330000 
1 1 1 9  22 7  o 92.98000 1.004000  91.13000 1.782000  94.83000 0.9250000 -3.707000      2.008000  
1 1 1 9  22 9  o 76.00000 0.5749000 75.15000 0.7425000 76.85000 0.8779000 -1.692000      1.150000  
1 1 1 9  22 11 o 84.11000 0.6322000 84.33000 0.9566000 83.90000 0.8269000 0.4247000      1.264000  
1 1 1 9  22 13 o 44.77000 0.3626000 44.78000 0.5402000 44.77000 0.4837000 0.7248000E-02  0.7251000 
1 1 1 9  22 15 o 68.05000 0.4830000 68.31000 0.6849000 67.79000 0.6812000 0.5236000      0.9660000 
1 1 1 9  22 17 o 28.11000 0.2996000 27.95000 0.4660000 28.26000 0.3768000 -0.3020000     0.5993000 
1 1 1 9  22 19 o 37.65000 0.3302000 37.62000 0.4337000 37.67000 0.4980000 -0.4506000E-01 0.6604000 
1 1 1 9  22 21 o 23.98000 0.5272000 24.75000 0.8739000 23.21000 0.5898000 1.539000       1.054000  
1 1 1 9  22 23 o 36.54000 0.3061000 36.82000 0.4293000 36.25000 0.4365000 0.5717000      0.6122000 
1 1 1 9  22 25 o 73.24000 0.5640000 73.05000 0.8510000 73.43000 0.7403000 -0.3811000     1.128000  
1 1 1 9  22 27 o 39.45000 0.3344000 39.77000 0.5224000 39.13000 0.4175000 0.6345000      0.6687000 
1 1 1 9  22 29 o 11.58000 0.4113000 11.49000 0.6477000 11.68000 0.5070000 -0.1974000     0.8226000 
1 1 1 9  22 31 o 22.59000 0.3545000 22.47000 0.5657000 22.71000 0.4274000 -0.2485000     0.7089000 
1 1 1 9  22 33 o 25.02000 0.3507000 24.80000 0.5792000 25.23000 0.3955000 -0.4285000     0.7013000 
1 1 1 9  22 35 o 36.77000 0.3931000 36.71000 0.6591000 36.82000 0.4286000 -0.1050000     0.7862000 
1 1 1 9  22 37 o 30.66000 0.3496000 30.47000 0.5226000 30.85000 0.4645000 -0.3780000     0.6992000 
1 1 1 9  22 39 o 21.84000 0.4039000 21.79000 0.6701000 21.89000 0.4511000 -0.1003000     0.8078000 
1 1 1 9  22 41 o 7.424000 0.8193000 7.373000 1.289000  7.475000 1.012000  -0.1024000     1.639000  
1 1 1 9  22 43 o 10.86000 0.5645000 10.91000 0.8673000 10.81000 0.7226000 0.1020000      1.129000  
1 1 1 9  22 45 o 28.41000 0.3452000 27.66000 0.5134000 29.16000 0.4615000 -1.504000      0.6904000 
1 1 1 9  22 47 o 12.55000 0.5000000 11.31000 0.8507000 13.79000 0.5256000 -2.481000      1.000000  
1 1 1 9  22 49 o 12.71000 0.4842000 12.82000 0.7418000 12.61000 0.6224000 0.2096000      0.9683000 
1 1 1 9  22 51 o 12.49000 0.5387000 11.65000 0.9032000 13.32000 0.5875000 -1.669000      1.077000  
1 1 1 9  22 53 o 15.48000 0.4317000 14.75000 0.6912000 16.22000 0.5175000 -1.473000      0.8634000 
1 1 1 9  22 55 f 7.292000 0.8440000 6.389000 1.472000  8.196000 0.8266000 -1.807000      1.688000  
1 1 1 9  22 57 o 5.494000 0.9492000 4.886000 1.556000  6.103000 1.087000  -1.218000      1.898000  
1 1 1 9  22 59 o 3.866000 1.025000  4.334000 1.573000  3.399000 1.316000  0.9350000      2.050000  
1 1 1 9  22 61 o 3.821000 1.061000  4.464000 1.663000  3.177000 1.320000  1.287000       2.123000  
1 1 1 9  23 0  o 15.80000 0.3757000 15.80000 0.3757000 15.80000 0.3757000 0.000000       0.000000  
1 1 1 9  23 2  o 65.05000 0.5925000 65.36000 0.9246000 64.74000 0.7412000 0.6189000      1.185000  
1 1 1 9  23 4  o 39.68000 0.3296000 40.15000 0.5052000 39.22000 0.4234000 0.9309000      0.6592000 
1 1 1 9  23 6  f 66.42000 0.5778000 66.80000 0.9508000 66.03000 0.6569000 0.7693000      1.156000  
1 1 1 9  23 8  o 74.83000 0.5656000 75.86000 0.7496000 73.80000 0.8471000 2.061000       1.131000  
1 1 1 9  23 10 o 46.51000 0.3732000 47.04000 0.4926000 45.97000 0.5608000 1.067000       0.7464000 
1 1 1 9  23 12 o 35.96000 0.3280000 36.50000 0.4649000 35.41000 0.4627000 1.092000       0.6559000 
1 1 1 9  23 14 o 66.29000 0.4713000 66.21000 0.6650000 66.37000 0.6681000 -0.1549000     0.9426000 
1 1 1 9  23 16 o 46.00000 0.3495000 45.58000 0.4881000 46.42000 0.5004000 -0.8435000     0.6990000 
1 1 1 9  23 18 o 39.01000 0.3749000 38.85000 0.4400000 39.18000 0.6073000 -0.3264000     0.7499000 
1 1 1 9  23 20 o 43.71000 0.3656000 42.99000 0.5438000 44.43000 0.4889000 -1.443000      0.7313000 
1 1 1 9  23 22 o 20.84000 0.3061000 20.39000 0.3687000 21.29000 0.4887000 -0.9031000     0.6121000 
1 1 1 9  23 24 o 28.15000 0.3129000 28.06000 0.3867000 28.24000 0.4921000 -0.1801000     0.6259000 
1 1 1 9  23 26 o 40.73000 0.3609000 40.86000 0.5471000 40.60000 0.4707000 0.2536000      0.7217000 
1 1 1 9  23 28 o 28.37000 0.2926000 29.08000 0.4540000 27.66000 0.3692000 1.419000       0.5852000 
1 1 1 9  23 30 o 3.895000 0.9428000 4.138000 1.419000  3.652000 1.242000  0.4854000      1.886000  
1 1 1 9  23 32 o 34.13000 0.3257000 34.41000 0.5054000 33.84000 0.4108000 0.5770000      0.6513000 
1 1 1 9  23 34 f 34.74000 0.5056000 34.38000 0.8462000 35.11000 0.5537000 -0.7208000     1.011000  
1 1 1 9  23 36 o 39.30000 0.3772000 38.70000 0.5471000 39.90000 0.5193000 -1.200000      0.7543000 
1 1 1 9  23 38 o 16.08000 0.4078000 17.10000 0.6180000 15.06000 0.5322000 2.045000       0.8156000 
1 1 1 9  23 40 f 8.130000 0.8818000 8.163000 1.498000  8.097000 0.9303000 0.6563000E-01  1.764000  
1 1 1 9  23 42 o 23.01000 0.3660000 22.33000 0.5499000 23.69000 0.4831000 -1.365000      0.7320000 
1 1 1 9  23 44 o 21.18000 0.3500000 20.94000 0.5423000 21.42000 0.4425000 -0.4762000     0.7000000 
1 1 1 9  23 46 o 22.65000 0.3829000 22.40000 0.6504000 22.91000 0.4044000 -0.5109000     0.7659000 
1 1 1 9  23 48 o 10.33000 0.6149000 10.79000 1.007000  9.861000 0.7060000 0.9306000      1.230000  
1 1 1 9  23 50 o 10.47000 0.6120000 11.29000 0.9823000 9.658000 0.7302000 1.631000       1.224000  
1 1 1 9  23 52 o 3.398000 0.9792000 3.245000 1.456000  3.551000 1.310000  -0.3060000     1.958000  
1 1 1 9  23 54 o 12.10000 0.5438000 12.05000 0.8059000 12.15000 0.7303000 -0.9979000E-01 1.088000  
1 1 1 9  23 56 o 3.440000 1.061000  4.116000 1.697000  2.763000 1.273000  1.353000       2.121000  
1 1 1 9  23 58 o 5.018000 1.060000  5.001000 1.608000  5.035000 1.383000  -0.3374000E-01 2.121000  
1 1 1 9  23 60 o 4.219000 1.005000  3.150000 1.419000  5.289000 1.424000  -2.139000      2.011000  
1 1 1 9  23 62 o 4.507000 1.063000  5.742000 1.678000  3.272000 1.305000  2.470000       2.126000  
1 1 1 9  24 1  o 113.5000 0.8411000 112.8000 1.267000  114.1000 1.107000  -1.219000      1.682000  
1 1 1 9  24 3  o 101.9000 0.7021000 100.2000 0.9770000 103.6000 1.009000  -3.484000      1.404000  
1 1 1 9  24 5  o 29.90000 0.3464000 29.78000 0.3820000 30.02000 0.5780000 -0.2362000     0.6928000 
1 1 1 9  24 7  o 92.31000 0.6607000 91.96000 0.8056000 92.65000 1.047000  -0.6929000     1.321000  
1 1 1 9  24 9  o 94.31000 0.7041000 94.22000 0.9193000 94.40000 1.067000  -0.1842000     1.408000  
1 1 1 9  24 11 o 59.66000 0.4427000 59.53000 0.5418000 59.79000 0.7004000 -0.2581000     0.8855000 
1 1 1 9  24 13 o 46.12000 0.4162000 46.63000 0.4904000 45.60000 0.6725000 1.036000       0.8323000 
1 1 1 9  24 15 o 82.13000 0.6200000 81.98000 0.8106000 82.28000 0.9382000 -0.3033000     1.240000  
1 1 1 9  24 17 o 46.97000 0.4511000 47.18000 0.5786000 46.75000 0.6922000 0.4313000      0.9022000 
1 1 1 9  24 19 o 66.68000 0.4768000 67.03000 0.6758000 66.32000 0.6729000 0.7126000      0.9537000 
1 1 1 9  24 21 o 58.66000 0.4986000 58.21000 0.6914000 59.11000 0.7188000 -0.8915000     0.9973000 
1 1 1 9  24 23 o 16.38000 0.2824000 16.56000 0.3918000 16.21000 0.4069000 0.3447000      0.5649000 
1 1 1 9  24 25 o 17.91000 0.3160000 18.11000 0.4865000 17.72000 0.4034000 0.3919000      0.6320000 
1 1 1 9  24 27 f 22.09000 0.2771000 22.47000 0.3827000 21.72000 0.4009000 0.7452000      0.5542000 
1 1 1 9  24 29 o 29.91000 0.3014000 30.34000 0.4680000 29.48000 0.3799000 0.8552000      0.6027000 
1 1 1 9  24 31 o 18.86000 0.3415000 18.89000 0.5094000 18.82000 0.4550000 0.7111000E-01  0.6831000 
1 1 1 9  24 33 o 25.94000 0.3713000 25.98000 0.5999000 25.89000 0.4376000 0.8177000E-01  0.7425000 
1 1 1 9  24 35 o 66.99000 0.5319000 67.98000 0.8015000 66.00000 0.6995000 1.980000       1.064000  
1 1 1 9  24 37 o 27.05000 0.4590000 27.37000 0.6309000 26.73000 0.6670000 0.6463000      0.9181000 
1 1 1 9  24 39 o 10.73000 0.5739000 9.917000 0.9560000 11.54000 0.6352000 -1.623000      1.148000  
1 1 1 9  24 41 o 7.858000 0.7947000 8.361000 1.110000  7.355000 1.138000  1.007000       1.589000  
1 1 1 9  24 43 o 16.89000 0.4112000 16.49000 0.6250000 17.30000 0.5346000 -0.8087000     0.8224000 
1 1 1 9  24 45 o 7.660000 0.8529000 7.819000 1.469000  7.502000 0.8662000 0.3176000      1.706000  
1 1 1 9  24 47 o 17.28000 0.4331000 17.67000 0.7223000 16.89000 0.4783000 0.7753000      0.8663000 
1 1 1 9  24 49 o 8.693000 0.6532000 8.268000 1.088000  9.117000 0.7230000 -0.8495000     1.306000  
1 1 1 9  24 51 o 8.847000 0.6507000 8.742000 1.010000  8.951000 0.8210000 -0.2086000     1.301000  
1 1 1 9  24 53 o 6.306000 0.9226000 5.232000 1.555000  7.380000 0.9926000 -2.148000      1.845000  
1 1 1 9  24 55 o 11.02000 0.5689000 10.98000 0.8690000 11.05000 0.7343000 -0.6675000E-01 1.138000  
1 1 1 9  24 57 o 4.905000 1.032000  4.710000 1.586000  5.100000 1.320000  -0.3900000     2.064000  
1 1 1 9  24 59 o 6.745000 0.9550000 8.183000 1.435000  5.308000 1.261000  2.875000       1.910000  
1 1 1 9  24 61 o 4.374000 1.067000  5.159000 1.724000  3.588000 1.256000  1.571000       2.133000  
1 1 1 9  25 0  o 51.73000 0.5335000 51.73000 0.5335000 51.73000 0.5335000 0.000000       0.000000  
1 1 1 9  25 2  o 38.73000 0.3034000 38.85000 0.4333000 38.61000 0.4247000 0.2398000      0.6067000 
1 1 1 9  25 4  o 120.2000 0.8243000 121.0000 1.175000  119.3000 1.156000  1.737000       1.649000  
1 1 1 9  25 6  o 124.6000 0.9865000 124.6000 1.396000  124.5000 1.395000  0.1206000      1.973000  
1 1 1 9  25 8  f 33.47000 0.3543000 33.47000 0.4631000 33.47000 0.5363000 -0.3616000E-02 0.7086000 
1 1 1 9  25 10 o 29.40000 0.2713000 29.14000 0.3321000 29.65000 0.4292000 -0.5138000     0.5427000 
1 1 1 9  25 12 o 36.19000 0.3010000 36.22000 0.3710000 36.16000 0.4742000 0.6458000E-01  0.6021000 
1 1 1 9  25 14 o 45.61000 0.4176000 45.33000 0.4863000 45.89000 0.6790000 -0.5631000     0.8352000 
1 1 1 9  25 16 o 35.16000 0.3477000 34.78000 0.4120000 35.55000 0.5602000 -0.7685000     0.6954000 
1 1 1 9  25 18 o 21.03000 0.2551000 21.17000 0.3578000 20.89000 0.3637000 0.2854000      0.5102000 
1 1 1 9  25 20 o 47.17000 0.3896000 47.31000 0.5877000 47.03000 0.5116000 0.2859000      0.7792000 
1 1 1 9  25 22 o 78.69000 0.6033000 78.78000 0.7835000 78.60000 0.9177000 0.1864000      1.207000  
1 1 1 9  25 24 o 15.17000 0.2991000 14.68000 0.4258000 15.66000 0.4201000 -0.9821000     0.5982000 
1 1 1 9  25 26 o 30.33000 0.3164000 30.71000 0.4845000 29.95000 0.4070000 0.7652000      0.6327000 
1 1 1 9  25 28 o 43.73000 0.3586000 43.67000 0.5581000 43.80000 0.4504000 -0.1330000     0.7172000 
1 1 1 9  25 30 o 53.01000 0.4320000 53.50000 0.6507000 52.52000 0.5684000 0.9801000      0.8640000 
1 1 1 9  25 32 o 19.94000 0.3847000 19.54000 0.6100000 20.34000 0.4689000 -0.8017000     0.7694000 
1 1 1 9  25 34 o 17.86000 0.3790000 17.48000 0.5979000 18.25000 0.4660000 -0.7738000     0.7581000 
1 1 1 9  25 36 o 37.49000 0.3966000 37.45000 0.5461000 37.53000 0.5752000 -0.7995000E-01 0.7931000 
1 1 1 9  25 38 o 16.41000 0.4117000 16.31000 0.6433000 16.52000 0.5139000 -0.2047000     0.8233000 
1 1 1 9  25 40 o 5.433000 1.297000  5.506000 2.077000  5.360000 1.552000  0.1469000      2.593000  
1 1 1 9  25 42 o 21.76000 0.3561000 22.03000 0.5231000 21.50000 0.4833000 0.5350000      0.7122000 
1 1 1 9  25 44 o 8.616000 0.6174000 8.999000 0.9285000 8.234000 0.8141000 0.7645000      1.235000  
1 1 1 9  25 46 o 4.866000 1.066000  4.776000 1.727000  4.956000 1.251000  -0.1800000     2.132000  
1 1 1 9  25 48 o 17.33000 0.3844000 16.39000 0.6273000 18.27000 0.4445000 -1.881000      0.7688000 
1 1 1 9  25 50 o 10.82000 0.5741000 10.27000 0.8457000 11.36000 0.7766000 -1.089000      1.148000  
1 1 1 9  25 52 o 6.830000 0.8564000 7.994000 1.297000  5.666000 1.119000  2.328000       1.713000  
1 1 1 9  25 54 o 6.865000 0.8321000 7.359000 1.359000  6.371000 0.9603000 0.9879000      1.664000  
1 1 1 9  25 56 o 9.603000 0.6414000 9.282000 1.060000  9.924000 0.7228000 -0.6413000     1.283000  
1 1 1 9  25 58 o 4.893000 1.077000  5.292000 1.526000  4.493000 1.521000  0.7991000      2.155000  
1 1 1 9  25 60 o 6.938000 0.8753000 8.116000 1.285000  5.761000 1.189000  2.356000       1.751000  
1 1 1 9  26 1  o 30.98000 0.2669000 31.32000 0.3822000 30.64000 0.3726000 0.6806000      0.5338000 
1 1 1 9  26 3  o 25.37000 0.2649000 25.78000 0.4050000 24.96000 0.3415000 0.8146000      0.5298000 
1 1 1 9  26 5  o 52.04000 0.4698000 51.91000 0.7694000 52.16000 0.5393000 -0.2466000     0.9396000 
1 1 1 9  26 7  o 31.74000 0.2832000 31.98000 0.3498000 31.49000 0.4454000 0.4852000      0.5664000 
1 1 1 9  26 9  o 8.922000 0.3456000 8.476000 0.4912000 9.368000 0.4861000 -0.8917000     0.6911000 
1 1 1 9  26 11 o 56.71000 0.4836000 56.53000 0.5192000 56.90000 0.8161000 -0.3681000     0.9672000 
1 1 1 9  26 13 o 67.50000 0.5844000 67.42000 0.6773000 67.58000 0.9526000 -0.1606000     1.169000  
1 1 1 9  26 15 o 26.11000 0.2625000 25.69000 0.3267000 26.54000 0.4109000 -0.8441000     0.5250000 
1 1 1 9  26 17 o 37.05000 0.3114000 36.51000 0.3784000 37.58000 0.4948000 -1.075000      0.6229000 
1 1 1 9  26 19 o 15.53000 0.2991000 15.12000 0.4194000 15.94000 0.4266000 -0.8160000     0.5983000 
1 1 1 9  26 21 o 35.08000 0.3643000 34.80000 0.5051000 35.36000 0.5250000 -0.5600000     0.7285000 
1 1 1 9  26 23 o 34.58000 0.3205000 34.11000 0.4762000 35.04000 0.4292000 -0.9345000     0.6411000 
1 1 1 9  26 25 o 30.93000 0.3211000 30.86000 0.4895000 31.00000 0.4157000 -0.1424000     0.6423000 
1 1 1 9  26 27 o 14.79000 0.3252000 14.80000 0.4567000 14.77000 0.4631000 0.2676000E-01  0.6504000 
1 1 1 9  26 29 o 22.65000 0.3022000 23.27000 0.4581000 22.03000 0.3941000 1.234000       0.6043000 
1 1 1 9  26 31 o 6.064000 0.8100000 5.547000 1.332000  6.581000 0.9217000 -1.033000      1.620000  
1 1 1 9  26 33 o 16.24000 0.4417000 15.78000 0.7499000 16.71000 0.4669000 -0.9302000     0.8834000 
1 1 1 9  26 35 o 39.68000 0.3573000 40.01000 0.5566000 39.36000 0.4482000 0.6449000      0.7146000 
1 1 1 9  26 37 o 26.98000 0.3552000 26.82000 0.5132000 27.15000 0.4914000 -0.3248000     0.7105000 
1 1 1 9  26 39 o 33.13000 0.3409000 33.58000 0.5261000 32.68000 0.4336000 0.9004000      0.6818000 
1 1 1 9  26 41 o 13.70000 0.4442000 14.44000 0.6937000 12.96000 0.5551000 1.486000       0.8885000 
1 1 1 9  26 43 f 22.27000 0.4303000 21.61000 0.6712000 22.93000 0.5386000 -1.318000      0.8606000 
1 1 1 9  26 45 o 3.636000 0.9891000 3.187000 1.422000  4.084000 1.376000  -0.8971000     1.978000  
1 1 1 9  26 47 o 9.737000 0.6456000 9.317000 1.117000  10.16000 0.6479000 -0.8413000     1.291000  
1 1 1 9  26 49 o 11.84000 0.4732000 11.27000 0.7681000 12.40000 0.5527000 -1.124000      0.9463000 
1 1 1 9  26 51 o 7.081000 0.7531000 7.318000 1.148000  6.843000 0.9754000 0.4750000      1.506000  
1 1 1 9  26 53 o 3.347000 0.9359000 2.928000 1.317000  3.766000 1.330000  -0.8379000     1.872000  
1 1 1 9  26 55 o 3.497000 0.9890000 3.016000 1.393000  3.978000 1.404000  -0.9620000     1.978000  
1 1 1 9  26 57 o 9.195000 0.6555000 9.381000 1.045000  9.009000 0.7912000 0.3716000      1.311000  
1 1 1 9  26 59 o 5.470000 0.9965000 6.468000 1.529000  4.473000 1.279000  1.994000       1.993000  
1 1 1 9  27 0  o 6.778000 0.8984000 6.778000 0.8984000 6.778000 0.8984000 0.000000       0.000000  
1 1 1 9  27 2  o 43.88000 0.3839000 43.72000 0.5430000 44.03000 0.5427000 -0.3111000     0.7677000 
1 1 1 9  27 4  o 70.28000 0.5743000 70.40000 0.8207000 70.17000 0.8037000 0.2322000      1.149000  
1 1 1 9  27 6  o 101.8000 0.8342000 100.6000 0.8788000 102.9000 1.418000  -2.369000      1.668000  
1 1 1 9  27 8  o 23.01000 0.2904000 23.17000 0.3616000 22.84000 0.4545000 0.3306000      0.5808000 
1 1 1 9  27 10 o 37.96000 0.3627000 38.02000 0.4278000 37.90000 0.5859000 0.1165000      0.7255000 
1 1 1 9  27 12 o 33.53000 0.3223000 33.83000 0.3626000 33.24000 0.5329000 0.5862000      0.6446000 
1 1 1 9  27 14 o 16.66000 0.2935000 17.04000 0.4210000 16.28000 0.4090000 0.7514000      0.5870000 
1 1 1 9  27 16 o 41.64000 0.3376000 41.35000 0.4120000 41.93000 0.5349000 -0.5747000     0.6752000 
1 1 1 9  27 18 o 49.25000 0.3823000 48.90000 0.4659000 49.60000 0.6063000 -0.7040000     0.7647000 
1 1 1 9  27 20 o 30.76000 0.2875000 30.36000 0.3522000 31.15000 0.4546000 -0.7925000     0.5751000 
1 1 1 9  27 22 o 56.59000 0.6646000 56.98000 0.5922000 56.21000 1.190000  0.7675000      1.329000  
1 1 1 9  27 24 o 35.90000 0.3081000 36.54000 0.4358000 35.26000 0.4355000 1.274000       0.6161000 
1 1 1 9  27 26 o 24.09000 0.3496000 23.96000 0.4867000 24.22000 0.5019000 -0.2620000     0.6991000 
1 1 1 9  27 28 o 21.03000 0.3061000 21.29000 0.4498000 20.77000 0.4154000 0.5237000      0.6122000 
1 1 1 9  27 30 o 9.066000 0.5456000 8.941000 0.8247000 9.191000 0.7146000 -0.2501000     1.091000  
1 1 1 9  27 32 o 9.939000 0.7712000 9.736000 1.374000  10.14000 0.7011000 -0.4065000     1.542000  
1 1 1 9  27 34 o 8.094000 0.6893000 8.285000 1.085000  7.903000 0.8509000 0.3815000      1.379000  
1 1 1 9  27 36 o 28.21000 0.3486000 27.88000 0.5099000 28.54000 0.4755000 -0.6572000     0.6972000 
1 1 1 9  27 38 o 15.72000 0.4149000 15.54000 0.6467000 15.89000 0.5200000 -0.3470000     0.8298000 
1 1 1 9  27 40 o 4.174000 1.101000  4.743000 1.766000  3.605000 1.315000  1.138000       2.202000  
1 1 1 9  27 42 o 18.03000 0.4060000 18.27000 0.5812000 17.78000 0.5672000 0.4828000      0.8121000 
1 1 1 9  27 44 f 2.996000 0.9315000 2.981000 1.399000  3.010000 1.231000  -0.2900000E-01 1.863000  
1 1 1 9  27 46 o 4.502000 1.077000  4.291000 1.696000  4.714000 1.326000  -0.4228000     2.153000  
1 1 1 9  27 48 o 7.648000 0.7013000 7.919000 1.144000  7.377000 0.8115000 0.5419000      1.403000  
1 1 1 9  27 50 o 7.813000 0.8288000 9.142000 0.9977000 6.483000 1.324000  2.659000       1.658000  
1 1 1 9  27 52 o 4.444000 0.9427000 3.723000 1.408000  5.165000 1.254000  -1.442000      1.885000  
1 1 1 9  27 54 o 11.97000 0.6703000 10.32000 1.201000  13.63000 0.5952000 -3.309000      1.341000  
1 1 1 9  27 56 o 15.65000 0.4512000 15.62000 0.7211000 15.68000 0.5426000 -0.5421000E-01 0.9024000 
1 1 1 9  27 58 o 5.300000 0.9918000 5.360000 1.623000  5.240000 1.140000  0.1198000      1.984000  
1 1 1 9  27 60 o 3.596000 0.9987000 3.960000 1.545000  3.232000 1.265000  0.7286000      1.997000  
1 1 1 9  28 1  o 56.09000 0.5028000 55.05000 0.5692000 57.12000 0.8290000 -2.069000      1.006000  
1 1 1 9  28 3  o 47.97000 0.4158000 48.17000 0.5976000 47.77000 0.5783000 0.4032000      0.8316000 
1 1 1 9  28 5  o 42.83000 0.4024000 43.13000 0.4760000 42.53000 0.6488000 0.6072000      0.8047000 
1 1 1 9  28 7  o 34.96000 0.3469000 35.01000 0.4064000 34.91000 0.5622000 0.1044000      0.6937000 
1 1 1 9  28 9  o 27.25000 0.2657000 27.36000 0.3333000 27.14000 0.4138000 0.2249000      0.5313000 
1 1 1 9  28 11 o 58.55000 0.4622000 58.78000 0.6107000 58.32000 0.6940000 0.4581000      0.9245000 
1 1 1 9  28 13 o 23.34000 0.2570000 23.43000 0.3216000 23.25000 0.4010000 0.1724000      0.5140000 
1 1 1 9  28 15 o 22.81000 0.2740000 22.22000 0.3642000 23.39000 0.4094000 -1.168000      0.5480000 
1 1 1 9  28 17 o 22.60000 0.2605000 23.08000 0.3218000 22.12000 0.4097000 0.9581000      0.5210000 
1 1 1 9  28 19 o 33.40000 0.2998000 32.60000 0.3619000 34.20000 0.4779000 -1.593000      0.5995000 
1 1 1 9  28 21 o 29.49000 0.4539000 29.60000 0.3549000 29.38000 0.8355000 0.2206000      0.9078000 
1 1 1 9  28 23 o 22.28000 0.2786000 21.78000 0.3436000 22.78000 0.4386000 -0.9923000     0.5571000 
1 1 1 9  28 25 o 24.83000 0.3258000 25.00000 0.4759000 24.67000 0.4451000 0.3382000      0.6516000 
1 1 1 9  28 27 o 12.75000 0.3758000 12.72000 0.5051000 12.79000 0.5567000 -0.6892000E-01 0.7517000 
1 1 1 9  28 29 o 16.12000 0.3672000 16.59000 0.5389000 15.65000 0.4988000 0.9420000      0.7343000 
1 1 1 9  28 31 o 44.92000 0.4294000 46.03000 0.7213000 43.82000 0.4662000 2.211000       0.8588000 
1 1 1 9  28 33 o 18.23000 0.3612000 18.80000 0.5435000 17.66000 0.4759000 1.144000       0.7224000 
1 1 1 9  28 35 o 6.473000 0.8899000 7.665000 1.111000  5.281000 1.391000  2.384000       1.780000  
1 1 1 9  28 37 o 7.044000 0.8175000 7.945000 1.117000  6.142000 1.194000  1.803000       1.635000  
1 1 1 9  28 39 o 25.27000 0.3309000 25.14000 0.5087000 25.40000 0.4235000 -0.2588000     0.6619000 
1 1 1 9  28 41 o 23.35000 0.4190000 23.55000 0.6452000 23.15000 0.5348000 0.3932000      0.8381000 
1 1 1 9  28 43 o 9.110000 0.5734000 9.866000 0.8871000 8.355000 0.7269000 1.510000       1.147000  
1 1 1 9  28 45 o 4.913000 0.9619000 4.748000 1.508000  5.078000 1.195000  -0.3300000     1.924000  
1 1 1 9  28 47 o 4.891000 0.9987000 5.218000 1.598000  4.565000 1.198000  0.6531000      1.997000  
1 1 1 9  28 49 o 9.368000 0.5995000 9.063000 0.9718000 9.673000 0.7022000 -0.6098000     1.199000  
1 1 1 9  28 51 o 3.884000 1.088000  4.081000 1.712000  3.686000 1.344000  0.3948000      2.177000  
1 1 1 9  28 53 o 10.93000 0.6217000 11.46000 1.004000  10.41000 0.7332000 1.044000       1.243000  
1 1 1 9  28 55 o 6.944000 0.8628000 6.696000 1.387000  7.192000 1.027000  -0.4958000     1.726000  
1 1 1 9  28 57 o 5.147000 1.045000  5.483000 1.637000  4.811000 1.299000  0.6719000      2.090000  
1 1 1 9  28 59 o 2.788000 0.8864000 2.787000 1.308000  2.790000 1.196000  -0.3324000E-02 1.773000  
1 1 1 9  29 0  o 24.98000 0.3663000 24.98000 0.3663000 24.98000 0.3663000 0.000000       0.000000  
1 1 1 9  29 2  o 109.3000 0.8717000 108.9000 1.228000  109.7000 1.238000  -0.7883000     1.743000  
1 1 1 9  29 4  o 16.38000 0.2754000 16.11000 0.3933000 16.65000 0.3856000 -0.5360000     0.5508000 
1 1 1 9  29 6  o 17.62000 0.2648000 17.86000 0.3285000 17.39000 0.4156000 0.4714000      0.5297000 
1 1 1 9  29 8  o 40.28000 0.3307000 39.75000 0.4017000 40.81000 0.5253000 -1.061000      0.6613000 
1 1 1 9  29 10 f 63.68000 0.4737000 63.20000 0.5755000 64.16000 0.7526000 -0.9686000     0.9475000 
1 1 1 9  29 12 o 29.16000 0.3413000 29.14000 0.3412000 29.18000 0.5911000 -0.4648000E-01 0.6825000 
1 1 1 9  29 14 o 42.81000 0.3598000 42.58000 0.4681000 43.05000 0.5466000 -0.4757000     0.7196000 
1 1 1 9  29 16 o 11.53000 0.3301000 11.75000 0.4209000 11.31000 0.5088000 0.4414000      0.6603000 
1 1 1 9  29 18 f 17.61000 0.2853000 17.84000 0.3741000 17.37000 0.4309000 0.4677000      0.5706000 
1 1 1 9  29 20 o 45.98000 0.5634000 46.19000 0.4511000 45.77000 1.033000  0.4219000      1.127000  
1 1 1 9  29 22 o 40.81000 0.3385000 40.51000 0.4152000 41.10000 0.5347000 -0.5942000     0.6770000 
1 1 1 9  29 24 o 20.28000 0.3629000 20.34000 0.3559000 20.22000 0.6326000 0.1141000      0.7259000 
1 1 1 9  29 26 o 8.609000 0.5690000 7.507000 0.8930000 9.710000 0.7055000 -2.203000      1.138000  
1 1 1 9  29 28 o 33.23000 0.3346000 33.02000 0.4322000 33.44000 0.5109000 -0.4194000     0.6692000 
1 1 1 9  29 30 o 31.54000 0.3643000 31.67000 0.6095000 31.40000 0.3993000 0.2667000      0.7286000 
1 1 1 9  29 32 o 6.415000 0.8255000 5.712000 1.347000  7.119000 0.9549000 -1.407000      1.651000  
1 1 1 9  29 34 o 10.37000 0.5591000 9.741000 0.8783000 11.00000 0.6921000 -1.260000      1.118000  
1 1 1 9  29 36 o 4.606000 0.9600000 6.326000 1.472000  2.887000 1.233000  3.439000       1.920000  
1 1 1 9  29 38 o 5.911000 0.9072000 5.642000 1.468000  6.180000 1.066000  -0.5376000     1.814000  
1 1 1 9  29 40 o 18.63000 0.4642000 18.60000 0.7187000 18.66000 0.5875000 -0.5959000E-01 0.9283000 
1 1 1 9  29 42 o 21.03000 0.3437000 20.87000 0.5326000 21.19000 0.4345000 -0.3166000     0.6874000 
1 1 1 9  29 44 o 17.16000 0.3675000 17.25000 0.5680000 17.08000 0.4664000 0.1663000      0.7349000 
1 1 1 9  29 46 o 16.10000 0.4112000 16.53000 0.6867000 15.67000 0.4524000 0.8618000      0.8223000 
1 1 1 9  29 48 o 13.30000 0.4543000 13.05000 0.7249000 13.56000 0.5478000 -0.5133000     0.9086000 
1 1 1 9  29 50 o 8.756000 0.7179000 8.118000 1.098000  9.395000 0.9247000 -1.277000      1.436000  
1 1 1 9  29 52 o 6.910000 0.8785000 5.940000 1.457000  7.880000 0.9814000 -1.940000      1.757000  
1 1 1 9  29 54 o 3.847000 1.097000  4.379000 1.738000  3.314000 1.340000  1.066000       2.195000  
1 1 1 9  29 56 o 2.992000 0.9200000 3.097000 1.394000  2.887000 1.201000  0.2094000      1.840000  
1 1 1 9  29 58 o 4.867000 1.059000  4.478000 1.776000  5.257000 1.154000  -0.7793000     2.118000  
1 1 1 9  30 1  o 25.99000 0.3024000 25.96000 0.4380000 26.03000 0.4171000 -0.6904000E-01 0.6048000 
1 1 1 9  30 3  o 30.06000 0.3052000 29.71000 0.3916000 30.40000 0.4682000 -0.6878000     0.6104000 
1 1 1 9  30 5  o 11.86000 0.4695000 12.41000 0.4470000 11.32000 0.8259000 1.082000       0.9391000 
1 1 1 9  30 7  o 17.57000 0.2651000 17.82000 0.3328000 17.33000 0.4128000 0.4887000      0.5302000 
1 1 1 9  30 9  o 46.49000 0.3661000 46.13000 0.4468000 46.85000 0.5800000 -0.7238000     0.7322000 
1 1 1 9  30 11 o 26.62000 0.2715000 26.53000 0.3353000 26.71000 0.4272000 -0.1740000     0.5431000 
1 1 1 9  30 13 o 58.61000 0.4597000 58.73000 0.6036000 58.48000 0.6934000 0.2501000      0.9193000 
1 1 1 9  30 15 o 33.91000 0.2997000 33.93000 0.3696000 33.89000 0.4720000 0.3317000E-01  0.5995000 
1 1 1 9  30 17 o 38.34000 0.3374000 38.31000 0.4457000 38.36000 0.5068000 -0.4905000E-01 0.6749000 
1 1 1 9  30 19 o 36.59000 0.4993000 35.87000 0.3868000 37.31000 0.9207000 -1.438000      0.9986000 
1 1 1 9  30 21 o 32.51000 0.3801000 32.08000 0.4261000 32.93000 0.6296000 -0.8568000     0.7602000 
1 1 1 9  30 23 o 21.68000 0.3577000 21.95000 0.3758000 21.41000 0.6087000 0.5478000      0.7154000 
1 1 1 9  30 25 o 20.59000 0.3210000 20.96000 0.4422000 20.22000 0.4654000 0.7340000      0.6420000 
1 1 1 9  30 27 o 49.98000 0.4139000 50.33000 0.5457000 49.63000 0.6224000 0.6992000      0.8277000 
1 1 1 9  30 29 o 16.37000 0.3674000 16.43000 0.5480000 16.32000 0.4894000 0.1136000      0.7347000 
1 1 1 9  30 31 o 25.09000 0.3350000 25.30000 0.5043000 24.88000 0.4413000 0.4212000      0.6701000 
1 1 1 9  30 33 f 7.343000 0.6913000 7.409000 0.9011000 7.278000 1.049000  0.1309000      1.383000  
1 1 1 9  30 35 o 14.71000 0.4070000 14.16000 0.6338000 15.27000 0.5108000 -1.107000      0.8140000 
1 1 1 9  30 37 o 16.83000 0.4065000 17.22000 0.5940000 16.44000 0.5549000 0.7793000      0.8129000 
1 1 1 9  30 39 o 10.79000 0.5288000 11.03000 0.7848000 10.54000 0.7088000 0.4833000      1.058000  
1 1 1 9  30 41 o 21.85000 0.3944000 21.99000 0.6614000 21.72000 0.4300000 0.2728000      0.7889000 
1 1 1 9  30 43 o 9.639000 0.6814000 9.339000 1.178000  9.940000 0.6861000 -0.6010000     1.363000  
1 1 1 9  30 45 o 7.035000 0.7169000 6.743000 1.175000  7.328000 0.8211000 -0.5844000     1.434000  
1 1 1 9  30 47 o 3.423000 0.9453000 4.275000 1.496000  2.572000 1.157000  1.703000       1.891000  
1 1 1 9  30 49 o 10.98000 0.5793000 10.32000 0.8600000 11.63000 0.7762000 -1.306000      1.159000  
1 1 1 9  30 51 o 4.629000 1.101000  4.589000 1.587000  4.670000 1.525000  -0.8193000E-01 2.201000  
1 1 1 9  30 53 o 7.761000 1.222000  7.318000 2.301000  8.203000 0.8223000 -0.8845000     2.444000  
1 1 1 9  30 55 o 9.342000 0.5679000 10.28000 0.8737000 8.400000 0.7256000 1.882000       1.136000  
1 1 1 9  30 57 o 8.733000 0.8662000 8.547000 1.516000  8.918000 0.8376000 -0.3700000     1.732000  
1 1 1 9  31 0  o 12.95000 0.5936000 12.95000 0.5936000 12.95000 0.5936000 0.000000       0.000000  
1 1 1 9  31 2  o 45.10000 0.3723000 45.64000 0.5652000 44.57000 0.4849000 1.068000       0.7447000 
1 1 1 9  31 4  o 50.20000 0.4718000 50.02000 0.5338000 50.38000 0.7782000 -0.3595000     0.9437000 
1 1 1 9  31 6  o 22.29000 0.3424000 21.90000 0.3287000 22.67000 0.6008000 -0.7704000     0.6848000 
1 1 1 9  31 8  o 27.44000 0.2790000 26.73000 0.3371000 28.14000 0.4446000 -1.411000      0.5579000 
1 1 1 9  31 10 o 49.56000 0.3862000 49.32000 0.4708000 49.81000 0.6124000 -0.4879000     0.7725000 
1 1 1 9  31 12 f 52.11000 0.4019000 51.88000 0.4910000 52.35000 0.6363000 -0.4743000     0.8037000 
1 1 1 9  31 14 o 39.19000 0.3256000 38.83000 0.3984000 39.56000 0.5152000 -0.7390000     0.6513000 
1 1 1 9  31 16 o 7.428000 0.5192000 6.389000 0.7864000 8.468000 0.6780000 -2.078000      1.038000  
1 1 1 9  31 18 o 24.14000 0.4349000 24.95000 0.3397000 23.34000 0.8007000 1.610000       0.8698000 
1 1 1 9  31 20 o 31.71000 0.3614000 31.64000 0.3691000 31.77000 0.6215000 -0.1256000     0.7228000 
1 1 1 9  31 22 o 22.72000 0.3196000 22.77000 0.4680000 22.67000 0.4355000 0.1011000      0.6393000 
1 1 1 9  31 24 o 22.21000 0.2888000 22.02000 0.3629000 22.40000 0.4493000 -0.3778000     0.5775000 
1 1 1 9  31 26 o 47.96000 0.4079000 47.18000 0.5323000 48.74000 0.6183000 -1.555000      0.8158000 
1 1 1 9  31 28 o 28.47000 0.3221000 28.11000 0.4270000 28.83000 0.4824000 -0.7229000     0.6443000 
1 1 1 9  31 30 o 27.29000 0.3337000 27.41000 0.4972000 27.16000 0.4450000 0.2464000      0.6673000 
1 1 1 9  31 32 o 15.58000 0.3644000 15.61000 0.5076000 15.54000 0.5231000 0.6736000E-01  0.7289000 
1 1 1 9  31 34 o 25.73000 0.3484000 25.80000 0.4421000 25.66000 0.5385000 0.1435000      0.6968000 
1 1 1 9  31 36 o 3.532000 1.002000  3.490000 1.422000  3.573000 1.412000  -0.8316000E-01 2.004000  
1 1 1 9  31 38 o 6.256000 0.7246000 6.591000 0.9637000 5.922000 1.082000  0.6681000      1.449000  
1 1 1 9  31 40 o 8.867000 0.5743000 8.850000 0.8632000 8.884000 0.7577000 -0.3436000E-01 1.149000  
1 1 1 9  31 42 o 8.702000 0.7599000 8.612000 1.308000  8.792000 0.7739000 -0.1800000     1.520000  
1 1 1 9  31 44 o 11.09000 0.4954000 10.97000 0.7779000 11.22000 0.6137000 -0.2529000     0.9908000 
1 1 1 9  31 46 o 12.47000 0.4678000 11.85000 0.7063000 13.09000 0.6137000 -1.237000      0.9356000 
1 1 1 9  31 48 o 6.691000 0.8273000 7.709000 1.121000  5.674000 1.217000  2.035000       1.655000  
1 1 1 9  31 50 o 15.20000 0.4949000 15.77000 0.6744000 14.62000 0.7246000 1.150000       0.9899000 
1 1 1 9  31 52 o 12.34000 0.6515000 11.04000 1.160000  13.63000 0.5936000 -2.587000      1.303000  
1 1 1 9  31 54 o 2.927000 0.8682000 2.337000 1.114000  3.517000 1.332000  -1.181000      1.736000  
1 1 1 9  31 56 o 6.199000 0.8596000 7.545000 0.9564000 4.854000 1.429000  2.691000       1.719000  
1 1 1 9  31 58 o 3.865000 1.118000  3.848000 1.650000  3.882000 1.509000  -0.3434000E-01 2.236000  
1 1 1 9  32 1  o 35.78000 0.3252000 36.33000 0.4282000 35.23000 0.4895000 1.100000       0.6504000 
1 1 1 9  32 3  o 68.84000 0.5633000 68.52000 0.7947000 69.15000 0.7987000 -0.6353000     1.127000  
1 1 1 9  32 5  o 54.79000 0.4366000 54.35000 0.5617000 55.23000 0.6686000 -0.8801000     0.8732000 
1 1 1 9  32 7  o 37.36000 0.3793000 38.06000 0.3948000 36.66000 0.6478000 1.398000       0.7587000 
1 1 1 9  32 9  o 58.34000 0.4407000 58.00000 0.5362000 58.68000 0.6996000 -0.6749000     0.8815000 
1 1 1 9  32 11 o 27.71000 0.2875000 27.69000 0.3749000 27.73000 0.4360000 -0.4259000E-01 0.5750000 
1 1 1 9  32 13 o 45.73000 0.3639000 46.25000 0.4540000 45.20000 0.5689000 1.049000       0.7279000 
1 1 1 9  32 15 o 47.17000 0.3726000 47.83000 0.4639000 46.51000 0.5831000 1.317000       0.7451000 
1 1 1 9  32 17 o 21.39000 0.4821000 20.89000 0.4063000 21.90000 0.8744000 -1.010000      0.9642000 
1 1 1 9  32 19 f 34.43000 0.3658000 34.94000 0.3847000 33.93000 0.6223000 1.007000       0.7316000 
1 1 1 9  32 21 o 22.18000 0.2911000 22.05000 0.3827000 22.31000 0.4387000 -0.2660000     0.5821000 
1 1 1 9  32 23 o 24.30000 0.3087000 24.76000 0.4267000 23.85000 0.4463000 0.9127000      0.6174000 
1 1 1 9  32 25 o 43.12000 0.3808000 42.80000 0.5033000 43.43000 0.5717000 -0.6328000     0.7616000 
1 1 1 9  32 27 o 5.275000 0.9542000 5.670000 1.246000  4.880000 1.446000  0.7899000      1.908000  
1 1 1 9  32 29 o 16.32000 0.3418000 15.71000 0.4821000 16.93000 0.4846000 -1.228000      0.6836000 
1 1 1 9  32 31 o 35.61000 0.3316000 35.65000 0.4649000 35.56000 0.4730000 0.8481000E-01  0.6633000 
1 1 1 9  32 33 o 23.54000 0.3419000 23.71000 0.4342000 23.36000 0.5282000 0.3493000      0.6838000 
1 1 1 9  32 35 o 16.95000 0.3967000 17.37000 0.4907000 16.53000 0.6233000 0.8490000      0.7933000 
1 1 1 9  32 37 o 11.06000 0.4705000 10.69000 0.6598000 11.42000 0.6709000 -0.7362000     0.9410000 
1 1 1 9  32 39 o 6.062000 0.8406000 6.027000 1.278000  6.097000 1.093000  -0.6997000E-01 1.681000  
1 1 1 9  32 41 o 12.65000 0.4605000 13.17000 0.6915000 12.12000 0.6083000 1.054000       0.9210000 
1 1 1 9  32 43 o 9.057000 0.5465000 9.042000 0.8312000 9.071000 0.7097000 -0.2914000E-01 1.093000  
1 1 1 9  32 45 o 19.47000 0.3664000 20.02000 0.5486000 18.91000 0.4859000 1.110000       0.7329000 
1 1 1 9  32 47 o 7.775000 0.6144000 8.380000 0.8684000 7.169000 0.8692000 1.211000       1.229000  
1 1 1 9  32 49 o 20.10000 0.3664000 20.20000 0.5084000 20.00000 0.5278000 0.2017000      0.7328000 
1 1 1 9  32 51 o 18.07000 0.3939000 17.74000 0.5651000 18.39000 0.5488000 -0.6437000     0.7877000 
1 1 1 9  32 53 o 13.22000 0.5104000 13.45000 0.8060000 12.98000 0.6263000 0.4639000      1.021000  
1 1 1 9  32 55 o 6.597000 0.8329000 6.943000 1.235000  6.251000 1.118000  0.6923000      1.666000  
1 1 1 9  32 57 o 3.885000 0.9313000 5.119000 1.421000  2.650000 1.204000  2.469000       1.863000  
1 1 1 9  33 0  o 14.38000 0.4263000 14.38000 0.4263000 14.38000 0.4263000 0.000000       0.000000  
1 1 1 9  33 2  o 43.42000 0.3692000 43.28000 0.4813000 43.57000 0.5599000 -0.2890000     0.7383000 
1 1 1 9  33 4  o 55.51000 0.4226000 55.79000 0.5178000 55.23000 0.6680000 0.5515000      0.8452000 
1 1 1 9  33 6  o 38.30000 0.3763000 38.34000 0.4335000 38.25000 0.6153000 0.8344000E-01  0.7526000 
1 1 1 9  33 8  o 27.51000 0.3494000 28.03000 0.3491000 26.99000 0.6054000 1.045000       0.6988000 
1 1 1 9  33 10 o 18.51000 0.3607000 18.14000 0.3535000 18.88000 0.6288000 -0.7419000     0.7214000 
1 1 1 9  33 12 o 34.81000 0.3536000 34.41000 0.5088000 35.21000 0.4913000 -0.7940000     0.7073000 
1 1 1 9  33 14 f 25.59000 0.3028000 25.76000 0.3467000 25.42000 0.4964000 0.3387000      0.6055000 
1 1 1 9  33 16 o 8.013000 0.6775000 7.803000 0.6054000 8.223000 1.212000  -0.4201000     1.355000  
1 1 1 9  33 18 o 11.26000 0.5344000 11.61000 0.5607000 10.90000 0.9098000 0.7138000      1.069000  
1 1 1 9  33 20 o 36.65000 0.3361000 36.55000 0.4387000 36.76000 0.5094000 -0.2126000     0.6722000 
1 1 1 9  33 22 o 32.78000 0.3096000 32.52000 0.3846000 33.04000 0.4852000 -0.5127000     0.6191000 
1 1 1 9  33 24 o 10.39000 0.4897000 9.923000 0.7236000 10.85000 0.6601000 -0.9272000     0.9794000 
1 1 1 9  33 26 o 5.738000 0.8526000 6.231000 1.118000  5.245000 1.288000  0.9863000      1.705000  
1 1 1 9  33 28 o 30.52000 0.3173000 30.85000 0.3927000 30.19000 0.4985000 0.6539000      0.6346000 
1 1 1 9  33 30 o 37.54000 0.3336000 37.96000 0.4700000 37.12000 0.4737000 0.8407000      0.6673000 
1 1 1 9  33 32 o 7.659000 0.9430000 7.327000 1.177000  7.992000 1.474000  -0.6645000     1.886000  
1 1 1 9  33 34 o 14.02000 0.4263000 14.36000 0.5291000 13.69000 0.6685000 0.6697000      0.8526000 
1 1 1 9  33 36 o 4.892000 0.8474000 5.919000 1.100000  3.864000 1.289000  2.055000       1.695000  
1 1 1 9  33 38 o 6.165000 0.8434000 6.544000 1.172000  5.787000 1.213000  0.7573000      1.687000  
1 1 1 9  33 40 o 5.012000 0.9631000 4.681000 1.465000  5.342000 1.251000  -0.6617000     1.926000  
1 1 1 9  33 42 o 3.065000 0.8825000 3.476000 1.341000  2.654000 1.148000  0.8224000      1.765000  
1 1 1 9  33 44 o 5.963000 0.8778000 5.117000 1.462000  6.808000 0.9723000 -1.691000      1.756000  
1 1 1 9  33 46 o 5.971000 0.8326000 5.957000 1.245000  5.984000 1.106000  -0.2686000E-01 1.665000  
1 1 1 9  33 48 o 5.785000 0.9289000 5.423000 1.294000  6.148000 1.333000  -0.7246000     1.858000  
1 1 1 9  33 50 o 6.848000 0.8272000 7.144000 1.026000  6.552000 1.298000  0.5921000      1.654000  
1 1 1 9  33 52 o 9.509000 0.5884000 9.250000 0.8765000 9.769000 0.7851000 -0.5183000     1.177000  
1 1 1 9  33 54 o 5.420000 0.9506000 4.315000 1.500000  6.526000 1.168000  -2.212000      1.901000  
1 1 1 9  33 56 o 4.581000 0.9931000 4.519000 1.497000  4.643000 1.306000  -0.1244000     1.986000  
1 1 1 9  34 1  o 27.65000 0.2752000 27.75000 0.3896000 27.56000 0.3887000 0.1822000      0.5503000 
1 1 1 9  34 3  f 40.55000 0.3525000 40.75000 0.4630000 40.35000 0.5316000 0.4082000      0.7049000 
1 1 1 9  34 5  o 7.908000 0.4887000 7.964000 0.5752000 7.851000 0.7903000 0.1125000      0.9775000 
1 1 1 9  34 7  o 30.29000 0.2934000 29.98000 0.3552000 30.60000 0.4671000 -0.6236000     0.5868000 
1 1 1 9  34 9  o 20.78000 0.4854000 20.05000 0.4163000 21.50000 0.8770000 -1.458000      0.9708000 
1 1 1 9  34 11 o 53.89000 0.5004000 53.76000 0.5673000 54.03000 0.8246000 -0.2702000     1.001000  
1 1 1 9  34 13 o 39.02000 0.5096000 40.11000 0.4167000 37.94000 0.9302000 2.169000       1.019000  
1 1 1 9  34 15 o 44.19000 0.4387000 44.57000 0.4991000 43.81000 0.7216000 0.7620000      0.8774000 
1 1 1 9  34 17 o 9.908000 0.6015000 10.45000 0.5330000 9.367000 1.078000  1.080000       1.203000  
1 1 1 9  34 19 o 15.82000 0.3629000 16.81000 0.5233000 14.84000 0.5030000 1.967000       0.7259000 
1 1 1 9  34 21 o 11.30000 0.4071000 11.88000 0.4789000 10.71000 0.6585000 1.167000       0.8142000 
1 1 1 9  34 23 o 34.82000 0.3231000 34.74000 0.4013000 34.89000 0.5064000 -0.1457000     0.6462000 
1 1 1 9  34 25 o 4.353000 0.9658000 4.146000 1.355000  4.560000 1.377000  -0.4140000     1.932000  
1 1 1 9  34 27 o 23.67000 0.3104000 23.64000 0.3881000 23.70000 0.4845000 -0.6449000E-01 0.6208000 
1 1 1 9  34 29 o 20.64000 0.3610000 20.35000 0.4987000 20.92000 0.5222000 -0.5747000     0.7221000 
1 1 1 9  34 31 o 6.168000 0.8686000 6.120000 1.092000  6.216000 1.351000  -0.9618000E-01 1.737000  
1 1 1 9  34 33 o 3.921000 0.8928000 2.457000 1.116000  5.385000 1.394000  -2.928000      1.786000  
1 1 1 9  34 35 o 4.380000 0.9188000 4.371000 1.320000  4.389000 1.278000  -0.1858000E-01 1.838000  
1 1 1 9  34 37 o 10.55000 0.5269000 10.87000 0.6522000 10.22000 0.8278000 0.6503000      1.054000  
1 1 1 9  34 39 o 5.158000 0.8632000 5.210000 1.186000  5.106000 1.255000  0.1046000      1.726000  
1 1 1 9  34 41 o 5.043000 1.011000  5.068000 1.653000  5.018000 1.163000  0.5086000E-01  2.021000  
1 1 1 9  34 43 o 3.111000 0.9017000 3.302000 1.335000  2.921000 1.212000  0.3815000      1.803000  
1 1 1 9  34 45 o 3.473000 0.9453000 3.732000 1.393000  3.214000 1.279000  0.5172000      1.891000  
1 1 1 9  34 47 o 5.320000 0.9865000 5.333000 1.262000  5.306000 1.516000  0.2671000E-01  1.973000  
1 1 1 9  34 49 o 10.72000 0.5407000 10.53000 0.8360000 10.92000 0.6860000 -0.3968000     1.081000  
1 1 1 9  34 51 o 4.027000 1.017000  4.073000 1.504000  3.981000 1.370000  0.9234000E-01  2.034000  
1 1 1 9  34 53 o 5.583000 0.9280000 4.827000 1.517000  6.340000 1.070000  -1.513000      1.856000  
1 1 1 9  34 55 o 7.286000 0.7152000 6.745000 1.143000  7.828000 0.8599000 -1.083000      1.430000  
1 1 1 9  35 0  o 26.72000 0.3834000 26.72000 0.3834000 26.72000 0.3834000 0.000000       0.000000  
1 1 1 9  35 2  o 10.73000 0.3697000 10.14000 0.5538000 11.32000 0.4898000 -1.171000      0.7393000 
1 1 1 9  35 4  o 36.23000 0.3732000 37.11000 0.4459000 35.34000 0.5986000 1.770000       0.7464000 
1 1 1 9  35 6  o 48.49000 0.4368000 47.82000 0.4620000 49.16000 0.7416000 -1.341000      0.8737000 
1 1 1 9  35 8  o 15.92000 0.2988000 15.73000 0.3850000 16.12000 0.4571000 -0.3965000     0.5976000 
1 1 1 9  35 10 o 27.50000 0.3019000 27.54000 0.4054000 27.46000 0.4474000 0.8036000E-01  0.6038000 
1 1 1 9  35 12 f 33.41000 0.5020000 32.80000 0.4143000 34.02000 0.9145000 -1.213000      1.004000  
1 1 1 9  35 14 o 18.16000 0.3984000 18.66000 0.4301000 17.66000 0.6708000 0.9946000      0.7968000 
1 1 1 9  35 16 o 19.74000 0.3757000 19.66000 0.3762000 19.83000 0.6505000 -0.1695000     0.7515000 
1 1 1 9  35 18 o 14.55000 0.3555000 14.56000 0.4626000 14.55000 0.5399000 0.1687000E-01  0.7110000 
1 1 1 9  35 20 o 29.61000 0.3014000 29.12000 0.3722000 30.09000 0.4743000 -0.9675000     0.6029000 
1 1 1 9  35 22 o 14.62000 0.3432000 14.78000 0.4383000 14.46000 0.5283000 0.3176000      0.6865000 
1 1 1 9  35 24 o 16.38000 0.4078000 15.94000 0.6186000 16.83000 0.5316000 -0.8834000     0.8157000 
1 1 1 9  35 26 o 21.22000 0.3211000 21.00000 0.4106000 21.43000 0.4938000 -0.4270000     0.6422000 
1 1 1 9  35 28 o 12.61000 0.5735000 12.68000 0.6932000 12.55000 0.9137000 0.1355000      1.147000  
1 1 1 9  35 30 o 17.62000 0.3636000 17.74000 0.4482000 17.51000 0.5727000 0.2313000      0.7273000 
1 1 1 9  35 32 o 30.46000 0.3327000 30.79000 0.4334000 30.13000 0.5049000 0.6656000      0.6654000 
1 1 1 9  35 34 o 8.867000 0.5097000 9.128000 0.6758000 8.606000 0.7631000 0.5222000      1.019000  
1 1 1 9  35 36 o 9.886000 0.4965000 10.77000 0.6357000 8.999000 0.7628000 1.774000       0.9930000 
1 1 1 9  35 38 o 10.85000 0.4338000 10.68000 0.6148000 11.01000 0.6122000 -0.3310000     0.8676000 
1 1 1 9  35 40 o 8.756000 0.7067000 8.181000 1.246000  9.331000 0.6677000 -1.150000      1.413000  
1 1 1 9  35 42 o 6.818000 0.6961000 6.989000 1.035000  6.647000 0.9312000 0.3420000      1.392000  
1 1 1 9  35 44 o 13.52000 0.4483000 13.49000 0.6861000 13.55000 0.5771000 -0.6100000E-01 0.8965000 
1 1 1 9  35 46 o 6.982000 0.7365000 7.039000 0.9840000 6.925000 1.096000  0.1143000      1.473000  
1 1 1 9  35 48 o 11.18000 0.5251000 10.83000 0.8438000 11.54000 0.6253000 -0.7128000     1.050000  
1 1 1 9  35 50 o 5.927000 0.8429000 6.058000 1.172000  5.795000 1.212000  0.2634000      1.686000  
1 1 1 9  35 52 o 9.126000 0.5625000 9.403000 0.7792000 8.848000 0.8116000 0.5551000      1.125000  
1 1 1 9  35 54 o 3.314000 0.9080000 3.725000 1.350000  2.904000 1.215000  0.8215000      1.816000  
1 1 1 9  36 1  o 15.16000 0.3024000 15.50000 0.4317000 14.82000 0.4237000 0.6807000      0.6049000 
1 1 1 9  36 3  o 10.54000 0.3838000 10.54000 0.5533000 10.53000 0.5320000 0.8194000E-02  0.7676000 
1 1 1 9  36 5  o 23.96000 0.2969000 24.40000 0.3905000 23.52000 0.4474000 0.8789000      0.5938000 
1 1 1 9  36 7  o 47.73000 0.3821000 47.29000 0.4626000 48.16000 0.6083000 -0.8713000     0.7642000 
1 1 1 9  36 9  o 37.55000 0.3834000 37.32000 0.4479000 37.78000 0.6223000 -0.4541000     0.7668000 
1 1 1 9  36 11 o 41.52000 0.3618000 41.80000 0.4800000 41.24000 0.5416000 0.5570000      0.7237000 
1 1 1 9  36 13 o 23.11000 0.3373000 23.10000 0.5108000 23.12000 0.4408000 -0.1968000E-01 0.6747000 
1 1 1 9  36 15 o 30.39000 0.3455000 30.71000 0.4169000 30.08000 0.5510000 0.6393000      0.6909000 
1 1 1 9  36 17 o 22.28000 0.2970000 22.33000 0.3783000 22.23000 0.4580000 0.1002000      0.5941000 
1 1 1 9  36 19 o 23.52000 0.3243000 23.74000 0.4360000 23.30000 0.4801000 0.4411000      0.6485000 
1 1 1 9  36 21 o 25.65000 0.3003000 25.80000 0.3721000 25.51000 0.4713000 0.2841000      0.6005000 
1 1 1 9  36 23 o 17.29000 0.4143000 17.30000 0.5842000 17.28000 0.5875000 0.1742000E-01  0.8285000 
1 1 1 9  36 25 o 27.40000 0.3294000 27.95000 0.4502000 26.84000 0.4810000 1.102000       0.6588000 
1 1 1 9  36 27 o 41.51000 0.3764000 41.86000 0.5045000 41.16000 0.5586000 0.6968000      0.7527000 
1 1 1 9  36 29 f 10.83000 0.5229000 10.69000 0.5573000 10.96000 0.8850000 -0.2706000     1.046000  
1 1 1 9  36 31 o 6.015000 0.7995000 6.800000 0.8223000 5.229000 1.371000  1.571000       1.599000  
1 1 1 9  36 33 o 13.67000 0.3624000 14.06000 0.5034000 13.28000 0.5215000 0.7739000      0.7248000 
1 1 1 9  36 35 o 8.751000 0.5257000 8.227000 0.7610000 9.276000 0.7254000 -1.049000      1.051000  
1 1 1 9  36 37 o 10.98000 0.5116000 11.48000 0.6995000 10.47000 0.7468000 1.007000       1.023000  
1 1 1 9  36 39 o 6.498000 0.6795000 5.653000 1.089000  7.343000 0.8123000 -1.690000      1.359000  
1 1 1 9  36 41 o 9.877000 0.5146000 9.859000 0.7926000 9.895000 0.6566000 -0.3615000E-01 1.029000  
1 1 1 9  36 43 f 6.316000 0.7994000 6.725000 1.110000  5.906000 1.151000  0.8185000      1.599000  
1 1 1 9  36 45 f 10.43000 0.5100000 10.60000 0.6854000 10.26000 0.7553000 0.3379000      1.020000  
1 1 1 9  36 47 o 8.049000 0.6631000 8.606000 0.8672000 7.491000 1.004000  1.115000       1.326000  
1 1 1 9  36 49 o 8.051000 0.6996000 7.550000 1.063000  8.553000 0.9096000 -1.003000      1.399000  
1 1 1 9  36 51 o 6.139000 0.8403000 6.538000 1.217000  5.739000 1.160000  0.7993000      1.681000  
1 1 1 9  36 53 o 5.570000 0.8875000 4.905000 1.372000  6.236000 1.126000  -1.331000      1.775000  
1 1 1 9  37 0  o 25.54000 0.3934000 25.54000 0.3934000 25.54000 0.3934000 0.000000       0.000000  
1 1 1 9  37 2  o 19.88000 0.2903000 19.71000 0.4128000 20.06000 0.4082000 -0.3549000     0.5805000 
1 1 1 9  37 4  f 29.36000 0.2944000 29.63000 0.3602000 29.09000 0.4658000 0.5401000      0.5888000 
1 1 1 9  37 6  o 17.20000 0.3415000 16.88000 0.4193000 17.51000 0.5393000 -0.6347000     0.6831000 
1 1 1 9  37 8  o 22.71000 0.3544000 22.04000 0.4844000 23.38000 0.5174000 -1.345000      0.7088000 
1 1 1 9  37 10 o 21.22000 0.3965000 20.20000 0.4733000 22.24000 0.6361000 -2.039000      0.7929000 
1 1 1 9  37 12 o 35.94000 0.3412000 36.07000 0.4581000 35.80000 0.5059000 0.2711000      0.6824000 
1 1 1 9  37 14 f 5.012000 0.8034000 6.418000 0.9367000 3.606000 1.305000  2.812000       1.607000  
1 1 1 9  37 16 o 33.03000 0.3522000 33.60000 0.4016000 32.46000 0.5788000 1.139000       0.7045000 
1 1 1 9  37 18 o 19.04000 0.3252000 18.95000 0.4359000 19.13000 0.4827000 -0.1834000     0.6504000 
1 1 1 9  37 20 o 34.13000 0.4365000 34.34000 0.5361000 33.91000 0.6890000 0.4334000      0.8730000 
1 1 1 9  37 22 o 32.53000 0.3667000 32.93000 0.5357000 32.14000 0.5008000 0.7835000      0.7334000 
1 1 1 9  37 24 o 26.74000 0.4060000 27.38000 0.5147000 26.11000 0.6281000 1.264000       0.8120000 
1 1 1 9  37 26 o 26.75000 0.3060000 26.87000 0.3856000 26.63000 0.4752000 0.2333000      0.6120000 
1 1 1 9  37 28 o 18.95000 0.3611000 18.77000 0.4155000 19.13000 0.5908000 -0.3626000     0.7223000 
1 1 1 9  37 30 o 10.60000 0.4675000 10.19000 0.6148000 11.01000 0.7045000 -0.8228000     0.9350000 
1 1 1 9  37 32 o 13.68000 0.3639000 13.62000 0.5036000 13.73000 0.5253000 -0.1095000     0.7277000 
1 1 1 9  37 34 o 8.670000 0.5151000 8.344000 0.6910000 8.996000 0.7642000 -0.6519000     1.030000  
1 1 1 9  37 36 f 4.477000 0.9190000 5.056000 1.322000  3.899000 1.277000  1.157000       1.838000  
1 1 1 9  37 38 o 6.661000 0.6353000 6.911000 0.8444000 6.411000 0.9495000 0.5005000      1.271000  
1 1 1 9  37 40 o 7.747000 0.6579000 7.639000 1.066000  7.855000 0.7711000 -0.2157000     1.316000  
1 1 1 9  37 42 o 16.35000 0.4012000 16.58000 0.6115000 16.12000 0.5194000 0.4594000      0.8024000 
1 1 1 9  37 44 o 6.798000 0.6810000 6.629000 0.9542000 6.967000 0.9718000 -0.3387000     1.362000  
1 1 1 9  37 46 o 9.625000 0.6200000 9.587000 0.7740000 9.664000 0.9688000 -0.7649000E-01 1.240000  
1 1 1 9  37 48 o 8.915000 0.6119000 8.584000 0.9021000 9.246000 0.8271000 -0.6619000     1.224000  
1 1 1 9  37 50 o 6.365000 0.8361000 5.301000 1.428000  7.428000 0.8692000 -2.127000      1.672000  
1 1 1 9  37 52 o 5.937000 0.9027000 6.256000 1.299000  5.617000 1.254000  0.6385000      1.805000  
1 1 1 9  38 1  o 31.78000 0.2976000 32.00000 0.4223000 31.57000 0.4194000 0.4348000      0.5952000 
1 1 1 9  38 3  o 7.466000 0.6789000 6.989000 0.8856000 7.943000 1.029000  -0.9535000     1.358000  
1 1 1 9  38 5  o 24.74000 0.3223000 25.46000 0.3617000 24.03000 0.5334000 1.435000       0.6445000 
1 1 1 9  38 7  o 13.14000 0.3771000 13.42000 0.5165000 12.86000 0.5496000 0.5598000      0.7542000 
1 1 1 9  38 9  o 2.710000 0.8334000 2.802000 1.201000  2.618000 1.156000  0.1842000      1.667000  
1 1 1 9  38 11 o 22.89000 0.3115000 22.60000 0.4310000 23.17000 0.4498000 -0.5717000     0.6230000 
1 1 1 9  38 13 o 18.61000 0.3450000 19.23000 0.5066000 18.00000 0.4683000 1.223000       0.6899000 
1 1 1 9  38 15 o 61.56000 0.4688000 62.01000 0.5787000 61.12000 0.7376000 0.8826000      0.9375000 
1 1 1 9  38 17 o 40.18000 0.3669000 40.29000 0.4864000 40.07000 0.5494000 0.2247000      0.7338000 
1 1 1 9  38 19 o 24.87000 0.3595000 25.10000 0.4376000 24.65000 0.5704000 0.4553000      0.7189000 
1 1 1 9  38 21 o 4.593000 1.114000  3.915000 1.465000  5.271000 1.680000  -1.356000      2.229000  
1 1 1 9  38 23 o 4.849000 0.9066000 5.278000 1.107000  4.419000 1.436000  0.8588000      1.813000  
1 1 1 9  38 25 o 5.614000 0.8434000 5.348000 1.091000  5.879000 1.286000  -0.5318000     1.687000  
1 1 1 9  38 27 o 12.43000 0.4330000 12.55000 0.4846000 12.30000 0.7177000 0.2474000      0.8659000 
1 1 1 9  38 29 o 10.49000 0.4391000 10.85000 0.5386000 10.14000 0.6936000 0.7078000      0.8782000 
1 1 1 9  38 31 o 21.21000 0.3011000 20.86000 0.4182000 21.56000 0.4332000 -0.7049000     0.6021000 
1 1 1 9  38 33 o 12.80000 0.3797000 12.02000 0.5408000 13.59000 0.5331000 -1.571000      0.7594000 
1 1 1 9  38 35 o 8.669000 0.5314000 8.728000 0.6903000 8.609000 0.8080000 0.1198000      1.063000  
1 1 1 9  38 37 o 3.987000 0.8682000 2.619000 1.150000  5.355000 1.301000  -2.736000      1.736000  
1 1 1 9  38 39 o 14.06000 0.3714000 13.79000 0.5351000 14.32000 0.5150000 -0.5326000     0.7427000 
1 1 1 9  38 41 o 4.744000 0.9824000 5.393000 1.446000  4.094000 1.331000  1.298000       1.965000  
1 1 1 9  38 43 o 8.005000 0.6225000 7.806000 0.8843000 8.204000 0.8763000 -0.3981000     1.245000  
1 1 1 9  38 45 o 13.09000 0.5000000 12.51000 0.6135000 13.68000 0.7896000 -1.169000      0.9999000 
1 1 1 9  38 47 o 8.265000 0.6877000 8.266000 1.057000  8.264000 0.8801000 0.2073000E-02  1.375000  
1 1 1 9  38 49 f 4.532000 1.046000  4.663000 1.606000  4.401000 1.339000  0.2619000      2.091000  
1 1 1 9  38 51 f 4.926000 1.113000  4.173000 1.498000  5.679000 1.646000  -1.505000      2.226000  
1 1 1 9  38 53 o 6.713000 2.103000  6.713000 2.103000  ?        ?         ?              ?         
1 1 1 9  39 0  o 19.87000 0.4714000 19.87000 0.4714000 19.87000 0.4714000 0.000000       0.000000  
1 1 1 9  39 2  o 45.50000 0.4144000 45.63000 0.5901000 45.37000 0.5819000 0.2590000      0.8288000 
1 1 1 9  39 4  o 52.06000 0.4094000 52.94000 0.5093000 51.18000 0.6411000 1.760000       0.8188000 
1 1 1 9  39 6  f 26.09000 0.3127000 26.20000 0.4180000 25.99000 0.4651000 0.2088000      0.6253000 
1 1 1 9  39 8  o 30.23000 0.3115000 30.05000 0.3797000 30.41000 0.4939000 -0.3569000     0.6230000 
1 1 1 9  39 10 o 26.68000 0.3611000 26.62000 0.4802000 26.73000 0.5395000 -0.1095000     0.7223000 
1 1 1 9  39 12 o 22.21000 0.3362000 21.44000 0.4883000 22.98000 0.4622000 -1.538000      0.6724000 
1 1 1 9  39 14 o 33.79000 0.3646000 33.57000 0.5324000 34.01000 0.4982000 -0.4388000     0.7291000 
1 1 1 9  39 16 o 24.84000 0.3170000 25.08000 0.4265000 24.60000 0.4691000 0.4808000      0.6340000 
1 1 1 9  39 18 o 12.23000 0.4886000 11.85000 0.7630000 12.60000 0.6105000 -0.7506000     0.9771000 
1 1 1 9  39 20 o 28.18000 0.3369000 28.09000 0.4531000 28.27000 0.4986000 -0.1769000     0.6737000 
1 1 1 9  39 22 o 33.93000 0.4094000 33.42000 0.5312000 34.44000 0.6232000 -1.024000      0.8189000 
1 1 1 9  39 24 o 14.99000 0.3723000 15.16000 0.4811000 14.81000 0.5685000 0.3478000      0.7447000 
1 1 1 9  39 26 o 6.110000 0.8292000 6.491000 0.8477000 5.730000 1.425000  0.7606000      1.658000  
1 1 1 9  39 28 o 30.25000 0.3134000 30.19000 0.3866000 30.31000 0.4933000 -0.1143000     0.6267000 
1 1 1 9  39 30 o 36.91000 0.3300000 36.40000 0.4605000 37.43000 0.4729000 -1.033000      0.6601000 
1 1 1 9  39 32 o 6.775000 0.6179000 6.847000 0.8086000 6.703000 0.9345000 0.1441000      1.236000  
1 1 1 9  39 34 o 7.328000 0.5870000 7.528000 0.7642000 7.128000 0.8913000 0.3999000      1.174000  
1 1 1 9  39 36 o 13.12000 0.4348000 13.55000 0.5215000 12.69000 0.6959000 0.8538000      0.8696000 
1 1 1 9  39 38 o 11.35000 0.4448000 10.99000 0.6729000 11.71000 0.5818000 -0.7192000     0.8895000 
1 1 1 9  39 40 o 7.161000 0.7472000 7.226000 1.166000  7.095000 0.9348000 0.1309000      1.494000  
1 1 1 9  39 42 o 7.292000 0.6934000 6.597000 1.031000  7.987000 0.9279000 -1.390000      1.387000  
1 1 1 9  39 44 o 3.147000 0.9007000 3.262000 1.280000  3.033000 1.268000  0.2283000      1.801000  
1 1 1 9  39 46 o 9.098000 0.6354000 8.833000 1.042000  9.363000 0.7282000 -0.5308000     1.271000  
1 1 1 9  39 48 o 3.776000 1.019000  4.507000 1.573000  3.044000 1.295000  1.463000       2.037000  
1 1 1 9  39 50 f 3.743000 0.9577000 4.319000 1.416000  3.166000 1.290000  1.152000       1.915000  
1 1 1 9  39 52 o 8.010000 1.012000  8.150000 1.695000  7.871000 1.107000  0.2795000      2.024000  
1 1 1 9  40 1  o 20.94000 0.3191000 21.73000 0.4639000 20.15000 0.4383000 1.581000       0.6381000 
1 1 1 9  40 3  o 11.23000 0.4831000 11.35000 0.6867000 11.10000 0.6798000 0.2518000      0.9662000 
1 1 1 9  40 5  o 14.10000 0.4173000 14.97000 0.5949000 13.24000 0.5855000 1.730000       0.8346000 
1 1 1 9  40 7  o 17.67000 0.3415000 17.72000 0.4547000 17.62000 0.5095000 0.9729000E-01  0.6829000 
1 1 1 9  40 9  o 25.59000 0.3738000 25.21000 0.5763000 25.97000 0.4762000 -0.7535000     0.7476000 
1 1 1 9  40 11 f 5.110000 0.8516000 4.078000 1.339000  6.142000 1.052000  -2.063000      1.703000  
1 1 1 9  40 13 o 10.09000 0.5290000 10.24000 0.7951000 9.936000 0.6981000 0.3013000      1.058000  
1 1 1 9  40 15 o 14.11000 0.4402000 14.43000 0.6541000 13.78000 0.5894000 0.6456000      0.8804000 
1 1 1 9  40 17 o 8.219000 0.7733000 7.897000 0.8897000 8.540000 1.265000  -0.6433000     1.547000  
1 1 1 9  40 19 o 19.93000 0.3452000 20.13000 0.4738000 19.74000 0.5021000 0.3941000      0.6904000 
1 1 1 9  40 21 o 21.90000 0.3263000 21.34000 0.4364000 22.47000 0.4853000 -1.134000      0.6526000 
1 1 1 9  40 23 o 21.78000 0.3967000 21.44000 0.5700000 22.13000 0.5519000 -0.6983000     0.7935000 
1 1 1 9  40 25 o 19.57000 0.4115000 19.72000 0.4417000 19.43000 0.6945000 0.2947000      0.8231000 
1 1 1 9  40 27 o 22.27000 0.3181000 22.18000 0.4109000 22.37000 0.4858000 -0.1890000     0.6363000 
1 1 1 9  40 29 o 8.288000 0.5018000 7.247000 0.6818000 9.328000 0.7363000 -2.081000      1.004000  
1 1 1 9  40 31 o 15.90000 0.3381000 15.46000 0.4813000 16.33000 0.4749000 -0.8753000     0.6762000 
1 1 1 9  40 33 o 11.86000 0.3974000 11.60000 0.5519000 12.13000 0.5721000 -0.5315000     0.7949000 
1 1 1 9  40 35 o 8.438000 0.5119000 8.830000 0.6684000 8.045000 0.7754000 0.7850000      1.024000  
1 1 1 9  40 37 o 13.05000 0.4474000 12.66000 0.6234000 13.43000 0.6419000 -0.7735000     0.8949000 
1 1 1 9  40 39 o 8.272000 0.5880000 8.102000 0.8249000 8.442000 0.8383000 -0.3404000     1.176000  
1 1 1 9  40 41 o 7.433000 0.8369000 6.989000 1.342000  7.876000 1.000000  -0.8876000     1.674000  
1 1 1 9  40 43 o 4.860000 0.8943000 5.154000 1.184000  4.566000 1.341000  0.5875000      1.789000  
1 1 1 9  40 45 o 10.07000 0.5748000 9.089000 0.9631000 11.05000 0.6276000 -1.965000      1.150000  
1 1 1 9  40 47 o 8.768000 0.6234000 8.609000 0.9254000 8.926000 0.8356000 -0.3171000     1.247000  
1 1 1 9  40 49 o 7.833000 0.6709000 8.059000 0.9591000 7.607000 0.9384000 0.4521000      1.342000  
1 1 1 9  40 51 o 10.18000 0.7983000 8.711000 0.8918000 11.65000 1.324000  -2.935000      1.597000  
1 1 1 9  41 0  o 44.56000 0.5102000 44.56000 0.5102000 44.56000 0.5102000 0.000000       0.000000  
1 1 1 9  41 2  o 31.86000 0.3085000 31.49000 0.4330000 32.22000 0.4395000 -0.7265000     0.6169000 
1 1 1 9  41 4  o 27.10000 0.3238000 27.12000 0.4374000 27.08000 0.4776000 0.3702000E-01  0.6476000 
1 1 1 9  41 6  o 16.64000 0.3450000 16.29000 0.4684000 16.98000 0.5067000 -0.6908000     0.6900000 
1 1 1 9  41 8  o 9.332000 0.4874000 8.539000 0.6893000 10.13000 0.6893000 -1.586000      0.9748000 
1 1 1 9  41 10 o 10.55000 0.4698000 9.980000 0.6239000 11.13000 0.7024000 -1.146000      0.9395000 
1 1 1 9  41 12 o 16.28000 0.3359000 16.59000 0.4474000 15.98000 0.5012000 0.6066000      0.6719000 
1 1 1 9  41 14 o 5.927000 0.9955000 5.637000 1.209000  6.218000 1.582000  -0.5811000     1.991000  
1 1 1 9  41 16 o 13.54000 0.4125000 13.64000 0.5760000 13.43000 0.5906000 0.2165000      0.8250000 
1 1 1 9  41 18 o 16.09000 0.3371000 16.37000 0.4283000 15.81000 0.5208000 0.5645000      0.6743000 
1 1 1 9  41 20 o 20.32000 0.3281000 20.60000 0.4288000 20.04000 0.4967000 0.5628000      0.6562000 
1 1 1 9  41 22 o 17.02000 0.3537000 16.59000 0.4251000 17.45000 0.5656000 -0.8650000     0.7075000 
1 1 1 9  41 24 o 5.229000 0.9729000 6.390000 1.229000  4.068000 1.508000  2.322000       1.946000  
1 1 1 9  41 26 o 24.24000 0.3052000 24.12000 0.3753000 24.36000 0.4815000 -0.2383000     0.6104000 
1 1 1 9  41 28 o 16.53000 0.3837000 16.57000 0.4296000 16.48000 0.6360000 0.9303000E-01  0.7675000 
1 1 1 9  41 30 o 15.89000 0.3357000 15.90000 0.4359000 15.87000 0.5107000 0.3353000E-01  0.6714000 
1 1 1 9  41 32 o 8.851000 0.4783000 8.682000 0.6682000 9.020000 0.6845000 -0.3376000     0.9566000 
1 1 1 9  41 34 o 4.444000 0.9158000 4.042000 1.415000  4.845000 1.163000  -0.8033000     1.832000  
1 1 1 9  41 36 o 3.317000 0.9047000 2.956000 1.170000  3.677000 1.381000  -0.7205000     1.809000  
1 1 1 9  41 38 o 6.175000 0.7306000 6.013000 1.021000  6.337000 1.045000  -0.3248000     1.461000  
1 1 1 9  41 40 o 6.709000 0.9244000 7.370000 1.313000  6.049000 1.302000  1.321000       1.849000  
1 1 1 9  41 42 o 11.23000 0.4730000 11.56000 0.5847000 10.90000 0.7436000 0.6638000      0.9459000 
1 1 1 9  41 44 o 3.579000 0.9794000 3.107000 1.263000  4.051000 1.497000  -0.9446000     1.959000  
1 1 1 9  41 46 o 3.065000 0.9019000 2.912000 1.256000  3.217000 1.295000  -0.3054000     1.804000  
1 1 1 9  41 48 o 3.733000 0.9583000 3.715000 1.395000  3.752000 1.314000  -0.3697000E-01 1.917000  
1 1 1 9  41 50 o 3.396000 0.9463000 3.066000 1.293000  3.725000 1.382000  -0.6593000     1.893000  
1 1 1 9  42 1  o 23.26000 0.3060000 22.43000 0.4275000 24.09000 0.4381000 -1.660000      0.6121000 
1 1 1 9  42 3  o 19.11000 0.3536000 18.47000 0.4789000 19.75000 0.5205000 -1.277000      0.7073000 
1 1 1 9  42 5  o 14.96000 0.3763000 14.84000 0.4961000 15.08000 0.5659000 -0.2382000     0.7526000 
1 1 1 9  42 7  o 31.71000 0.3566000 31.84000 0.3943000 31.58000 0.5942000 0.2549000      0.7131000 
1 1 1 9  42 9  o 50.59000 0.4267000 49.96000 0.5555000 51.23000 0.6479000 -1.262000      0.8534000 
1 1 1 9  42 11 o 24.75000 0.4948000 24.31000 0.4342000 25.18000 0.8892000 -0.8658000     0.9896000 
1 1 1 9  42 13 o 18.67000 0.3230000 18.94000 0.4231000 18.39000 0.4881000 0.5416000      0.6460000 
1 1 1 9  42 15 o 38.89000 0.3641000 38.41000 0.4781000 39.38000 0.5492000 -0.9680000     0.7281000 
1 1 1 9  42 17 o 23.13000 0.3074000 23.36000 0.3799000 22.90000 0.4835000 0.4586000      0.6149000 
1 1 1 9  42 19 o 5.334000 0.8573000 6.167000 0.9259000 4.500000 1.443000  1.666000       1.715000  
1 1 1 9  42 21 o 3.404000 0.9083000 3.235000 1.171000  3.573000 1.389000  -0.3382000     1.817000  
1 1 1 9  42 23 o 9.845000 0.5148000 9.684000 0.6445000 10.01000 0.8028000 -0.3220000     1.030000  
1 1 1 9  42 25 o 21.87000 0.3336000 21.74000 0.4463000 22.00000 0.4959000 -0.2605000     0.6672000 
1 1 1 9  42 27 o 23.67000 0.3239000 23.90000 0.4087000 23.44000 0.5025000 0.4603000      0.6477000 
1 1 1 9  42 29 o 3.939000 0.8705000 4.518000 1.095000  3.361000 1.354000  1.157000       1.741000  
1 1 1 9  42 31 o 2.805000 0.8130000 2.991000 1.171000  2.620000 1.129000  0.3710000      1.626000  
1 1 1 9  42 33 o 8.320000 0.6000000 8.647000 0.8667000 7.992000 0.8298000 0.6552000      1.200000  
1 1 1 9  42 35 o 3.866000 0.8995000 3.995000 1.261000  3.737000 1.283000  0.2583000      1.799000  
1 1 1 9  42 37 o 4.848000 0.9028000 5.237000 1.209000  4.458000 1.341000  0.7785000      1.806000  
1 1 1 9  42 39 o 8.243000 0.6719000 8.219000 0.9208000 8.267000 0.9787000 -0.4826000E-01 1.344000  
1 1 1 9  42 41 o 5.067000 0.9814000 5.347000 1.371000  4.786000 1.404000  0.5608000      1.963000  
1 1 1 9  42 43 o 9.681000 0.5955000 10.12000 0.6949000 9.246000 0.9674000 0.8716000      1.191000  
1 1 1 9  42 45 o 5.262000 0.9133000 4.242000 1.364000  6.282000 1.215000  -2.039000      1.827000  
1 1 1 9  42 47 o 3.951000 0.9334000 3.521000 1.314000  4.382000 1.326000  -0.8606000     1.867000  
1 1 1 9  42 49 o 3.538000 0.9210000 3.383000 1.269000  3.694000 1.336000  -0.3110000     1.842000  
1 1 1 9  43 0  o 18.33000 0.4987000 18.33000 0.4987000 18.33000 0.4987000 0.000000       0.000000  
1 1 1 9  43 2  o 12.17000 0.5261000 11.51000 0.8461000 12.82000 0.6255000 -1.316000      1.052000  
1 1 1 9  43 4  o 10.98000 0.4692000 11.30000 0.5746000 10.67000 0.7418000 0.6258000      0.9383000 
1 1 1 9  43 6  o 31.54000 0.3319000 31.78000 0.4349000 31.31000 0.5014000 0.4681000      0.6637000 
1 1 1 9  43 8  o 24.34000 0.5173000 23.59000 0.5070000 25.09000 0.9018000 -1.495000      1.035000  
1 1 1 9  43 10 o 17.46000 0.3344000 17.50000 0.4178000 17.41000 0.5223000 0.9621000E-01  0.6688000 
1 1 1 9  43 12 o 28.46000 0.3109000 28.75000 0.3900000 28.17000 0.4842000 0.5873000      0.6217000 
1 1 1 9  43 14 o 32.31000 0.3509000 32.46000 0.3991000 32.15000 0.5772000 0.3020000      0.7018000 
1 1 1 9  43 16 o 8.151000 0.5683000 8.016000 0.7018000 8.287000 0.8941000 -0.2710000     1.137000  
1 1 1 9  43 18 o 5.543000 0.8040000 5.132000 1.047000  5.954000 1.220000  -0.8216000     1.608000  
1 1 1 9  43 20 o 3.278000 0.8670000 2.687000 1.104000  3.869000 1.337000  -1.182000      1.734000  
1 1 1 9  43 22 f 15.45000 0.3798000 16.05000 0.4542000 14.86000 0.6088000 1.183000       0.7595000 
1 1 1 9  43 24 o 11.80000 0.3969000 11.04000 0.5199000 12.55000 0.5999000 -1.510000      0.7938000 
1 1 1 9  43 26 o 6.608000 0.7304000 7.107000 0.8970000 6.109000 1.153000  0.9982000      1.461000  
1 1 1 9  43 28 o 15.44000 0.3513000 14.73000 0.4419000 16.14000 0.5463000 -1.409000      0.7026000 
1 1 1 9  43 30 o 8.562000 0.5077000 7.771000 0.7122000 9.354000 0.7239000 -1.582000      1.015000  
1 1 1 9  43 32 o 14.38000 0.3683000 13.89000 0.5553000 14.88000 0.4841000 -0.9874000     0.7367000 
1 1 1 9  43 34 f 10.89000 0.4442000 11.49000 0.6044000 10.28000 0.6511000 1.207000       0.8883000 
1 1 1 9  43 36 o 5.421000 0.9202000 5.894000 1.201000  4.948000 1.394000  0.9457000      1.840000  
1 1 1 9  43 38 o 4.906000 0.9681000 4.913000 1.289000  4.900000 1.445000  0.1342000E-01  1.936000  
1 1 1 9  43 40 o 3.578000 0.9873000 3.714000 1.429000  3.441000 1.363000  0.2731000      1.975000  
1 1 1 9  43 42 f 4.221000 0.9797000 4.216000 1.263000  4.225000 1.498000  -0.9048000E-02 1.959000  
1 1 1 9  43 44 o 6.145000 0.8914000 5.112000 1.475000  7.177000 1.001000  -2.065000      1.783000  
1 1 1 9  43 46 o 5.992000 0.8669000 6.208000 1.252000  5.777000 1.199000  0.4307000      1.734000  
1 1 1 9  43 48 o 7.278000 0.6578000 6.758000 1.020000  7.798000 0.8311000 -1.040000      1.316000  
1 1 1 9  44 1  o 7.737000 0.6818000 7.495000 1.106000  7.979000 0.7980000 -0.4834000     1.364000  
1 1 1 9  44 3  o 2.722000 0.8413000 2.342000 1.088000  3.101000 1.284000  -0.7592000     1.683000  
1 1 1 9  44 5  o 10.25000 0.4828000 10.92000 0.6547000 9.579000 0.7097000 1.342000       0.9655000 
1 1 1 9  44 7  o 5.281000 0.9226000 6.331000 1.059000  4.230000 1.511000  2.101000       1.845000  
1 1 1 9  44 9  o 17.25000 0.3601000 17.73000 0.4088000 16.77000 0.5929000 0.9596000      0.7202000 
1 1 1 9  44 11 o 21.50000 0.3306000 21.40000 0.3937000 21.60000 0.5312000 -0.1998000     0.6612000 
1 1 1 9  44 13 o 13.19000 0.3866000 13.57000 0.4920000 12.82000 0.5966000 0.7494000      0.7733000 
1 1 1 9  44 15 o 3.617000 0.9049000 3.574000 1.242000  3.660000 1.317000  -0.8571000E-01 1.810000  
1 1 1 9  44 17 o 11.75000 0.3919000 11.97000 0.5010000 11.53000 0.6029000 0.4443000      0.7839000 
1 1 1 9  44 19 o 10.58000 0.4177000 10.90000 0.5232000 10.25000 0.6512000 0.6534000      0.8353000 
1 1 1 9  44 21 o 10.88000 0.4492000 10.47000 0.5311000 11.28000 0.7246000 -0.8150000     0.8985000 
1 1 1 9  44 23 o 5.915000 0.6892000 5.255000 0.9527000 6.575000 0.9962000 -1.320000      1.378000  
1 1 1 9  44 25 f 7.067000 0.6302000 6.874000 0.8550000 7.261000 0.9259000 -0.3862000     1.260000  
1 1 1 9  44 27 o 12.45000 0.4036000 12.47000 0.5119000 12.42000 0.6240000 0.5344000E-01  0.8071000 
1 1 1 9  44 29 o 10.85000 0.4533000 11.08000 0.5450000 10.61000 0.7245000 0.4717000      0.9066000 
1 1 1 9  44 31 o 15.83000 0.3378000 15.86000 0.4687000 15.79000 0.4867000 0.7311000E-01  0.6757000 
1 1 1 9  44 33 f 6.304000 0.6751000 6.622000 0.8769000 5.986000 1.027000  0.6363000      1.350000  
1 1 1 9  44 35 o 9.513000 0.5498000 9.982000 0.6234000 9.044000 0.9057000 0.9384000      1.100000  
1 1 1 9  44 37 o 8.564000 0.6372000 8.680000 0.9112000 8.447000 0.8910000 0.2325000      1.274000  
1 1 1 9  44 39 o 5.043000 0.9947000 5.478000 1.181000  4.607000 1.601000  0.8714000      1.989000  
1 1 1 9  44 41 o 5.370000 0.8670000 5.312000 1.023000  5.427000 1.400000  -0.1150000     1.734000  
1 1 1 9  44 43 o 4.505000 1.000000  4.152000 1.474000  4.859000 1.353000  -0.7066000     2.001000  
1 1 1 9  44 45 o 3.110000 0.9222000 3.055000 1.309000  3.164000 1.299000  -0.1084000     1.844000  
1 1 1 9  44 47 o 7.903000 0.7010000 7.914000 0.9027000 7.893000 1.073000  0.2079000E-01  1.402000  
1 1 1 9  45 0  o 12.93000 0.6853000 12.93000 0.6853000 12.93000 0.6853000 0.000000       0.000000  
1 1 1 9  45 2  o 10.85000 0.6017000 11.81000 0.5831000 9.886000 1.053000  1.923000       1.203000  
1 1 1 9  45 4  o 14.18000 0.3788000 14.01000 0.4520000 14.34000 0.6079000 -0.3317000     0.7575000 
1 1 1 9  45 6  o 19.54000 0.3368000 19.53000 0.4453000 19.54000 0.5054000 -0.9993000E-02 0.6736000 
1 1 1 9  45 8  o 20.42000 0.3795000 20.77000 0.3883000 20.07000 0.6522000 0.6957000      0.7591000 
1 1 1 9  45 10 o 10.86000 0.4125000 10.95000 0.5377000 10.78000 0.6257000 0.1758000      0.8250000 
1 1 1 9  45 12 o 8.333000 0.4869000 7.788000 0.6980000 8.878000 0.6790000 -1.090000      0.9737000 
1 1 1 9  45 14 o 9.320000 0.4562000 9.432000 0.6061000 9.207000 0.6820000 0.2251000      0.9124000 
1 1 1 9  45 16 o 19.84000 0.3737000 19.44000 0.3855000 20.24000 0.6404000 -0.7990000     0.7475000 
1 1 1 9  45 18 f 7.477000 0.5997000 7.066000 0.8700000 7.888000 0.8257000 -0.8215000     1.199000  
1 1 1 9  45 20 o 9.299000 0.4653000 9.216000 0.5805000 9.382000 0.7274000 -0.1662000     0.9306000 
1 1 1 9  45 22 o 10.01000 0.4268000 9.820000 0.5567000 10.20000 0.6471000 -0.3773000     0.8537000 
1 1 1 9  45 24 o 10.69000 0.4374000 10.73000 0.5657000 10.65000 0.6672000 0.7806000E-01  0.8747000 
1 1 1 9  45 26 o 5.718000 0.7673000 6.472000 0.8018000 4.965000 1.308000  1.507000       1.535000  
1 1 1 9  45 28 o 4.501000 0.9256000 4.937000 1.152000  4.064000 1.449000  0.8734000      1.851000  
1 1 1 9  45 30 f 16.68000 0.3389000 16.93000 0.4730000 16.43000 0.4855000 0.4960000      0.6779000 
1 1 1 9  45 32 o 11.40000 0.4151000 10.69000 0.5735000 12.10000 0.6002000 -1.414000      0.8301000 
1 1 1 9  45 34 o 10.77000 0.4841000 10.66000 0.7055000 10.88000 0.6631000 -0.2220000     0.9682000 
1 1 1 9  45 36 o 9.414000 0.6529000 9.326000 0.8076000 9.502000 1.026000  -0.1762000     1.306000  
1 1 1 9  45 38 o 3.999000 0.9601000 3.574000 1.310000  4.425000 1.404000  -0.8503000     1.920000  
1 1 1 9  45 40 o 6.788000 0.8003000 6.788000 1.240000  6.787000 1.012000  0.5989000E-03  1.601000  
1 1 1 9  45 42 o 7.709000 0.7076000 7.117000 1.053000  8.302000 0.9455000 -1.186000      1.415000  
1 1 1 9  45 44 f 6.774000 0.7810000 6.702000 0.9418000 6.846000 1.246000  -0.1437000     1.562000  
1 1 1 9  45 46 o 6.448000 1.074000  7.137000 1.330000  5.759000 1.687000  1.378000       2.148000  
1 1 1 9  46 1  o 21.64000 0.4154000 22.30000 0.6401000 20.98000 0.5297000 1.317000       0.8308000 
1 1 1 9  46 3  o 19.52000 0.3064000 19.25000 0.4306000 19.80000 0.4361000 -0.5514000     0.6129000 
1 1 1 9  46 5  o 12.98000 0.4183000 12.98000 0.5622000 12.99000 0.6195000 -0.1264000E-01 0.8366000 
1 1 1 9  46 7  o 9.187000 0.4747000 8.812000 0.6186000 9.562000 0.7202000 -0.7502000     0.9494000 
1 1 1 9  46 9  o 11.26000 0.3914000 11.06000 0.5215000 11.45000 0.5838000 -0.3865000     0.7828000 
1 1 1 9  46 11 o 12.51000 0.3596000 12.73000 0.4597000 12.30000 0.5532000 0.4271000      0.7193000 
1 1 1 9  46 13 o 22.97000 0.3009000 23.01000 0.3693000 22.92000 0.4751000 0.9568000E-01  0.6018000 
1 1 1 9  46 15 f 12.78000 0.3642000 12.63000 0.4895000 12.92000 0.5394000 -0.2877000     0.7284000 
1 1 1 9  46 17 o 5.412000 0.8404000 5.410000 1.084000  5.414000 1.285000  -0.4645000E-02 1.681000  
1 1 1 9  46 19 o 11.55000 0.3888000 11.18000 0.5105000 11.91000 0.5865000 -0.7312000     0.7775000 
1 1 1 9  46 21 o 5.226000 0.7904000 5.350000 0.9937000 5.102000 1.229000  0.2474000      1.581000  
1 1 1 9  46 23 o 5.442000 0.7655000 4.972000 1.049000  5.912000 1.115000  -0.9399000     1.531000  
1 1 1 9  46 25 o 11.11000 0.4274000 11.55000 0.5117000 10.66000 0.6848000 0.8809000      0.8549000 
1 1 1 9  46 27 o 4.627000 0.8706000 4.488000 1.128000  4.765000 1.327000  -0.2767000     1.741000  
1 1 1 9  46 29 o 5.320000 0.8578000 6.387000 1.055000  4.254000 1.353000  2.133000       1.716000  
1 1 1 9  46 31 o 5.157000 0.8129000 5.069000 1.070000  5.244000 1.224000  -0.1747000     1.626000  
1 1 1 9  46 33 o 10.57000 0.4839000 10.26000 0.6921000 10.89000 0.6765000 -0.6359000     0.9678000 
1 1 1 9  46 35 o 5.363000 1.065000  5.797000 1.137000  4.930000 1.801000  0.8669000      2.130000  
1 1 1 9  46 37 o 5.605000 0.9419000 5.637000 1.131000  5.573000 1.506000  0.6418000E-01  1.884000  
1 1 1 9  46 39 o 5.707000 0.9842000 5.019000 1.629000  6.395000 1.105000  -1.376000      1.968000  
1 1 1 9  46 41 o 4.333000 0.8746000 3.193000 1.255000  5.473000 1.219000  -2.280000      1.749000  
1 1 1 9  46 43 f 3.472000 0.9323000 3.345000 1.310000  3.598000 1.326000  -0.2536000     1.865000  
1 1 1 9  46 45 o 5.381000 2.250000  5.381000 2.250000  ?        ?         ?              ?         
1 1 1 9  47 0  o 20.00000 0.4257000 20.00000 0.4257000 20.00000 0.4257000 0.000000       0.000000  
1 1 1 9  47 2  o 27.78000 0.3305000 27.31000 0.4240000 28.26000 0.5071000 -0.9440000     0.6610000 
1 1 1 9  47 4  o 22.17000 0.3639000 22.10000 0.5231000 22.25000 0.5059000 -0.1429000     0.7278000 
1 1 1 9  47 6  o 13.16000 0.3766000 13.28000 0.4778000 13.04000 0.5823000 0.2409000      0.7533000 
1 1 1 9  47 8  o 9.829000 0.4444000 9.641000 0.5752000 10.02000 0.6775000 -0.3775000     0.8888000 
1 1 1 9  47 10 o 11.06000 0.4023000 10.72000 0.5479000 11.39000 0.5893000 -0.6648000     0.8047000 
1 1 1 9  47 12 o 19.46000 0.3051000 19.50000 0.3889000 19.43000 0.4703000 0.7631000E-01  0.6103000 
1 1 1 9  47 14 o 16.45000 0.3262000 16.16000 0.4081000 16.75000 0.5091000 -0.5824000     0.6524000 
1 1 1 9  47 16 o 24.50000 0.3486000 24.17000 0.4206000 24.84000 0.5561000 -0.6689000     0.6972000 
1 1 1 9  47 18 o 6.997000 0.6164000 6.932000 0.8351000 7.062000 0.9068000 -0.1299000     1.233000  
1 1 1 9  47 20 o 3.202000 0.8743000 3.538000 1.263000  2.867000 1.209000  0.6710000      1.749000  
1 1 1 9  47 22 o 7.970000 0.5537000 7.955000 0.6635000 7.985000 0.8866000 -0.3035000E-01 1.107000  
1 1 1 9  47 24 o 11.47000 0.4247000 12.00000 0.4845000 10.94000 0.6978000 1.066000       0.8495000 
1 1 1 9  47 26 o 11.32000 0.4325000 12.21000 0.4939000 10.44000 0.7101000 1.762000       0.8650000 
1 1 1 9  47 28 o 5.424000 0.7895000 5.329000 1.002000  5.519000 1.220000  -0.1902000     1.579000  
1 1 1 9  47 30 o 4.600000 0.8932000 4.094000 1.305000  5.106000 1.220000  -1.012000      1.786000  
1 1 1 9  47 32 o 8.837000 0.5479000 9.141000 0.7632000 8.533000 0.7865000 0.6073000      1.096000  
1 1 1 9  47 34 o 12.82000 0.5999000 12.91000 0.6044000 12.73000 1.036000  0.1831000      1.200000  
1 1 1 9  47 36 o 7.572000 0.7066000 7.231000 0.8634000 7.912000 1.119000  -0.6811000     1.413000  
1 1 1 9  47 38 o 2.914000 0.8456000 3.480000 1.294000  2.349000 1.088000  1.132000       1.691000  
1 1 1 9  47 40 o 3.183000 0.8593000 2.193000 1.056000  4.174000 1.356000  -1.981000      1.719000  
1 1 1 9  47 42 o 4.377000 0.8657000 3.228000 1.249000  5.525000 1.199000  -2.297000      1.731000  
1 1 1 9  48 1  o 21.93000 0.2945000 21.81000 0.4141000 22.05000 0.4188000 -0.2354000     0.5890000 
1 1 1 9  48 3  o 13.88000 0.4135000 14.06000 0.5576000 13.71000 0.6107000 0.3526000      0.8269000 
1 1 1 9  48 5  o 8.724000 0.4961000 8.954000 0.5787000 8.493000 0.8060000 0.4618000      0.9923000 
1 1 1 9  48 7  o 7.833000 0.5707000 7.664000 0.7885000 8.002000 0.8254000 -0.3378000     1.141000  
1 1 1 9  48 9  o 8.518000 0.5322000 7.218000 0.8235000 9.818000 0.6743000 -2.600000      1.064000  
1 1 1 9  48 11 o 8.254000 0.4974000 8.272000 0.6790000 8.235000 0.7270000 0.3741000E-01  0.9948000 
1 1 1 9  48 13 o 6.747000 0.6284000 6.518000 0.8313000 6.975000 0.9426000 -0.4565000     1.257000  
1 1 1 9  48 15 o 7.053000 0.6261000 6.408000 0.9568000 7.699000 0.8079000 -1.291000      1.252000  
1 1 1 9  48 17 o 5.509000 0.7466000 6.606000 0.8031000 4.412000 1.259000  2.194000       1.493000  
1 1 1 9  48 19 o 10.42000 0.4817000 10.94000 0.6732000 9.907000 0.6891000 1.032000       0.9633000 
1 1 1 9  48 21 o 3.947000 0.8967000 3.641000 1.152000  4.253000 1.374000  -0.6125000     1.793000  
1 1 1 9  48 23 o 4.875000 0.7992000 5.947000 0.8283000 3.803000 1.367000  2.144000       1.598000  
1 1 1 9  48 25 o 5.462000 0.8124000 5.874000 0.9018000 5.050000 1.352000  0.8239000      1.625000  
1 1 1 9  48 27 o 4.847000 0.8205000 4.009000 1.136000  5.684000 1.185000  -1.674000      1.641000  
1 1 1 9  48 29 o 6.526000 0.7664000 4.735000 1.333000  8.318000 0.7562000 -3.583000      1.533000  
1 1 1 9  48 31 o 8.557000 0.5349000 8.773000 0.7364000 8.341000 0.7760000 0.4313000      1.070000  
1 1 1 9  48 33 o 4.015000 0.8653000 3.079000 1.280000  4.951000 1.165000  -1.872000      1.731000  
1 1 1 9  48 35 o 4.622000 1.071000  4.356000 1.311000  4.888000 1.694000  -0.5318000     2.142000  
1 1 1 9  48 37 o 3.984000 0.8349000 5.062000 1.139000  2.907000 1.221000  2.156000       1.670000  
1 1 1 9  48 39 o 3.513000 0.9371000 3.043000 1.323000  3.983000 1.327000  -0.9403000     1.874000  
1 1 1 9  48 41 o 4.225000 0.9304000 3.414000 1.299000  5.037000 1.332000  -1.623000      1.861000  
1 1 1 9  49 0  o 3.033000 1.203000  3.033000 1.203000  3.033000 1.203000  0.000000       0.000000  
1 1 1 9  49 2  o 5.685000 0.7827000 5.386000 1.197000  5.983000 1.008000  -0.5967000     1.565000  
1 1 1 9  49 4  o 7.236000 0.7853000 7.541000 0.7445000 6.930000 1.383000  0.6106000      1.571000  
1 1 1 9  49 6  o 2.961000 0.8245000 3.223000 1.152000  2.699000 1.180000  0.5242000      1.649000  
1 1 1 9  49 8  o 5.142000 0.7757000 4.387000 1.123000  5.897000 1.071000  -1.510000      1.551000  
1 1 1 9  49 10 o 8.339000 0.5087000 7.773000 0.6769000 8.905000 0.7597000 -1.132000      1.017000  
1 1 1 9  49 12 o 10.67000 0.5155000 10.58000 0.7326000 10.76000 0.7255000 -0.1870000     1.031000  
1 1 1 9  49 14 o 7.739000 0.5736000 6.984000 0.8763000 8.494000 0.7404000 -1.510000      1.147000  
1 1 1 9  49 16 o 12.84000 0.3739000 12.73000 0.4840000 12.96000 0.5700000 -0.2269000     0.7478000 
1 1 1 9  49 18 o 5.970000 0.7981000 6.565000 1.081000  5.374000 1.174000  1.190000       1.596000  
1 1 1 9  49 20 o 11.66000 0.4097000 11.60000 0.5190000 11.73000 0.6339000 -0.1325000     0.8193000 
1 1 1 9  49 22 o 12.39000 0.4022000 12.02000 0.4728000 12.76000 0.6508000 -0.7436000     0.8045000 
1 1 1 9  49 24 o 5.357000 0.7863000 5.898000 0.7790000 4.817000 1.366000  1.081000       1.573000  
1 1 1 9  49 26 o 14.67000 0.3663000 14.86000 0.4442000 14.48000 0.5825000 0.3853000      0.7326000 
1 1 1 9  49 28 o 10.31000 0.4752000 10.56000 0.5870000 10.05000 0.7475000 0.5157000      0.9504000 
1 1 1 9  49 30 o 8.200000 0.5704000 8.192000 0.8007000 8.207000 0.8126000 -0.1437000E-01 1.141000  
1 1 1 9  49 32 o 7.781000 0.6382000 7.294000 1.015000  8.267000 0.7737000 -0.9732000     1.276000  
1 1 1 9  49 34 o 4.491000 1.052000  3.501000 1.260000  5.481000 1.685000  -1.980000      2.104000  
1 1 1 9  49 36 o 4.614000 0.8762000 5.400000 1.136000  3.828000 1.334000  1.572000       1.752000  
1 1 1 9  49 38 o 3.652000 0.9764000 3.076000 1.215000  4.229000 1.529000  -1.154000      1.953000  
1 1 1 9  49 40 o 5.078000 1.002000  6.032000 1.375000  4.124000 1.459000  1.907000       2.004000  
1 1 1 9  50 1  o 9.929000 0.4544000 10.39000 0.5729000 9.471000 0.7055000 0.9165000      0.9088000 
1 1 1 9  50 3  o 10.13000 0.4332000 9.703000 0.6231000 10.56000 0.6018000 -0.8586000     0.8663000 
1 1 1 9  50 5  o 3.188000 0.8903000 3.342000 1.126000  3.034000 1.379000  0.3074000      1.781000  
1 1 1 9  50 7  o 3.018000 0.8148000 3.461000 1.155000  2.575000 1.150000  0.8861000      1.630000  
1 1 1 9  50 9  o 9.675000 0.4883000 9.332000 0.5763000 10.02000 0.7885000 -0.6855000     0.9767000 
1 1 1 9  50 11 o 7.662000 0.5916000 7.295000 0.7704000 8.029000 0.8980000 -0.7335000     1.183000  
1 1 1 9  50 13 o 9.033000 0.4776000 8.685000 0.6926000 9.380000 0.6577000 -0.6952000     0.9552000 
1 1 1 9  50 15 o 11.49000 0.4392000 11.44000 0.6440000 11.54000 0.5973000 -0.9755000E-01 0.8784000 
1 1 1 9  50 17 f 11.13000 0.4417000 11.24000 0.6287000 11.02000 0.6206000 0.2219000      0.8834000 
1 1 1 9  50 19 o 11.70000 0.4041000 11.14000 0.5268000 12.27000 0.6130000 -1.125000      0.8082000 
1 1 1 9  50 21 o 17.70000 0.3357000 17.51000 0.4102000 17.88000 0.5317000 -0.3706000     0.6715000 
1 1 1 9  50 23 o 13.00000 0.3885000 13.38000 0.4462000 12.62000 0.6362000 0.7640000      0.7771000 
1 1 1 9  50 25 o 6.970000 0.6406000 6.963000 0.7392000 6.977000 1.046000  -0.1329000E-01 1.281000  
1 1 1 9  50 27 o 2.817000 0.8723000 2.445000 1.120000  3.188000 1.337000  -0.7431000     1.745000  
1 1 1 9  50 29 o 3.298000 0.8567000 3.558000 1.183000  3.038000 1.240000  0.5202000      1.713000  
1 1 1 9  50 31 o 4.336000 0.9619000 4.437000 1.389000  4.235000 1.331000  0.2017000      1.924000  
1 1 1 9  50 33 o 8.221000 0.7453000 7.776000 0.8655000 8.666000 1.214000  -0.8902000     1.491000  
1 1 1 9  50 35 o 3.497000 0.9875000 3.375000 1.244000  3.619000 1.534000  -0.2436000     1.975000  
1 1 1 9  50 37 o 9.337000 0.5699000 9.681000 0.6832000 8.993000 0.9125000 0.6878000      1.140000  
1 1 1 9  50 39 o 4.564000 1.109000  5.462000 1.684000  3.667000 1.444000  1.795000       2.218000  
1 1 1 9  51 0  o 2.774000 1.156000  2.774000 1.156000  2.774000 1.156000  0.000000       0.000000  
1 1 1 9  51 2  o 4.299000 0.8751000 5.137000 1.112000  3.462000 1.351000  1.675000       1.750000  
1 1 1 9  51 4  o 7.717000 0.5131000 7.582000 0.7337000 7.851000 0.7174000 -0.2689000     1.026000  
1 1 1 9  51 6  o 10.32000 0.5723000 11.88000 0.4733000 8.766000 1.042000  3.114000       1.145000  
1 1 1 9  51 8  o 4.694000 1.113000  3.313000 1.148000  6.075000 1.907000  -2.762000      2.226000  
1 1 1 9  51 10 o 3.268000 0.7704000 4.336000 1.142000  2.200000 1.034000  2.136000       1.541000  
1 1 1 9  51 12 o 11.76000 0.4151000 11.18000 0.6032000 12.35000 0.5705000 -1.165000      0.8302000 
1 1 1 9  51 14 o 6.543000 0.6442000 7.327000 0.7771000 5.758000 1.028000  1.568000       1.288000  
1 1 1 9  51 16 o 19.77000 0.3325000 19.64000 0.4488000 19.91000 0.4908000 -0.2672000     0.6650000 
1 1 1 9  51 18 o 9.001000 0.4865000 8.738000 0.6344000 9.263000 0.7377000 -0.5251000     0.9730000 
1 1 1 9  51 20 o 9.944000 0.4665000 9.712000 0.6478000 10.18000 0.6715000 -0.4647000     0.9331000 
1 1 1 9  51 22 o 3.912000 0.9149000 3.061000 1.230000  4.763000 1.355000  -1.702000      1.830000  
1 1 1 9  51 24 o 5.613000 0.8145000 4.903000 1.121000  6.322000 1.182000  -1.419000      1.629000  
1 1 1 9  51 26 o 3.506000 0.9617000 3.535000 1.288000  3.477000 1.429000  0.5830000E-01  1.923000  
1 1 1 9  51 28 o 8.825000 0.6061000 8.073000 0.7706000 9.578000 0.9358000 -1.505000      1.212000  
1 1 1 9  51 30 o 3.408000 0.9296000 2.937000 1.189000  3.880000 1.430000  -0.9428000     1.859000  
1 1 1 9  51 32 o 5.542000 0.9711000 6.359000 0.9672000 4.724000 1.684000  1.635000       1.942000  
1 1 1 9  51 34 o 8.852000 0.6999000 8.719000 0.8589000 8.984000 1.105000  -0.2644000     1.400000  
1 1 1 9  51 36 o 10.84000 0.5217000 9.713000 0.7381000 11.97000 0.7375000 -2.257000      1.043000  
1 1 1 9  51 38 o 4.632000 1.286000  4.504000 1.700000  4.761000 1.931000  -0.2567000     2.573000  
1 1 1 9  52 1  o 4.667000 0.8333000 4.303000 1.211000  5.032000 1.145000  -0.7291000     1.667000  
1 1 1 9  52 3  o 10.86000 0.4359000 11.29000 0.5416000 10.42000 0.6832000 0.8732000      0.8718000 
1 1 1 9  52 5  o 5.873000 0.7659000 5.395000 0.9257000 6.350000 1.221000  -0.9553000     1.532000  
1 1 1 9  52 7  o 2.876000 0.8287000 2.941000 1.131000  2.811000 1.211000  0.1297000      1.657000  
1 1 1 9  52 9  o 8.676000 0.6360000 9.152000 0.6060000 8.200000 1.118000  0.9523000      1.272000  
1 1 1 9  52 11 o 3.912000 0.9362000 3.965000 1.361000  3.859000 1.286000  0.1054000      1.872000  
1 1 1 9  52 13 f 2.940000 0.8279000 2.876000 1.160000  3.004000 1.182000  -0.1279000     1.656000  
1 1 1 9  52 15 o 5.770000 0.7500000 5.662000 1.088000  5.879000 1.032000  -0.2162000     1.500000  
1 1 1 9  52 17 o 5.892000 0.7210000 6.178000 0.8872000 5.606000 1.137000  0.5725000      1.442000  
1 1 1 9  52 19 o 5.986000 0.7151000 5.045000 1.034000  6.927000 0.9876000 -1.882000      1.430000  
1 1 1 9  52 21 o 4.709000 0.8909000 4.362000 1.151000  5.056000 1.360000  -0.6933000     1.782000  
1 1 1 9  52 23 o 3.364000 0.9016000 2.603000 1.111000  4.124000 1.421000  -1.521000      1.803000  
1 1 1 9  52 25 o 12.15000 0.4633000 12.27000 0.6245000 12.04000 0.6845000 0.2331000      0.9266000 
1 1 1 9  52 27 o 10.45000 0.8523000 10.14000 0.7274000 10.75000 1.542000  -0.6133000     1.705000  
1 1 1 9  52 29 o 7.401000 0.7341000 7.153000 0.9640000 7.648000 1.107000  -0.4949000     1.468000  
1 1 1 9  52 31 o 3.004000 0.8599000 3.564000 1.272000  2.445000 1.158000  1.118000       1.720000  
1 1 1 9  52 33 o 3.001000 0.9069000 3.250000 1.262000  2.751000 1.302000  0.4985000      1.814000  
1 1 1 9  52 35 o 4.677000 1.016000  5.082000 1.398000  4.271000 1.476000  0.8111000      2.033000  
1 1 1 9  53 0  o 6.271000 0.8667000 6.271000 0.8667000 6.271000 0.8667000 0.000000       0.000000  
1 1 1 9  53 2  o 3.535000 0.8453000 2.560000 1.132000  4.510000 1.256000  -1.951000      1.691000  
1 1 1 9  53 4  o 8.682000 0.5090000 8.610000 0.6571000 8.754000 0.7774000 -0.1435000     1.018000  
1 1 1 9  53 6  o 11.41000 0.3971000 11.22000 0.4873000 11.60000 0.6271000 -0.3816000     0.7942000 
1 1 1 9  53 8  o 8.033000 0.5286000 7.986000 0.7084000 8.079000 0.7848000 -0.9278000E-01 1.057000  
1 1 1 9  53 10 o 7.569000 0.8036000 7.976000 0.8593000 7.162000 1.358000  0.8139000      1.607000  
1 1 1 9  53 12 o 10.36000 0.4482000 10.40000 0.5840000 10.33000 0.6801000 0.7248000E-01  0.8964000 
1 1 1 9  53 14 f 4.703000 0.8271000 4.821000 1.126000  4.585000 1.212000  0.2368000      1.654000  
1 1 1 9  53 16 o 6.875000 0.5840000 6.903000 0.7664000 6.848000 0.8815000 0.5447000E-01  1.168000  
1 1 1 9  53 18 o 4.710000 0.7606000 6.478000 0.8755000 2.942000 1.244000  3.536000       1.521000  
1 1 1 9  53 20 o 6.216000 0.7105000 4.901000 1.090000  7.532000 0.9113000 -2.631000      1.421000  
1 1 1 9  53 22 o 7.679000 0.6226000 6.667000 0.7809000 8.690000 0.9699000 -2.023000      1.245000  
1 1 1 9  53 24 o 4.138000 0.9804000 4.804000 1.267000  3.472000 1.496000  1.331000       1.961000  
1 1 1 9  53 26 o 5.675000 1.170000  5.181000 1.054000  6.169000 2.090000  -0.9881000     2.340000  
1 1 1 9  53 28 f 5.427000 0.9735000 5.488000 1.272000  5.367000 1.474000  0.1212000      1.947000  
1 1 1 9  53 30 o 7.078000 0.7980000 7.194000 0.9709000 6.962000 1.267000  0.2313000      1.596000  
1 1 1 9  53 32 o 3.785000 1.048000  4.239000 1.549000  3.331000 1.413000  0.9079000      2.096000  
1 1 1 9  53 34 f 3.360000 0.9664000 3.832000 1.463000  2.888000 1.263000  0.9443000      1.933000  
1 1 1 9  54 1  o 6.856000 0.6995000 7.252000 0.9864000 6.460000 0.9920000 0.7921000      1.399000  
1 1 1 9  54 3  o 4.041000 0.9127000 4.556000 1.340000  3.525000 1.240000  1.030000       1.825000  
1 1 1 9  54 5  o 9.925000 0.4606000 9.447000 0.6077000 10.40000 0.6923000 -0.9569000     0.9212000 
1 1 1 9  54 7  o 6.727000 0.6594000 6.201000 0.9834000 7.252000 0.8786000 -1.051000      1.319000  
1 1 1 9  54 9  o 2.746000 0.8325000 2.572000 1.142000  2.921000 1.212000  -0.3492000     1.665000  
1 1 1 9  54 11 o 4.025000 1.001000  3.760000 1.230000  4.289000 1.581000  -0.5291000     2.003000  
1 1 1 9  54 13 o 4.967000 1.009000  4.192000 1.272000  5.743000 1.567000  -1.551000      2.018000  
1 1 1 9  54 15 o 5.151000 0.7756000 4.715000 1.070000  5.587000 1.123000  -0.8715000     1.551000  
1 1 1 9  54 17 o 3.330000 0.8656000 3.084000 1.140000  3.576000 1.303000  -0.4918000     1.731000  
1 1 1 9  54 19 o 4.583000 0.9270000 5.132000 1.226000  4.034000 1.391000  1.098000       1.854000  
1 1 1 9  54 21 o 7.981000 0.8107000 8.363000 0.7526000 7.599000 1.436000  0.7639000      1.621000  
1 1 1 9  54 23 o 3.982000 1.021000  2.767000 1.181000  5.196000 1.666000  -2.428000      2.042000  
1 1 1 9  54 25 o 3.545000 1.034000  3.488000 1.213000  3.602000 1.675000  -0.1133000     2.069000  
1 1 1 9  54 27 o 5.580000 1.033000  4.576000 1.376000  6.583000 1.542000  -2.007000      2.066000  
1 1 1 9  54 29 f 4.594000 1.104000  4.371000 1.417000  4.817000 1.693000  -0.4461000     2.208000  
1 1 1 9  54 31 o 2.679000 0.8617000 2.768000 1.231000  2.589000 1.206000  0.1783000      1.723000  
1 1 1 9  54 33 o 4.046000 1.734000  4.046000 1.734000  ?        ?         ?              ?         
1 1 1 9  55 0  o 8.244000 0.7924000 8.244000 0.7924000 8.244000 0.7924000 0.000000       0.000000  
1 1 1 9  55 2  o 2.999000 0.8429000 3.478000 1.300000  2.519000 1.074000  0.9587000      1.686000  
1 1 1 9  55 4  o 11.93000 0.4326000 12.21000 0.6486000 11.66000 0.5727000 0.5545000      0.8652000 
1 1 1 9  55 6  o 13.12000 0.4685000 13.86000 0.6520000 12.37000 0.6729000 1.483000       0.9369000 
1 1 1 9  55 8  o 11.76000 0.5059000 11.40000 0.8037000 12.11000 0.6145000 -0.7158000     1.012000  
1 1 1 9  55 10 o 10.89000 0.4514000 10.71000 0.6173000 11.08000 0.6588000 -0.3738000     0.9029000 
1 1 1 9  55 12 o 9.581000 0.5628000 8.998000 0.8465000 10.16000 0.7418000 -1.166000      1.126000  
1 1 1 9  55 14 o 4.777000 0.9230000 5.660000 1.085000  3.893000 1.493000  1.767000       1.846000  
1 1 1 9  55 16 o 4.228000 1.053000  3.465000 1.284000  4.991000 1.669000  -1.526000      2.106000  
1 1 1 9  55 18 o 2.556000 0.7784000 1.990000 0.9492000 3.122000 1.234000  -1.132000      1.557000  
1 1 1 9  55 20 o 3.278000 0.9366000 3.140000 1.195000  3.415000 1.442000  -0.2756000     1.873000  
1 1 1 9  55 22 o 7.568000 0.7826000 9.894000 0.6212000 5.243000 1.437000  4.651000       1.565000  
1 1 1 9  55 24 o 7.950000 0.8017000 7.680000 0.8728000 8.220000 1.345000  -0.5400000     1.603000  
1 1 1 9  55 26 o 3.617000 1.082000  3.133000 1.396000  4.102000 1.653000  -0.9686000     2.164000  
1 1 1 9  55 28 o 3.426000 0.9750000 3.162000 1.333000  3.690000 1.423000  -0.5281000     1.950000  
1 1 1 9  55 30 o 6.155000 0.9314000 6.432000 1.211000  5.879000 1.415000  0.5537000      1.863000  
1 1 1 9  56 1  o 7.442000 0.6322000 7.725000 0.9689000 7.160000 0.8122000 0.5652000      1.264000  
1 1 1 9  56 3  o 14.98000 0.3784000 15.41000 0.5585000 14.55000 0.5107000 0.8565000      0.7568000 
1 1 1 9  56 5  o 4.934000 0.8466000 4.587000 1.249000  5.280000 1.144000  -0.6925000     1.693000  
1 1 1 9  56 7  o 4.621000 0.9131000 3.855000 1.378000  5.387000 1.198000  -1.531000      1.826000  
1 1 1 9  56 9  o 7.250000 0.5921000 7.629000 0.7263000 6.871000 0.9353000 0.7574000      1.184000  
1 1 1 9  56 11 o 10.75000 0.4848000 9.932000 0.7252000 11.57000 0.6436000 -1.640000      0.9696000 
1 1 1 9  56 13 o 4.500000 0.8471000 5.395000 0.9851000 3.605000 1.378000  1.790000       1.694000  
1 1 1 9  56 15 o 11.18000 0.6060000 11.37000 0.5899000 10.99000 1.059000  0.3871000      1.212000  
1 1 1 9  56 17 o 7.089000 0.7736000 7.570000 0.7604000 6.608000 1.348000  0.9624000      1.547000  
1 1 1 9  56 19 o 7.391000 0.8004000 7.808000 0.7037000 6.974000 1.438000  0.8344000      1.601000  
1 1 1 9  56 21 o 3.482000 0.9797000 3.615000 1.175000  3.349000 1.568000  0.2654000      1.959000  
1 1 1 9  56 23 o 2.914000 0.9304000 2.522000 1.118000  3.307000 1.488000  -0.7847000     1.861000  
1 1 1 9  56 25 o 3.802000 1.169000  3.200000 1.412000  4.404000 1.864000  -1.205000      2.338000  
1 1 1 9  56 27 f 5.051000 0.9784000 6.012000 1.193000  4.090000 1.551000  1.922000       1.957000  
1 1 1 9  57 0  o 16.73000 0.5697000 16.73000 0.5697000 16.73000 0.5697000 0.000000       0.000000  
1 1 1 9  57 2  o 9.631000 0.4901000 8.856000 0.7190000 10.41000 0.6661000 -1.550000      0.9801000 
1 1 1 9  57 4  o 3.114000 0.8772000 3.023000 1.218000  3.204000 1.262000  -0.1808000     1.754000  
1 1 1 9  57 6  o 5.012000 0.8665000 5.772000 1.218000  4.252000 1.232000  1.521000       1.733000  
1 1 1 9  57 8  o 8.545000 0.5637000 8.339000 0.7489000 8.752000 0.8428000 -0.4126000     1.127000  
1 1 1 9  57 10 o 2.863000 0.8499000 3.355000 1.284000  2.370000 1.114000  0.9849000      1.700000  
1 1 1 9  57 12 o 3.848000 0.9140000 3.102000 1.269000  4.594000 1.316000  -1.492000      1.828000  
1 1 1 9  57 14 o 3.849000 0.8874000 4.155000 1.216000  3.542000 1.293000  0.6122000      1.775000  
1 1 1 9  57 16 o 11.18000 0.4609000 11.53000 0.5366000 10.84000 0.7495000 0.6906000      0.9218000 
1 1 1 9  57 18 o 13.39000 0.5552000 14.83000 0.4718000 11.96000 1.005000  2.874000       1.110000  
1 1 1 9  57 20 f 9.553000 0.6217000 9.553000 0.6217000 ?        ?         ?              ?         
1 1 1 9  57 22 o 3.104000 0.9976000 2.838000 1.209000  3.370000 1.587000  -0.5318000     1.995000  
1 1 1 9  57 24 o 5.790000 1.152000  6.609000 1.210000  4.972000 1.961000  1.637000       2.304000  
1 1 1 9  57 26 o 4.391000 1.159000  4.081000 1.537000  4.701000 1.734000  -0.6203000     2.317000  
1 1 1 9  58 1  o 5.042000 0.8773000 5.202000 1.206000  4.882000 1.274000  0.3199000      1.755000  
1 1 1 9  58 3  o 4.627000 0.8542000 4.141000 1.311000  5.113000 1.096000  -0.9713000     1.708000  
1 1 1 9  58 5  o 6.738000 0.7640000 5.825000 1.250000  7.650000 0.8781000 -1.824000      1.528000  
1 1 1 9  58 7  o 13.08000 0.4020000 12.87000 0.5557000 13.30000 0.5810000 -0.4230000     0.8040000 
1 1 1 9  58 9  o 3.311000 0.9495000 3.232000 1.328000  3.390000 1.358000  -0.1581000     1.899000  
1 1 1 9  58 11 o 5.447000 0.8842000 5.125000 1.166000  5.768000 1.329000  -0.6426000     1.768000  
1 1 1 9  58 13 o 3.637000 0.9372000 3.494000 1.219000  3.779000 1.424000  -0.2851000     1.874000  
1 1 1 9  58 15 o 3.620000 0.9483000 2.883000 1.163000  4.357000 1.498000  -1.474000      1.897000  
1 1 1 9  58 17 f 3.602000 1.203000  3.602000 1.203000  ?        ?         ?              ?         
1 1 1 9  58 19 o 6.025000 1.181000  4.905000 1.075000  7.145000 2.102000  -2.240000      2.361000  
1 1 1 9  58 21 o 6.059000 1.031000  5.960000 1.138000  6.158000 1.719000  -0.1982000     2.061000  
1 1 1 9  58 23 o 5.626000 1.070000  6.211000 1.213000  5.041000 1.764000  1.169000       2.140000  
1 1 1 9  59 0  o 4.025000 1.220000  4.025000 1.220000  4.025000 1.220000  0.000000       0.000000  
1 1 1 9  59 2  o 2.958000 0.8408000 3.342000 1.257000  2.574000 1.117000  0.7680000      1.682000  
1 1 1 9  59 4  o 6.569000 0.7810000 6.882000 1.099000  6.257000 1.110000  0.6254000      1.562000  
1 1 1 9  59 6  o 6.003000 0.7721000 6.056000 1.200000  5.949000 0.9716000 0.1069000      1.544000  
1 1 1 9  59 8  o 3.709000 0.9237000 3.301000 1.299000  4.117000 1.314000  -0.8165000     1.847000  
1 1 1 9  59 10 o 3.720000 0.9045000 4.034000 1.227000  3.407000 1.329000  0.6271000      1.809000  
1 1 1 9  59 12 o 3.872000 0.9244000 3.186000 1.279000  4.557000 1.335000  -1.371000      1.849000  
1 1 1 9  59 14 o 6.112000 0.9023000 5.307000 0.9952000 6.916000 1.505000  -1.609000      1.805000  
1 1 1 9  59 16 o 3.632000 0.9678000 3.988000 1.194000  3.275000 1.523000  0.7123000      1.936000  
1 1 1 9  59 18 o 3.264000 0.9716000 3.036000 1.166000  3.493000 1.555000  -0.4561000     1.943000  
1 1 1 9  59 20 f 5.585000 1.024000  5.444000 1.326000  5.726000 1.560000  -0.2815000     2.048000  
1 1 1 9  60 1  o 8.655000 0.5356000 8.328000 0.7478000 8.981000 0.7669000 -0.6526000     1.071000  
1 1 1 9  60 3  o 6.411000 0.8339000 6.317000 1.397000  6.505000 0.9113000 -0.1882000     1.668000  
1 1 1 9  60 5  o 5.673000 0.7492000 4.052000 1.262000  7.294000 0.8083000 -3.242000      1.498000  
1 1 1 9  60 7  o 4.804000 0.8993000 5.111000 1.344000  4.498000 1.195000  0.6124000      1.799000  
1 1 1 9  60 9  o 3.180000 0.8683000 3.614000 1.252000  2.746000 1.204000  0.8678000      1.737000  
1 1 1 9  60 11 o 5.251000 0.9391000 4.914000 1.016000  5.588000 1.580000  -0.6744000     1.878000  
1 1 1 9  60 13 o 4.400000 0.9925000 3.511000 1.289000  5.289000 1.510000  -1.777000      1.985000  
1 1 1 9  60 15 o 2.607000 0.8699000 2.287000 1.059000  2.927000 1.380000  -0.6403000     1.740000  
1 1 1 9  61 0  o 3.354000 1.229000  3.354000 1.229000  3.354000 1.229000  0.000000       0.000000  
1 1 1 9  61 2  o 3.346000 0.9311000 3.742000 1.446000  2.950000 1.174000  0.7923000      1.862000  
1 1 1 9  61 4  o 3.390000 0.8618000 3.593000 1.225000  3.186000 1.213000  0.4074000      1.724000  
1 1 1 9  61 6  o 3.246000 0.8846000 3.859000 1.387000  2.634000 1.099000  1.225000       1.769000  
1 1 1 9  61 8  o 4.689000 0.9134000 4.930000 1.175000  4.447000 1.399000  0.4829000      1.827000  
1 1 1 9  61 10 o 3.144000 0.9703000 2.535000 1.092000  3.752000 1.604000  -1.217000      1.941000  
1 1 1 9  61 12 o 9.093000 1.697000  9.093000 1.697000  ?        ?         ?              ?         
1 1 1 9  62 3  o 5.149000 1.823000  5.149000 1.823000  ?        ?         ?              ?         
1 1 1 10 0  0  o 23.99000 0.3906000 23.99000 0.3906000 23.99000 0.3906000 0.000000       0.000000  
1 1 1 10 0  2  o 72.75000 0.8191000 72.75000 0.8191000 72.75000 0.8191000 0.000000       0.000000  
1 1 1 10 0  4  o 59.97000 0.6815000 59.97000 0.6815000 59.97000 0.6815000 0.000000       0.000000  
1 1 1 10 0  6  o 16.70000 0.2460000 16.70000 0.2460000 16.70000 0.2460000 0.000000       0.000000  
1 1 1 10 0  8  o 40.59000 0.4815000 40.59000 0.4815000 40.59000 0.4815000 0.000000       0.000000  
1 1 1 10 0  10 o 62.06000 0.8664000 62.06000 0.8664000 62.06000 0.8664000 0.000000       0.000000  
1 1 1 10 0  12 o 19.92000 0.2844000 19.92000 0.2844000 19.92000 0.2844000 0.000000       0.000000  
1 1 1 10 0  14 o 68.35000 0.6736000 68.35000 0.6736000 68.35000 0.6736000 0.000000       0.000000  
1 1 1 10 0  16 o 22.15000 0.4587000 22.15000 0.4587000 22.15000 0.4587000 0.000000       0.000000  
1 1 1 10 0  18 o 48.89000 0.5085000 48.89000 0.5085000 48.89000 0.5085000 0.000000       0.000000  
1 1 1 10 0  20 o 33.02000 0.3943000 33.02000 0.3943000 33.02000 0.3943000 0.000000       0.000000  
1 1 1 10 0  22 o 23.19000 0.7978000 23.19000 0.7978000 23.19000 0.7978000 0.000000       0.000000  
1 1 1 10 0  24 o 30.90000 0.4077000 30.90000 0.4077000 30.90000 0.4077000 0.000000       0.000000  
1 1 1 10 0  26 o 59.23000 0.8679000 59.23000 0.8679000 59.23000 0.8679000 0.000000       0.000000  
1 1 1 10 0  28 o 40.44000 0.6643000 40.44000 0.6643000 40.44000 0.6643000 0.000000       0.000000  
1 1 1 10 0  30 o 65.86000 0.6721000 65.86000 0.6721000 65.86000 0.6721000 0.000000       0.000000  
1 1 1 10 0  32 o 63.55000 0.7540000 63.55000 0.7540000 63.55000 0.7540000 0.000000       0.000000  
1 1 1 10 0  34 o 34.23000 0.4431000 34.23000 0.4431000 34.23000 0.4431000 0.000000       0.000000  
1 1 1 10 0  36 o 13.56000 0.6130000 13.56000 0.6130000 13.56000 0.6130000 0.000000       0.000000  
1 1 1 10 0  38 o 3.192000 1.341000  3.192000 1.341000  3.192000 1.341000  0.000000       0.000000  
1 1 1 10 0  40 o 17.73000 0.5023000 17.73000 0.5023000 17.73000 0.5023000 0.000000       0.000000  
1 1 1 10 0  42 o 25.72000 0.5315000 25.72000 0.5315000 25.72000 0.5315000 0.000000       0.000000  
1 1 1 10 0  44 o 9.158000 0.9564000 9.158000 0.9564000 9.158000 0.9564000 0.000000       0.000000  
1 1 1 10 0  46 o 40.79000 0.5125000 40.79000 0.5125000 40.79000 0.5125000 0.000000       0.000000  
1 1 1 10 0  48 o 36.15000 0.4911000 36.15000 0.4911000 36.15000 0.4911000 0.000000       0.000000  
1 1 1 10 0  50 o 6.479000 1.198000  6.479000 1.198000  6.479000 1.198000  0.000000       0.000000  
1 1 1 10 0  52 o 3.782000 1.407000  3.782000 1.407000  3.782000 1.407000  0.000000       0.000000  
1 1 1 10 0  54 o 15.99000 0.6157000 15.99000 0.6157000 15.99000 0.6157000 0.000000       0.000000  
1 1 1 10 0  56 o 7.973000 0.9467000 7.973000 0.9467000 7.973000 0.9467000 0.000000       0.000000  
1 1 1 10 0  58 o 3.169000 1.333000  3.169000 1.333000  3.169000 1.333000  0.000000       0.000000  
1 1 1 10 0  60 o 5.924000 1.321000  5.924000 1.321000  5.924000 1.321000  0.000000       0.000000  
1 1 1 10 0  62 o 5.945000 1.420000  5.945000 1.420000  5.945000 1.420000  0.000000       0.000000  
1 1 1 10 0  64 o 3.713000 1.455000  3.713000 1.455000  3.713000 1.455000  0.000000       0.000000  
1 1 1 10 0  66 o 3.030000 1.347000  3.030000 1.347000  3.030000 1.347000  0.000000       0.000000  
1 1 1 10 1  1  o 75.08000 0.5591000 75.37000 0.8482000 74.80000 0.7286000 0.5738000      1.118000  
1 1 1 10 1  3  o 34.74000 0.2965000 35.12000 0.4230000 34.36000 0.4155000 0.7587000      0.5929000 
1 1 1 10 1  5  o 86.36000 0.7239000 86.93000 0.8429000 85.79000 1.177000  1.138000       1.448000  
1 1 1 10 1  7  o 29.97000 0.2507000 29.61000 0.3247000 30.33000 0.3822000 -0.7189000     0.5015000 
1 1 1 10 1  9  f 86.42000 0.7653000 86.66000 0.9713000 86.19000 1.183000  0.4714000      1.531000  
1 1 1 10 1  11 f 24.73000 0.2310000 24.87000 0.3529000 24.59000 0.2980000 0.2787000      0.4619000 
1 1 1 10 1  13 o 21.49000 0.2063000 21.49000 0.2908000 21.50000 0.2928000 -0.7732000E-02 0.4126000 
1 1 1 10 1  15 o 29.67000 0.2657000 29.56000 0.4007000 29.77000 0.3489000 -0.2105000     0.5313000 
1 1 1 10 1  17 o 74.16000 0.5575000 74.46000 0.7331000 73.86000 0.8401000 0.6088000      1.115000  
1 1 1 10 1  19 o 32.72000 0.2745000 32.72000 0.3882000 32.72000 0.3883000 0.6683000E-02  0.5490000 
1 1 1 10 1  21 o 56.20000 0.4084000 56.31000 0.5782000 56.09000 0.5769000 0.2235000      0.8168000 
1 1 1 10 1  23 o 77.06000 0.5415000 77.40000 0.7684000 76.71000 0.7632000 0.6911000      1.083000  
1 1 1 10 1  25 o 68.10000 0.5240000 68.85000 0.6932000 67.35000 0.7860000 1.498000       1.048000  
1 1 1 10 1  27 o 101.7000 0.7616000 101.2000 0.9907000 102.3000 1.157000  -1.104000      1.523000  
1 1 1 10 1  29 o 48.25000 0.4291000 48.57000 0.6098000 47.92000 0.6039000 0.6490000      0.8582000 
1 1 1 10 1  31 o 46.83000 0.3947000 47.16000 0.5166000 46.49000 0.5969000 0.6671000      0.7894000 
1 1 1 10 1  33 o 73.59000 0.5658000 73.79000 0.8562000 73.40000 0.7397000 0.3815000      1.132000  
1 1 1 10 1  35 o 14.23000 0.3704000 14.46000 0.5124000 14.00000 0.5349000 0.4628000      0.7408000 
1 1 1 10 1  37 o 35.05000 0.3866000 35.58000 0.6277000 34.53000 0.4514000 1.052000       0.7732000 
1 1 1 10 1  39 o 8.259000 0.7226000 7.761000 1.093000  8.757000 0.9457000 -0.9959000     1.445000  
1 1 1 10 1  41 o 16.74000 0.3879000 16.85000 0.5530000 16.62000 0.5442000 0.2283000      0.7759000 
1 1 1 10 1  43 f 36.99000 0.3675000 36.41000 0.5479000 37.57000 0.4900000 -1.166000      0.7350000 
1 1 1 10 1  45 o 45.59000 0.4085000 45.53000 0.5291000 45.66000 0.6227000 -0.1325000     0.8171000 
1 1 1 10 1  47 o 9.937000 0.6298000 9.862000 0.9020000 10.01000 0.8793000 -0.1501000     1.260000  
1 1 1 10 1  49 o 5.265000 1.071000  4.794000 1.512000  5.737000 1.518000  -0.9435000     2.142000  
1 1 1 10 1  51 o 3.293000 0.9555000 3.250000 1.333000  3.337000 1.370000  -0.8708000E-01 1.911000  
1 1 1 10 1  53 o 5.050000 0.9416000 4.511000 1.394000  5.590000 1.266000  -1.079000      1.883000  
1 1 1 10 1  55 o 7.821000 0.7029000 7.978000 1.042000  7.664000 0.9436000 0.3139000      1.406000  
1 1 1 10 1  57 o 9.675000 0.6448000 8.956000 1.051000  10.39000 0.7478000 -1.437000      1.290000  
1 1 1 10 1  59 o 8.135000 0.7668000 7.740000 1.149000  8.530000 1.015000  -0.7897000     1.534000  
1 1 1 10 1  61 o 9.666000 0.6661000 9.939000 0.9492000 9.392000 0.9347000 0.5467000      1.332000  
1 1 1 10 1  63 o 10.05000 0.5925000 10.13000 0.8433000 9.964000 0.8326000 0.1710000      1.185000  
1 1 1 10 1  65 o 5.570000 1.133000  5.036000 1.678000  6.103000 1.524000  -1.068000      2.267000  
1 1 1 10 2  0  o 28.63000 0.3594000 28.63000 0.3594000 28.63000 0.3594000 0.000000       0.000000  
1 1 1 10 2  2  o 32.49000 0.2800000 32.57000 0.3976000 32.41000 0.3944000 0.1550000      0.5600000 
1 1 1 10 2  4  o 33.02000 0.3014000 33.36000 0.3512000 32.68000 0.4900000 0.6720000      0.6029000 
1 1 1 10 2  6  o 39.23000 0.3070000 39.14000 0.4013000 39.32000 0.4648000 -0.1788000     0.6141000 
1 1 1 10 2  8  o 14.24000 0.1941000 14.45000 0.2539000 14.02000 0.2936000 0.4304000      0.3882000 
1 1 1 10 2  10 o 37.42000 0.2996000 37.16000 0.4503000 37.68000 0.3953000 -0.5202000     0.5992000 
1 1 1 10 2  12 o 68.17000 0.5122000 68.22000 0.7749000 68.12000 0.6699000 0.9434000E-01  1.024000  
1 1 1 10 2  14 o 118.8000 0.8768000 118.8000 1.325000  118.9000 1.148000  -0.6419000E-01 1.754000  
1 1 1 10 2  16 o 55.04000 0.4060000 55.30000 0.5014000 54.78000 0.6386000 0.5211000      0.8119000 
1 1 1 10 2  18 o 42.21000 0.3683000 41.95000 0.5191000 42.46000 0.5226000 -0.5167000     0.7365000 
1 1 1 10 2  20 o 108.3000 0.7444000 109.1000 1.059000  107.6000 1.046000  1.512000       1.489000  
1 1 1 10 2  22 o 115.9000 0.9202000 115.7000 1.299000  116.2000 1.304000  -0.4676000     1.840000  
1 1 1 10 2  24 o 12.38000 0.3829000 12.26000 0.5375000 12.50000 0.5455000 -0.2437000     0.7658000 
1 1 1 10 2  26 f 70.03000 0.8139000 69.60000 0.8085000 70.46000 1.413000  -0.8593000     1.628000  
1 1 1 10 2  28 o 68.69000 0.4913000 68.59000 0.6930000 68.79000 0.6966000 -0.2029000     0.9826000 
1 1 1 10 2  30 o 47.08000 0.3944000 47.25000 0.5944000 46.91000 0.5186000 0.3405000      0.7888000 
1 1 1 10 2  32 o 20.41000 0.3065000 20.12000 0.4255000 20.70000 0.4412000 -0.5777000     0.6130000 
1 1 1 10 2  34 o 25.97000 0.3237000 26.03000 0.4205000 25.90000 0.4924000 0.1248000      0.6475000 
1 1 1 10 2  36 o 42.48000 0.4002000 42.31000 0.5623000 42.64000 0.5697000 -0.3299000     0.8004000 
1 1 1 10 2  38 o 26.59000 0.3053000 26.43000 0.4269000 26.76000 0.4366000 -0.3291000     0.6106000 
1 1 1 10 2  40 o 43.03000 0.4093000 43.13000 0.5784000 42.94000 0.5793000 0.1931000      0.8186000 
1 1 1 10 2  42 o 20.22000 0.3565000 20.34000 0.5562000 20.09000 0.4462000 0.2493000      0.7131000 
1 1 1 10 2  44 o 27.92000 0.3822000 27.53000 0.5310000 28.32000 0.5499000 -0.7931000     0.7644000 
1 1 1 10 2  46 o 20.13000 0.4453000 19.88000 0.7611000 20.39000 0.4626000 -0.5108000     0.8907000 
1 1 1 10 2  48 o 24.71000 0.3638000 24.80000 0.5532000 24.63000 0.4725000 0.1680000      0.7276000 
1 1 1 10 2  50 o 20.59000 0.3549000 20.81000 0.5569000 20.37000 0.4402000 0.4478000      0.7098000 
1 1 1 10 2  52 o 21.39000 0.3481000 21.62000 0.5389000 21.16000 0.4407000 0.4589000      0.6962000 
1 1 1 10 2  54 o 19.65000 0.4028000 18.94000 0.5709000 20.36000 0.5684000 -1.423000      0.8056000 
1 1 1 10 2  56 o 24.86000 0.3622000 25.19000 0.4734000 24.52000 0.5484000 0.6710000      0.7245000 
1 1 1 10 2  58 o 4.889000 0.9097000 6.077000 1.177000  3.701000 1.387000  2.376000       1.819000  
1 1 1 10 2  60 o 12.13000 0.4820000 12.36000 0.6754000 11.91000 0.6879000 0.4566000      0.9641000 
1 1 1 10 2  62 o 11.21000 0.5755000 11.40000 0.8093000 11.02000 0.8185000 0.3824000      1.151000  
1 1 1 10 2  64 o 3.982000 1.009000  5.281000 1.575000  2.682000 1.261000  2.598000       2.017000  
1 1 1 10 2  66 o 2.791000 0.8877000 2.982000 1.294000  2.599000 1.215000  0.3831000      1.775000  
1 1 1 10 3  1  o 47.44000 0.3625000 47.37000 0.4751000 47.51000 0.5477000 -0.1444000     0.7251000 
1 1 1 10 3  3  o 72.84000 0.5426000 72.28000 0.7049000 73.40000 0.8252000 -1.118000      1.085000  
1 1 1 10 3  5  o 20.00000 0.1978000 19.65000 0.2549000 20.35000 0.3026000 -0.6912000     0.3957000 
1 1 1 10 3  7  o 23.81000 0.2137000 23.78000 0.2806000 23.84000 0.3224000 -0.6245000E-01 0.4274000 
1 1 1 10 3  9  o 29.03000 0.2286000 28.88000 0.3219000 29.19000 0.3247000 -0.3122000     0.4572000 
1 1 1 10 3  11 o 78.27000 0.5402000 77.83000 0.7598000 78.72000 0.7681000 -0.8844000     1.080000  
1 1 1 10 3  13 o 143.2000 1.194000  143.5000 1.953000  142.9000 1.376000  0.5399000      2.389000  
1 1 1 10 3  15 o 203.9000 1.495000  203.2000 2.254000  204.6000 1.965000  -1.317000      2.990000  
1 1 1 10 3  17 o 126.7000 0.8927000 127.6000 1.103000  125.8000 1.404000  1.797000       1.785000  
1 1 1 10 3  19 o 76.33000 0.5511000 75.72000 0.6695000 76.94000 0.8755000 -1.214000      1.102000  
1 1 1 10 3  21 o 61.26000 0.4741000 61.10000 0.7135000 61.41000 0.6245000 -0.3065000     0.9482000 
1 1 1 10 3  23 o 39.92000 0.3203000 39.60000 0.4451000 40.24000 0.4607000 -0.6380000     0.6406000 
1 1 1 10 3  25 o 97.47000 0.7295000 97.77000 0.9561000 97.17000 1.102000  0.6081000      1.459000  
1 1 1 10 3  27 o 45.92000 0.3862000 46.01000 0.5024000 45.83000 0.5868000 0.1841000      0.7725000 
1 1 1 10 3  29 o 16.26000 0.3575000 16.81000 0.5477000 15.71000 0.4597000 1.106000       0.7151000 
1 1 1 10 3  31 o 29.38000 0.2982000 29.21000 0.4184000 29.56000 0.4251000 -0.3506000     0.5965000 
1 1 1 10 3  33 o 20.98000 0.3424000 20.72000 0.5241000 21.24000 0.4408000 -0.5203000     0.6849000 
1 1 1 10 3  35 o 46.51000 0.3665000 46.99000 0.5197000 46.02000 0.5168000 0.9705000      0.7329000 
1 1 1 10 3  37 o 33.85000 0.3712000 33.41000 0.6242000 34.29000 0.4018000 -0.8839000     0.7423000 
1 1 1 10 3  39 o 36.90000 0.5017000 37.53000 0.8864000 36.28000 0.4703000 1.245000       1.003000  
1 1 1 10 3  41 o 9.095000 0.6746000 9.276000 0.9770000 8.915000 0.9305000 0.3610000      1.349000  
1 1 1 10 3  43 f 30.16000 0.4037000 30.34000 0.6844000 29.98000 0.4283000 0.3626000      0.8074000 
1 1 1 10 3  45 o 15.28000 0.4591000 15.74000 0.7104000 14.82000 0.5819000 0.9180000      0.9183000 
1 1 1 10 3  47 f 10.20000 0.7576000 10.35000 1.297000  10.05000 0.7834000 0.3031000      1.515000  
1 1 1 10 3  49 o 15.98000 0.4801000 15.66000 0.8165000 16.31000 0.5052000 -0.6451000     0.9601000 
1 1 1 10 3  51 o 5.379000 1.037000  6.410000 1.533000  4.349000 1.395000  2.061000       2.073000  
1 1 1 10 3  53 o 10.93000 0.5447000 11.08000 0.8180000 10.78000 0.7196000 0.2978000      1.089000  
1 1 1 10 3  55 o 7.173000 0.7389000 7.319000 1.140000  7.028000 0.9400000 0.2914000      1.478000  
1 1 1 10 3  57 o 6.749000 0.8079000 6.714000 1.293000  6.784000 0.9687000 -0.6968000E-01 1.616000  
1 1 1 10 3  59 o 6.278000 0.9993000 6.256000 1.331000  6.301000 1.491000  -0.4482000E-01 1.999000  
1 1 1 10 3  61 o 6.040000 0.9881000 6.124000 1.363000  5.956000 1.431000  0.1684000      1.976000  
1 1 1 10 3  63 o 4.543000 1.029000  4.367000 1.500000  4.720000 1.409000  -0.3527000     2.058000  
1 1 1 10 3  65 o 3.725000 1.063000  3.775000 1.492000  3.675000 1.515000  0.1001000      2.126000  
1 1 1 10 4  0  o 42.85000 0.4337000 42.85000 0.4337000 42.85000 0.4337000 0.000000       0.000000  
1 1 1 10 4  2  o 68.35000 0.4722000 68.59000 0.6701000 68.11000 0.6655000 0.4771000      0.9444000 
1 1 1 10 4  4  o 61.69000 0.4286000 62.08000 0.6099000 61.30000 0.6022000 0.7796000      0.8571000 
1 1 1 10 4  6  o 33.07000 0.3031000 32.70000 0.3478000 33.43000 0.4964000 -0.7279000     0.6062000 
1 1 1 10 4  8  o 39.14000 0.2856000 39.33000 0.4056000 38.95000 0.4023000 0.3819000      0.5713000 
1 1 1 10 4  10 o 42.27000 0.3735000 42.03000 0.6054000 42.51000 0.4374000 -0.4798000     0.7469000 
1 1 1 10 4  12 o 45.69000 0.3306000 45.68000 0.4673000 45.71000 0.4679000 -0.2677000E-01 0.6613000 
1 1 1 10 4  14 o 103.6000 0.8199000 103.4000 1.158000  103.7000 1.161000  -0.3069000     1.640000  
1 1 1 10 4  16 o 53.83000 0.4173000 53.94000 0.5478000 53.72000 0.6297000 0.2174000      0.8347000 
1 1 1 10 4  18 o 99.42000 0.7071000 99.34000 0.8648000 99.50000 1.119000  -0.1592000     1.414000  
1 1 1 10 4  20 o 60.87000 0.4477000 62.34000 0.5618000 59.40000 0.6972000 2.945000       0.8954000 
1 1 1 10 4  22 o 11.98000 0.4033000 12.52000 0.5122000 11.44000 0.6230000 1.076000       0.8065000 
1 1 1 10 4  24 o 53.31000 0.3939000 52.92000 0.5502000 53.69000 0.5638000 -0.7744000     0.7878000 
1 1 1 10 4  26 o 27.92000 0.5044000 27.88000 0.8189000 27.95000 0.5892000 -0.6627000E-01 1.009000  
1 1 1 10 4  28 o 34.67000 0.3083000 34.28000 0.4293000 35.06000 0.4426000 -0.7742000     0.6166000 
1 1 1 10 4  30 o 34.73000 0.4317000 35.61000 0.6159000 33.86000 0.6050000 1.751000       0.8634000 
1 1 1 10 4  32 o 15.09000 0.3577000 15.05000 0.4890000 15.12000 0.5221000 -0.6398000E-01 0.7153000 
1 1 1 10 4  34 f 21.54000 0.3782000 21.22000 0.6494000 21.86000 0.3880000 -0.6410000     0.7565000 
1 1 1 10 4  36 o 28.27000 0.3728000 28.23000 0.6013000 28.31000 0.4408000 -0.7467000E-01 0.7455000 
1 1 1 10 4  38 o 4.137000 1.010000  4.390000 1.509000  3.884000 1.343000  0.5065000      2.020000  
1 1 1 10 4  40 o 17.02000 0.4130000 17.03000 0.5839000 17.01000 0.5844000 0.2114000E-01  0.8261000 
1 1 1 10 4  42 o 42.70000 0.3700000 42.18000 0.5755000 43.22000 0.4651000 -1.036000      0.7399000 
1 1 1 10 4  44 o 9.930000 0.6438000 10.17000 0.9841000 9.688000 0.8302000 0.4839000      1.288000  
1 1 1 10 4  46 o 34.10000 0.3469000 34.03000 0.5431000 34.17000 0.4318000 -0.1403000     0.6938000 
1 1 1 10 4  48 o 34.54000 0.3688000 34.34000 0.5512000 34.74000 0.4902000 -0.4003000     0.7377000 
1 1 1 10 4  50 o 17.68000 0.3796000 17.13000 0.6112000 18.24000 0.4505000 -1.113000      0.7593000 
1 1 1 10 4  52 o 3.543000 0.9568000 4.628000 1.549000  2.457000 1.124000  2.172000       1.914000  
1 1 1 10 4  54 o 16.64000 0.3885000 16.36000 0.6179000 16.93000 0.4709000 -0.5692000     0.7769000 
1 1 1 10 4  56 o 13.00000 0.4713000 13.43000 0.6932000 12.58000 0.6386000 0.8495000      0.9425000 
1 1 1 10 4  58 o 3.241000 0.9714000 3.178000 1.442000  3.305000 1.302000  -0.1277000     1.943000  
1 1 1 10 4  60 o 4.785000 1.063000  3.981000 1.675000  5.589000 1.310000  -1.608000      2.126000  
1 1 1 10 4  62 o 2.654000 0.8848000 2.615000 1.242000  2.693000 1.260000  -0.7798000E-01 1.770000  
1 1 1 10 4  64 o 8.943000 0.6607000 8.291000 0.9519000 9.595000 0.9166000 -1.304000      1.321000  
1 1 1 10 4  66 o 4.619000 1.099000  4.752000 1.683000  4.486000 1.415000  0.2663000      2.199000  
1 1 1 10 5  1  o 103.0000 0.7036000 104.3000 1.007000  101.7000 0.9834000 2.541000       1.407000  
1 1 1 10 5  3  o 37.83000 0.2758000 37.38000 0.3851000 38.28000 0.3950000 -0.9030000     0.5516000 
1 1 1 10 5  5  o 38.58000 0.3016000 38.53000 0.3961000 38.63000 0.4549000 -0.1004000     0.6032000 
1 1 1 10 5  7  o 15.64000 0.1759000 15.72000 0.2475000 15.55000 0.2501000 0.1718000      0.3519000 
1 1 1 10 5  9  o 38.09000 0.3019000 37.91000 0.4532000 38.27000 0.3988000 -0.3596000     0.6037000 
1 1 1 10 5  11 o 89.02000 0.7917000 89.31000 1.231000  88.73000 0.9963000 0.5778000      1.583000  
1 1 1 10 5  13 o 91.68000 0.6304000 92.34000 0.8979000 91.02000 0.8852000 1.322000       1.261000  
1 1 1 10 5  15 o 88.35000 0.6582000 88.76000 0.8659000 87.94000 0.9914000 0.8198000      1.316000  
1 1 1 10 5  17 o 128.3000 0.9051000 128.3000 1.109000  128.2000 1.431000  0.1297000      1.810000  
1 1 1 10 5  19 o 71.37000 0.5412000 71.47000 0.7089000 71.28000 0.8180000 0.1880000      1.082000  
1 1 1 10 5  21 o 30.02000 0.2919000 29.91000 0.4335000 30.13000 0.3909000 -0.2158000     0.5837000 
1 1 1 10 5  23 o 114.1000 0.7843000 115.1000 1.117000  113.1000 1.101000  2.024000       1.569000  
1 1 1 10 5  25 o 80.95000 0.7334000 80.29000 0.9160000 81.60000 1.146000  -1.312000      1.467000  
1 1 1 10 5  27 o 72.15000 0.5123000 72.22000 0.7219000 72.07000 0.7271000 0.1525000      1.025000  
1 1 1 10 5  29 o 54.23000 0.4382000 53.93000 0.5658000 54.53000 0.6693000 -0.6033000     0.8764000 
1 1 1 10 5  31 o 39.46000 0.3564000 39.72000 0.5348000 39.20000 0.4711000 0.5177000      0.7127000 
1 1 1 10 5  33 o 11.80000 0.5109000 12.12000 0.6863000 11.48000 0.7571000 0.6366000      1.022000  
1 1 1 10 5  35 o 49.13000 0.4482000 48.56000 0.7509000 49.69000 0.4897000 -1.130000      0.8965000 
1 1 1 10 5  37 o 40.86000 0.4030000 41.02000 0.6747000 40.70000 0.4409000 0.3210000      0.8060000 
1 1 1 10 5  39 o 23.32000 0.3790000 22.53000 0.6038000 24.10000 0.4582000 -1.573000      0.7580000 
1 1 1 10 5  41 o 21.51000 0.3519000 21.18000 0.5541000 21.83000 0.4341000 -0.6488000     0.7038000 
1 1 1 10 5  43 o 18.93000 0.4053000 18.75000 0.5875000 19.12000 0.5585000 -0.3712000     0.8106000 
1 1 1 10 5  45 o 8.337000 0.7411000 8.593000 1.165000  8.082000 0.9165000 0.5113000      1.482000  
1 1 1 10 5  47 o 13.62000 0.5800000 13.68000 0.9817000 13.55000 0.6179000 0.1245000      1.160000  
1 1 1 10 5  49 o 9.576000 0.7077000 9.427000 1.201000  9.724000 0.7487000 -0.2968000     1.415000  
1 1 1 10 5  51 o 16.24000 0.4159000 16.23000 0.6195000 16.26000 0.5550000 -0.2515000E-01 0.8318000 
1 1 1 10 5  53 o 12.08000 0.4913000 12.48000 0.7583000 11.67000 0.6250000 0.8132000      0.9827000 
1 1 1 10 5  55 o 17.56000 0.3959000 17.70000 0.5737000 17.43000 0.5457000 0.2691000      0.7918000 
1 1 1 10 5  57 o 11.04000 0.5215000 10.98000 0.8348000 11.09000 0.6254000 -0.1122000     1.043000  
1 1 1 10 5  59 o 5.052000 0.9327000 3.449000 1.524000  6.655000 1.076000  -3.206000      1.865000  
1 1 1 10 5  61 o 9.186000 0.6850000 9.003000 1.121000  9.370000 0.7877000 -0.3666000     1.370000  
1 1 1 10 5  63 o 12.43000 0.6126000 12.65000 0.9742000 12.21000 0.7429000 0.4382000      1.225000  
1 1 1 10 5  65 f 5.571000 1.039000  4.892000 1.611000  6.250000 1.313000  -1.358000      2.078000  
1 1 1 10 6  0  o 3.485000 0.6412000 3.485000 0.6412000 3.485000 0.6412000 0.000000       0.000000  
1 1 1 10 6  2  o 19.64000 0.1880000 19.26000 0.2463000 20.03000 0.2841000 -0.7669000     0.3760000 
1 1 1 10 6  4  o 64.77000 0.4842000 64.70000 0.6342000 64.85000 0.7319000 -0.1502000     0.9685000 
1 1 1 10 6  6  o 42.26000 0.3510000 42.37000 0.4938000 42.15000 0.4989000 0.2166000      0.7020000 
1 1 1 10 6  8  o 32.49000 0.3044000 32.34000 0.4964000 32.64000 0.3524000 -0.3043000     0.6087000 
1 1 1 10 6  10 o 38.00000 0.3036000 37.62000 0.4555000 38.39000 0.4014000 -0.7681000     0.6071000 
1 1 1 10 6  12 o 55.92000 0.3950000 55.95000 0.5591000 55.89000 0.5580000 0.6073000E-01  0.7899000 
1 1 1 10 6  14 o 136.9000 0.9642000 137.1000 1.183000  136.7000 1.523000  0.4394000      1.928000  
1 1 1 10 6  16 o 86.29000 0.6448000 86.06000 0.8409000 86.52000 0.9778000 -0.4581000     1.290000  
1 1 1 10 6  18 o 68.97000 0.5005000 69.20000 0.6142000 68.74000 0.7903000 0.4621000      1.001000  
1 1 1 10 6  20 o 111.1000 0.8240000 111.2000 1.080000  110.9000 1.245000  0.2482000      1.648000  
1 1 1 10 6  22 o 22.22000 0.3016000 22.09000 0.3754000 22.34000 0.4721000 -0.2548000     0.6031000 
1 1 1 10 6  24 o 32.55000 0.3356000 31.78000 0.4559000 33.31000 0.4925000 -1.532000      0.6711000 
1 1 1 10 6  26 o 54.83000 0.4697000 54.69000 0.6543000 54.97000 0.6740000 -0.2849000     0.9393000 
1 1 1 10 6  28 o 26.05000 0.3100000 25.59000 0.4574000 26.52000 0.4187000 -0.9285000     0.6201000 
1 1 1 10 6  30 o 24.96000 0.3628000 24.64000 0.6092000 25.29000 0.3943000 -0.6537000     0.7257000 
1 1 1 10 6  32 o 17.73000 0.3480000 17.36000 0.5205000 18.09000 0.4619000 -0.7338000     0.6959000 
1 1 1 10 6  34 o 9.405000 0.6039000 9.635000 0.8150000 9.175000 0.8915000 0.4604000      1.208000  
1 1 1 10 6  36 o 48.59000 0.4622000 48.32000 0.7442000 48.86000 0.5482000 -0.5421000     0.9244000 
1 1 1 10 6  38 f 40.13000 0.3526000 39.97000 0.5510000 40.29000 0.4402000 -0.3277000     0.7053000 
1 1 1 10 6  40 o 17.75000 0.3852000 18.10000 0.5678000 17.39000 0.5205000 0.7061000      0.7703000 
1 1 1 10 6  42 o 32.13000 0.3558000 32.64000 0.5296000 31.61000 0.4753000 1.025000       0.7116000 
1 1 1 10 6  44 o 10.80000 0.5865000 10.86000 0.8868000 10.73000 0.7677000 0.1205000      1.173000  
1 1 1 10 6  46 f 17.05000 0.4105000 17.79000 0.6300000 16.31000 0.5263000 1.487000       0.8209000 
1 1 1 10 6  48 o 14.31000 0.5770000 13.96000 0.9704000 14.67000 0.6244000 -0.7070000     1.154000  
1 1 1 10 6  50 o 27.92000 0.3726000 27.72000 0.6169000 28.13000 0.4181000 -0.4094000     0.7452000 
1 1 1 10 6  52 o 6.764000 0.8459000 7.320000 1.208000  6.209000 1.185000  1.111000       1.692000  
1 1 1 10 6  54 o 8.845000 0.6287000 9.588000 0.8879000 8.101000 0.8905000 1.487000       1.257000  
1 1 1 10 6  56 o 2.770000 0.8738000 2.561000 1.215000  2.979000 1.256000  -0.4185000     1.748000  
1 1 1 10 6  58 o 4.716000 1.056000  4.993000 1.558000  4.439000 1.426000  0.5545000      2.112000  
1 1 1 10 6  60 o 13.73000 0.6420000 14.06000 1.158000  13.39000 0.5553000 0.6722000      1.284000  
1 1 1 10 6  62 o 3.499000 1.023000  3.608000 1.497000  3.389000 1.394000  0.2184000      2.045000  
1 1 1 10 6  64 o 5.490000 1.093000  5.322000 1.589000  5.658000 1.500000  -0.3358000     2.185000  
1 1 1 10 6  66 o 5.110000 1.030000  6.120000 1.631000  4.101000 1.260000  2.019000       2.061000  
1 1 1 10 7  1  o 15.87000 0.1805000 15.82000 0.2544000 15.91000 0.2562000 -0.9020000E-01 0.3610000 
1 1 1 10 7  3  o 38.66000 0.3208000 38.32000 0.4499000 39.00000 0.4574000 -0.6807000     0.6415000 
1 1 1 10 7  5  o 40.40000 0.3146000 40.66000 0.4765000 40.14000 0.4110000 0.5234000      0.6293000 
1 1 1 10 7  7  o 22.03000 0.2492000 21.92000 0.2690000 22.15000 0.4197000 -0.2222000     0.4985000 
1 1 1 10 7  9  o 20.29000 0.1906000 20.20000 0.2683000 20.39000 0.2708000 -0.1888000     0.3812000 
1 1 1 10 7  11 o 65.72000 0.4947000 65.60000 0.7472000 65.84000 0.6487000 -0.2478000     0.9895000 
1 1 1 10 7  13 o 159.6000 1.121000  160.0000 1.377000  159.2000 1.769000  0.8170000      2.242000  
1 1 1 10 7  15 o 87.56000 0.6232000 88.11000 0.7684000 87.00000 0.9815000 1.108000       1.246000  
1 1 1 10 7  17 o 59.19000 0.4572000 58.53000 0.5906000 59.84000 0.6982000 -1.309000      0.9145000 
1 1 1 10 7  19 o 40.04000 0.3220000 39.94000 0.3901000 40.14000 0.5124000 -0.1975000     0.6440000 
1 1 1 10 7  21 f 55.68000 0.4689000 55.66000 0.6607000 55.70000 0.6655000 -0.3645000E-01 0.9378000 
1 1 1 10 7  23 o 86.97000 0.6530000 87.73000 0.8595000 86.21000 0.9831000 1.515000       1.306000  
1 1 1 10 7  25 o 95.87000 0.7680000 96.30000 1.086000  95.44000 1.086000  0.8544000      1.536000  
1 1 1 10 7  27 o 90.06000 0.6765000 89.47000 1.015000  90.65000 0.8947000 -1.184000      1.353000  
1 1 1 10 7  29 f 14.02000 0.3787000 14.08000 0.5791000 13.96000 0.4883000 0.1168000      0.7574000 
1 1 1 10 7  31 o 71.84000 0.5277000 71.69000 0.8284000 71.99000 0.6539000 -0.2991000     1.055000  
1 1 1 10 7  33 o 25.55000 0.3044000 25.57000 0.4684000 25.52000 0.3887000 0.4920000E-01  0.6087000 
1 1 1 10 7  35 o 28.00000 0.3738000 27.56000 0.6013000 28.44000 0.4444000 -0.8828000     0.7477000 
1 1 1 10 7  37 o 41.39000 0.3991000 41.11000 0.5553000 41.67000 0.5735000 -0.5631000     0.7983000 
1 1 1 10 7  39 o 17.83000 0.4322000 17.04000 0.6714000 18.62000 0.5444000 -1.583000      0.8643000 
1 1 1 10 7  41 o 13.52000 0.4690000 13.83000 0.7370000 13.22000 0.5803000 0.6116000      0.9380000 
1 1 1 10 7  43 f 20.22000 0.4043000 19.59000 0.5996000 20.84000 0.5425000 -1.256000      0.8086000 
1 1 1 10 7  45 o 41.19000 0.3876000 40.84000 0.5753000 41.53000 0.5195000 -0.6982000     0.7751000 
1 1 1 10 7  47 o 23.30000 0.3574000 23.13000 0.5646000 23.48000 0.4384000 -0.3480000     0.7148000 
1 1 1 10 7  49 o 28.02000 0.3903000 27.69000 0.6589000 28.36000 0.4184000 -0.6702000     0.7805000 
1 1 1 10 7  51 f 24.02000 0.3832000 24.21000 0.5536000 23.83000 0.5300000 0.3808000      0.7664000 
1 1 1 10 7  53 o 12.14000 0.4656000 12.27000 0.7169000 12.00000 0.5944000 0.2759000      0.9313000 
1 1 1 10 7  55 o 13.83000 0.5262000 13.26000 0.8643000 14.40000 0.6005000 -1.137000      1.052000  
1 1 1 10 7  57 o 3.061000 0.9474000 3.040000 1.351000  3.083000 1.329000  -0.4231000E-01 1.895000  
1 1 1 10 7  59 o 7.542000 0.9699000 6.553000 1.724000  8.532000 0.8884000 -1.980000      1.940000  
1 1 1 10 7  61 o 11.82000 0.5334000 12.23000 0.8564000 11.42000 0.6360000 0.8076000      1.067000  
1 1 1 10 7  63 o 3.005000 0.9155000 3.172000 1.362000  2.837000 1.223000  0.3355000      1.831000  
1 1 1 10 7  65 o 6.062000 0.9194000 6.620000 1.355000  5.504000 1.243000  1.117000       1.839000  
1 1 1 10 8  0  o 45.81000 0.4596000 45.81000 0.4596000 45.81000 0.4596000 0.000000       0.000000  
1 1 1 10 8  2  o 16.20000 0.1658000 16.01000 0.2327000 16.39000 0.2362000 -0.3750000     0.3316000 
1 1 1 10 8  4  o 18.92000 0.2175000 18.98000 0.3096000 18.87000 0.3055000 0.1104000      0.4350000 
1 1 1 10 8  6  o 59.43000 0.4489000 59.14000 0.5837000 59.71000 0.6821000 -0.5673000     0.8978000 
1 1 1 10 8  8  o 13.91000 0.1765000 14.05000 0.2482000 13.77000 0.2509000 0.2774000      0.3529000 
1 1 1 10 8  10 o 96.19000 0.7121000 95.72000 1.072000  96.65000 0.9374000 -0.9253000     1.424000  
1 1 1 10 8  12 o 185.8000 1.304000  185.7000 1.596000  185.9000 2.064000  -0.1683000     2.609000  
1 1 1 10 8  14 o 154.8000 1.089000  154.8000 1.332000  154.8000 1.723000  -0.6917000E-01 2.178000  
1 1 1 10 8  16 o 38.67000 0.3075000 38.38000 0.3693000 38.97000 0.4917000 -0.5918000     0.6149000 
1 1 1 10 8  18 o 79.62000 0.5989000 79.77000 0.7837000 79.46000 0.9058000 0.3106000      1.198000  
1 1 1 10 8  20 o 51.76000 0.4097000 52.95000 0.5441000 50.57000 0.6126000 2.384000       0.8194000 
1 1 1 10 8  22 o 126.0000 1.368000  125.6000 1.217000  126.4000 2.450000  -0.8154000     2.736000  
1 1 1 10 8  24 o 72.09000 0.5898000 72.42000 0.8316000 71.77000 0.8367000 0.6423000      1.180000  
1 1 1 10 8  26 o 24.22000 0.3055000 23.59000 0.4571000 24.84000 0.4053000 -1.252000      0.6110000 
1 1 1 10 8  28 o 17.12000 0.3202000 17.15000 0.4825000 17.10000 0.4209000 0.4964000E-01  0.6403000 
1 1 1 10 8  30 o 38.68000 0.3466000 38.89000 0.5161000 38.47000 0.4629000 0.4229000      0.6933000 
1 1 1 10 8  32 o 18.65000 0.3583000 19.09000 0.4825000 18.22000 0.5299000 0.8753000      0.7166000 
1 1 1 10 8  34 o 18.95000 0.3711000 19.38000 0.6190000 18.51000 0.4094000 0.8642000      0.7421000 
1 1 1 10 8  36 o 7.324000 1.090000  7.682000 2.007000  6.967000 0.8533000 0.7148000      2.180000  
1 1 1 10 8  38 o 22.55000 0.4071000 22.31000 0.6166000 22.78000 0.5317000 -0.4736000     0.8142000 
1 1 1 10 8  40 o 13.57000 0.4367000 13.55000 0.6997000 13.58000 0.5228000 -0.2720000E-01 0.8734000 
1 1 1 10 8  42 o 16.71000 0.4064000 17.44000 0.6185000 15.98000 0.5273000 1.461000       0.8128000 
1 1 1 10 8  44 o 27.39000 0.3578000 26.74000 0.5271000 28.04000 0.4840000 -1.292000      0.7156000 
1 1 1 10 8  46 o 17.39000 0.4243000 17.40000 0.6353000 17.38000 0.5625000 0.2048000E-01  0.8485000 
1 1 1 10 8  48 o 4.512000 0.9332000 3.302000 1.395000  5.722000 1.239000  -2.420000      1.866000  
1 1 1 10 8  50 o 12.40000 0.5489000 11.85000 0.9314000 12.94000 0.5813000 -1.088000      1.098000  
1 1 1 10 8  52 f 19.11000 0.3816000 19.98000 0.5673000 18.24000 0.5106000 1.741000       0.7632000 
1 1 1 10 8  54 o 7.060000 0.7585000 6.907000 1.239000  7.212000 0.8758000 -0.3045000     1.517000  
1 1 1 10 8  56 o 4.266000 1.006000  4.393000 1.529000  4.139000 1.307000  0.2546000      2.011000  
1 1 1 10 8  58 o 11.16000 0.5637000 11.95000 0.8203000 10.37000 0.7733000 1.586000       1.127000  
1 1 1 10 8  60 o 7.547000 1.117000  7.244000 2.027000  7.851000 0.9375000 -0.6072000     2.233000  
1 1 1 10 8  62 o 5.842000 1.006000  5.969000 1.592000  5.714000 1.229000  0.2554000      2.011000  
1 1 1 10 8  64 o 8.494000 0.6965000 8.297000 1.119000  8.691000 0.8291000 -0.3938000     1.393000  
1 1 1 10 8  66 o 6.056000 0.9896000 7.677000 1.466000  4.436000 1.329000  3.242000       1.979000  
1 1 1 10 9  1  o 24.90000 0.2208000 25.35000 0.3407000 24.45000 0.2810000 0.8980000      0.4416000 
1 1 1 10 9  3  o 22.85000 0.1918000 22.81000 0.2704000 22.88000 0.2720000 -0.6965000E-01 0.3835000 
1 1 1 10 9  5  o 44.92000 0.3208000 44.94000 0.4537000 44.91000 0.4537000 0.3800000E-01  0.6416000 
1 1 1 10 9  7  o 39.81000 0.3140000 39.91000 0.4105000 39.72000 0.4752000 0.1879000      0.6280000 
1 1 1 10 9  9  o 57.01000 0.4004000 57.41000 0.5702000 56.60000 0.5622000 0.8086000      0.8008000 
1 1 1 10 9  11 o 38.22000 0.3093000 38.08000 0.3979000 38.35000 0.4738000 -0.2686000     0.6187000 
1 1 1 10 9  13 o 63.99000 0.4653000 63.51000 0.5633000 64.47000 0.7408000 -0.9583000     0.9307000 
1 1 1 10 9  15 o 43.97000 0.3374000 43.76000 0.4066000 44.18000 0.5387000 -0.4191000     0.6749000 
1 1 1 10 9  17 o 42.43000 0.3307000 42.68000 0.4017000 42.18000 0.5254000 0.5010000      0.6614000 
1 1 1 10 9  19 o 76.10000 0.5759000 75.88000 0.7489000 76.32000 0.8751000 -0.4426000     1.152000  
1 1 1 10 9  21 o 177.8000 1.893000  175.3000 1.510000  180.3000 3.471000  -4.934000      3.785000  
1 1 1 10 9  23 o 66.38000 0.4888000 66.52000 0.7690000 66.23000 0.6036000 0.2950000      0.9776000 
1 1 1 10 9  25 o 39.05000 0.3895000 39.17000 0.6239000 38.93000 0.4664000 0.2437000      0.7790000 
1 1 1 10 9  27 o 37.02000 0.3213000 37.24000 0.5015000 36.80000 0.4019000 0.4378000      0.6426000 
1 1 1 10 9  29 o 42.18000 0.3492000 42.09000 0.5448000 42.26000 0.4370000 -0.1684000     0.6984000 
1 1 1 10 9  31 o 48.03000 0.3795000 47.96000 0.5928000 48.11000 0.4741000 -0.1506000     0.7590000 
1 1 1 10 9  33 o 21.99000 0.3171000 22.24000 0.4665000 21.75000 0.4295000 0.4838000      0.6342000 
1 1 1 10 9  35 o 47.01000 0.4010000 47.81000 0.6050000 46.20000 0.5266000 1.605000       0.8021000 
1 1 1 10 9  37 o 21.69000 0.3439000 22.05000 0.5247000 21.34000 0.4446000 0.7135000      0.6878000 
1 1 1 10 9  39 o 26.38000 0.3441000 26.39000 0.5205000 26.37000 0.4504000 0.2172000E-01  0.6883000 
1 1 1 10 9  41 o 17.05000 0.4064000 16.18000 0.6241000 17.92000 0.5206000 -1.739000      0.8127000 
1 1 1 10 9  43 o 47.66000 0.3950000 48.34000 0.6219000 46.98000 0.4871000 1.357000       0.7899000 
1 1 1 10 9  45 o 35.87000 0.3991000 36.18000 0.6645000 35.55000 0.4423000 0.6266000      0.7983000 
1 1 1 10 9  47 o 22.83000 0.3746000 22.88000 0.5579000 22.78000 0.5002000 0.9794000E-01  0.7492000 
1 1 1 10 9  49 o 35.14000 0.5246000 34.76000 0.9571000 35.53000 0.4300000 -0.7681000     1.049000  
1 1 1 10 9  51 o 22.77000 0.4126000 22.91000 0.6849000 22.63000 0.4602000 0.2797000      0.8251000 
1 1 1 10 9  53 o 14.51000 0.4541000 14.91000 0.6777000 14.10000 0.6047000 0.8103000      0.9083000 
1 1 1 10 9  55 o 11.30000 0.4974000 11.75000 0.7739000 10.86000 0.6249000 0.8947000      0.9947000 
1 1 1 10 9  57 o 10.38000 0.5290000 11.17000 0.8535000 9.589000 0.6252000 1.583000       1.058000  
1 1 1 10 9  59 o 5.677000 0.9800000 5.372000 1.591000  5.982000 1.145000  -0.6099000     1.960000  
1 1 1 10 9  61 o 9.044000 0.7300000 9.422000 1.075000  8.666000 0.9883000 0.7560000      1.460000  
1 1 1 10 9  63 o 6.531000 0.8671000 8.545000 1.029000  4.518000 1.396000  4.028000       1.734000  
1 1 1 10 9  65 o 4.010000 1.034000  4.814000 1.644000  3.207000 1.256000  1.607000       2.069000  
1 1 1 10 10 0  o 80.14000 1.110000  80.14000 1.110000  80.14000 1.110000  0.000000       0.000000  
1 1 1 10 10 2  o 24.59000 0.2122000 24.77000 0.2833000 24.40000 0.3160000 0.3650000      0.4244000 
1 1 1 10 10 4  o 12.66000 0.1628000 12.82000 0.2302000 12.50000 0.2303000 0.3133000      0.3256000 
1 1 1 10 10 6  o 53.14000 0.4061000 52.79000 0.5261000 53.49000 0.6187000 -0.6922000     0.8121000 
1 1 1 10 10 8  o 78.44000 0.5411000 78.43000 0.7650000 78.45000 0.7655000 -0.1723000E-01 1.082000  
1 1 1 10 10 10 o 51.92000 0.3995000 51.94000 0.5188000 51.89000 0.6077000 0.4771000E-01  0.7990000 
1 1 1 10 10 12 o 115.7000 0.8162000 116.3000 1.005000  115.1000 1.286000  1.265000       1.632000  
1 1 1 10 10 14 o 61.24000 0.4485000 60.60000 0.5392000 61.88000 0.7169000 -1.271000      0.8970000 
1 1 1 10 10 16 o 80.63000 0.5800000 79.88000 0.6998000 81.38000 0.9250000 -1.495000      1.160000  
1 1 1 10 10 18 o 102.9000 0.7325000 102.5000 0.8907000 103.3000 1.163000  -0.7709000     1.465000  
1 1 1 10 10 20 o 63.68000 0.5575000 62.93000 0.6316000 64.44000 0.9189000 -1.504000      1.115000  
1 1 1 10 10 22 o 28.30000 0.3278000 28.91000 0.4742000 27.68000 0.4528000 1.225000       0.6556000 
1 1 1 10 10 24 o 20.46000 0.3065000 20.67000 0.4485000 20.25000 0.4180000 0.4240000      0.6131000 
1 1 1 10 10 26 o 70.20000 0.5142000 69.96000 0.8067000 70.44000 0.6379000 -0.4858000     1.028000  
1 1 1 10 10 28 o 46.19000 0.3689000 45.95000 0.5746000 46.43000 0.4628000 -0.4821000     0.7379000 
1 1 1 10 10 30 o 29.94000 0.3007000 30.32000 0.4673000 29.55000 0.3786000 0.7712000      0.6014000 
1 1 1 10 10 32 o 40.71000 0.3426000 41.30000 0.5362000 40.13000 0.4266000 1.172000       0.6853000 
1 1 1 10 10 34 o 36.86000 0.3274000 37.41000 0.5099000 36.31000 0.4109000 1.103000       0.6549000 
1 1 1 10 10 36 f 35.49000 0.5056000 35.86000 0.9227000 35.13000 0.4138000 0.7379000      1.011000  
1 1 1 10 10 38 o 53.21000 0.4784000 53.26000 0.8036000 53.16000 0.5194000 0.1026000      0.9569000 
1 1 1 10 10 40 o 24.59000 0.3527000 24.38000 0.5234000 24.81000 0.4729000 -0.4335000     0.7054000 
1 1 1 10 10 42 o 5.121000 1.130000  5.268000 1.585000  4.975000 1.610000  0.2929000      2.259000  
1 1 1 10 10 44 o 33.08000 0.3467000 33.15000 0.5409000 33.01000 0.4339000 0.1345000      0.6935000 
1 1 1 10 10 46 o 23.58000 0.3931000 24.28000 0.5430000 22.89000 0.5685000 1.395000       0.7861000 
1 1 1 10 10 48 o 23.17000 0.3704000 23.57000 0.5589000 22.78000 0.4863000 0.7863000      0.7409000 
1 1 1 10 10 50 o 18.03000 0.4444000 17.04000 0.7341000 19.02000 0.5010000 -1.981000      0.8887000 
1 1 1 10 10 52 o 9.381000 0.6356000 9.492000 0.9545000 9.270000 0.8396000 0.2214000      1.271000  
1 1 1 10 10 54 o 10.41000 0.5260000 11.05000 0.7888000 9.768000 0.6961000 1.284000       1.052000  
1 1 1 10 10 56 o 6.047000 0.9252000 5.188000 1.578000  6.905000 0.9663000 -1.717000      1.850000  
1 1 1 10 10 58 o 8.571000 0.7245000 9.094000 0.9951000 8.048000 1.053000  1.045000       1.449000  
1 1 1 10 10 60 o 7.754000 1.204000  6.639000 2.266000  8.869000 0.8141000 -2.230000      2.408000  
1 1 1 10 10 62 o 6.086000 1.011000  5.897000 1.558000  6.275000 1.287000  -0.3775000     2.021000  
1 1 1 10 10 64 o 4.177000 1.072000  4.614000 1.643000  3.741000 1.376000  0.8731000      2.143000  
1 1 1 10 11 1  o 62.20000 0.4323000 62.14000 0.6105000 62.26000 0.6123000 -0.1232000     0.8646000 
1 1 1 10 11 3  o 73.34000 0.5861000 73.50000 0.8304000 73.18000 0.8274000 0.3181000      1.172000  
1 1 1 10 11 5  o 27.65000 0.2188000 27.49000 0.3085000 27.80000 0.3103000 -0.3123000     0.4376000 
1 1 1 10 11 7  o 31.39000 0.2621000 31.25000 0.3404000 31.53000 0.3986000 -0.2772000     0.5242000 
1 1 1 10 11 9  o 100.0000 0.7095000 100.0000 0.8667000 100.1000 1.124000  -0.2475000E-01 1.419000  
1 1 1 10 11 11 f 104.0000 0.7710000 103.6000 1.004000  104.4000 1.171000  -0.7711000     1.542000  
1 1 1 10 11 13 o 37.94000 0.3147000 37.76000 0.4054000 38.13000 0.4816000 -0.3728000     0.6295000 
1 1 1 10 11 15 o 141.4000 0.9962000 141.5000 1.220000  141.2000 1.575000  0.2965000      1.992000  
1 1 1 10 11 17 o 42.35000 0.3343000 42.32000 0.4024000 42.37000 0.5340000 -0.4995000E-01 0.6686000 
1 1 1 10 11 19 o 7.796000 0.6590000 8.767000 0.6272000 6.825000 1.159000  1.941000       1.318000  
1 1 1 10 11 21 o 106.0000 0.7897000 105.7000 1.028000  106.4000 1.199000  -0.6861000     1.579000  
1 1 1 10 11 23 o 30.87000 0.3400000 31.51000 0.4865000 30.22000 0.4752000 1.298000       0.6801000 
1 1 1 10 11 25 o 67.94000 0.5705000 68.24000 0.9613000 67.64000 0.6146000 0.5956000      1.141000  
1 1 1 10 11 27 o 55.02000 0.4195000 55.72000 0.6631000 54.32000 0.5142000 1.402000       0.8391000 
1 1 1 10 11 29 o 25.01000 0.2964000 25.08000 0.4576000 24.94000 0.3768000 0.1379000      0.5928000 
1 1 1 10 11 31 o 35.37000 0.3198000 35.71000 0.5006000 35.03000 0.3981000 0.6810000      0.6396000 
1 1 1 10 11 33 o 19.49000 0.3211000 19.68000 0.4678000 19.31000 0.4401000 0.3734000      0.6423000 
1 1 1 10 11 35 o 19.81000 0.3341000 20.02000 0.4869000 19.60000 0.4578000 0.4201000      0.6683000 
1 1 1 10 11 37 o 29.95000 0.3821000 30.27000 0.6508000 29.63000 0.4006000 0.6375000      0.7643000 
1 1 1 10 11 39 o 27.12000 0.3661000 26.86000 0.5103000 27.39000 0.5252000 -0.5350000     0.7323000 
1 1 1 10 11 41 f 36.70000 0.3472000 36.81000 0.5421000 36.60000 0.4341000 0.2071000      0.6945000 
1 1 1 10 11 43 o 54.63000 0.4342000 55.15000 0.6839000 54.10000 0.5350000 1.052000       0.8683000 
1 1 1 10 11 45 o 23.98000 0.3547000 23.49000 0.5598000 24.47000 0.4358000 -0.9736000     0.7095000 
1 1 1 10 11 47 o 7.281000 1.059000  6.713000 1.631000  7.848000 1.352000  -1.136000      2.118000  
1 1 1 10 11 49 o 22.74000 0.4909000 ?        ?         22.74000 0.4909000 ?              ?         
1 1 1 10 11 51 o 21.01000 0.3594000 21.15000 0.5433000 20.87000 0.4705000 0.2808000      0.7187000 
1 1 1 10 11 53 o 17.94000 0.3722000 17.73000 0.5975000 18.14000 0.4441000 -0.4061000     0.7445000 
1 1 1 10 11 55 o 5.851000 0.8925000 5.125000 1.533000  6.576000 0.9141000 -1.451000      1.785000  
1 1 1 10 11 57 o 3.309000 0.9778000 3.777000 1.523000  2.841000 1.227000  0.9365000      1.956000  
1 1 1 10 11 59 o 5.700000 1.019000  5.384000 1.790000  6.016000 0.9750000 -0.6318000     2.038000  
1 1 1 10 11 61 o 4.021000 1.054000  4.308000 1.632000  3.735000 1.334000  0.5729000      2.108000  
1 1 1 10 11 63 o 4.317000 1.068000  4.724000 1.629000  3.909000 1.381000  0.8152000      2.136000  
1 1 1 10 11 65 o 3.595000 1.045000  3.671000 1.636000  3.518000 1.299000  0.1529000      2.089000  
1 1 1 10 12 0  o 49.91000 0.4990000 49.91000 0.4990000 49.91000 0.4990000 0.000000       0.000000  
1 1 1 10 12 2  o 70.68000 0.4888000 70.15000 0.6860000 71.22000 0.6965000 -1.069000      0.9776000 
1 1 1 10 12 4  o 38.41000 0.2815000 37.93000 0.3926000 38.88000 0.4034000 -0.9548000     0.5629000 
1 1 1 10 12 6  o 143.0000 1.380000  141.2000 1.927000  144.8000 1.977000  -3.620000      2.761000  
1 1 1 10 12 8  o 145.9000 1.148000  146.7000 1.632000  145.2000 1.616000  1.449000       2.297000  
1 1 1 10 12 10 o 147.1000 1.082000  148.3000 1.431000  145.9000 1.624000  2.440000       2.165000  
1 1 1 10 12 12 o 47.58000 0.3574000 47.72000 0.4326000 47.44000 0.5690000 0.2801000      0.7148000 
1 1 1 10 12 14 o 56.03000 0.4325000 56.06000 0.5584000 56.00000 0.6605000 0.6269000E-01  0.8649000 
1 1 1 10 12 16 o 13.21000 0.2890000 12.85000 0.3221000 13.57000 0.4798000 -0.7216000     0.5779000 
1 1 1 10 12 18 o 65.49000 0.5672000 65.96000 0.6558000 65.01000 0.9256000 0.9477000      1.134000  
1 1 1 10 12 20 o 49.34000 0.4007000 48.85000 0.5143000 49.84000 0.6147000 -0.9904000     0.8015000 
1 1 1 10 12 22 o 98.57000 0.6813000 99.06000 0.9670000 98.08000 0.9602000 0.9734000      1.363000  
1 1 1 10 12 24 o 92.96000 1.054000  93.04000 1.824000  92.89000 1.055000  0.1481000      2.107000  
1 1 1 10 12 26 o 115.5000 0.8213000 116.2000 1.302000  114.8000 1.002000  1.369000       1.643000  
1 1 1 10 12 28 o 65.44000 0.4847000 65.33000 0.7597000 65.55000 0.6022000 -0.2196000     0.9695000 
1 1 1 10 12 30 o 15.56000 0.3442000 15.96000 0.5306000 15.16000 0.4386000 0.8000000      0.6884000 
1 1 1 10 12 32 o 36.83000 0.3256000 36.48000 0.5049000 37.17000 0.4112000 -0.6888000     0.6512000 
1 1 1 10 12 34 o 51.46000 0.4535000 51.27000 0.6282000 51.65000 0.6542000 -0.3847000     0.9070000 
1 1 1 10 12 36 o 13.17000 0.4999000 13.40000 0.8167000 12.94000 0.5767000 0.4619000      0.9998000 
1 1 1 10 12 38 o 32.07000 0.3841000 32.66000 0.6205000 31.48000 0.4527000 1.178000       0.7681000 
1 1 1 10 12 40 o 33.88000 0.3392000 34.37000 0.5320000 33.38000 0.4208000 0.9973000      0.6783000 
1 1 1 10 12 42 o 11.76000 0.5700000 10.54000 0.9731000 12.98000 0.5940000 -2.444000      1.140000  
1 1 1 10 12 44 o 37.56000 0.3928000 38.20000 0.5565000 36.93000 0.5546000 1.267000       0.7857000 
1 1 1 10 12 46 o 30.55000 0.4257000 30.28000 0.6482000 30.82000 0.5520000 -0.5389000     0.8513000 
1 1 1 10 12 48 o 7.661000 0.8555000 6.066000 1.549000  9.256000 0.7257000 -3.190000      1.711000  
1 1 1 10 12 50 o 20.73000 0.4152000 21.07000 0.7064000 20.40000 0.4367000 0.6700000      0.8305000 
1 1 1 10 12 52 o 6.640000 0.8236000 6.939000 1.246000  6.342000 1.077000  0.5971000      1.647000  
1 1 1 10 12 54 o 4.513000 0.9872000 4.722000 1.500000  4.305000 1.284000  0.4171000      1.974000  
1 1 1 10 12 56 o 19.51000 0.3756000 20.05000 0.5925000 18.96000 0.4618000 1.088000       0.7512000 
1 1 1 10 12 58 o 17.44000 0.4164000 17.65000 0.6067000 17.23000 0.5707000 0.4235000      0.8329000 
1 1 1 10 12 60 o 5.676000 1.086000  5.528000 1.793000  5.823000 1.227000  -0.2954000     2.172000  
1 1 1 10 12 62 o 7.125000 0.8787000 7.861000 1.234000  6.388000 1.251000  1.473000       1.757000  
1 1 1 10 12 64 o 6.045000 1.140000  5.749000 1.918000  6.341000 1.233000  -0.5922000     2.280000  
1 1 1 10 13 1  o 28.54000 0.2460000 28.72000 0.3766000 28.37000 0.3167000 0.3595000      0.4921000 
1 1 1 10 13 3  o 67.28000 0.4675000 67.52000 0.6632000 67.04000 0.6590000 0.4821000      0.9349000 
1 1 1 10 13 5  o 67.54000 0.5453000 66.77000 0.7626000 68.32000 0.7797000 -1.550000      1.091000  
1 1 1 10 13 7  o 34.44000 0.4534000 34.05000 0.4383000 34.83000 0.7937000 -0.7873000     0.9067000 
1 1 1 10 13 9  o 118.1000 1.146000  118.9000 1.631000  117.3000 1.610000  1.628000       2.292000  
1 1 1 10 13 11 o 104.5000 0.7428000 103.8000 0.9001000 105.2000 1.182000  -1.410000      1.486000  
1 1 1 10 13 13 f 51.43000 0.3851000 50.85000 0.4594000 52.02000 0.6182000 -1.168000      0.7702000 
1 1 1 10 13 15 o 45.06000 0.3912000 44.83000 0.5458000 45.30000 0.5605000 -0.4674000     0.7823000 
1 1 1 10 13 17 o 46.91000 0.4162000 46.34000 0.4311000 47.48000 0.7121000 -1.135000      0.8324000 
1 1 1 10 13 19 o 39.99000 0.3377000 39.71000 0.5067000 40.27000 0.4467000 -0.5591000     0.6754000 
1 1 1 10 13 21 o 88.77000 0.6667000 88.54000 0.8681000 89.00000 1.012000  -0.4648000     1.333000  
1 1 1 10 13 23 o 99.09000 0.7903000 100.2000 1.126000  98.01000 1.109000  2.165000       1.581000  
1 1 1 10 13 25 o 49.12000 0.3821000 49.60000 0.6001000 48.64000 0.4731000 0.9643000      0.7642000 
1 1 1 10 13 27 o 36.57000 0.3194000 36.83000 0.4954000 36.32000 0.4032000 0.5127000      0.6387000 
1 1 1 10 13 29 o 67.43000 0.4994000 68.02000 0.7894000 66.83000 0.6121000 1.184000       0.9989000 
1 1 1 10 13 31 o 8.227000 0.5699000 8.087000 0.9182000 8.366000 0.6752000 -0.2792000     1.140000  
1 1 1 10 13 33 o 35.85000 0.3236000 36.21000 0.5015000 35.49000 0.4092000 0.7190000      0.6472000 
1 1 1 10 13 35 o 22.72000 0.3825000 23.09000 0.5828000 22.36000 0.4955000 0.7279000      0.7650000 
1 1 1 10 13 37 o 22.63000 0.3609000 22.15000 0.5927000 23.11000 0.4119000 -0.9601000     0.7218000 
1 1 1 10 13 39 o 17.48000 0.3865000 17.38000 0.5884000 17.58000 0.5012000 -0.1979000     0.7729000 
1 1 1 10 13 41 o 14.66000 0.4603000 14.02000 0.7601000 15.30000 0.5193000 -1.272000      0.9205000 
1 1 1 10 13 43 o 17.87000 0.4734000 17.67000 0.7690000 18.07000 0.5524000 -0.4065000     0.9468000 
1 1 1 10 13 45 o 15.53000 0.4448000 15.08000 0.7085000 15.97000 0.5381000 -0.8956000     0.8896000 
1 1 1 10 13 47 o 8.422000 0.7487000 8.667000 1.139000  8.177000 0.9724000 0.4898000      1.497000  
1 1 1 10 13 49 o 18.67000 0.5203000 19.89000 0.9178000 17.45000 0.4905000 2.444000       1.041000  
1 1 1 10 13 51 o 12.58000 0.5159000 13.10000 0.7268000 12.07000 0.7325000 1.025000       1.032000  
1 1 1 10 13 53 o 8.183000 0.6050000 8.217000 0.9556000 8.148000 0.7421000 0.6840000E-01  1.210000  
1 1 1 10 13 55 o 10.07000 0.5765000 9.364000 0.9777000 10.77000 0.6113000 -1.408000      1.153000  
1 1 1 10 13 57 o 6.542000 0.8100000 6.658000 1.255000  6.425000 1.025000  0.2325000      1.620000  
1 1 1 10 13 59 f 3.924000 1.102000  3.895000 1.646000  3.954000 1.464000  -0.5862000E-01 2.203000  
1 1 1 10 13 61 o 8.408000 0.8154000 9.830000 1.233000  6.985000 1.067000  2.845000       1.631000  
1 1 1 10 13 63 o 5.468000 1.067000  6.002000 1.651000  4.934000 1.352000  1.068000       2.134000  
1 1 1 10 13 65 o 6.016000 1.013000  6.640000 1.611000  5.392000 1.227000  1.247000       2.026000  
1 1 1 10 14 0  o 177.7000 1.707000  177.7000 1.707000  177.7000 1.707000  0.000000       0.000000  
1 1 1 10 14 2  o 63.81000 0.4447000 63.80000 0.6287000 63.82000 0.6292000 -0.2228000E-01 0.8895000 
1 1 1 10 14 4  o 137.5000 1.013000  138.2000 1.334000  136.8000 1.524000  1.372000       2.025000  
1 1 1 10 14 6  o 79.48000 0.7137000 79.64000 0.9013000 79.31000 1.107000  0.3280000      1.427000  
1 1 1 10 14 8  o 89.86000 0.7165000 89.87000 1.013000  89.85000 1.014000  0.2888000E-01  1.433000  
1 1 1 10 14 10 o 119.8000 1.060000  119.5000 1.640000  120.2000 1.344000  -0.6479000     2.120000  
1 1 1 10 14 12 o 84.63000 0.6981000 84.04000 0.7344000 85.22000 1.187000  -1.178000      1.396000  
1 1 1 10 14 14 f 108.6000 0.7721000 107.7000 0.9337000 109.5000 1.230000  -1.792000      1.544000  
1 1 1 10 14 16 o 81.20000 0.6715000 80.55000 0.7062000 81.85000 1.142000  -1.307000      1.343000  
1 1 1 10 14 18 o 36.67000 0.3182000 36.92000 0.4789000 36.41000 0.4190000 0.5143000      0.6363000 
1 1 1 10 14 20 o 47.22000 0.5990000 47.36000 0.5910000 47.08000 1.042000  0.2785000      1.198000  
1 1 1 10 14 22 o 74.35000 0.6033000 74.60000 0.8520000 74.11000 0.8544000 0.4875000      1.207000  
1 1 1 10 14 24 o 56.62000 0.5121000 55.74000 0.8314000 57.50000 0.5980000 -1.756000      1.024000  
1 1 1 10 14 26 o 40.28000 0.3518000 39.90000 0.5198000 40.65000 0.4741000 -0.7503000     0.7035000 
1 1 1 10 14 28 o 46.37000 0.3685000 46.31000 0.5743000 46.43000 0.4620000 -0.1168000     0.7370000 
1 1 1 10 14 30 o 22.53000 0.2977000 22.86000 0.4619000 22.20000 0.3757000 0.6576000      0.5954000 
1 1 1 10 14 32 o 9.039000 0.5429000 8.751000 0.8710000 9.328000 0.6483000 -0.5763000     1.086000  
1 1 1 10 14 34 o 41.27000 0.3933000 42.36000 0.5538000 40.18000 0.5585000 2.180000       0.7865000 
1 1 1 10 14 36 o 26.29000 0.3195000 26.42000 0.4968000 26.15000 0.4018000 0.2732000      0.6390000 
1 1 1 10 14 38 o 46.29000 0.4808000 45.78000 0.7361000 46.80000 0.6189000 -1.021000      0.9616000 
1 1 1 10 14 40 o 41.59000 0.4390000 41.84000 0.7177000 41.35000 0.5058000 0.4861000      0.8781000 
1 1 1 10 14 42 o 24.71000 0.3835000 24.84000 0.6358000 24.58000 0.4292000 0.2581000      0.7670000 
1 1 1 10 14 44 o 21.72000 0.4112000 21.48000 0.7003000 21.97000 0.4312000 -0.4963000     0.8224000 
1 1 1 10 14 46 o 32.85000 0.3612000 32.07000 0.5378000 33.64000 0.4823000 -1.569000      0.7224000 
1 1 1 10 14 48 o 7.839000 0.7455000 7.090000 1.252000  8.589000 0.8094000 -1.499000      1.491000  
1 1 1 10 14 50 o 10.23000 0.7029000 10.33000 1.086000  10.13000 0.8931000 0.2049000      1.406000  
1 1 1 10 14 52 o 5.715000 0.9020000 5.573000 1.443000  5.857000 1.082000  -0.2839000     1.804000  
1 1 1 10 14 54 o 3.956000 0.9586000 3.540000 1.450000  4.372000 1.255000  -0.8320000     1.917000  
1 1 1 10 14 56 o 8.413000 0.6520000 9.175000 0.9725000 7.650000 0.8687000 1.525000       1.304000  
1 1 1 10 14 58 o 12.46000 0.5162000 11.71000 0.8550000 13.21000 0.5785000 -1.500000      1.032000  
1 1 1 10 14 60 o 10.95000 0.6529000 11.74000 1.102000  10.15000 0.7011000 1.587000       1.306000  
1 1 1 10 14 62 o 5.123000 1.025000  6.050000 1.550000  4.196000 1.341000  1.854000       2.050000  
1 1 1 10 14 64 o 4.630000 1.086000  4.862000 1.751000  4.399000 1.284000  0.4624000      2.171000  
1 1 1 10 15 1  o 25.69000 0.2797000 25.13000 0.4262000 26.25000 0.3622000 -1.113000      0.5593000 
1 1 1 10 15 3  o 33.80000 0.3041000 34.12000 0.4364000 33.47000 0.4235000 0.6473000      0.6081000 
1 1 1 10 15 5  o 159.6000 1.257000  160.1000 1.785000  159.1000 1.769000  1.065000       2.513000  
1 1 1 10 15 7  o 160.4000 1.261000  161.3000 1.793000  159.5000 1.774000  1.844000       2.522000  
1 1 1 10 15 9  o 55.57000 0.5180000 54.34000 0.7929000 56.80000 0.6667000 -2.466000      1.036000  
1 1 1 10 15 11 o 27.87000 0.3712000 27.54000 0.5281000 28.20000 0.5219000 -0.6541000     0.7424000 
1 1 1 10 15 13 o 58.76000 0.4530000 58.36000 0.5821000 59.16000 0.6943000 -0.8006000     0.9061000 
1 1 1 10 15 15 o 22.11000 0.4167000 20.93000 0.3586000 23.29000 0.7523000 -2.358000      0.8334000 
1 1 1 10 15 17 o 89.21000 0.6669000 89.07000 1.005000  89.35000 0.8764000 -0.2853000     1.334000  
1 1 1 10 15 19 o 25.01000 0.2835000 25.29000 0.4287000 24.74000 0.3710000 0.5438000      0.5670000 
1 1 1 10 15 21 o 50.91000 0.4375000 50.87000 0.6072000 50.95000 0.6301000 -0.8010000E-01 0.8751000 
1 1 1 10 15 23 o 33.69000 0.3167000 34.14000 0.4160000 33.23000 0.4777000 0.9126000      0.6334000 
1 1 1 10 15 25 o 16.21000 0.3482000 16.34000 0.5405000 16.08000 0.4391000 0.2525000      0.6964000 
1 1 1 10 15 27 o 30.92000 0.3184000 31.22000 0.4637000 30.63000 0.4365000 0.5912000      0.6369000 
1 1 1 10 15 29 o 19.57000 0.3068000 19.82000 0.4749000 19.32000 0.3884000 0.4992000      0.6135000 
1 1 1 10 15 31 o 26.45000 0.2960000 25.97000 0.4555000 26.93000 0.3782000 -0.9548000     0.5921000 
1 1 1 10 15 33 o 26.45000 0.3181000 26.42000 0.4705000 26.48000 0.4281000 -0.6270000E-01 0.6361000 
1 1 1 10 15 35 o 22.68000 0.3811000 22.94000 0.6003000 22.41000 0.4697000 0.5324000      0.7623000 
1 1 1 10 15 37 o 66.27000 0.5919000 67.03000 0.9671000 65.50000 0.6827000 1.533000       1.184000  
1 1 1 10 15 39 o 21.01000 0.4151000 20.33000 0.6802000 21.69000 0.4761000 -1.361000      0.8302000 
1 1 1 10 15 41 o 62.78000 0.4810000 63.00000 0.7574000 62.56000 0.5932000 0.4412000      0.9620000 
1 1 1 10 15 43 o 14.14000 0.4674000 14.47000 0.7593000 13.81000 0.5453000 0.6581000      0.9348000 
1 1 1 10 15 45 o 29.37000 0.3980000 30.31000 0.6772000 28.43000 0.4185000 1.873000       0.7961000 
1 1 1 10 15 47 o 33.78000 0.3587000 33.75000 0.5378000 33.82000 0.4749000 -0.6579000E-01 0.7174000 
1 1 1 10 15 49 o 5.850000 0.9053000 6.181000 1.427000  5.518000 1.114000  0.6629000      1.811000  
1 1 1 10 15 51 o 11.03000 0.6524000 10.56000 1.047000  11.49000 0.7791000 -0.9217000     1.305000  
1 1 1 10 15 53 o 3.722000 0.9741000 3.399000 1.425000  4.045000 1.329000  -0.6461000     1.948000  
1 1 1 10 15 55 o 7.665000 0.6951000 8.995000 1.017000  6.335000 0.9477000 2.661000       1.390000  
1 1 1 10 15 57 o 5.832000 0.9315000 5.520000 1.511000  6.143000 1.090000  -0.6232000     1.863000  
1 1 1 10 15 59 o 10.33000 0.6455000 9.493000 1.078000  11.17000 0.7106000 -1.673000      1.291000  
1 1 1 10 15 61 o 7.619000 0.8607000 7.463000 1.466000  7.776000 0.9027000 -0.3130000     1.721000  
1 1 1 10 15 63 o 7.624000 0.8353000 7.901000 1.357000  7.347000 0.9741000 0.5545000      1.671000  
1 1 1 10 16 0  o 67.16000 0.7695000 67.16000 0.7695000 67.16000 0.7695000 0.000000       0.000000  
1 1 1 10 16 2  o 112.6000 0.7940000 111.6000 1.248000  113.6000 0.9816000 -1.965000      1.588000  
1 1 1 10 16 4  o 106.8000 0.8466000 106.4000 1.192000  107.2000 1.202000  -0.7876000     1.693000  
1 1 1 10 16 6  o 99.10000 0.8826000 98.91000 1.111000  99.29000 1.372000  -0.3806000     1.765000  
1 1 1 10 16 8  o 101.8000 0.8092000 101.7000 1.144000  101.8000 1.145000  -0.6171000E-01 1.618000  
1 1 1 10 16 10 o 20.18000 0.2766000 20.05000 0.3843000 20.31000 0.3978000 -0.2536000     0.5531000 
1 1 1 10 16 12 o 58.06000 0.4844000 56.91000 0.6715000 59.21000 0.6984000 -2.302000      0.9688000 
1 1 1 10 16 14 o 117.8000 0.9591000 116.9000 1.012000  118.7000 1.630000  -1.834000      1.918000  
1 1 1 10 16 16 o 68.93000 0.6249000 68.31000 0.9596000 69.55000 0.8009000 -1.237000      1.250000  
1 1 1 10 16 18 o 58.76000 0.4580000 58.56000 0.6886000 58.95000 0.6042000 -0.3892000     0.9161000 
1 1 1 10 16 20 o 104.8000 0.8328000 104.6000 1.174000  104.9000 1.182000  -0.2547000     1.666000  
1 1 1 10 16 22 o 51.91000 0.4802000 51.49000 0.5402000 52.34000 0.7940000 -0.8495000     0.9604000 
1 1 1 10 16 24 o 16.85000 0.3144000 16.92000 0.4691000 16.78000 0.4187000 0.1351000      0.6288000 
1 1 1 10 16 26 o 12.32000 0.4256000 13.31000 0.5515000 11.33000 0.6484000 1.979000       0.8512000 
1 1 1 10 16 28 o 20.50000 0.2956000 20.56000 0.4529000 20.43000 0.3800000 0.1288000      0.5912000 
1 1 1 10 16 30 f 35.48000 0.3202000 35.99000 0.4991000 34.97000 0.4012000 1.028000       0.6403000 
1 1 1 10 16 32 o 38.31000 0.3502000 38.98000 0.5212000 37.65000 0.4678000 1.335000       0.7003000 
1 1 1 10 16 34 o 22.48000 0.3584000 22.53000 0.5887000 22.44000 0.4087000 0.9138000E-01  0.7167000 
1 1 1 10 16 36 o 47.56000 0.5327000 47.20000 0.7361000 47.92000 0.7701000 -0.7171000     1.065000  
1 1 1 10 16 38 o 18.85000 0.5706000 19.99000 1.016000  17.70000 0.5201000 2.291000       1.141000  
1 1 1 10 16 40 o 66.82000 0.5863000 68.20000 0.9983000 65.44000 0.6150000 2.761000       1.173000  
1 1 1 10 16 42 o 27.09000 0.3429000 27.13000 0.5431000 27.04000 0.4188000 0.9770000E-01  0.6859000 
1 1 1 10 16 44 o 25.84000 0.3408000 26.05000 0.5304000 25.63000 0.4280000 0.4252000      0.6816000 
1 1 1 10 16 46 o 18.01000 0.4039000 18.64000 0.6047000 17.38000 0.5355000 1.253000       0.8078000 
1 1 1 10 16 48 o 12.27000 0.7526000 12.51000 1.362000  12.04000 0.6410000 0.4763000      1.505000  
1 1 1 10 16 50 o 13.28000 0.4645000 13.26000 0.7370000 13.30000 0.5656000 -0.3819000E-01 0.9290000 
1 1 1 10 16 52 o 10.78000 0.5095000 11.50000 0.7682000 10.05000 0.6695000 1.454000       1.019000  
1 1 1 10 16 54 o 10.11000 0.5548000 10.05000 0.9421000 10.17000 0.5863000 -0.1119000     1.110000  
1 1 1 10 16 56 o 14.23000 0.4390000 14.58000 0.6411000 13.89000 0.6000000 0.6887000      0.8781000 
1 1 1 10 16 58 o 6.892000 1.237000  6.109000 2.185000  7.675000 1.161000  -1.566000      2.474000  
1 1 1 10 16 60 o 4.012000 0.9956000 3.701000 1.498000  4.323000 1.312000  -0.6224000     1.991000  
1 1 1 10 16 62 o 4.547000 1.061000  5.174000 1.598000  3.919000 1.396000  1.255000       2.122000  
1 1 1 10 16 64 o 4.243000 1.084000  4.381000 1.700000  4.105000 1.345000  0.2765000      2.168000  
1 1 1 10 17 1  o 100.0000 0.7078000 99.15000 1.113000  100.9000 0.8744000 -1.704000      1.416000  
1 1 1 10 17 3  o 73.28000 0.5249000 72.58000 0.8259000 73.99000 0.6482000 -1.405000      1.050000  
1 1 1 10 17 5  o 83.79000 0.7524000 84.12000 0.9516000 83.46000 1.166000  0.6512000      1.505000  
1 1 1 10 17 7  o 64.11000 0.5893000 64.64000 0.7476000 63.58000 0.9111000 1.062000       1.179000  
1 1 1 10 17 9  o 101.2000 0.9029000 101.2000 1.400000  101.3000 1.141000  -0.7811000E-01 1.806000  
1 1 1 10 17 11 o 50.08000 0.4777000 50.35000 0.6075000 49.81000 0.7375000 0.5398000      0.9554000 
1 1 1 10 17 13 o 36.69000 0.3610000 35.78000 0.3879000 37.59000 0.6088000 -1.814000      0.7219000 
1 1 1 10 17 15 o 74.96000 0.5650000 74.22000 0.8456000 75.69000 0.7494000 -1.472000      1.130000  
1 1 1 10 17 17 o 78.86000 0.5929000 78.50000 0.8901000 79.22000 0.7836000 -0.7196000     1.186000  
1 1 1 10 17 19 o 50.92000 0.4346000 51.32000 0.6167000 50.52000 0.6125000 0.7950000      0.8692000 
1 1 1 10 17 21 o 55.60000 0.4376000 56.27000 0.5786000 54.93000 0.6566000 1.343000       0.8751000 
1 1 1 10 17 23 f 45.26000 0.3766000 45.55000 0.5664000 44.96000 0.4965000 0.5845000      0.7532000 
1 1 1 10 17 25 f 42.11000 0.3650000 42.45000 0.5559000 41.78000 0.4732000 0.6777000      0.7300000 
1 1 1 10 17 27 o 17.42000 0.3068000 17.98000 0.4583000 16.86000 0.4081000 1.121000       0.6136000 
1 1 1 10 17 29 f 8.341000 0.5407000 8.707000 0.8434000 7.975000 0.6768000 0.7317000      1.081000  
1 1 1 10 17 31 o 35.16000 0.3212000 35.56000 0.5019000 34.77000 0.4010000 0.7971000      0.6424000 
1 1 1 10 17 33 o 61.18000 0.4855000 62.05000 0.7346000 60.30000 0.6350000 1.751000       0.9710000 
1 1 1 10 17 35 o 11.39000 0.5624000 12.31000 0.8665000 10.46000 0.7172000 1.848000       1.125000  
1 1 1 10 17 37 o 7.855000 0.7371000 8.283000 1.203000  7.426000 0.8519000 0.8567000      1.474000  
1 1 1 10 17 39 o 53.96000 0.4971000 54.59000 0.8428000 53.34000 0.5273000 1.251000       0.9942000 
1 1 1 10 17 41 o 23.02000 0.3615000 23.44000 0.5679000 22.61000 0.4475000 0.8311000      0.7230000 
1 1 1 10 17 43 o 14.31000 0.4562000 14.86000 0.7061000 13.76000 0.5778000 1.104000       0.9124000 
1 1 1 10 17 45 o 6.361000 0.9551000 5.601000 1.600000  7.121000 1.043000  -1.519000      1.910000  
1 1 1 10 17 47 o 4.790000 0.9689000 6.219000 1.410000  3.362000 1.329000  2.857000       1.938000  
1 1 1 10 17 49 o 7.008000 0.7627000 6.758000 1.323000  7.257000 0.7587000 -0.4992000     1.525000  
1 1 1 10 17 51 o 7.238000 0.8282000 7.621000 1.270000  6.855000 1.063000  0.7667000      1.656000  
1 1 1 10 17 53 f 4.406000 1.011000  4.390000 1.554000  4.421000 1.294000  -0.3069000E-01 2.023000  
1 1 1 10 17 55 o 6.761000 0.9650000 7.056000 1.264000  6.466000 1.458000  0.5906000      1.930000  
1 1 1 10 17 57 o 9.972000 0.8455000 8.314000 1.470000  11.63000 0.8352000 -3.317000      1.691000  
1 1 1 10 17 59 o 5.147000 1.079000  4.154000 1.729000  6.140000 1.290000  -1.987000      2.158000  
1 1 1 10 17 61 o 6.174000 0.8751000 6.836000 1.295000  5.512000 1.178000  1.324000       1.750000  
1 1 1 10 17 63 o 2.993000 0.9412000 3.145000 1.448000  2.840000 1.203000  0.3051000      1.882000  
1 1 1 10 18 0  o 85.16000 0.9626000 85.16000 0.9626000 85.16000 0.9626000 0.000000       0.000000  
1 1 1 10 18 2  o 93.22000 0.6635000 93.24000 1.051000  93.19000 0.8100000 0.4293000E-01  1.327000  
1 1 1 10 18 4  o 104.6000 0.7416000 104.2000 1.170000  105.0000 0.9117000 -0.7976000     1.483000  
1 1 1 10 18 6  o 23.92000 0.3533000 23.32000 0.5093000 24.52000 0.4896000 -1.206000      0.7065000 
1 1 1 10 18 8  o 104.6000 0.8318000 103.9000 1.168000  105.3000 1.184000  -1.376000      1.664000  
1 1 1 10 18 10 o 85.08000 0.7635000 85.38000 0.9695000 84.78000 1.180000  0.5964000      1.527000  
1 1 1 10 18 12 o 25.60000 0.3443000 25.97000 0.5292000 25.23000 0.4406000 0.7309000      0.6886000 
1 1 1 10 18 14 o 56.00000 0.4350000 55.84000 0.6537000 56.16000 0.5740000 -0.3260000     0.8699000 
1 1 1 10 18 16 o 62.33000 0.4781000 62.40000 0.7197000 62.25000 0.6295000 0.1572000      0.9562000 
1 1 1 10 18 18 f 26.10000 0.2951000 25.39000 0.3629000 26.81000 0.4655000 -1.423000      0.5903000 
1 1 1 10 18 20 o 36.79000 0.3247000 36.87000 0.4256000 36.71000 0.4905000 0.1583000      0.6494000 
1 1 1 10 18 22 o 88.66000 0.8024000 88.28000 1.003000  89.03000 1.253000  -0.7524000     1.605000  
1 1 1 10 18 24 o 35.86000 0.3061000 35.44000 0.4251000 36.28000 0.4405000 -0.8346000     0.6121000 
1 1 1 10 18 26 o 59.60000 0.4723000 59.45000 0.7132000 59.76000 0.6194000 -0.3124000     0.9446000 
1 1 1 10 18 28 o 7.314000 0.6430000 6.998000 1.060000  7.629000 0.7276000 -0.6310000     1.286000  
1 1 1 10 18 30 o 17.82000 0.3168000 18.19000 0.4832000 17.45000 0.4100000 0.7429000      0.6337000 
1 1 1 10 18 32 o 25.07000 0.3209000 25.02000 0.4777000 25.12000 0.4286000 -0.1003000     0.6417000 
1 1 1 10 18 34 f 24.82000 0.3623000 25.62000 0.5807000 24.02000 0.4336000 1.592000       0.7247000 
1 1 1 10 18 36 o 28.02000 0.3876000 27.85000 0.6184000 28.18000 0.4675000 -0.3267000     0.7752000 
1 1 1 10 18 38 o 20.48000 0.3721000 20.65000 0.5593000 20.30000 0.4909000 0.3564000      0.7442000 
1 1 1 10 18 40 o 36.05000 0.3524000 36.46000 0.5558000 35.65000 0.4333000 0.8129000      0.7048000 
1 1 1 10 18 42 o 25.07000 0.3484000 25.42000 0.5488000 24.73000 0.4294000 0.6823000      0.6968000 
1 1 1 10 18 44 o 18.65000 0.3899000 18.21000 0.6256000 19.10000 0.4653000 -0.8871000     0.7797000 
1 1 1 10 18 46 o 15.05000 0.4165000 15.60000 0.6460000 14.50000 0.5260000 1.102000       0.8330000 
1 1 1 10 18 48 o 3.001000 0.9397000 2.912000 1.374000  3.089000 1.282000  -0.1766000     1.879000  
1 1 1 10 18 50 o 18.49000 0.3617000 18.32000 0.5672000 18.67000 0.4488000 -0.3428000     0.7233000 
1 1 1 10 18 52 o 13.80000 0.4468000 13.02000 0.7171000 14.58000 0.5331000 -1.565000      0.8935000 
1 1 1 10 18 54 o 19.10000 0.3790000 18.70000 0.6107000 19.50000 0.4490000 -0.8065000     0.7579000 
1 1 1 10 18 56 o 7.203000 0.7537000 8.213000 1.056000  6.194000 1.075000  2.019000       1.507000  
1 1 1 10 18 58 o 4.609000 1.053000  4.510000 1.646000  4.707000 1.313000  -0.1969000     2.106000  
1 1 1 10 18 60 o 4.739000 1.062000  5.056000 1.550000  4.422000 1.452000  0.6341000      2.124000  
1 1 1 10 18 62 o 4.267000 1.095000  4.196000 1.728000  4.338000 1.344000  -0.1417000     2.189000  
1 1 1 10 19 1  o 40.79000 0.3068000 41.32000 0.4393000 40.26000 0.4284000 1.058000       0.6136000 
1 1 1 10 19 3  o 24.95000 0.2388000 24.78000 0.3884000 25.11000 0.2777000 -0.3317000     0.4775000 
1 1 1 10 19 5  o 66.36000 0.7751000 65.82000 0.7611000 66.90000 1.351000  -1.072000      1.550000  
1 1 1 10 19 7  o 82.85000 0.7439000 83.41000 0.9478000 82.29000 1.147000  1.114000       1.488000  
1 1 1 10 19 9  o 76.45000 0.6910000 77.47000 0.8864000 75.43000 1.060000  2.036000       1.382000  
1 1 1 10 19 11 f 89.62000 0.8037000 89.40000 1.243000  89.84000 1.020000  -0.4374000     1.607000  
1 1 1 10 19 13 o 166.0000 1.460000  165.0000 2.250000  167.0000 1.861000  -2.078000      2.920000  
1 1 1 10 19 15 o 42.88000 0.4300000 42.55000 0.6538000 43.20000 0.5586000 -0.6504000     0.8600000 
1 1 1 10 19 17 o 101.9000 0.7035000 101.4000 0.9897000 102.4000 1.000000  -0.9900000     1.407000  
1 1 1 10 19 19 o 45.24000 0.4249000 44.03000 0.4789000 46.44000 0.7020000 -2.404000      0.8498000 
1 1 1 10 19 21 o 56.18000 0.4109000 56.93000 0.5859000 55.43000 0.5764000 1.494000       0.8219000 
1 1 1 10 19 23 o 62.69000 0.4883000 62.94000 0.7378000 62.45000 0.6398000 0.4995000      0.9766000 
1 1 1 10 19 25 o 53.44000 0.5736000 53.08000 0.8001000 53.80000 0.8221000 -0.7219000     1.147000  
1 1 1 10 19 27 o 69.23000 0.4966000 69.80000 0.7053000 68.66000 0.6994000 1.139000       0.9932000 
1 1 1 10 19 29 o 43.50000 0.3572000 44.20000 0.5607000 42.79000 0.4425000 1.403000       0.7143000 
1 1 1 10 19 31 o 19.32000 0.3495000 19.91000 0.5779000 18.74000 0.3934000 1.172000       0.6991000 
1 1 1 10 19 33 o 29.00000 0.3573000 29.17000 0.5705000 28.84000 0.4304000 0.3280000      0.7146000 
1 1 1 10 19 35 o 26.53000 0.3725000 26.93000 0.6275000 26.13000 0.4016000 0.7982000      0.7450000 
1 1 1 10 19 37 o 31.78000 0.3455000 31.52000 0.5145000 32.04000 0.4612000 -0.5224000     0.6910000 
1 1 1 10 19 39 o 32.73000 0.3895000 32.84000 0.6566000 32.62000 0.4193000 0.2248000      0.7791000 
1 1 1 10 19 41 o 29.64000 0.3401000 30.06000 0.5270000 29.21000 0.4302000 0.8530000      0.6803000 
1 1 1 10 19 43 o 15.26000 0.4308000 15.87000 0.6556000 14.65000 0.5590000 1.219000       0.8616000 
1 1 1 10 19 45 o 11.94000 0.4832000 11.83000 0.7996000 12.04000 0.5426000 -0.2117000     0.9663000 
1 1 1 10 19 47 o 13.33000 0.5398000 13.91000 0.8604000 12.75000 0.6521000 1.161000       1.080000  
1 1 1 10 19 49 o 15.26000 0.4195000 15.87000 0.6412000 14.64000 0.5412000 1.227000       0.8391000 
1 1 1 10 19 51 f 11.05000 0.5246000 11.03000 0.8228000 11.07000 0.6508000 -0.3647000E-01 1.049000  
1 1 1 10 19 53 o 21.86000 0.3981000 22.20000 0.6643000 21.52000 0.4389000 0.6784000      0.7962000 
1 1 1 10 19 55 o 4.771000 1.040000  5.090000 1.472000  4.451000 1.470000  0.6395000      2.081000  
1 1 1 10 19 57 o 3.094000 0.9703000 2.922000 1.398000  3.265000 1.346000  -0.3429000     1.941000  
1 1 1 10 19 59 o 6.552000 1.105000  7.982000 1.532000  5.122000 1.593000  2.860000       2.210000  
1 1 1 10 19 61 o 7.625000 0.7818000 7.643000 1.200000  7.607000 1.002000  0.3606000E-01  1.564000  
1 1 1 10 19 63 o 6.032000 1.002000  5.259000 1.764000  6.804000 0.9501000 -1.545000      2.004000  
1 1 1 10 20 0  o 6.892000 0.5243000 6.892000 0.5243000 6.892000 0.5243000 0.000000       0.000000  
1 1 1 10 20 2  o 21.11000 0.2438000 21.72000 0.3837000 20.51000 0.3009000 1.213000       0.4876000 
1 1 1 10 20 4  o 55.68000 0.4596000 55.46000 0.6556000 55.90000 0.6444000 -0.4382000     0.9193000 
1 1 1 10 20 6  o 60.95000 0.5629000 61.71000 0.7204000 60.19000 0.8652000 1.521000       1.126000  
1 1 1 10 20 8  o 59.01000 0.6988000 58.15000 1.205000  59.87000 0.7076000 -1.718000      1.398000  
1 1 1 10 20 10 o 155.2000 1.368000  155.4000 2.120000  155.1000 1.730000  0.2989000      2.736000  
1 1 1 10 20 12 o 126.2000 1.118000  126.5000 1.734000  125.8000 1.410000  0.6377000      2.235000  
1 1 1 10 20 14 o 75.38000 0.5680000 74.41000 0.8469000 76.35000 0.7573000 -1.944000      1.136000  
1 1 1 10 20 16 f 61.00000 0.4375000 61.41000 0.6214000 60.59000 0.6160000 0.8264000      0.8750000 
1 1 1 10 20 18 o 76.34000 0.6527000 76.67000 0.7599000 76.00000 1.062000  0.6743000      1.305000  
1 1 1 10 20 20 o 57.80000 0.4214000 57.18000 0.5878000 58.43000 0.6040000 -1.248000      0.8428000 
1 1 1 10 20 22 o 19.68000 0.3309000 19.36000 0.4369000 20.00000 0.4970000 -0.6398000     0.6617000 
1 1 1 10 20 24 o 29.25000 0.3001000 29.02000 0.3935000 29.48000 0.4533000 -0.4590000     0.6002000 
1 1 1 10 20 26 o 25.86000 0.3121000 25.80000 0.4810000 25.93000 0.3977000 -0.1270000     0.6242000 
1 1 1 10 20 28 o 11.59000 0.6153000 11.37000 1.018000  11.81000 0.6916000 -0.4436000     1.231000  
1 1 1 10 20 30 o 13.19000 0.3818000 13.44000 0.5822000 12.95000 0.4940000 0.4905000      0.7636000 
1 1 1 10 20 32 o 7.296000 0.7102000 7.939000 1.028000  6.652000 0.9796000 1.287000       1.420000  
1 1 1 10 20 34 o 37.56000 0.3872000 38.26000 0.6467000 36.85000 0.4259000 1.410000       0.7744000 
1 1 1 10 20 36 o 33.15000 0.3535000 33.07000 0.5161000 33.22000 0.4834000 -0.1504000     0.7071000 
1 1 1 10 20 38 o 17.24000 0.3963000 17.75000 0.6159000 16.72000 0.4988000 1.029000       0.7926000 
1 1 1 10 20 40 f 15.11000 0.5162000 14.70000 0.8848000 15.51000 0.5320000 -0.8115000     1.032000  
1 1 1 10 20 42 o 15.56000 0.4296000 16.19000 0.6756000 14.94000 0.5309000 1.251000       0.8592000 
1 1 1 10 20 44 o 4.582000 1.085000  3.832000 1.541000  5.333000 1.528000  -1.501000      2.171000  
1 1 1 10 20 46 o 6.950000 0.8196000 6.772000 1.260000  7.129000 1.048000  -0.3572000     1.639000  
1 1 1 10 20 48 o 4.835000 0.9958000 4.182000 1.650000  5.488000 1.115000  -1.306000      1.992000  
1 1 1 10 20 50 o 20.81000 0.3568000 21.27000 0.5329000 20.35000 0.4745000 0.9129000      0.7136000 
1 1 1 10 20 52 f 11.14000 0.5732000 10.95000 0.9481000 11.32000 0.6444000 -0.3777000     1.146000  
1 1 1 10 20 54 o 9.662000 0.5962000 9.594000 0.9690000 9.730000 0.6949000 -0.1363000     1.192000  
1 1 1 10 20 56 o 9.508000 0.6218000 9.504000 1.011000  9.513000 0.7241000 -0.8832000E-02 1.244000  
1 1 1 10 20 58 o 6.053000 0.9929000 6.758000 1.501000  5.349000 1.300000  1.409000       1.986000  
1 1 1 10 20 60 o 5.266000 1.173000  5.523000 1.552000  5.008000 1.758000  0.5155000      2.345000  
1 1 1 10 20 62 o 4.602000 1.036000  4.383000 1.601000  4.821000 1.314000  -0.4382000     2.072000  
1 1 1 10 21 1  o 43.61000 0.4502000 43.19000 0.6223000 44.03000 0.6509000 -0.8415000     0.9005000 
1 1 1 10 21 3  o 20.25000 0.3173000 20.52000 0.4683000 19.98000 0.4282000 0.5434000      0.6345000 
1 1 1 10 21 5  o 73.68000 0.5559000 74.15000 0.8457000 73.22000 0.7218000 0.9226000      1.112000  
1 1 1 10 21 7  o 48.97000 0.6073000 48.96000 1.056000  48.98000 0.6007000 -0.2172000E-01 1.215000  
1 1 1 10 21 9  o 28.77000 0.4757000 29.29000 0.8338000 28.25000 0.4580000 1.036000       0.9513000 
1 1 1 10 21 11 o 33.58000 0.3714000 33.06000 0.5650000 34.10000 0.4822000 -1.042000      0.7428000 
1 1 1 10 21 13 o 32.53000 0.4904000 33.32000 0.7815000 31.74000 0.5926000 1.587000       0.9808000 
1 1 1 10 21 15 o 9.523000 0.4222000 9.378000 0.7221000 9.668000 0.4379000 -0.2897000     0.8445000 
1 1 1 10 21 17 o 37.00000 0.3211000 37.14000 0.4225000 36.85000 0.4837000 0.2890000      0.6423000 
1 1 1 10 21 19 o 46.41000 0.3528000 46.57000 0.4978000 46.26000 0.5002000 0.3045000      0.7057000 
1 1 1 10 21 21 o 24.05000 0.2619000 24.17000 0.3624000 23.94000 0.3782000 0.2340000      0.5238000 
1 1 1 10 21 23 o 47.82000 0.3986000 47.57000 0.5092000 48.06000 0.6134000 -0.4900000     0.7972000 
1 1 1 10 21 25 o 16.64000 0.3190000 16.61000 0.4369000 16.67000 0.4649000 -0.5853000E-01 0.6379000 
1 1 1 10 21 27 o 45.22000 0.3819000 45.09000 0.5731000 45.35000 0.5051000 -0.2581000     0.7639000 
1 1 1 10 21 29 o 21.49000 0.3382000 21.73000 0.5633000 21.26000 0.3744000 0.4729000      0.6764000 
1 1 1 10 21 31 o 35.24000 0.3810000 35.25000 0.6141000 35.23000 0.4512000 0.1720000E-01  0.7620000 
1 1 1 10 21 33 o 51.15000 0.4627000 51.57000 0.7766000 50.72000 0.5034000 0.8521000      0.9254000 
1 1 1 10 21 35 o 46.62000 0.4395000 46.99000 0.7379000 46.25000 0.4776000 0.7351000      0.8790000 
1 1 1 10 21 37 o 21.06000 0.4031000 20.09000 0.5710000 22.04000 0.5691000 -1.958000      0.8062000 
1 1 1 10 21 39 f 15.01000 0.4330000 14.87000 0.7077000 15.16000 0.4992000 -0.2851000     0.8660000 
1 1 1 10 21 41 o 5.773000 0.9996000 4.970000 1.639000  6.576000 1.145000  -1.606000      1.999000  
1 1 1 10 21 43 o 8.611000 0.7495000 9.015000 1.112000  8.207000 1.005000  0.8081000      1.499000  
1 1 1 10 21 45 o 19.94000 0.3459000 21.01000 0.5433000 18.86000 0.4282000 2.150000       0.6918000 
1 1 1 10 21 47 o 9.556000 0.6606000 10.27000 1.097000  8.839000 0.7364000 1.434000       1.321000  
1 1 1 10 21 49 o 8.593000 0.6651000 8.623000 1.032000  8.564000 0.8398000 0.5987000E-01  1.330000  
1 1 1 10 21 51 o 4.926000 1.110000  5.576000 1.749000  4.277000 1.368000  1.299000       2.221000  
1 1 1 10 21 53 o 6.658000 0.8354000 6.661000 1.402000  6.655000 0.9082000 0.6361000E-02  1.671000  
1 1 1 10 21 55 o 7.167000 0.8272000 7.820000 1.085000  6.513000 1.249000  1.308000       1.654000  
1 1 1 10 21 57 o 4.787000 1.052000  4.066000 1.563000  5.507000 1.408000  -1.441000      2.103000  
1 1 1 10 21 59 o 6.825000 1.013000  7.205000 1.713000  6.445000 1.083000  0.7607000      2.026000  
1 1 1 10 21 61 o 3.919000 1.048000  4.465000 1.593000  3.372000 1.361000  1.093000       2.095000  
1 1 1 10 22 0  o 3.794000 1.035000  3.794000 1.035000  3.794000 1.035000  0.000000       0.000000  
1 1 1 10 22 2  o 107.7000 0.7992000 109.0000 1.220000  106.3000 1.032000  2.669000       1.598000  
1 1 1 10 22 4  o 64.16000 0.4886000 63.36000 0.7321000 64.95000 0.6472000 -1.587000      0.9772000 
1 1 1 10 22 6  o 13.37000 0.2795000 12.92000 0.4899000 13.81000 0.2691000 -0.8882000     0.5589000 
1 1 1 10 22 8  f 16.27000 0.4059000 17.02000 0.6360000 15.51000 0.5044000 1.502000       0.8118000 
1 1 1 10 22 10 o 38.81000 0.4023000 38.38000 0.6079000 39.24000 0.5272000 -0.8600000     0.8046000 
1 1 1 10 22 12 o 21.77000 0.3131000 21.97000 0.4279000 21.58000 0.4571000 0.3941000      0.6261000 
1 1 1 10 22 14 o 108.0000 0.7447000 108.4000 1.056000  107.7000 1.051000  0.6715000      1.489000  
1 1 1 10 22 16 o 59.65000 0.4634000 59.25000 0.6037000 60.04000 0.7033000 -0.7882000     0.9269000 
1 1 1 10 22 18 o 45.94000 0.3768000 45.56000 0.4909000 46.32000 0.5717000 -0.7552000     0.7536000 
1 1 1 10 22 20 o 30.28000 0.2764000 30.04000 0.3872000 30.51000 0.3947000 -0.4654000     0.5529000 
1 1 1 10 22 22 o 32.36000 0.2858000 32.40000 0.4019000 32.32000 0.4064000 0.7359000E-01  0.5715000 
1 1 1 10 22 24 o 65.81000 0.5447000 66.39000 0.7741000 65.23000 0.7667000 1.162000       1.089000  
1 1 1 10 22 26 o 15.82000 0.4467000 15.51000 0.5564000 16.14000 0.6991000 -0.6267000     0.8934000 
1 1 1 10 22 28 o 45.33000 0.3806000 45.73000 0.5721000 44.92000 0.5022000 0.8049000      0.7613000 
1 1 1 10 22 30 o 32.92000 0.3127000 33.01000 0.4849000 32.83000 0.3950000 0.1806000      0.6254000 
1 1 1 10 22 32 o 4.000000 0.9294000 3.219000 1.430000  4.781000 1.187000  -1.562000      1.859000  
1 1 1 10 22 34 o 19.64000 0.4106000 19.61000 0.6702000 19.67000 0.4746000 -0.5777000E-01 0.8212000 
1 1 1 10 22 36 o 19.45000 0.3811000 19.17000 0.5906000 19.73000 0.4817000 -0.5640000     0.7621000 
1 1 1 10 22 38 o 17.05000 0.4026000 16.94000 0.6492000 17.17000 0.4762000 -0.2348000     0.8051000 
1 1 1 10 22 40 o 25.75000 0.3835000 25.85000 0.6372000 25.65000 0.4271000 0.1976000      0.7671000 
1 1 1 10 22 42 o 3.826000 1.031000  3.445000 1.460000  4.208000 1.458000  -0.7635000     2.063000  
1 1 1 10 22 44 o 12.45000 0.4857000 12.22000 0.7829000 12.69000 0.5751000 -0.4710000     0.9714000 
1 1 1 10 22 46 o 8.925000 0.8701000 7.575000 1.614000  10.27000 0.6515000 -2.699000      1.740000  
1 1 1 10 22 48 o 12.17000 0.5013000 12.34000 0.7993000 12.00000 0.6053000 0.3452000      1.003000  
1 1 1 10 22 50 o 5.555000 1.003000  5.985000 1.422000  5.125000 1.415000  0.8594000      2.006000  
1 1 1 10 22 52 o 8.781000 0.7911000 8.096000 1.432000  9.465000 0.6728000 -1.369000      1.582000  
1 1 1 10 22 54 o 3.218000 0.9849000 3.607000 1.483000  2.830000 1.297000  0.7769000      1.970000  
1 1 1 10 22 56 o 6.034000 1.106000  6.265000 1.774000  5.804000 1.320000  0.4608000      2.212000  
1 1 1 10 22 58 o 3.425000 0.9978000 3.599000 1.541000  3.250000 1.268000  0.3486000      1.996000  
1 1 1 10 22 60 o 4.441000 1.029000  4.668000 1.561000  4.214000 1.342000  0.4537000      2.059000  
1 1 1 10 22 62 o 8.574000 0.7176000 9.446000 1.142000  7.703000 0.8693000 1.744000       1.435000  
1 1 1 10 23 1  o 97.73000 0.6739000 98.30000 0.9585000 97.17000 0.9477000 1.130000       1.348000  
1 1 1 10 23 3  o 95.71000 0.7144000 95.92000 1.084000  95.50000 0.9306000 0.4192000      1.429000  
1 1 1 10 23 5  o 47.85000 0.3538000 47.51000 0.5019000 48.20000 0.4988000 -0.6902000     0.7076000 
1 1 1 10 23 7  o 90.16000 0.7696000 91.29000 1.268000  89.03000 0.8719000 2.266000       1.539000  
1 1 1 10 23 9  o 64.43000 0.5985000 64.71000 0.7507000 64.14000 0.9322000 0.5749000      1.197000  
1 1 1 10 23 11 o 65.50000 0.5444000 65.97000 0.7724000 65.04000 0.7674000 0.9288000      1.089000  
1 1 1 10 23 13 o 12.27000 0.2534000 12.22000 0.3577000 12.33000 0.3591000 -0.1145000     0.5069000 
1 1 1 10 23 15 f 60.08000 0.4662000 60.11000 0.6107000 60.05000 0.7045000 0.6002000E-01  0.9324000 
1 1 1 10 23 17 o 34.86000 0.3608000 35.59000 0.4768000 34.12000 0.5417000 1.465000       0.7217000 
1 1 1 10 23 19 o 23.75000 0.2548000 24.04000 0.3590000 23.47000 0.3615000 0.5717000      0.5095000 
1 1 1 10 23 21 f 32.89000 0.3655000 32.71000 0.5629000 33.07000 0.4664000 -0.3543000     0.7311000 
1 1 1 10 23 23 o 17.51000 0.3239000 17.66000 0.3740000 17.36000 0.5288000 0.3028000      0.6477000 
1 1 1 10 23 25 o 35.14000 0.3030000 35.09000 0.4257000 35.19000 0.4312000 -0.1005000     0.6059000 
1 1 1 10 23 27 o 18.18000 0.3221000 18.81000 0.4991000 17.56000 0.4073000 1.248000       0.6442000 
1 1 1 10 23 29 o 15.24000 0.3416000 15.63000 0.5216000 14.84000 0.4412000 0.7941000      0.6831000 
1 1 1 10 23 31 o 50.72000 0.4192000 50.78000 0.6257000 50.65000 0.5579000 0.1294000      0.8383000 
1 1 1 10 23 33 o 18.14000 0.3563000 17.96000 0.5677000 18.33000 0.4307000 -0.3702000     0.7126000 
1 1 1 10 23 35 o 26.85000 0.3725000 26.41000 0.6170000 27.28000 0.4176000 -0.8674000     0.7450000 
1 1 1 10 23 37 o 12.83000 0.6325000 12.26000 0.9885000 13.39000 0.7892000 -1.127000      1.265000  
1 1 1 10 23 39 o 21.55000 0.3558000 21.11000 0.5576000 21.99000 0.4420000 -0.8789000     0.7116000 
1 1 1 10 23 41 o 13.16000 0.4943000 13.65000 0.7310000 12.67000 0.6656000 0.9786000      0.9886000 
1 1 1 10 23 43 o 12.32000 0.5130000 12.30000 0.7892000 12.35000 0.6557000 -0.5306000E-01 1.026000  
1 1 1 10 23 45 o 32.42000 0.3415000 31.91000 0.5314000 32.93000 0.4292000 -1.021000      0.6831000 
1 1 1 10 23 47 o 15.52000 0.4651000 15.60000 0.7859000 15.45000 0.4977000 0.1577000      0.9302000 
1 1 1 10 23 49 o 12.51000 0.4751000 12.29000 0.7620000 12.73000 0.5676000 -0.4373000     0.9502000 
1 1 1 10 23 51 o 14.58000 0.4461000 14.40000 0.7127000 14.77000 0.5368000 -0.3703000     0.8922000 
1 1 1 10 23 53 o 2.774000 0.8605000 2.921000 1.319000  2.627000 1.105000  0.2938000      1.721000  
1 1 1 10 23 55 o 8.083000 0.7054000 8.642000 1.073000  7.525000 0.9165000 1.117000       1.411000  
1 1 1 10 23 57 o 3.519000 1.018000  3.798000 1.533000  3.240000 1.340000  0.5579000      2.036000  
1 1 1 10 23 59 o 6.570000 0.9745000 4.564000 1.786000  8.577000 0.7804000 -4.013000      1.949000  
1 1 1 10 23 61 o 4.023000 1.101000  3.823000 1.569000  4.224000 1.544000  -0.4002000     2.202000  
1 1 1 10 24 0  o 73.31000 0.7265000 73.31000 0.7265000 73.31000 0.7265000 0.000000       0.000000  
1 1 1 10 24 2  o 25.52000 0.2699000 25.74000 0.4233000 25.29000 0.3350000 0.4507000      0.5398000 
1 1 1 10 24 4  o 86.61000 0.6010000 86.66000 0.8520000 86.56000 0.8480000 0.9492000E-01  1.202000  
1 1 1 10 24 6  o 19.06000 0.3153000 19.38000 0.5161000 18.74000 0.3624000 0.6373000      0.6306000 
1 1 1 10 24 8  o 68.15000 0.5191000 68.38000 0.7879000 67.92000 0.6760000 0.4633000      1.038000  
1 1 1 10 24 10 o 80.83000 0.6713000 79.95000 0.7066000 81.71000 1.142000  -1.768000      1.343000  
1 1 1 10 24 12 o 53.98000 0.4575000 54.41000 0.6588000 53.54000 0.6352000 0.8690000      0.9151000 
1 1 1 10 24 14 o 39.52000 0.3665000 39.66000 0.5308000 39.38000 0.5056000 0.2726000      0.7331000 
1 1 1 10 24 16 f 19.80000 0.2918000 19.57000 0.4664000 20.03000 0.3508000 -0.4548000     0.5836000 
1 1 1 10 24 18 o 24.15000 0.2705000 23.51000 0.3544000 24.80000 0.4088000 -1.289000      0.5410000 
1 1 1 10 24 20 o 42.11000 0.4007000 42.15000 0.6490000 42.06000 0.4701000 0.9739000E-01  0.8013000 
1 1 1 10 24 22 o 93.73000 0.6529000 94.20000 0.9255000 93.26000 0.9212000 0.9385000      1.306000  
1 1 1 10 24 24 o 12.17000 0.4150000 11.90000 0.4933000 12.44000 0.6675000 -0.5402000     0.8300000 
1 1 1 10 24 26 o 28.16000 0.2777000 27.94000 0.3879000 28.38000 0.3976000 -0.4365000     0.5554000 
1 1 1 10 24 28 o 33.27000 0.3030000 33.56000 0.4265000 32.99000 0.4306000 0.5656000      0.6061000 
1 1 1 10 24 30 o 22.89000 0.3283000 23.16000 0.4665000 22.62000 0.4619000 0.5345000      0.6565000 
1 1 1 10 24 32 o 27.55000 0.3528000 27.97000 0.5872000 27.13000 0.3912000 0.8402000      0.7056000 
1 1 1 10 24 34 o 32.57000 0.3714000 33.18000 0.6162000 31.97000 0.4150000 1.213000       0.7429000 
1 1 1 10 24 36 o 51.38000 0.4353000 51.57000 0.6485000 51.20000 0.5809000 0.3737000      0.8707000 
1 1 1 10 24 38 o 5.766000 0.9754000 6.134000 1.493000  5.399000 1.255000  0.7351000      1.951000  
1 1 1 10 24 40 o 5.710000 1.344000  6.385000 2.277000  5.036000 1.428000  1.349000       2.688000  
1 1 1 10 24 42 o 12.91000 0.4843000 12.73000 0.7729000 13.09000 0.5838000 -0.3626000     0.9686000 
1 1 1 10 24 44 o 30.22000 0.3517000 30.59000 0.5213000 29.86000 0.4722000 0.7252000      0.7034000 
1 1 1 10 24 46 o 10.94000 0.6189000 11.28000 1.052000  10.60000 0.6523000 0.6820000      1.238000  
1 1 1 10 24 48 o 7.819000 0.6948000 8.440000 1.123000  7.198000 0.8182000 1.243000       1.390000  
1 1 1 10 24 50 o 16.92000 0.4455000 17.04000 0.5918000 16.79000 0.6660000 0.2430000      0.8910000 
1 1 1 10 24 52 o 4.457000 1.007000  4.503000 1.592000  4.412000 1.232000  0.9109000E-01  2.013000  
1 1 1 10 24 54 o 11.17000 0.5633000 11.51000 0.8981000 10.83000 0.6802000 0.6782000      1.127000  
1 1 1 10 24 56 o 8.947000 0.6582000 9.631000 0.9810000 8.264000 0.8778000 1.367000       1.316000  
1 1 1 10 24 58 o 3.407000 1.030000  3.942000 1.664000  2.872000 1.214000  1.070000       2.060000  
1 1 1 10 24 60 o 6.204000 0.9496000 6.204000 1.619000  6.204000 0.9927000 -0.6294000E-04 1.899000  
1 1 1 10 25 1  o 67.04000 0.5769000 65.85000 0.9305000 68.24000 0.6822000 -2.389000      1.154000  
1 1 1 10 25 3  o 25.24000 0.2742000 25.46000 0.4024000 25.02000 0.3725000 0.4389000      0.5483000 
1 1 1 10 25 5  o 39.04000 0.3773000 38.68000 0.6179000 39.40000 0.4331000 -0.7217000     0.7546000 
1 1 1 10 25 7  o 44.38000 0.3576000 44.92000 0.4869000 43.83000 0.5238000 1.091000       0.7151000 
1 1 1 10 25 9  o 19.11000 0.4805000 19.13000 0.4153000 19.09000 0.8667000 0.3503000E-01  0.9611000 
1 1 1 10 25 11 o 46.14000 0.4033000 46.56000 0.4424000 45.72000 0.6744000 0.8345000      0.8066000 
1 1 1 10 25 13 o 64.33000 0.5388000 64.46000 0.5820000 64.19000 0.9070000 0.2698000      1.078000  
1 1 1 10 25 15 o 69.72000 0.4962000 69.02000 0.6935000 70.42000 0.7100000 -1.406000      0.9925000 
1 1 1 10 25 17 o 47.29000 0.4547000 46.77000 0.5745000 47.81000 0.7050000 -1.033000      0.9094000 
1 1 1 10 25 19 o 11.51000 0.3069000 11.80000 0.4187000 11.22000 0.4490000 0.5862000      0.6139000 
1 1 1 10 25 21 o 31.62000 0.2864000 31.83000 0.4023000 31.42000 0.4077000 0.4070000      0.5727000 
1 1 1 10 25 23 o 15.63000 0.3813000 15.47000 0.5212000 15.79000 0.5567000 -0.3137000     0.7626000 
1 1 1 10 25 25 o 18.21000 0.2764000 18.29000 0.3917000 18.13000 0.3900000 0.1641000      0.5527000 
1 1 1 10 25 27 o 26.98000 0.3166000 26.98000 0.4873000 26.98000 0.4044000 0.4953000E-02  0.6332000 
1 1 1 10 25 29 o 44.26000 0.3799000 45.22000 0.5753000 43.29000 0.4962000 1.926000       0.7597000 
1 1 1 10 25 31 o 38.69000 0.3834000 38.12000 0.6330000 39.26000 0.4326000 -1.139000      0.7667000 
1 1 1 10 25 33 o 35.91000 0.3844000 36.64000 0.6410000 35.19000 0.4244000 1.445000       0.7688000 
1 1 1 10 25 35 o 14.32000 0.4606000 14.10000 0.7004000 14.54000 0.5983000 -0.4346000     0.9212000 
1 1 1 10 25 37 o 45.21000 0.4058000 45.87000 0.6042000 44.55000 0.5419000 1.321000       0.8116000 
1 1 1 10 25 39 o 6.775000 0.8565000 8.089000 1.091000  5.461000 1.320000  2.628000       1.713000  
1 1 1 10 25 41 f 39.49000 0.4179000 40.03000 0.7012000 38.96000 0.4550000 1.066000       0.8359000 
1 1 1 10 25 43 o 10.82000 0.6397000 11.14000 0.9747000 10.49000 0.8287000 0.6516000      1.279000  
1 1 1 10 25 45 o 8.716000 1.068000  7.887000 1.981000  9.545000 0.8015000 -1.658000      2.137000  
1 1 1 10 25 47 o 9.963000 0.5581000 10.09000 0.9285000 9.838000 0.6194000 0.2497000      1.116000  
1 1 1 10 25 49 o 13.42000 0.4699000 13.43000 0.6983000 13.40000 0.6291000 0.2751000E-01  0.9399000 
1 1 1 10 25 51 o 10.96000 0.5258000 11.38000 0.8254000 10.54000 0.6514000 0.8470000      1.052000  
1 1 1 10 25 53 o 9.567000 0.7286000 9.928000 1.173000  9.206000 0.8640000 0.7219000      1.457000  
1 1 1 10 25 55 o 9.126000 0.7590000 9.549000 1.326000  8.703000 0.7398000 0.8465000      1.518000  
1 1 1 10 25 57 o 9.341000 0.6353000 9.094000 1.053000  9.588000 0.7104000 -0.4945000     1.271000  
1 1 1 10 25 59 o 5.722000 1.052000  6.776000 1.564000  4.669000 1.409000  2.107000       2.105000  
1 1 1 10 25 61 o 4.480000 1.172000  4.403000 1.739000  4.558000 1.572000  -0.1542000     2.344000  
1 1 1 10 26 0  o 101.6000 1.400000  101.6000 1.400000  101.6000 1.400000  0.000000       0.000000  
1 1 1 10 26 2  o 14.97000 0.2787000 14.52000 0.4165000 15.42000 0.3704000 -0.9007000     0.5573000 
1 1 1 10 26 4  o 33.61000 0.2961000 33.89000 0.4049000 33.34000 0.4322000 0.5520000      0.5922000 
1 1 1 10 26 6  o 91.55000 0.6836000 91.76000 0.9010000 91.34000 1.028000  0.4248000      1.367000  
1 1 1 10 26 8  o 21.45000 0.3381000 21.02000 0.4485000 21.88000 0.5060000 -0.8609000     0.6762000 
1 1 1 10 26 10 o 85.09000 0.6983000 85.44000 0.7535000 84.75000 1.176000  0.6970000      1.397000  
1 1 1 10 26 12 o 53.53000 0.4068000 53.42000 0.4974000 53.64000 0.6438000 -0.2133000     0.8136000 
1 1 1 10 26 14 o 71.19000 0.6134000 71.00000 0.7092000 71.37000 1.001000  -0.3633000     1.227000  
1 1 1 10 26 16 o 75.17000 0.5723000 75.10000 0.7483000 75.23000 0.8662000 -0.1297000     1.145000  
1 1 1 10 26 18 o 56.95000 0.4164000 56.51000 0.5833000 57.38000 0.5944000 -0.8683000     0.8328000 
1 1 1 10 26 20 o 46.39000 0.3830000 46.61000 0.5776000 46.17000 0.5031000 0.4347000      0.7660000 
1 1 1 10 26 22 o 27.73000 0.3310000 27.29000 0.4363000 28.18000 0.4980000 -0.8858000     0.6621000 
1 1 1 10 26 24 o 16.98000 0.2862000 17.10000 0.3924000 16.87000 0.4168000 0.2285000      0.5725000 
1 1 1 10 26 26 o 14.17000 0.3167000 14.07000 0.4447000 14.27000 0.4510000 -0.2019000     0.6333000 
1 1 1 10 26 28 o 36.02000 0.3369000 36.08000 0.4976000 35.97000 0.4542000 0.1104000      0.6737000 
1 1 1 10 26 30 o 21.30000 0.3612000 21.45000 0.5618000 21.15000 0.4540000 0.2954000      0.7223000 
1 1 1 10 26 32 o 37.35000 0.3432000 37.45000 0.5370000 37.25000 0.4276000 0.2018000      0.6865000 
1 1 1 10 26 34 o 14.68000 0.4141000 15.05000 0.6455000 14.31000 0.5189000 0.7440000      0.8282000 
1 1 1 10 26 36 o 30.51000 0.3326000 30.75000 0.5133000 30.27000 0.4232000 0.4788000      0.6652000 
1 1 1 10 26 38 o 6.123000 0.9693000 7.359000 1.221000  4.887000 1.506000  2.472000       1.939000  
1 1 1 10 26 40 o 10.35000 0.5494000 10.33000 0.8828000 10.37000 0.6543000 -0.4033000E-01 1.099000  
1 1 1 10 26 42 o 22.18000 0.3885000 22.11000 0.5555000 22.25000 0.5434000 -0.1352000     0.7770000 
1 1 1 10 26 44 o 18.75000 0.4217000 19.21000 0.7076000 18.30000 0.4590000 0.9042000      0.8435000 
1 1 1 10 26 46 o 23.25000 0.3714000 22.64000 0.6186000 23.86000 0.4112000 -1.228000      0.7428000 
1 1 1 10 26 48 o 13.12000 0.5373000 13.12000 0.8826000 13.11000 0.6131000 0.9677000E-02  1.075000  
1 1 1 10 26 50 o 5.394000 0.9723000 5.126000 1.447000  5.662000 1.299000  -0.5360000     1.945000  
1 1 1 10 26 52 o 3.910000 1.046000  4.017000 1.560000  3.804000 1.394000  0.2131000      2.092000  
1 1 1 10 26 54 o 3.599000 1.077000  3.960000 1.670000  3.239000 1.359000  0.7207000      2.153000  
1 1 1 10 26 56 o 8.287000 0.7020000 7.536000 1.187000  9.038000 0.7493000 -1.502000      1.404000  
1 1 1 10 26 58 o 5.713000 1.027000  4.873000 1.733000  6.552000 1.100000  -1.679000      2.053000  
1 1 1 10 26 60 o 4.858000 1.070000  5.931000 1.663000  3.784000 1.346000  2.147000       2.140000  
1 1 1 10 27 1  o 34.18000 0.3362000 35.16000 0.5455000 33.21000 0.3933000 1.950000       0.6725000 
1 1 1 10 27 3  o 83.70000 0.5838000 84.66000 0.8356000 82.74000 0.8156000 1.918000       1.168000  
1 1 1 10 27 5  o 25.06000 0.2501000 25.11000 0.3693000 25.01000 0.3374000 0.9870000E-01  0.5003000 
1 1 1 10 27 7  o 42.76000 0.3304000 42.69000 0.4746000 42.84000 0.4599000 -0.1476000     0.6609000 
1 1 1 10 27 9  o 57.27000 0.4307000 56.73000 0.5198000 57.82000 0.6868000 -1.096000      0.8614000 
1 1 1 10 27 11 o 43.88000 0.3881000 44.41000 0.4305000 43.36000 0.6458000 1.049000       0.7761000 
1 1 1 10 27 13 o 61.42000 0.4771000 61.35000 0.6246000 61.49000 0.7213000 -0.1405000     0.9541000 
1 1 1 10 27 15 o 40.64000 0.3454000 39.93000 0.4459000 41.36000 0.5275000 -1.433000      0.6908000 
1 1 1 10 27 17 o 27.53000 0.2709000 27.10000 0.3329000 27.95000 0.4275000 -0.8562000     0.5419000 
1 1 1 10 27 19 o 33.51000 0.3736000 33.21000 0.6225000 33.82000 0.4133000 -0.6108000     0.7472000 
1 1 1 10 27 21 o 55.04000 0.4387000 54.93000 0.5738000 55.15000 0.6637000 -0.2226000     0.8774000 
1 1 1 10 27 23 o 24.34000 0.3112000 24.73000 0.3773000 23.94000 0.4951000 0.7852000      0.6225000 
1 1 1 10 27 25 o 36.48000 0.3126000 35.95000 0.4315000 37.01000 0.4525000 -1.060000      0.6252000 
1 1 1 10 27 27 o 5.027000 0.9847000 5.109000 1.537000  4.945000 1.231000  0.1639000      1.969000  
1 1 1 10 27 29 f 13.58000 0.4212000 14.10000 0.5562000 13.06000 0.6326000 1.037000       0.8423000 
1 1 1 10 27 31 o 23.51000 0.3223000 23.31000 0.4947000 23.70000 0.4133000 -0.3933000     0.6446000 
1 1 1 10 27 33 o 28.68000 0.3258000 29.23000 0.5043000 28.12000 0.4125000 1.114000       0.6516000 
1 1 1 10 27 35 o 18.00000 0.3627000 18.90000 0.5525000 17.09000 0.4702000 1.807000       0.7255000 
1 1 1 10 27 37 o 14.48000 0.4183000 14.73000 0.6483000 14.24000 0.5288000 0.4920000      0.8366000 
1 1 1 10 27 39 o 9.584000 0.5875000 9.570000 0.9095000 9.598000 0.7441000 -0.2831000E-01 1.175000  
1 1 1 10 27 41 o 6.279000 1.000000  8.226000 1.371000  4.331000 1.456000  3.896000       2.000000  
1 1 1 10 27 43 f 7.169000 0.7692000 6.400000 1.298000  7.938000 0.8252000 -1.538000      1.538000  
1 1 1 10 27 45 f 7.172000 0.7421000 6.751000 1.227000  7.593000 0.8345000 -0.8419000     1.484000  
1 1 1 10 27 47 o 4.537000 0.9882000 4.735000 1.513000  4.340000 1.272000  0.3944000      1.976000  
1 1 1 10 27 49 o 5.302000 0.9768000 5.293000 1.501000  5.311000 1.251000  -0.1787000E-01 1.954000  
1 1 1 10 27 51 o 6.998000 1.010000  7.749000 1.571000  6.248000 1.269000  1.502000       2.019000  
1 1 1 10 27 53 o 9.338000 0.8079000 9.414000 1.317000  9.262000 0.9357000 0.1519000      1.616000  
1 1 1 10 27 55 o 8.345000 0.7347000 7.752000 1.236000  8.938000 0.7953000 -1.186000      1.469000  
1 1 1 10 27 57 o 5.049000 0.9738000 4.634000 1.575000  5.464000 1.146000  -0.8298000     1.948000  
1 1 1 10 27 59 o 5.879000 0.9630000 6.373000 1.566000  5.385000 1.121000  0.9877000      1.926000  
1 1 1 10 28 0  o 60.88000 0.7179000 60.88000 0.7179000 60.88000 0.7179000 0.000000       0.000000  
1 1 1 10 28 2  o 53.80000 0.3954000 53.60000 0.5575000 54.00000 0.5608000 -0.4009000     0.7907000 
1 1 1 10 28 4  o 78.26000 0.6342000 78.16000 0.9018000 78.36000 0.8920000 -0.2021000     1.268000  
1 1 1 10 28 6  o 28.49000 0.2929000 28.25000 0.4622000 28.72000 0.3598000 -0.4704000     0.5857000 
1 1 1 10 28 8  o 39.82000 0.3830000 39.66000 0.4553000 39.99000 0.6160000 -0.3352000     0.7660000 
1 1 1 10 28 10 o 21.05000 0.2601000 21.45000 0.3491000 20.64000 0.3857000 0.8112000      0.5202000 
1 1 1 10 28 12 o 11.28000 0.3000000 11.15000 0.3965000 11.42000 0.4504000 -0.2724000     0.6000000 
1 1 1 10 28 14 o 24.86000 0.2602000 25.10000 0.3262000 24.61000 0.4056000 0.4865000      0.5205000 
1 1 1 10 28 16 o 17.37000 0.2834000 17.22000 0.4036000 17.51000 0.3980000 -0.2860000     0.5669000 
1 1 1 10 28 18 o 14.92000 0.2841000 14.60000 0.3895000 15.23000 0.4137000 -0.6342000     0.5683000 
1 1 1 10 28 20 o 20.87000 0.3156000 20.25000 0.4134000 21.49000 0.4770000 -1.236000      0.6312000 
1 1 1 10 28 22 o 3.890000 0.7147000 4.940000 0.9536000 2.841000 1.065000  2.099000       1.429000  
1 1 1 10 28 24 o 23.87000 0.2756000 23.80000 0.3838000 23.93000 0.3957000 -0.1350000     0.5512000 
1 1 1 10 28 26 o 32.97000 0.3032000 32.71000 0.4194000 33.24000 0.4379000 -0.5290000     0.6063000 
1 1 1 10 28 28 o 4.609000 0.8758000 3.966000 1.250000  5.252000 1.227000  -1.286000      1.752000  
1 1 1 10 28 30 o 13.15000 0.4097000 12.97000 0.6378000 13.32000 0.5145000 -0.3520000     0.8194000 
1 1 1 10 28 32 o 35.64000 0.3788000 35.59000 0.6242000 35.70000 0.4293000 -0.1046000     0.7575000 
1 1 1 10 28 34 o 22.23000 0.3558000 22.86000 0.5226000 21.59000 0.4829000 1.267000       0.7115000 
1 1 1 10 28 36 o 16.44000 0.4075000 17.51000 0.5769000 15.37000 0.5757000 2.142000       0.8150000 
1 1 1 10 28 38 o 18.61000 0.4191000 19.00000 0.5539000 18.22000 0.6290000 0.7808000      0.8381000 
1 1 1 10 28 40 o 16.49000 0.4124000 17.14000 0.6124000 15.83000 0.5527000 1.301000       0.8249000 
1 1 1 10 28 42 f 6.110000 0.8631000 5.550000 1.456000  6.670000 0.9268000 -1.120000      1.726000  
1 1 1 10 28 44 o 18.58000 0.3562000 18.76000 0.5487000 18.40000 0.4544000 0.3591000      0.7124000 
1 1 1 10 28 46 o 6.564000 0.7933000 6.636000 1.279000  6.491000 0.9389000 0.1450000      1.587000  
1 1 1 10 28 48 o 11.61000 0.5014000 12.65000 0.7185000 10.58000 0.6996000 2.069000       1.003000  
1 1 1 10 28 50 o 3.440000 0.9689000 3.634000 1.439000  3.247000 1.298000  0.3874000      1.938000  
1 1 1 10 28 52 o 6.228000 0.9994000 6.680000 1.342000  5.776000 1.481000  0.9038000      1.999000  
1 1 1 10 28 54 o 12.31000 0.6029000 12.01000 1.029000  12.61000 0.6292000 -0.6007000     1.206000  
1 1 1 10 28 56 o 2.997000 0.9352000 3.135000 1.400000  2.859000 1.241000  0.2763000      1.870000  
1 1 1 10 28 58 o 6.009000 0.8969000 6.690000 1.395000  5.328000 1.128000  1.362000       1.794000  
1 1 1 10 29 1  o 13.76000 0.3241000 13.84000 0.4095000 13.69000 0.5025000 0.1474000      0.6482000 
1 1 1 10 29 3  o 94.89000 0.7109000 94.03000 1.068000  95.75000 0.9382000 -1.720000      1.422000  
1 1 1 10 29 5  o 56.90000 0.4143000 56.68000 0.5871000 57.11000 0.5847000 -0.4332000     0.8286000 
1 1 1 10 29 7  o 52.02000 0.4409000 52.80000 0.6423000 51.23000 0.6040000 1.568000       0.8817000 
1 1 1 10 29 9  o 68.86000 0.5072000 68.10000 0.6129000 69.62000 0.8084000 -1.515000      1.014000  
1 1 1 10 29 11 o 88.94000 0.6404000 89.17000 0.7862000 88.71000 1.011000  0.4523000      1.281000  
1 1 1 10 29 13 o 72.94000 0.5596000 73.22000 0.7379000 72.65000 0.8414000 0.5720000      1.119000  
1 1 1 10 29 15 o 8.716000 0.3745000 8.950000 0.4775000 8.483000 0.5771000 0.4670000      0.7490000 
1 1 1 10 29 17 o 11.04000 0.3276000 10.72000 0.4498000 11.35000 0.4763000 -0.6233000     0.6551000 
1 1 1 10 29 19 o 31.07000 0.3193000 30.85000 0.3561000 31.29000 0.5301000 -0.4385000     0.6386000 
1 1 1 10 29 21 o 38.99000 0.3489000 38.62000 0.4625000 39.35000 0.5226000 -0.7260000     0.6979000 
1 1 1 10 29 23 o 36.51000 0.3819000 36.82000 0.3967000 36.20000 0.6527000 0.6196000      0.7638000 
1 1 1 10 29 25 o 5.254000 0.7804000 5.428000 1.048000  5.081000 1.156000  0.3466000      1.561000  
1 1 1 10 29 27 o 3.083000 0.9106000 3.573000 1.401000  2.593000 1.164000  0.9798000      1.821000  
1 1 1 10 29 29 o 26.03000 0.3229000 25.87000 0.4790000 26.19000 0.4331000 -0.3146000     0.6457000 
1 1 1 10 29 31 o 54.90000 0.4894000 55.07000 0.8185000 54.72000 0.5368000 0.3511000      0.9788000 
1 1 1 10 29 33 o 24.11000 0.3439000 24.15000 0.5008000 24.08000 0.4714000 0.6869000E-01  0.6878000 
1 1 1 10 29 35 o 34.02000 0.3378000 34.00000 0.5220000 34.03000 0.4287000 -0.2574000E-01 0.6755000 
1 1 1 10 29 37 o 17.50000 0.4427000 17.92000 0.7078000 17.07000 0.5319000 0.8502000      0.8854000 
1 1 1 10 29 39 o 28.75000 0.3305000 29.14000 0.5134000 28.36000 0.4163000 0.7811000      0.6610000 
1 1 1 10 29 41 o 21.46000 0.3918000 21.17000 0.6634000 21.75000 0.4170000 -0.5730000     0.7835000 
1 1 1 10 29 43 o 16.96000 0.4278000 17.61000 0.7141000 16.31000 0.4713000 1.304000       0.8556000 
1 1 1 10 29 45 o 11.31000 0.5316000 10.92000 0.8966000 11.71000 0.5715000 -0.7888000     1.063000  
1 1 1 10 29 47 f 5.908000 0.8708000 5.587000 1.423000  6.228000 1.005000  -0.6412000     1.742000  
1 1 1 10 29 49 o 7.065000 0.8866000 5.803000 1.526000  8.327000 0.9028000 -2.524000      1.773000  
1 1 1 10 29 51 o 8.898000 0.6843000 9.542000 0.9119000 8.253000 1.021000  1.289000       1.369000  
1 1 1 10 29 53 o 6.003000 0.9470000 4.737000 1.685000  7.269000 0.8651000 -2.531000      1.894000  
1 1 1 10 29 55 o 6.520000 0.9556000 6.482000 1.549000  6.558000 1.120000  -0.7586000E-01 1.911000  
1 1 1 10 29 57 o 7.633000 1.147000  6.452000 2.140000  8.814000 0.8272000 -2.362000      2.294000  
1 1 1 10 30 0  o 85.23000 0.8408000 85.23000 0.8408000 85.23000 0.8408000 0.000000       0.000000  
1 1 1 10 30 2  o 66.42000 0.5508000 66.43000 0.7799000 66.40000 0.7781000 0.2441000E-01  1.102000  
1 1 1 10 30 4  o 42.46000 0.3766000 42.47000 0.5391000 42.45000 0.5259000 0.1995000E-01  0.7531000 
1 1 1 10 30 6  o 40.36000 0.3201000 39.96000 0.4561000 40.77000 0.4492000 -0.8170000     0.6402000 
1 1 1 10 30 8  o 14.65000 0.2719000 14.97000 0.3411000 14.33000 0.4234000 0.6460000      0.5437000 
1 1 1 10 30 10 o 55.06000 0.4169000 55.52000 0.5154000 54.60000 0.6555000 0.9166000      0.8338000 
1 1 1 10 30 12 o 39.09000 0.3229000 39.03000 0.3964000 39.14000 0.5099000 -0.1004000     0.6459000 
1 1 1 10 30 14 o 71.86000 0.5514000 71.88000 0.7219000 71.85000 0.8336000 0.2355000E-01  1.103000  
1 1 1 10 30 16 o 35.68000 0.3070000 35.55000 0.3785000 35.81000 0.4834000 -0.2524000     0.6140000 
1 1 1 10 30 18 o 24.47000 0.3026000 24.37000 0.3732000 24.57000 0.4764000 -0.1989000     0.6052000 
1 1 1 10 30 20 o 30.44000 0.2877000 30.55000 0.3575000 30.32000 0.4508000 0.2244000      0.5753000 
1 1 1 10 30 22 o 29.31000 0.4825000 28.72000 0.3985000 29.90000 0.8790000 -1.185000      0.9651000 
1 1 1 10 30 24 o 3.231000 0.8787000 3.243000 1.176000  3.220000 1.306000  0.2321000E-01  1.757000  
1 1 1 10 30 26 o 30.82000 0.3080000 30.96000 0.3824000 30.67000 0.4829000 0.2895000      0.6160000 
1 1 1 10 30 28 o 8.599000 0.6030000 8.445000 0.8375000 8.754000 0.8678000 -0.3091000     1.206000  
1 1 1 10 30 30 o 28.50000 0.3152000 28.81000 0.4893000 28.18000 0.3975000 0.6299000      0.6304000 
1 1 1 10 30 32 o 13.11000 0.4560000 13.17000 0.6679000 13.05000 0.6210000 0.1192000      0.9120000 
1 1 1 10 30 34 o 12.08000 0.4760000 12.25000 0.7198000 11.90000 0.6230000 0.3464000      0.9520000 
1 1 1 10 30 36 o 12.47000 0.5913000 12.20000 0.9121000 12.73000 0.7526000 -0.5357000     1.183000  
1 1 1 10 30 38 o 8.549000 0.6552000 9.141000 0.8975000 7.958000 0.9547000 1.183000       1.310000  
1 1 1 10 30 40 o 6.738000 0.8358000 5.645000 1.443000  7.831000 0.8438000 -2.185000      1.672000  
1 1 1 10 30 42 o 10.70000 0.4923000 10.63000 0.7786000 10.76000 0.6026000 -0.1230000     0.9845000 
1 1 1 10 30 44 o 9.406000 0.5289000 9.335000 0.8187000 9.478000 0.6700000 -0.1434000     1.058000  
1 1 1 10 30 46 o 3.539000 0.9399000 3.218000 1.366000  3.859000 1.291000  -0.6416000     1.880000  
1 1 1 10 30 48 o 6.018000 0.9387000 5.983000 1.430000  6.054000 1.217000  -0.7112000E-01 1.877000  
1 1 1 10 30 50 o 10.81000 0.5574000 9.804000 0.9348000 11.81000 0.6074000 -2.002000      1.115000  
1 1 1 10 30 52 o 3.438000 0.9654000 3.464000 1.436000  3.412000 1.291000  0.5138000E-01  1.931000  
1 1 1 10 30 54 o 5.486000 1.102000  5.458000 1.866000  5.514000 1.174000  -0.5594000E-01 2.204000  
1 1 1 10 30 56 f 6.642000 0.9013000 5.843000 1.583000  7.441000 0.8626000 -1.598000      1.803000  
1 1 1 10 30 58 o 6.114000 0.9428000 6.248000 1.543000  5.979000 1.083000  0.2687000      1.886000  
1 1 1 10 31 1  o 27.59000 0.3070000 27.20000 0.4456000 27.97000 0.4225000 -0.7775000     0.6141000 
1 1 1 10 31 3  f 41.11000 0.3797000 41.70000 0.5361000 40.53000 0.5379000 1.169000       0.7595000 
1 1 1 10 31 5  o 22.71000 0.2573000 22.42000 0.3767000 22.99000 0.3506000 -0.5668000     0.5147000 
1 1 1 10 31 7  o 20.91000 0.2781000 21.33000 0.3779000 20.49000 0.4081000 0.8352000      0.5562000 
1 1 1 10 31 9  o 14.58000 0.2724000 14.52000 0.3519000 14.63000 0.4158000 -0.1137000     0.5447000 
1 1 1 10 31 11 o 53.10000 0.4061000 52.73000 0.4944000 53.47000 0.6444000 -0.7407000     0.8122000 
1 1 1 10 31 13 o 34.64000 0.3173000 34.81000 0.4208000 34.47000 0.4752000 0.3416000      0.6347000 
1 1 1 10 31 15 o 34.31000 0.3377000 34.01000 0.3730000 34.61000 0.5631000 -0.5999000     0.6754000 
1 1 1 10 31 17 o 46.78000 0.4620000 46.71000 0.6026000 46.86000 0.7004000 -0.1476000     0.9239000 
1 1 1 10 31 19 o 27.47000 0.2804000 27.57000 0.3490000 27.37000 0.4389000 0.1980000      0.5607000 
1 1 1 10 31 21 o 12.35000 0.3425000 12.85000 0.4540000 11.85000 0.5130000 1.002000       0.6850000 
1 1 1 10 31 23 o 20.22000 0.3815000 20.42000 0.4381000 20.03000 0.6246000 0.3904000      0.7629000 
1 1 1 10 31 25 o 6.711000 0.6711000 7.259000 0.7432000 6.163000 1.118000  1.095000       1.342000  
1 1 1 10 31 27 o 37.41000 0.4298000 36.63000 0.6719000 38.19000 0.5363000 -1.562000      0.8597000 
1 1 1 10 31 29 o 15.27000 0.3687000 14.87000 0.4620000 15.67000 0.5746000 -0.7973000     0.7373000 
1 1 1 10 31 31 o 25.02000 0.3681000 24.69000 0.5096000 25.35000 0.5314000 -0.6568000     0.7363000 
1 1 1 10 31 33 o 18.16000 0.3768000 18.37000 0.5641000 17.96000 0.4997000 0.4169000      0.7536000 
1 1 1 10 31 35 o 15.79000 0.3945000 15.76000 0.5736000 15.81000 0.5419000 -0.5325000E-01 0.7891000 
1 1 1 10 31 37 o 9.704000 0.5253000 10.37000 0.7704000 9.043000 0.7142000 1.323000       1.051000  
1 1 1 10 31 39 o 19.18000 0.3452000 19.07000 0.5334000 19.30000 0.4384000 -0.2276000     0.6905000 
1 1 1 10 31 41 o 7.974000 0.7749000 7.838000 1.358000  8.110000 0.7461000 -0.2724000     1.550000  
1 1 1 10 31 43 o 13.74000 0.4313000 14.09000 0.6947000 13.40000 0.5113000 0.6888000      0.8626000 
1 1 1 10 31 45 o 6.350000 0.8099000 5.993000 1.340000  6.706000 0.9094000 -0.7133000     1.620000  
1 1 1 10 31 47 o 8.053000 0.7286000 8.705000 1.034000  7.401000 1.027000  1.305000       1.457000  
1 1 1 10 31 49 o 7.430000 0.7682000 7.387000 1.220000  7.474000 0.9333000 -0.8678000E-01 1.536000  
1 1 1 10 31 51 o 4.059000 1.027000  3.831000 1.540000  4.287000 1.357000  -0.4554000     2.053000  
1 1 1 10 31 53 o 5.030000 0.9777000 5.967000 1.397000  4.092000 1.368000  1.875000       1.955000  
1 1 1 10 31 55 o 6.383000 0.8820000 7.634000 1.267000  5.133000 1.227000  2.501000       1.764000  
1 1 1 10 31 57 o 6.872000 0.9157000 7.531000 1.571000  6.213000 0.9422000 1.318000       1.831000  
1 1 1 10 32 0  o 14.41000 0.5635000 14.41000 0.5635000 14.41000 0.5635000 0.000000       0.000000  
1 1 1 10 32 2  o 36.59000 0.3234000 36.94000 0.4899000 36.24000 0.4223000 0.7056000      0.6467000 
1 1 1 10 32 4  o 34.81000 0.3244000 35.03000 0.4246000 34.58000 0.4906000 0.4497000      0.6489000 
1 1 1 10 32 6  o 33.68000 0.3192000 33.39000 0.4176000 33.98000 0.4829000 -0.5809000     0.6385000 
1 1 1 10 32 8  o 42.80000 0.3452000 42.74000 0.4219000 42.85000 0.5465000 -0.1043000     0.6904000 
1 1 1 10 32 10 o 15.85000 0.2770000 15.55000 0.3571000 16.15000 0.4235000 -0.5943000     0.5540000 
1 1 1 10 32 12 o 13.43000 0.3030000 13.83000 0.4209000 13.03000 0.4360000 0.8058000      0.6060000 
1 1 1 10 32 14 o 48.08000 0.4270000 48.08000 0.4650000 48.08000 0.7162000 -0.8240000E-03 0.8539000 
1 1 1 10 32 16 o 39.54000 0.3479000 40.14000 0.4625000 38.94000 0.5197000 1.200000       0.6957000 
1 1 1 10 32 18 o 22.58000 0.2992000 22.56000 0.4150000 22.61000 0.4312000 -0.4923000E-01 0.5985000 
1 1 1 10 32 20 o 36.58000 0.3328000 36.43000 0.4332000 36.74000 0.5052000 -0.3088000     0.6655000 
1 1 1 10 32 22 o 12.17000 0.4886000 11.62000 0.4729000 12.71000 0.8553000 -1.081000      0.9773000 
1 1 1 10 32 24 o 11.49000 0.3967000 10.90000 0.5341000 12.08000 0.5866000 -1.176000      0.7933000 
1 1 1 10 32 26 o 19.21000 0.3396000 19.11000 0.4877000 19.32000 0.4727000 -0.2099000     0.6792000 
1 1 1 10 32 28 o 25.48000 0.3128000 25.22000 0.3843000 25.75000 0.4937000 -0.5326000     0.6256000 
1 1 1 10 32 30 o 31.13000 0.4027000 31.32000 0.5090000 30.94000 0.6241000 0.3800000      0.8053000 
1 1 1 10 32 32 o 19.17000 0.4040000 18.84000 0.5474000 19.50000 0.5942000 -0.6583000     0.8079000 
1 1 1 10 32 34 o 12.35000 0.4648000 12.49000 0.5953000 12.21000 0.7139000 0.2877000      0.9295000 
1 1 1 10 32 36 o 12.20000 0.4175000 12.35000 0.5941000 12.04000 0.5866000 0.3052000      0.8349000 
1 1 1 10 32 38 o 5.922000 0.8114000 6.923000 0.8816000 4.920000 1.362000  2.003000       1.623000  
1 1 1 10 32 40 o 6.953000 0.6429000 6.508000 0.9614000 7.398000 0.8538000 -0.8900000     1.286000  
1 1 1 10 32 42 o 6.796000 1.143000  6.330000 2.106000  7.262000 0.8897000 -0.9315000     2.286000  
1 1 1 10 32 44 o 4.657000 1.036000  4.674000 1.596000  4.641000 1.321000  0.3310000E-01  2.072000  
1 1 1 10 32 46 o 7.779000 0.6487000 8.178000 1.008000  7.381000 0.8165000 0.7977000      1.297000  
1 1 1 10 32 48 o 6.123000 0.9111000 6.742000 1.341000  5.504000 1.234000  1.238000       1.822000  
1 1 1 10 32 50 o 5.370000 0.9849000 4.920000 1.577000  5.820000 1.181000  -0.9010000     1.970000  
1 1 1 10 32 52 o 8.761000 0.8924000 7.374000 1.614000  10.15000 0.7628000 -2.774000      1.785000  
1 1 1 10 32 54 f 6.810000 0.8946000 6.351000 1.509000  7.270000 0.9618000 -0.9189000     1.789000  
1 1 1 10 32 56 o 3.417000 0.9535000 3.949000 1.453000  2.886000 1.235000  1.063000       1.907000  
1 1 1 10 33 1  o 27.38000 0.2921000 27.79000 0.3830000 26.97000 0.4412000 0.8244000      0.5842000 
1 1 1 10 33 3  o 42.08000 0.3763000 42.50000 0.5393000 41.66000 0.5250000 0.8393000      0.7526000 
1 1 1 10 33 5  o 71.19000 0.5856000 70.38000 0.8166000 71.99000 0.8396000 -1.617000      1.171000  
1 1 1 10 33 7  o 35.95000 0.3094000 36.53000 0.3862000 35.36000 0.4835000 1.168000       0.6188000 
1 1 1 10 33 9  o 21.58000 0.2670000 21.89000 0.3307000 21.27000 0.4193000 0.6172000      0.5341000 
1 1 1 10 33 11 o 44.35000 0.3731000 44.35000 0.4894000 44.35000 0.5632000 -0.1022000E-02 0.7461000 
1 1 1 10 33 13 o 28.86000 0.3166000 28.50000 0.3509000 29.22000 0.5270000 -0.7130000     0.6331000 
1 1 1 10 33 15 o 18.91000 0.2905000 18.87000 0.3873000 18.94000 0.4332000 -0.7238000E-01 0.5811000 
1 1 1 10 33 17 o 16.71000 0.2949000 16.40000 0.3784000 17.02000 0.4524000 -0.6161000     0.5898000 
1 1 1 10 33 19 o 50.51000 0.4446000 50.41000 0.6314000 50.61000 0.6262000 -0.1955000     0.8893000 
1 1 1 10 33 21 o 15.80000 0.4106000 16.19000 0.3841000 15.42000 0.7257000 0.7753000      0.8211000 
1 1 1 10 33 23 o 36.01000 0.3366000 35.85000 0.4448000 36.17000 0.5053000 -0.3190000     0.6732000 
1 1 1 10 33 25 o 14.37000 0.4695000 14.01000 0.5312000 14.73000 0.7742000 -0.7241000     0.9390000 
1 1 1 10 33 27 f 28.35000 0.3275000 28.35000 0.4482000 28.34000 0.4775000 0.1061000E-01  0.6550000 
1 1 1 10 33 29 o 19.36000 0.3429000 19.02000 0.4461000 19.70000 0.5210000 -0.6835000     0.6858000 
1 1 1 10 33 31 o 5.478000 0.8769000 6.476000 1.029000  4.479000 1.420000  1.997000       1.754000  
1 1 1 10 33 33 o 5.656000 0.8747000 6.845000 0.9552000 4.467000 1.466000  2.378000       1.749000  
1 1 1 10 33 35 o 7.569000 0.5941000 7.476000 0.8726000 7.662000 0.8065000 -0.1852000     1.188000  
1 1 1 10 33 37 o 16.88000 0.3381000 16.89000 0.4815000 16.87000 0.4747000 0.1289000E-01  0.6762000 
1 1 1 10 33 39 o 10.63000 0.4726000 10.48000 0.6893000 10.78000 0.6468000 -0.3028000     0.9452000 
1 1 1 10 33 41 o 16.76000 0.3761000 16.17000 0.5675000 17.34000 0.4936000 -1.168000      0.7522000 
1 1 1 10 33 43 o 15.06000 0.4096000 14.94000 0.6204000 15.18000 0.5349000 -0.2364000     0.8192000 
1 1 1 10 33 45 o 12.03000 0.4469000 11.85000 0.6461000 12.20000 0.6176000 -0.3513000     0.8938000 
1 1 1 10 33 47 o 9.580000 0.6037000 9.632000 0.7643000 9.529000 0.9346000 0.1022000      1.207000  
1 1 1 10 33 49 o 8.382000 0.7333000 8.234000 1.104000  8.529000 0.9652000 -0.2953000     1.467000  
1 1 1 10 33 51 o 5.485000 1.086000  5.309000 1.614000  5.660000 1.454000  -0.3507000     2.173000  
1 1 1 10 33 53 o 9.755000 0.5617000 10.06000 0.8579000 9.450000 0.7252000 0.6109000      1.123000  
1 1 1 10 33 55 o 9.509000 0.5754000 10.14000 0.7629000 8.873000 0.8615000 1.271000       1.151000  
1 1 1 10 34 0  o 12.23000 0.4847000 12.23000 0.4847000 12.23000 0.4847000 0.000000       0.000000  
1 1 1 10 34 2  o 41.28000 0.3578000 41.40000 0.4663000 41.16000 0.5427000 0.2438000      0.7156000 
1 1 1 10 34 4  o 45.97000 0.3550000 45.81000 0.5014000 46.13000 0.5026000 -0.3244000     0.7099000 
1 1 1 10 34 6  o 44.11000 0.4425000 43.44000 0.5498000 44.78000 0.6935000 -1.338000      0.8850000 
1 1 1 10 34 8  o 32.94000 0.3647000 33.31000 0.3740000 32.57000 0.6262000 0.7335000      0.7294000 
1 1 1 10 34 10 o 21.47000 0.2971000 21.57000 0.3495000 21.38000 0.4804000 0.1886000      0.5941000 
1 1 1 10 34 12 o 38.91000 0.3700000 39.40000 0.4143000 38.43000 0.6131000 0.9683000      0.7400000 
1 1 1 10 34 14 o 21.14000 0.3066000 20.80000 0.4286000 21.48000 0.4386000 -0.6737000     0.6132000 
1 1 1 10 34 16 o 42.75000 0.3537000 42.66000 0.4362000 42.83000 0.5568000 -0.1627000     0.7073000 
1 1 1 10 34 18 o 27.91000 0.3049000 28.02000 0.3973000 27.79000 0.4627000 0.2276000      0.6099000 
1 1 1 10 34 20 o 55.12000 0.5184000 54.94000 0.5891000 55.30000 0.8533000 -0.3571000     1.037000  
1 1 1 10 34 22 o 29.06000 0.3096000 29.16000 0.4125000 28.96000 0.4619000 0.2034000      0.6193000 
1 1 1 10 34 24 o 10.92000 0.4504000 11.12000 0.5971000 10.71000 0.6745000 0.4122000      0.9008000 
1 1 1 10 34 26 o 29.96000 0.3339000 29.49000 0.4535000 30.44000 0.4900000 -0.9483000     0.6677000 
1 1 1 10 34 28 o 6.258000 0.9718000 6.735000 1.053000  5.782000 1.634000  0.9522000      1.944000  
1 1 1 10 34 30 o 20.05000 0.3724000 20.92000 0.3949000 19.18000 0.6315000 1.740000       0.7448000 
1 1 1 10 34 32 f 10.58000 0.4918000 10.41000 0.6207000 10.75000 0.7630000 -0.3422000     0.9836000 
1 1 1 10 34 34 o 6.308000 0.6938000 6.073000 0.9962000 6.542000 0.9660000 -0.4692000     1.388000  
1 1 1 10 34 36 o 15.33000 0.3537000 15.83000 0.4877000 14.83000 0.5124000 0.9996000      0.7074000 
1 1 1 10 34 38 o 18.38000 0.3770000 17.91000 0.5266000 18.86000 0.5395000 -0.9556000     0.7539000 
1 1 1 10 34 40 o 5.035000 0.8620000 4.520000 1.300000  5.549000 1.132000  -1.029000      1.724000  
1 1 1 10 34 42 o 4.692000 0.9339000 3.951000 1.442000  5.434000 1.187000  -1.483000      1.868000  
1 1 1 10 34 44 o 8.824000 0.5623000 8.501000 0.8552000 9.148000 0.7304000 -0.6473000     1.125000  
1 1 1 10 34 46 o 7.449000 0.8077000 6.402000 1.115000  8.495000 1.169000  -2.093000      1.615000  
1 1 1 10 34 48 o 9.994000 0.5678000 9.229000 0.7852000 10.76000 0.8203000 -1.529000      1.136000  
1 1 1 10 34 50 o 9.282000 0.5825000 9.464000 0.8379000 9.100000 0.8093000 0.3642000      1.165000  
1 1 1 10 34 52 o 12.21000 0.4496000 12.91000 0.6618000 11.51000 0.6086000 1.401000       0.8991000 
1 1 1 10 34 54 o 4.446000 1.052000  4.298000 1.586000  4.593000 1.383000  -0.2952000     2.105000  
1 1 1 10 35 1  o 25.14000 0.2682000 24.85000 0.3761000 25.43000 0.3823000 -0.5789000     0.5363000 
1 1 1 10 35 3  o 23.65000 0.3223000 24.16000 0.3823000 23.13000 0.5189000 1.037000       0.6445000 
1 1 1 10 35 5  o 50.35000 0.3813000 50.20000 0.5403000 50.49000 0.5383000 -0.2837000     0.7626000 
1 1 1 10 35 7  o 36.06000 0.3165000 36.51000 0.3890000 35.60000 0.4994000 0.9134000      0.6330000 
1 1 1 10 35 9  o 55.09000 0.6612000 55.69000 0.5805000 54.48000 1.188000  1.205000       1.322000  
1 1 1 10 35 11 o 44.50000 0.4017000 44.18000 0.5608000 44.82000 0.5753000 -0.6436000     0.8034000 
1 1 1 10 35 13 o 19.11000 0.2881000 18.94000 0.3774000 19.28000 0.4353000 -0.3381000     0.5762000 
1 1 1 10 35 15 o 19.17000 0.2971000 19.14000 0.3964000 19.20000 0.4427000 -0.6035000E-01 0.5942000 
1 1 1 10 35 17 o 20.78000 0.2850000 20.72000 0.3605000 20.83000 0.4416000 -0.1110000     0.5701000 
1 1 1 10 35 19 o 22.09000 0.3657000 22.61000 0.3714000 21.56000 0.6301000 1.050000       0.7314000 
1 1 1 10 35 21 o 26.51000 0.3758000 27.48000 0.4107000 25.55000 0.6296000 1.938000       0.7517000 
1 1 1 10 35 23 o 24.84000 0.3092000 24.45000 0.4164000 25.22000 0.4572000 -0.7703000     0.6184000 
1 1 1 10 35 25 o 27.17000 0.3460000 27.82000 0.5106000 26.53000 0.4671000 1.293000       0.6920000 
1 1 1 10 35 27 f 26.68000 0.3332000 27.62000 0.4525000 25.74000 0.4893000 1.880000       0.6665000 
1 1 1 10 35 29 o 10.42000 0.5084000 10.36000 0.5890000 10.49000 0.8289000 -0.1320000     1.017000  
1 1 1 10 35 31 o 10.98000 0.4619000 11.21000 0.5599000 10.75000 0.7347000 0.4650000      0.9237000 
1 1 1 10 35 33 o 8.550000 0.5152000 8.141000 0.7402000 8.958000 0.7169000 -0.8169000     1.030000  
1 1 1 10 35 35 o 10.65000 0.4400000 10.64000 0.6028000 10.65000 0.6413000 -0.2202000E-02 0.8801000 
1 1 1 10 35 37 o 19.99000 0.3453000 20.09000 0.5177000 19.90000 0.4570000 0.1919000      0.6906000 
1 1 1 10 35 39 o 17.33000 0.3339000 17.66000 0.4692000 16.99000 0.4753000 0.6687000      0.6678000 
1 1 1 10 35 41 o 9.633000 0.5173000 9.115000 0.7890000 10.15000 0.6693000 -1.037000      1.035000  
1 1 1 10 35 43 o 10.26000 0.5154000 9.164000 0.8127000 11.37000 0.6342000 -2.202000      1.031000  
1 1 1 10 35 45 o 3.431000 0.9231000 2.898000 1.242000  3.964000 1.366000  -1.066000      1.846000  
1 1 1 10 35 47 o 7.309000 0.7383000 7.140000 0.9734000 7.479000 1.110000  -0.3385000     1.477000  
1 1 1 10 35 49 o 5.895000 0.7940000 6.267000 1.106000  5.523000 1.140000  0.7446000      1.588000  
1 1 1 10 35 51 o 6.664000 0.7756000 8.850000 0.8428000 4.479000 1.302000  4.371000       1.551000  
1 1 1 10 35 53 o 3.362000 0.9509000 3.501000 1.376000  3.222000 1.312000  0.2794000      1.902000  
1 1 1 10 35 55 o 3.845000 1.764000  3.845000 1.764000  ?        ?         ?              ?         
1 1 1 10 36 0  o 32.32000 0.4156000 32.32000 0.4156000 32.32000 0.4156000 0.000000       0.000000  
1 1 1 10 36 2  o 21.81000 0.2746000 21.82000 0.3868000 21.79000 0.3900000 0.2687000E-01  0.5493000 
1 1 1 10 36 4  o 10.20000 0.4178000 10.50000 0.5412000 9.904000 0.6367000 0.5923000      0.8357000 
1 1 1 10 36 6  o 19.99000 0.3220000 19.65000 0.4008000 20.34000 0.5042000 -0.6942000     0.6441000 
1 1 1 10 36 8  o 20.51000 0.3137000 20.79000 0.3634000 20.23000 0.5114000 0.5518000      0.6274000 
1 1 1 10 36 10 o 31.73000 0.3843000 31.96000 0.4253000 31.50000 0.6401000 0.4570000      0.7685000 
1 1 1 10 36 12 o 16.87000 0.3945000 17.47000 0.4226000 16.27000 0.6662000 1.193000       0.7889000 
1 1 1 10 36 14 o 28.97000 0.4091000 28.76000 0.4762000 29.18000 0.6653000 -0.4182000     0.8182000 
1 1 1 10 36 16 o 34.10000 0.3849000 34.53000 0.3951000 33.68000 0.6606000 0.8506000      0.7698000 
1 1 1 10 36 18 o 18.63000 0.4140000 18.80000 0.4204000 18.47000 0.7134000 0.3232000      0.8281000 
1 1 1 10 36 20 o 31.26000 0.4155000 31.77000 0.5116000 30.74000 0.6549000 1.026000       0.8310000 
1 1 1 10 36 22 o 32.54000 0.3139000 32.85000 0.3921000 32.22000 0.4904000 0.6353000      0.6279000 
1 1 1 10 36 24 o 19.89000 0.3956000 19.90000 0.4366000 19.87000 0.6599000 0.3408000E-01  0.7913000 
1 1 1 10 36 26 o 10.32000 0.4875000 11.73000 0.6491000 8.901000 0.7275000 2.831000       0.9750000 
1 1 1 10 36 28 o 4.041000 0.9286000 2.652000 1.170000  5.430000 1.443000  -2.777000      1.857000  
1 1 1 10 36 30 f 6.901000 0.7999000 8.268000 0.6215000 5.535000 1.474000  2.733000       1.600000  
1 1 1 10 36 32 o 3.005000 0.8497000 3.069000 1.194000  2.941000 1.209000  0.1279000      1.699000  
1 1 1 10 36 34 o 14.58000 0.3513000 14.73000 0.4680000 14.43000 0.5241000 0.2972000      0.7026000 
1 1 1 10 36 36 o 11.46000 0.4247000 12.22000 0.5558000 10.71000 0.6424000 1.510000       0.8495000 
1 1 1 10 36 38 o 6.744000 0.7421000 7.587000 0.7891000 5.901000 1.257000  1.686000       1.484000  
1 1 1 10 36 40 o 17.86000 0.3396000 18.05000 0.4825000 17.67000 0.4779000 0.3721000      0.6791000 
1 1 1 10 36 42 o 6.176000 0.8874000 6.554000 1.383000  5.797000 1.113000  0.7568000      1.775000  
1 1 1 10 36 44 o 3.686000 0.9459000 3.182000 1.299000  4.189000 1.375000  -1.008000      1.892000  
1 1 1 10 36 46 o 10.94000 0.5512000 11.42000 0.6922000 10.45000 0.8581000 0.9696000      1.102000  
1 1 1 10 36 48 f 3.834000 0.9978000 4.030000 1.522000  3.637000 1.291000  0.3925000      1.996000  
1 1 1 10 36 50 o 4.233000 1.020000  4.673000 1.500000  3.793000 1.382000  0.8793000      2.039000  
1 1 1 10 36 52 o 3.253000 0.9121000 2.477000 1.146000  4.030000 1.419000  -1.553000      1.824000  
1 1 1 10 36 54 o 5.110000 1.020000  5.707000 1.471000  4.512000 1.412000  1.195000       2.039000  
1 1 1 10 37 1  o 18.95000 0.2927000 18.86000 0.4160000 19.04000 0.4119000 -0.1835000     0.5854000 
1 1 1 10 37 3  o 30.40000 0.3067000 30.25000 0.4094000 30.54000 0.4567000 -0.2901000     0.6134000 
1 1 1 10 37 5  o 22.98000 0.3356000 23.91000 0.4459000 22.04000 0.5017000 1.872000       0.6712000 
1 1 1 10 37 7  f 29.37000 0.2998000 29.47000 0.3647000 29.27000 0.4760000 0.1908000      0.5996000 
1 1 1 10 37 9  o 31.95000 0.3209000 32.48000 0.4292000 31.43000 0.4772000 1.046000       0.6418000 
1 1 1 10 37 11 o 55.95000 0.5077000 55.41000 0.5267000 56.50000 0.8681000 -1.086000      1.015000  
1 1 1 10 37 13 o 12.29000 0.5554000 12.63000 0.6236000 11.96000 0.9193000 0.6708000      1.111000  
1 1 1 10 37 15 o 27.65000 0.6442000 28.11000 0.9082000 27.18000 0.9138000 0.9297000      1.288000  
1 1 1 10 37 17 o 34.39000 0.3988000 35.34000 0.4511000 33.44000 0.6578000 1.893000       0.7977000 
1 1 1 10 37 19 o 16.71000 0.4343000 16.89000 0.4681000 16.54000 0.7317000 0.3498000      0.8686000 
1 1 1 10 37 21 o 16.39000 0.4641000 16.33000 0.5231000 16.45000 0.7669000 -0.1229000     0.9283000 
1 1 1 10 37 23 o 3.357000 0.9275000 3.130000 1.259000  3.584000 1.363000  -0.4535000     1.855000  
1 1 1 10 37 25 o 11.57000 0.4927000 11.68000 0.6521000 11.45000 0.7386000 0.2321000      0.9853000 
1 1 1 10 37 27 o 14.35000 0.3695000 14.91000 0.4903000 13.79000 0.5529000 1.125000       0.7390000 
1 1 1 10 37 29 o 21.21000 0.3391000 21.56000 0.3909000 20.86000 0.5541000 0.7051000      0.6782000 
1 1 1 10 37 31 o 5.217000 0.7521000 4.552000 1.120000  5.882000 1.004000  -1.330000      1.504000  
1 1 1 10 37 33 o 17.90000 0.3228000 18.15000 0.4323000 17.66000 0.4796000 0.4944000      0.6457000 
1 1 1 10 37 35 o 12.04000 0.3998000 12.33000 0.5372000 11.75000 0.5924000 0.5810000      0.7997000 
1 1 1 10 37 37 o 6.541000 0.7081000 7.325000 0.8581000 5.756000 1.127000  1.569000       1.416000  
1 1 1 10 37 39 o 8.794000 0.5594000 9.599000 0.8114000 7.989000 0.7702000 1.610000       1.119000  
1 1 1 10 37 41 o 2.925000 0.8617000 2.654000 1.210000  3.197000 1.228000  -0.5429000     1.723000  
1 1 1 10 37 43 o 9.194000 0.5576000 8.947000 0.7855000 9.441000 0.7915000 -0.4947000     1.115000  
1 1 1 10 37 45 o 8.507000 0.7685000 8.936000 0.7510000 8.079000 1.341000  0.8575000      1.537000  
1 1 1 10 37 47 o 11.50000 0.5413000 11.63000 0.8687000 11.37000 0.6461000 0.2654000      1.083000  
1 1 1 10 37 49 o 3.834000 1.028000  4.210000 1.573000  3.459000 1.323000  0.7512000      2.055000  
1 1 1 10 37 51 o 10.78000 0.5203000 9.999000 0.8282000 11.56000 0.6301000 -1.558000      1.041000  
1 1 1 10 37 53 o 3.582000 0.9734000 3.940000 1.408000  3.223000 1.344000  0.7177000      1.947000  
1 1 1 10 38 0  f 2.306000 1.063000  2.306000 1.063000  2.306000 1.063000  0.000000       0.000000  
1 1 1 10 38 2  o 38.54000 0.3696000 38.46000 0.5221000 38.62000 0.5233000 -0.1614000     0.7392000 
1 1 1 10 38 4  o 21.68000 0.3027000 21.85000 0.4600000 21.51000 0.3936000 0.3459000      0.6054000 
1 1 1 10 38 6  o 18.54000 0.3507000 18.70000 0.5241000 18.37000 0.4660000 0.3287000      0.7013000 
1 1 1 10 38 8  o 41.60000 0.3706000 41.69000 0.4886000 41.51000 0.5574000 0.1796000      0.7413000 
1 1 1 10 38 10 o 3.689000 0.8769000 4.005000 1.208000  3.372000 1.272000  0.6330000      1.754000  
1 1 1 10 38 12 o 35.49000 0.3663000 35.51000 0.5265000 35.47000 0.5095000 0.4515000E-01  0.7327000 
1 1 1 10 38 14 o 52.82000 0.5077000 52.06000 0.5679000 53.57000 0.8417000 -1.514000      1.015000  
1 1 1 10 38 16 o 28.22000 0.4273000 28.22000 0.4273000 ?        ?         ?              ?         
1 1 1 10 38 18 o 16.36000 0.3944000 16.62000 0.5765000 16.09000 0.5385000 0.5347000      0.7888000 
1 1 1 10 38 20 o 26.20000 0.3083000 26.42000 0.3840000 25.97000 0.4825000 0.4516000      0.6166000 
1 1 1 10 38 22 o 17.81000 0.3390000 17.98000 0.4259000 17.65000 0.5276000 0.3261000      0.6781000 
1 1 1 10 38 24 o 26.71000 0.3378000 26.38000 0.3785000 27.04000 0.5596000 -0.6658000     0.6756000 
1 1 1 10 38 26 o 12.73000 0.4576000 12.36000 0.7043000 13.11000 0.5843000 -0.7494000     0.9151000 
1 1 1 10 38 28 o 6.556000 0.6717000 6.911000 0.7848000 6.201000 1.090000  0.7104000      1.343000  
1 1 1 10 38 30 o 28.53000 0.3052000 28.08000 0.3813000 28.98000 0.4767000 -0.8976000     0.6105000 
1 1 1 10 38 32 o 16.45000 0.3259000 16.59000 0.4382000 16.30000 0.4824000 0.2947000      0.6517000 
1 1 1 10 38 34 o 11.91000 0.3894000 12.69000 0.4989000 11.13000 0.5981000 1.561000       0.7789000 
1 1 1 10 38 36 o 11.04000 0.4537000 11.15000 0.6506000 10.92000 0.6324000 0.2308000      0.9073000 
1 1 1 10 38 38 o 15.91000 0.4001000 15.27000 0.5629000 16.56000 0.5687000 -1.283000      0.8002000 
1 1 1 10 38 40 o 15.98000 0.3830000 15.70000 0.5874000 16.27000 0.4916000 -0.5703000     0.7660000 
1 1 1 10 38 42 o 3.331000 0.9550000 3.051000 1.333000  3.611000 1.368000  -0.5604000     1.910000  
1 1 1 10 38 44 f 2.791000 0.8831000 2.872000 1.214000  2.711000 1.283000  0.1611000      1.766000  
1 1 1 10 38 46 o 6.138000 0.8221000 5.975000 1.169000  6.301000 1.156000  -0.3254000     1.644000  
1 1 1 10 38 48 o 5.148000 0.9214000 4.138000 1.448000  6.158000 1.140000  -2.020000      1.843000  
1 1 1 10 38 50 o 4.753000 1.002000  4.979000 1.508000  4.527000 1.320000  0.4511000      2.004000  
1 1 1 10 38 52 o 4.041000 1.002000  4.998000 1.510000  3.084000 1.319000  1.914000       2.005000  
1 1 1 10 39 1  o 37.39000 0.3244000 37.39000 0.4617000 37.39000 0.4560000 -0.4406000E-02 0.6489000 
1 1 1 10 39 3  o 36.46000 0.3872000 36.10000 0.6295000 36.82000 0.4510000 -0.7169000     0.7744000 
1 1 1 10 39 5  o 38.15000 0.3492000 37.99000 0.5284000 38.31000 0.4567000 -0.3168000     0.6984000 
1 1 1 10 39 7  o 23.30000 0.4633000 22.55000 0.8021000 24.06000 0.4639000 -1.510000      0.9266000 
1 1 1 10 39 9  o 21.02000 0.3237000 20.99000 0.4620000 21.05000 0.4537000 -0.6055000E-01 0.6475000 
1 1 1 10 39 11 o 9.987000 0.4917000 9.133000 0.7841000 10.84000 0.5933000 -1.707000      0.9833000 
1 1 1 10 39 13 o 42.10000 0.3731000 42.77000 0.5002000 41.42000 0.5536000 1.343000       0.7461000 
1 1 1 10 39 15 o 26.17000 0.3034000 25.98000 0.3872000 26.37000 0.4672000 -0.3864000     0.6068000 
1 1 1 10 39 17 o 27.50000 0.3807000 28.41000 0.3913000 26.59000 0.6531000 1.816000       0.7614000 
1 1 1 10 39 19 o 11.29000 0.4857000 11.14000 0.5642000 11.45000 0.7909000 -0.3052000     0.9715000 
1 1 1 10 39 21 o 23.64000 0.4009000 24.01000 0.4262000 23.28000 0.6791000 0.7349000      0.8018000 
1 1 1 10 39 23 o 38.51000 0.3852000 38.65000 0.4338000 38.37000 0.6367000 0.2836000      0.7704000 
1 1 1 10 39 25 o 15.26000 0.4070000 15.85000 0.6047000 14.66000 0.5449000 1.195000       0.8139000 
1 1 1 10 39 27 o 7.306000 0.5958000 7.703000 0.6802000 6.910000 0.9783000 0.7935000      1.192000  
1 1 1 10 39 29 f 15.16000 0.3392000 15.11000 0.4212000 15.22000 0.5317000 -0.1135000     0.6783000 
1 1 1 10 39 31 o 20.57000 0.3040000 20.34000 0.4351000 20.79000 0.4247000 -0.4464000     0.6080000 
1 1 1 10 39 33 o 19.46000 0.3095000 19.51000 0.4341000 19.42000 0.4414000 0.9162000E-01  0.6191000 
1 1 1 10 39 35 o 7.996000 0.5877000 8.214000 0.8376000 7.779000 0.8247000 0.4349000      1.175000  
1 1 1 10 39 37 o 4.151000 0.8829000 4.648000 1.210000  3.654000 1.286000  0.9940000      1.766000  
1 1 1 10 39 39 f 10.30000 0.4917000 10.99000 0.6979000 9.613000 0.6928000 1.374000       0.9834000 
1 1 1 10 39 41 o 8.234000 0.6229000 7.579000 0.9131000 8.889000 0.8475000 -1.310000      1.246000  
1 1 1 10 39 43 o 8.904000 0.5655000 8.699000 0.7750000 9.109000 0.8238000 -0.4107000     1.131000  
1 1 1 10 39 45 o 3.353000 0.9247000 3.554000 1.333000  3.151000 1.282000  0.4033000      1.849000  
1 1 1 10 39 47 o 12.19000 0.4586000 11.74000 0.6889000 12.64000 0.6056000 -0.8961000     0.9173000 
1 1 1 10 39 49 o 7.058000 0.7834000 6.400000 1.220000  7.717000 0.9830000 -1.318000      1.567000  
1 1 1 10 39 51 o 12.54000 0.4722000 12.26000 0.7246000 12.82000 0.6057000 -0.5608000     0.9444000 
1 1 1 10 40 0  o 25.67000 0.4148000 25.67000 0.4148000 25.67000 0.4148000 0.000000       0.000000  
1 1 1 10 40 2  o 24.75000 0.2940000 24.68000 0.4163000 24.83000 0.4152000 -0.1477000     0.5880000 
1 1 1 10 40 4  o 19.21000 0.3191000 18.76000 0.4850000 19.66000 0.4148000 -0.8958000     0.6382000 
1 1 1 10 40 6  o 23.36000 0.3776000 24.31000 0.6012000 22.41000 0.4569000 1.902000       0.7551000 
1 1 1 10 40 8  o 25.99000 0.3192000 26.30000 0.4354000 25.67000 0.4668000 0.6242000      0.6383000 
1 1 1 10 40 10 o 11.00000 0.4864000 10.86000 0.7592000 11.13000 0.6082000 -0.2794000     0.9727000 
1 1 1 10 40 12 f 7.408000 0.5742000 8.128000 0.7101000 6.689000 0.9025000 1.439000       1.148000  
1 1 1 10 40 14 o 21.33000 0.4145000 20.88000 0.4750000 21.79000 0.6794000 -0.9110000     0.8290000 
1 1 1 10 40 16 o 14.86000 0.3600000 14.60000 0.4683000 15.11000 0.5469000 -0.5124000     0.7201000 
1 1 1 10 40 18 o 9.752000 0.4980000 9.491000 0.6390000 10.01000 0.7640000 -0.5229000     0.9960000 
1 1 1 10 40 20 o 28.79000 0.3408000 28.43000 0.3883000 29.15000 0.5601000 -0.7200000     0.6816000 
1 1 1 10 40 22 o 4.159000 1.009000  4.456000 1.280000  3.862000 1.559000  0.5940000      2.018000  
1 1 1 10 40 24 o 15.35000 0.4208000 15.21000 0.5649000 15.50000 0.6239000 -0.2822000     0.8417000 
1 1 1 10 40 26 o 6.679000 0.6859000 7.858000 0.6838000 5.499000 1.189000  2.358000       1.372000  
1 1 1 10 40 28 o 10.44000 0.4112000 10.70000 0.4982000 10.19000 0.6543000 0.5079000      0.8224000 
1 1 1 10 40 30 o 9.508000 0.4517000 9.781000 0.5288000 9.236000 0.7325000 0.5456000      0.9034000 
1 1 1 10 40 32 o 17.61000 0.3164000 17.45000 0.4541000 17.78000 0.4407000 -0.3305000     0.6328000 
1 1 1 10 40 34 o 4.556000 0.8884000 3.994000 1.349000  5.117000 1.156000  -1.122000      1.777000  
1 1 1 10 40 36 o 6.382000 0.6691000 6.133000 0.9546000 6.631000 0.9378000 -0.4978000     1.338000  
1 1 1 10 40 38 o 6.340000 0.7420000 6.243000 0.8874000 6.436000 1.189000  -0.1934000     1.484000  
1 1 1 10 40 40 o 5.220000 0.9218000 5.708000 1.148000  4.732000 1.443000  0.9751000      1.844000  
1 1 1 10 40 42 o 3.060000 0.8972000 3.335000 1.364000  2.786000 1.166000  0.5482000      1.794000  
1 1 1 10 40 44 o 3.505000 0.9346000 3.590000 1.313000  3.419000 1.330000  0.1711000      1.869000  
1 1 1 10 40 46 o 8.101000 0.6375000 7.747000 1.014000  8.455000 0.7726000 -0.7078000     1.275000  
1 1 1 10 40 48 o 3.165000 0.9491000 3.758000 1.500000  2.572000 1.163000  1.186000       1.898000  
1 1 1 10 40 50 o 7.392000 0.7305000 8.171000 0.9282000 6.613000 1.128000  1.558000       1.461000  
1 1 1 10 41 1  o 5.843000 0.7917000 6.301000 1.092000  5.384000 1.147000  0.9169000      1.583000  
1 1 1 10 41 3  o 38.83000 0.3554000 38.92000 0.5332000 38.74000 0.4700000 0.1891000      0.7108000 
1 1 1 10 41 5  o 43.21000 0.3882000 42.77000 0.5913000 43.64000 0.5031000 -0.8768000     0.7764000 
1 1 1 10 41 7  o 36.95000 0.3370000 36.52000 0.4121000 37.38000 0.5334000 -0.8577000     0.6741000 
1 1 1 10 41 9  o 24.08000 0.3236000 23.46000 0.4389000 24.69000 0.4756000 -1.233000      0.6472000 
1 1 1 10 41 11 o 15.75000 0.4970000 16.62000 0.5993000 14.88000 0.7930000 1.732000       0.9940000 
1 1 1 10 41 13 o 14.09000 0.3552000 13.92000 0.4654000 14.27000 0.5367000 -0.3535000     0.7104000 
1 1 1 10 41 15 o 35.79000 0.4382000 36.37000 0.5551000 35.21000 0.6781000 1.163000       0.8763000 
1 1 1 10 41 17 o 9.142000 0.5252000 8.730000 0.6751000 9.553000 0.8048000 -0.8231000     1.050000  
1 1 1 10 41 19 o 6.088000 0.8002000 5.156000 1.107000  7.019000 1.155000  -1.863000      1.600000  
1 1 1 10 41 21 o 12.62000 0.4004000 11.98000 0.5415000 13.26000 0.5899000 -1.280000      0.8008000 
1 1 1 10 41 23 o 15.46000 0.3963000 15.80000 0.5127000 15.12000 0.6044000 0.6800000      0.7925000 
1 1 1 10 41 25 o 11.08000 0.4855000 10.96000 0.6170000 11.19000 0.7497000 -0.2318000     0.9710000 
1 1 1 10 41 27 o 7.133000 0.6174000 6.514000 0.8479000 7.751000 0.8977000 -1.237000      1.235000  
1 1 1 10 41 29 o 11.67000 0.3778000 11.77000 0.4738000 11.57000 0.5885000 0.1998000      0.7556000 
1 1 1 10 41 31 o 13.59000 0.3520000 13.36000 0.4924000 13.81000 0.5031000 -0.4485000     0.7040000 
1 1 1 10 41 33 o 13.20000 0.3765000 12.84000 0.5615000 13.56000 0.5016000 -0.7218000     0.7529000 
1 1 1 10 41 35 f 6.125000 0.6850000 5.859000 0.9650000 6.390000 0.9724000 -0.5305000     1.370000  
1 1 1 10 41 37 o 6.124000 0.7810000 5.972000 1.157000  6.276000 1.049000  -0.3040000     1.562000  
1 1 1 10 41 39 f 3.580000 0.9467000 2.820000 1.185000  4.339000 1.477000  -1.519000      1.893000  
1 1 1 10 41 41 o 8.173000 0.5865000 8.052000 0.8049000 8.294000 0.8533000 -0.2419000     1.173000  
1 1 1 10 41 43 o 13.98000 0.3998000 13.95000 0.5576000 14.02000 0.5731000 -0.6704000E-01 0.7996000 
1 1 1 10 41 45 o 9.508000 0.6091000 8.655000 1.002000  10.36000 0.6921000 -1.706000      1.218000  
1 1 1 10 41 47 o 4.079000 1.009000  4.895000 1.525000  3.264000 1.322000  1.631000       2.018000  
1 1 1 10 41 49 o 2.647000 0.8310000 2.693000 1.199000  2.601000 1.151000  0.9176000E-01  1.662000  
1 1 1 10 42 0  o 43.49000 0.5709000 43.49000 0.5709000 43.49000 0.5709000 0.000000       0.000000  
1 1 1 10 42 2  o 25.57000 0.3195000 25.31000 0.4253000 25.83000 0.4768000 -0.5177000     0.6389000 
1 1 1 10 42 4  o 19.81000 0.3600000 19.89000 0.5300000 19.74000 0.4872000 0.1466000      0.7199000 
1 1 1 10 42 6  o 10.78000 0.5179000 11.76000 0.6199000 9.806000 0.8298000 1.949000       1.036000  
1 1 1 10 42 8  o 12.76000 0.3919000 13.85000 0.5558000 11.67000 0.5525000 2.179000       0.7837000 
1 1 1 10 42 10 o 8.123000 0.5615000 7.475000 0.7613000 8.771000 0.8256000 -1.297000      1.123000  
1 1 1 10 42 12 o 26.61000 0.3473000 26.18000 0.4404000 27.04000 0.5370000 -0.8600000     0.6946000 
1 1 1 10 42 14 o 37.99000 0.3961000 37.89000 0.4783000 38.09000 0.6314000 -0.2031000     0.7921000 
1 1 1 10 42 16 o 14.19000 0.4008000 13.75000 0.5412000 14.62000 0.5913000 -0.8708000     0.8016000 
1 1 1 10 42 18 o 19.66000 0.3308000 19.37000 0.4496000 19.95000 0.4853000 -0.5836000     0.6615000 
1 1 1 10 42 20 o 27.76000 0.3466000 27.51000 0.5023000 28.01000 0.4776000 -0.4993000     0.6931000 
1 1 1 10 42 22 o 17.55000 0.3689000 18.18000 0.4710000 16.93000 0.5679000 1.251000       0.7378000 
1 1 1 10 42 24 o 10.50000 0.4451000 10.38000 0.6117000 10.62000 0.6468000 -0.2440000     0.8903000 
1 1 1 10 42 26 o 15.99000 0.3777000 15.56000 0.5480000 16.41000 0.5201000 -0.8486000     0.7555000 
1 1 1 10 42 28 o 23.89000 0.3469000 22.82000 0.3760000 24.96000 0.5831000 -2.143000      0.6938000 
1 1 1 10 42 30 o 10.44000 0.4107000 11.08000 0.5174000 9.798000 0.6379000 1.282000       0.8214000 
1 1 1 10 42 32 o 12.42000 0.3615000 12.40000 0.4874000 12.44000 0.5340000 -0.3884000E-01 0.7230000 
1 1 1 10 42 34 o 3.623000 0.8976000 2.979000 1.241000  4.267000 1.297000  -1.288000      1.795000  
1 1 1 10 42 36 o 14.21000 0.4367000 13.56000 0.6990000 14.85000 0.5238000 -1.292000      0.8734000 
1 1 1 10 42 38 o 9.212000 0.6628000 9.543000 0.6511000 8.881000 1.155000  0.6613000      1.326000  
1 1 1 10 42 40 o 9.275000 0.5455000 9.455000 0.7098000 9.095000 0.8286000 0.3603000      1.091000  
1 1 1 10 42 42 o 11.17000 0.5507000 11.33000 0.7481000 11.02000 0.8083000 0.3092000      1.101000  
1 1 1 10 42 44 o 5.117000 0.9487000 4.912000 1.401000  5.322000 1.280000  -0.4097000     1.897000  
1 1 1 10 42 46 o 3.247000 0.9036000 3.520000 1.296000  2.975000 1.260000  0.5445000      1.807000  
1 1 1 10 42 48 o 7.291000 0.7087000 6.122000 1.150000  8.459000 0.8286000 -2.338000      1.417000  
1 1 1 10 43 1  o 13.66000 0.3738000 14.07000 0.5157000 13.25000 0.5411000 0.8189000      0.7475000 
1 1 1 10 43 3  o 9.590000 0.4856000 9.168000 0.7200000 10.01000 0.6519000 -0.8447000     0.9713000 
1 1 1 10 43 5  o 9.084000 0.5275000 9.266000 0.7134000 8.901000 0.7773000 0.3647000      1.055000  
1 1 1 10 43 7  o 22.53000 0.3378000 22.70000 0.3895000 22.36000 0.5521000 0.3457000      0.6756000 
1 1 1 10 43 9  o 6.547000 0.6886000 6.317000 0.8907000 6.777000 1.051000  -0.4601000     1.377000  
1 1 1 10 43 11 o 7.910000 0.5640000 7.407000 0.7648000 8.413000 0.8290000 -1.006000      1.128000  
1 1 1 10 43 13 o 17.40000 0.3360000 18.02000 0.4701000 16.77000 0.4801000 1.246000       0.6720000 
1 1 1 10 43 15 o 10.49000 0.4397000 10.24000 0.6187000 10.74000 0.6249000 -0.4959000     0.8793000 
1 1 1 10 43 17 o 24.80000 0.3118000 25.25000 0.4227000 24.34000 0.4586000 0.9115000      0.6236000 
1 1 1 10 43 19 o 11.98000 0.4320000 12.09000 0.6054000 11.87000 0.6163000 0.2177000      0.8639000 
1 1 1 10 43 21 o 8.494000 0.5713000 8.965000 0.6686000 8.024000 0.9264000 0.9413000      1.143000  
1 1 1 10 43 23 o 12.72000 0.3810000 12.76000 0.5045000 12.67000 0.5709000 0.8937000E-01  0.7619000 
1 1 1 10 43 25 o 7.691000 0.5691000 7.632000 0.7913000 7.750000 0.8182000 -0.1186000     1.138000  
1 1 1 10 43 27 o 7.853000 0.5970000 7.909000 0.8129000 7.797000 0.8745000 0.1121000      1.194000  
1 1 1 10 43 29 o 6.282000 0.7140000 7.301000 0.7218000 5.264000 1.232000  2.038000       1.428000  
1 1 1 10 43 31 o 4.081000 0.8593000 4.031000 1.170000  4.131000 1.259000  -0.9933000E-01 1.719000  
1 1 1 10 43 33 o 3.430000 0.8961000 3.189000 1.222000  3.672000 1.311000  -0.4828000     1.792000  
1 1 1 10 43 35 o 8.723000 0.5968000 8.176000 0.9203000 9.270000 0.7602000 -1.094000      1.194000  
1 1 1 10 43 37 o 5.542000 0.9367000 5.689000 1.338000  5.395000 1.311000  0.2936000      1.873000  
1 1 1 10 43 39 o 5.023000 0.9002000 4.863000 1.198000  5.184000 1.344000  -0.3204000     1.800000  
1 1 1 10 43 41 o 3.568000 0.9528000 3.693000 1.301000  3.444000 1.392000  0.2496000      1.906000  
1 1 1 10 43 43 o 3.075000 0.8912000 2.896000 1.215000  3.255000 1.304000  -0.3587000     1.782000  
1 1 1 10 43 45 o 5.645000 0.9199000 5.084000 1.381000  6.207000 1.216000  -1.123000      1.840000  
1 1 1 10 43 47 o 6.330000 0.7875000 7.246000 0.9174000 5.415000 1.280000  1.831000       1.575000  
1 1 1 10 44 0  o 11.94000 0.5535000 11.94000 0.5535000 11.94000 0.5535000 0.000000       0.000000  
1 1 1 10 44 2  o 6.689000 0.6690000 7.109000 0.8913000 6.268000 0.9980000 0.8417000      1.338000  
1 1 1 10 44 4  o 7.301000 0.6112000 7.729000 0.7922000 6.872000 0.9311000 0.8564000      1.222000  
1 1 1 10 44 6  o 17.51000 0.3239000 17.33000 0.4603000 17.69000 0.4560000 -0.3666000     0.6479000 
1 1 1 10 44 8  o 3.435000 0.8658000 3.767000 1.218000  3.102000 1.231000  0.6652000      1.732000  
1 1 1 10 44 10 o 17.04000 0.3218000 17.70000 0.4048000 16.37000 0.5004000 1.327000       0.6437000 
1 1 1 10 44 12 o 13.73000 0.3470000 13.67000 0.4563000 13.79000 0.5228000 -0.1166000     0.6939000 
1 1 1 10 44 14 o 24.38000 0.2974000 24.46000 0.3765000 24.30000 0.4605000 0.1544000      0.5949000 
1 1 1 10 44 16 o 8.211000 0.5075000 7.556000 0.7242000 8.866000 0.7112000 -1.310000      1.015000  
1 1 1 10 44 18 o 3.799000 0.8168000 2.595000 1.121000  5.003000 1.188000  -2.408000      1.634000  
1 1 1 10 44 20 o 6.861000 0.5623000 6.350000 0.7376000 7.372000 0.8490000 -1.022000      1.125000  
1 1 1 10 44 22 o 3.818000 0.9001000 3.386000 1.218000  4.250000 1.326000  -0.8639000     1.800000  
1 1 1 10 44 24 o 4.433000 0.8474000 4.860000 1.093000  4.006000 1.295000  0.8533000      1.695000  
1 1 1 10 44 26 o 3.106000 0.8517000 2.732000 1.106000  3.480000 1.295000  -0.7483000     1.703000  
1 1 1 10 44 28 o 12.11000 0.3979000 12.86000 0.4935000 11.35000 0.6242000 1.510000       0.7957000 
1 1 1 10 44 30 o 6.677000 0.6458000 6.774000 0.7607000 6.580000 1.044000  0.1944000      1.292000  
1 1 1 10 44 32 o 11.56000 0.4344000 11.01000 0.6305000 12.12000 0.5978000 -1.104000      0.8689000 
1 1 1 10 44 34 o 10.33000 0.4547000 9.970000 0.6423000 10.69000 0.6437000 -0.7212000     0.9094000 
1 1 1 10 44 36 o 12.11000 0.5144000 11.20000 0.6796000 13.02000 0.7723000 -1.821000      1.029000  
1 1 1 10 44 38 o 3.128000 0.8867000 3.521000 1.263000  2.735000 1.245000  0.7853000      1.773000  
1 1 1 10 44 40 o 3.780000 0.9810000 3.232000 1.275000  4.329000 1.491000  -1.097000      1.962000  
1 1 1 10 44 42 o 8.270000 0.6308000 7.776000 0.9926000 8.764000 0.7788000 -0.9879000     1.262000  
1 1 1 10 44 44 o 6.175000 0.8351000 6.620000 1.184000  5.730000 1.178000  0.8900000      1.670000  
1 1 1 10 44 46 o 7.783000 0.6603000 8.029000 0.8836000 7.537000 0.9814000 0.4918000      1.321000  
1 1 1 10 45 1  o 10.65000 0.5760000 11.17000 0.9593000 10.12000 0.6378000 1.044000       1.152000  
1 1 1 10 45 3  o 35.93000 0.3241000 35.29000 0.4531000 36.58000 0.4634000 -1.294000      0.6481000 
1 1 1 10 45 5  f 31.36000 0.3087000 31.40000 0.4415000 31.31000 0.4316000 0.9442000E-01  0.6174000 
1 1 1 10 45 7  o 15.16000 0.3637000 15.62000 0.4810000 14.70000 0.5456000 0.9231000      0.7274000 
1 1 1 10 45 9  o 7.807000 0.5269000 6.736000 0.7749000 8.878000 0.7141000 -2.143000      1.054000  
1 1 1 10 45 11 o 7.972000 0.4960000 8.161000 0.6385000 7.783000 0.7593000 0.3777000      0.9921000 
1 1 1 10 45 13 o 5.351000 0.7502000 5.313000 1.016000  5.389000 1.104000  -0.7641000E-01 1.500000  
1 1 1 10 45 15 o 17.71000 0.3062000 17.85000 0.3958000 17.57000 0.4672000 0.2727000      0.6123000 
1 1 1 10 45 17 o 19.83000 0.3344000 19.95000 0.3906000 19.71000 0.5428000 0.2346000      0.6688000 
1 1 1 10 45 19 o 6.551000 0.6917000 7.323000 0.7904000 5.779000 1.135000  1.544000       1.383000  
1 1 1 10 45 21 o 5.821000 0.7159000 5.909000 0.9235000 5.734000 1.094000  0.1749000      1.432000  
1 1 1 10 45 23 o 8.494000 0.4811000 8.166000 0.6304000 8.821000 0.7269000 -0.6548000     0.9622000 
1 1 1 10 45 25 f 9.689000 0.4434000 10.10000 0.5524000 9.272000 0.6936000 0.8325000      0.8867000 
1 1 1 10 45 27 o 2.655000 0.7820000 3.113000 1.168000  2.198000 1.040000  0.9150000      1.564000  
1 1 1 10 45 29 o 5.792000 0.7588000 6.108000 0.9015000 5.475000 1.221000  0.6326000      1.518000  
1 1 1 10 45 31 o 7.724000 0.5932000 7.470000 0.8636000 7.978000 0.8136000 -0.5081000     1.186000  
1 1 1 10 45 33 o 5.377000 0.7948000 4.840000 1.126000  5.915000 1.122000  -1.075000      1.590000  
1 1 1 10 45 35 o 3.461000 0.9006000 3.846000 1.257000  3.077000 1.290000  0.7689000      1.801000  
1 1 1 10 45 37 o 6.616000 0.6313000 7.001000 0.8908000 6.232000 0.8947000 0.7690000      1.263000  
1 1 1 10 45 39 o 6.233000 1.026000  6.941000 0.9983000 5.525000 1.793000  1.416000       2.052000  
1 1 1 10 45 41 f 7.588000 0.6233000 7.238000 0.8099000 7.938000 0.9476000 -0.6999000     1.247000  
1 1 1 10 45 43 o 2.940000 0.8602000 2.986000 1.192000  2.894000 1.241000  0.9136000E-01  1.720000  
1 1 1 10 45 45 o 3.279000 0.9197000 3.059000 1.218000  3.499000 1.378000  -0.4399000     1.839000  
1 1 1 10 46 0  o 4.643000 1.191000  4.643000 1.191000  4.643000 1.191000  0.000000       0.000000  
1 1 1 10 46 2  o 5.766000 0.7524000 6.857000 0.8722000 4.676000 1.226000  2.181000       1.505000  
1 1 1 10 46 4  o 3.932000 1.011000  4.649000 1.609000  3.215000 1.224000  1.434000       2.022000  
1 1 1 10 46 6  o 13.32000 0.3798000 13.73000 0.5818000 12.91000 0.4884000 0.8252000      0.7597000 
1 1 1 10 46 8  o 11.80000 0.3742000 11.58000 0.4909000 12.01000 0.5649000 -0.4361000     0.7484000 
1 1 1 10 46 10 o 9.387000 0.4474000 8.643000 0.6331000 10.13000 0.6325000 -1.487000      0.8949000 
1 1 1 10 46 12 o 12.56000 0.3509000 12.29000 0.4734000 12.83000 0.5182000 -0.5406000     0.7018000 
1 1 1 10 46 14 o 4.146000 0.8122000 3.341000 1.165000  4.951000 1.132000  -1.610000      1.624000  
1 1 1 10 46 16 o 9.004000 0.4871000 8.711000 0.6221000 9.296000 0.7498000 -0.5856000     0.9742000 
1 1 1 10 46 18 f 11.93000 0.3739000 11.68000 0.5026000 12.18000 0.5538000 -0.5001000     0.7478000 
1 1 1 10 46 20 o 7.730000 0.5395000 8.091000 0.6375000 7.369000 0.8705000 0.7220000      1.079000  
1 1 1 10 46 22 o 7.763000 0.5392000 7.694000 0.6714000 7.831000 0.8440000 -0.1370000     1.078000  
1 1 1 10 46 24 o 11.67000 0.3826000 11.67000 0.4805000 11.66000 0.5954000 0.1485000E-01  0.7651000 
1 1 1 10 46 26 o 5.354000 0.7674000 4.915000 1.050000  5.793000 1.119000  -0.8774000     1.535000  
1 1 1 10 46 28 o 9.672000 0.4779000 9.103000 0.6436000 10.24000 0.7066000 -1.138000      0.9558000 
1 1 1 10 46 30 o 6.285000 0.8940000 5.589000 1.485000  6.982000 0.9965000 -1.393000      1.788000  
1 1 1 10 46 32 o 5.255000 0.7531000 5.014000 1.012000  5.496000 1.116000  -0.4814000     1.506000  
1 1 1 10 46 34 o 4.816000 0.8944000 3.747000 1.255000  5.886000 1.275000  -2.139000      1.789000  
1 1 1 10 46 36 o 5.238000 0.8744000 4.861000 1.220000  5.616000 1.253000  -0.7551000     1.749000  
1 1 1 10 46 38 f 8.273000 0.7568000 8.443000 0.7193000 8.104000 1.332000  0.3388000      1.514000  
1 1 1 10 46 40 o 4.218000 0.9411000 3.525000 1.369000  4.911000 1.292000  -1.385000      1.882000  
1 1 1 10 46 42 o 3.467000 1.037000  3.766000 1.574000  3.168000 1.350000  0.5983000      2.073000  
1 1 1 10 46 44 o 4.314000 1.073000  3.864000 1.438000  4.764000 1.593000  -0.8998000     2.146000  
1 1 1 10 47 1  o 9.692000 0.4470000 10.34000 0.6038000 9.040000 0.6593000 1.304000       0.8940000 
1 1 1 10 47 3  o 10.17000 0.4310000 10.57000 0.5815000 9.775000 0.6364000 0.7906000      0.8621000 
1 1 1 10 47 5  o 7.635000 0.5698000 7.231000 0.9185000 8.039000 0.6746000 -0.8077000     1.140000  
1 1 1 10 47 7  o 3.633000 0.8858000 2.895000 1.219000  4.371000 1.286000  -1.476000      1.772000  
1 1 1 10 47 9  o 3.118000 0.8603000 3.375000 1.254000  2.861000 1.178000  0.5138000      1.721000  
1 1 1 10 47 11 o 7.606000 0.5149000 7.380000 0.7096000 7.833000 0.7462000 -0.4526000     1.030000  
1 1 1 10 47 13 f 16.52000 0.3456000 16.46000 0.4098000 16.58000 0.5567000 -0.1258000     0.6913000 
1 1 1 10 47 15 o 8.798000 0.4618000 8.557000 0.6337000 9.039000 0.6718000 -0.4827000     0.9235000 
1 1 1 10 47 17 o 8.712000 0.4670000 8.251000 0.6288000 9.173000 0.6907000 -0.9221000     0.9340000 
1 1 1 10 47 19 o 3.055000 0.8567000 2.928000 1.174000  3.182000 1.248000  -0.2541000     1.713000  
1 1 1 10 47 21 o 3.316000 0.8410000 3.751000 1.159000  2.882000 1.219000  0.8683000      1.682000  
1 1 1 10 47 23 o 6.374000 0.6804000 6.757000 0.7530000 5.991000 1.133000  0.7668000      1.361000  
1 1 1 10 47 25 o 10.11000 0.4516000 9.936000 0.5613000 10.29000 0.7076000 -0.3548000     0.9032000 
1 1 1 10 47 27 o 5.540000 0.7845000 5.273000 1.009000  5.808000 1.201000  -0.5355000     1.569000  
1 1 1 10 47 29 o 8.397000 0.5359000 7.771000 0.7381000 9.023000 0.7772000 -1.252000      1.072000  
1 1 1 10 47 31 o 12.01000 0.5085000 11.70000 0.8373000 12.33000 0.5771000 -0.6333000     1.017000  
1 1 1 10 47 33 o 3.750000 0.9581000 3.384000 1.310000  4.116000 1.399000  -0.7326000     1.916000  
1 1 1 10 47 35 o 3.726000 0.9760000 3.831000 1.245000  3.620000 1.503000  0.2101000      1.952000  
1 1 1 10 47 37 o 4.434000 0.8533000 5.762000 1.043000  3.106000 1.351000  2.656000       1.707000  
1 1 1 10 47 39 o 3.322000 0.8967000 3.244000 1.234000  3.400000 1.302000  -0.1556000     1.793000  
1 1 1 10 47 41 o 3.094000 0.8846000 3.806000 1.390000  2.381000 1.094000  1.425000       1.769000  
1 1 1 10 47 43 o 6.639000 0.9720000 5.527000 1.377000  7.751000 1.372000  -2.224000      1.944000  
1 1 1 10 48 0  o 4.720000 1.197000  4.720000 1.197000  4.720000 1.197000  0.000000       0.000000  
1 1 1 10 48 2  o 3.869000 0.9234000 3.651000 1.216000  4.087000 1.390000  -0.4358000     1.847000  
1 1 1 10 48 4  o 10.16000 0.4432000 10.54000 0.6697000 9.772000 0.5808000 0.7706000      0.8864000 
1 1 1 10 48 6  o 13.73000 0.3411000 13.71000 0.4921000 13.75000 0.4725000 -0.4165000E-01 0.6822000 
1 1 1 10 48 8  o 2.465000 0.7670000 2.322000 1.022000  2.608000 1.144000  -0.2856000     1.534000  
1 1 1 10 48 10 o 11.57000 0.3757000 10.96000 0.5014000 12.18000 0.5597000 -1.214000      0.7514000 
1 1 1 10 48 12 o 5.721000 0.7224000 6.315000 0.8342000 5.128000 1.180000  1.187000       1.445000  
1 1 1 10 48 14 o 2.990000 0.8098000 3.429000 1.197000  2.552000 1.091000  0.8767000      1.620000  
1 1 1 10 48 16 o 16.44000 0.3386000 15.78000 0.4729000 17.11000 0.4848000 -1.338000      0.6772000 
1 1 1 10 48 18 o 8.092000 0.5336000 7.724000 0.7632000 8.460000 0.7459000 -0.7365000     1.067000  
1 1 1 10 48 20 o 3.031000 0.8397000 2.820000 1.107000  3.241000 1.263000  -0.4213000     1.679000  
1 1 1 10 48 22 o 9.912000 0.4615000 10.14000 0.5391000 9.683000 0.7493000 0.4587000      0.9231000 
1 1 1 10 48 24 o 5.776000 0.7328000 6.265000 0.7624000 5.288000 1.252000  0.9768000      1.466000  
1 1 1 10 48 26 o 13.14000 0.3765000 13.90000 0.4425000 12.38000 0.6092000 1.522000       0.7529000 
1 1 1 10 48 28 o 13.47000 0.3756000 13.55000 0.4651000 13.40000 0.5898000 0.1563000      0.7511000 
1 1 1 10 48 30 o 3.319000 0.9044000 2.965000 1.273000  3.673000 1.285000  -0.7075000     1.809000  
1 1 1 10 48 32 o 7.403000 0.7734000 6.968000 1.301000  7.839000 0.8370000 -0.8710000     1.547000  
1 1 1 10 48 34 o 9.112000 0.6631000 9.030000 0.6779000 9.193000 1.140000  -0.1633000     1.326000  
1 1 1 10 48 36 o 3.884000 1.006000  2.840000 1.213000  4.928000 1.605000  -2.088000      2.012000  
1 1 1 10 48 38 o 5.132000 0.9056000 5.945000 0.9865000 4.319000 1.519000  1.626000       1.811000  
1 1 1 10 48 40 o 4.945000 0.9497000 6.003000 1.236000  3.888000 1.442000  2.115000       1.899000  
1 1 1 10 48 42 o 4.805000 2.087000  4.805000 2.087000  ?        ?         ?              ?         
1 1 1 10 49 1  o 5.682000 0.7190000 5.675000 0.9942000 5.689000 1.039000  -0.1374000E-01 1.438000  
1 1 1 10 49 3  o 11.87000 0.4427000 11.52000 0.6205000 12.22000 0.6316000 -0.6963000     0.8854000 
1 1 1 10 49 5  f 7.731000 0.5081000 7.498000 0.7414000 7.965000 0.6951000 -0.4677000     1.016000  
1 1 1 10 49 7  o 3.573000 0.8528000 3.693000 1.207000  3.452000 1.205000  0.2407000      1.706000  
1 1 1 10 49 9  o 3.653000 0.8678000 3.997000 1.132000  3.308000 1.316000  0.6887000      1.736000  
1 1 1 10 49 11 o 4.579000 0.7978000 4.847000 1.062000  4.312000 1.191000  0.5350000      1.596000  
1 1 1 10 49 13 o 3.190000 0.8033000 2.249000 1.016000  4.131000 1.245000  -1.882000      1.607000  
1 1 1 10 49 15 o 5.721000 0.7733000 6.510000 0.9758000 4.932000 1.200000  1.578000       1.547000  
1 1 1 10 49 17 o 5.543000 0.7619000 6.460000 0.9250000 4.626000 1.211000  1.834000       1.524000  
1 1 1 10 49 19 o 3.890000 0.8197000 2.706000 1.121000  5.075000 1.196000  -2.369000      1.639000  
1 1 1 10 49 21 o 13.51000 0.3698000 13.46000 0.4570000 13.57000 0.5816000 -0.1024000     0.7397000 
1 1 1 10 49 23 o 12.71000 0.3939000 13.09000 0.4503000 12.32000 0.6464000 0.7681000      0.7878000 
1 1 1 10 49 25 o 17.05000 0.3343000 17.29000 0.4151000 16.81000 0.5241000 0.4833000      0.6686000 
1 1 1 10 49 27 o 7.962000 0.5413000 7.738000 0.6956000 8.185000 0.8296000 -0.4465000     1.083000  
1 1 1 10 49 29 o 15.20000 0.3638000 14.95000 0.4897000 15.45000 0.5381000 -0.5072000     0.7276000 
1 1 1 10 49 31 o 9.142000 0.5522000 8.372000 0.8668000 9.913000 0.6845000 -1.541000      1.104000  
1 1 1 10 49 33 o 6.448000 1.093000  6.561000 1.108000  6.335000 1.885000  0.2260000      2.187000  
1 1 1 10 49 35 o 2.455000 0.8179000 2.051000 0.9709000 2.859000 1.316000  -0.8078000     1.636000  
1 1 1 10 49 37 o 2.543000 0.8384000 2.401000 1.138000  2.684000 1.232000  -0.2837000     1.677000  
1 1 1 10 49 39 o 4.166000 0.9623000 3.559000 1.267000  4.773000 1.449000  -1.214000      1.925000  
1 1 1 10 50 0  o 5.208000 1.072000  5.208000 1.072000  5.208000 1.072000  0.000000       0.000000  
1 1 1 10 50 2  o 7.462000 0.6019000 7.392000 0.8806000 7.533000 0.8208000 -0.1402000     1.204000  
1 1 1 10 50 4  o 8.169000 0.5881000 8.701000 0.6492000 7.638000 0.9809000 1.062000       1.176000  
1 1 1 10 50 6  o 13.17000 0.3698000 13.53000 0.4849000 12.82000 0.5586000 0.7058000      0.7397000 
1 1 1 10 50 8  o 8.164000 0.5523000 8.486000 0.5971000 7.842000 0.9294000 0.6446000      1.105000  
1 1 1 10 50 10 o 5.677000 0.6965000 6.555000 0.7450000 4.799000 1.177000  1.756000       1.393000  
1 1 1 10 50 12 f 3.213000 0.8412000 3.146000 1.174000  3.281000 1.205000  -0.1350000     1.682000  
1 1 1 10 50 14 o 7.845000 0.5668000 7.574000 0.8768000 8.117000 0.7187000 -0.5437000     1.134000  
1 1 1 10 50 16 o 13.11000 0.3730000 12.76000 0.4688000 13.46000 0.5804000 -0.6989000     0.7461000 
1 1 1 10 50 18 o 8.907000 0.5108000 8.304000 0.7437000 9.511000 0.7005000 -1.206000      1.022000  
1 1 1 10 50 20 o 2.748000 0.8354000 2.917000 1.202000  2.579000 1.160000  0.3379000      1.671000  
1 1 1 10 50 22 o 6.928000 0.7218000 6.302000 1.106000  7.554000 0.9276000 -1.252000      1.444000  
1 1 1 10 50 24 o 4.927000 0.8207000 5.415000 0.9108000 4.439000 1.365000  0.9757000      1.641000  
1 1 1 10 50 26 o 7.946000 0.6207000 6.634000 0.9724000 9.258000 0.7718000 -2.624000      1.241000  
1 1 1 10 50 28 f 3.223000 0.8778000 2.720000 1.161000  3.725000 1.317000  -1.005000      1.756000  
1 1 1 10 50 30 o 9.935000 0.5160000 9.990000 0.7383000 9.881000 0.7210000 0.1084000      1.032000  
1 1 1 10 50 32 o 7.859000 0.7984000 7.189000 1.007000  8.530000 1.239000  -1.341000      1.597000  
1 1 1 10 50 34 o 6.842000 0.8750000 7.066000 1.008000  6.618000 1.430000  0.4486000      1.750000  
1 1 1 10 50 36 o 7.112000 0.8177000 6.964000 1.120000  7.260000 1.192000  -0.2962000     1.635000  
1 1 1 10 50 38 o 3.184000 0.9215000 2.779000 1.251000  3.589000 1.354000  -0.8103000     1.843000  
1 1 1 10 51 1  o 7.058000 0.6462000 7.261000 0.9344000 6.856000 0.8928000 0.4056000      1.292000  
1 1 1 10 51 3  o 3.550000 0.8809000 3.565000 1.216000  3.535000 1.275000  0.2982000E-01  1.762000  
1 1 1 10 51 5  o 7.298000 0.7021000 6.409000 0.8816000 8.188000 1.093000  -1.779000      1.404000  
1 1 1 10 51 7  o 3.435000 0.8171000 4.162000 1.180000  2.709000 1.131000  1.453000       1.634000  
1 1 1 10 51 9  o 14.65000 0.3367000 14.37000 0.4398000 14.92000 0.5099000 -0.5452000     0.6734000 
1 1 1 10 51 11 o 8.767000 0.4878000 9.222000 0.6387000 8.313000 0.7374000 0.9089000      0.9755000 
1 1 1 10 51 13 o 6.147000 0.7048000 5.567000 1.093000  6.727000 0.8902000 -1.161000      1.410000  
1 1 1 10 51 15 f 4.231000 0.8566000 4.566000 1.117000  3.896000 1.299000  0.6702000      1.713000  
1 1 1 10 51 17 o 6.151000 0.7032000 5.607000 1.009000  6.694000 0.9793000 -1.087000      1.406000  
1 1 1 10 51 19 o 3.417000 0.8798000 3.238000 1.172000  3.596000 1.312000  -0.3579000     1.760000  
1 1 1 10 51 21 o 3.008000 0.8532000 2.513000 1.081000  3.503000 1.320000  -0.9902000     1.706000  
1 1 1 10 51 23 o 15.56000 0.4137000 15.87000 0.6154000 15.26000 0.5529000 0.6122000      0.8273000 
1 1 1 10 51 25 o 14.62000 0.4018000 14.47000 0.5705000 14.77000 0.5661000 -0.2978000     0.8037000 
1 1 1 10 51 27 o 5.461000 0.9699000 4.880000 1.377000  6.042000 1.366000  -1.162000      1.940000  
1 1 1 10 51 29 o 12.98000 0.5295000 13.06000 0.5847000 12.91000 0.8829000 0.1572000      1.059000  
1 1 1 10 51 31 o 6.925000 1.038000  6.992000 0.8959000 6.857000 1.874000  0.1354000      2.077000  
1 1 1 10 51 33 o 3.863000 1.006000  4.069000 1.411000  3.657000 1.434000  0.4124000      2.012000  
1 1 1 10 51 35 o 4.139000 0.9942000 3.546000 1.395000  4.731000 1.417000  -1.185000      1.988000  
1 1 1 10 51 37 f 5.089000 1.001000  4.362000 1.497000  5.816000 1.328000  -1.454000      2.002000  
1 1 1 10 52 0  o 7.831000 1.160000  7.831000 1.160000  7.831000 1.160000  0.000000       0.000000  
1 1 1 10 52 2  o 15.11000 0.3816000 15.26000 0.5035000 14.96000 0.5735000 0.2934000      0.7632000 
1 1 1 10 52 4  o 11.52000 0.3738000 11.56000 0.5186000 11.47000 0.5385000 0.9196000E-01  0.7476000 
1 1 1 10 52 6  o 3.297000 0.8746000 3.546000 1.175000  3.048000 1.296000  0.4976000      1.749000  
1 1 1 10 52 8  f 7.117000 0.6239000 7.869000 0.7507000 6.365000 0.9968000 1.503000       1.248000  
1 1 1 10 52 10 o 7.572000 0.5558000 7.722000 0.7406000 7.423000 0.8289000 0.2992000      1.112000  
1 1 1 10 52 12 o 7.751000 0.5631000 7.684000 0.8254000 7.818000 0.7663000 -0.1346000     1.126000  
1 1 1 10 52 14 o 8.130000 0.4945000 8.074000 0.6855000 8.186000 0.7129000 -0.1127000     0.9890000 
1 1 1 10 52 16 o 4.967000 0.8430000 5.484000 1.106000  4.449000 1.273000  1.034000       1.686000  
1 1 1 10 52 18 o 13.56000 0.3806000 13.53000 0.4650000 13.59000 0.6027000 -0.5261000E-01 0.7612000 
1 1 1 10 52 20 o 13.94000 0.3882000 13.86000 0.5147000 14.02000 0.5812000 -0.1540000     0.7763000 
1 1 1 10 52 22 o 6.966000 0.7121000 5.712000 1.133000  8.220000 0.8630000 -2.508000      1.424000  
1 1 1 10 52 24 o 6.498000 0.6971000 6.374000 0.8787000 6.621000 1.082000  -0.2470000     1.394000  
1 1 1 10 52 26 o 3.490000 1.216000  3.490000 1.216000  ?        ?         ?              ?         
1 1 1 10 52 28 o 3.577000 0.9577000 3.770000 1.224000  3.384000 1.473000  0.3867000      1.915000  
1 1 1 10 52 30 o 4.685000 0.9942000 4.757000 1.190000  4.612000 1.593000  0.1457000      1.988000  
1 1 1 10 52 32 o 3.705000 1.056000  3.819000 1.548000  3.590000 1.438000  0.2290000      2.113000  
1 1 1 10 52 34 o 3.138000 0.9544000 3.146000 1.390000  3.131000 1.308000  0.1510000E-01  1.909000  
1 1 1 10 52 36 o 4.793000 1.995000  4.793000 1.995000  ?        ?         ?              ?         
1 1 1 10 53 1  o 14.49000 0.4062000 14.17000 0.5717000 14.81000 0.5773000 -0.6420000     0.8124000 
1 1 1 10 53 3  o 5.346000 0.7698000 5.869000 1.103000  4.823000 1.074000  1.046000       1.540000  
1 1 1 10 53 5  o 11.22000 0.4213000 10.33000 0.6575000 12.12000 0.5269000 -1.795000      0.8426000 
1 1 1 10 53 7  o 4.828000 0.9556000 4.860000 1.354000  4.797000 1.349000  0.6248000E-01  1.911000  
1 1 1 10 53 9  o 13.63000 0.4138000 13.16000 0.5833000 14.09000 0.5872000 -0.9246000     0.8277000 
1 1 1 10 53 11 o 13.88000 0.4269000 13.64000 0.6441000 14.11000 0.5604000 -0.4704000     0.8538000 
1 1 1 10 53 13 o 3.331000 0.7838000 4.006000 1.072000  2.655000 1.144000  1.352000       1.568000  
1 1 1 10 53 15 o 4.337000 0.9056000 4.346000 1.310000  4.327000 1.251000  0.1942000E-01  1.811000  
1 1 1 10 53 17 o 4.220000 0.8794000 4.587000 1.209000  3.852000 1.277000  0.7354000      1.759000  
1 1 1 10 53 19 o 12.11000 0.4286000 12.05000 0.5707000 12.17000 0.6395000 -0.1122000     0.8571000 
1 1 1 10 53 21 o 6.232000 0.6925000 5.274000 0.9857000 7.189000 0.9729000 -1.915000      1.385000  
1 1 1 10 53 23 o 4.970000 0.9405000 4.496000 1.191000  5.443000 1.456000  -0.9468000     1.881000  
1 1 1 10 53 25 o 6.017000 1.217000  5.186000 1.314000  6.848000 2.049000  -1.663000      2.434000  
1 1 1 10 53 27 o 4.816000 0.9803000 5.440000 1.198000  4.192000 1.552000  1.247000       1.961000  
1 1 1 10 53 29 o 6.111000 1.124000  6.208000 1.163000  6.014000 1.924000  0.1940000      2.248000  
1 1 1 10 53 31 o 4.232000 0.9910000 4.956000 1.405000  3.509000 1.398000  1.447000       1.982000  
1 1 1 10 53 33 o 6.485000 0.8949000 7.331000 1.098000  5.639000 1.413000  1.692000       1.790000  
1 1 1 10 54 0  o 3.636000 1.284000  3.636000 1.284000  3.636000 1.284000  0.000000       0.000000  
1 1 1 10 54 2  o 5.487000 0.8034000 5.030000 1.163000  5.944000 1.109000  -0.9137000     1.607000  
1 1 1 10 54 4  o 9.435000 0.4853000 10.29000 0.6634000 8.576000 0.7084000 1.719000       0.9706000 
1 1 1 10 54 6  o 10.62000 0.4376000 10.82000 0.6216000 10.42000 0.6161000 0.4020000      0.8752000 
1 1 1 10 54 8  o 4.483000 0.9676000 4.748000 1.332000  4.217000 1.404000  0.5317000      1.935000  
1 1 1 10 54 10 o 5.399000 0.8784000 5.056000 1.342000  5.741000 1.133000  -0.6849000     1.757000  
1 1 1 10 54 12 f 4.529000 0.8788000 4.920000 1.200000  4.139000 1.284000  0.7804000      1.758000  
1 1 1 10 54 14 o 7.969000 0.6089000 8.082000 0.9206000 7.857000 0.7972000 0.2245000      1.218000  
1 1 1 10 54 16 o 8.290000 0.5127000 7.903000 0.6774000 8.677000 0.7699000 -0.7743000     1.025000  
1 1 1 10 54 18 o 3.235000 0.8778000 3.224000 1.192000  3.245000 1.289000  -0.2031000E-01 1.756000  
1 1 1 10 54 20 o 3.824000 0.9064000 3.551000 1.182000  4.097000 1.375000  -0.5459000     1.813000  
1 1 1 10 54 22 o 4.598000 1.034000  4.873000 1.241000  4.323000 1.654000  0.5499000      2.068000  
1 1 1 10 54 24 o 6.505000 0.9276000 7.397000 0.9097000 5.614000 1.617000  1.783000       1.855000  
1 1 1 10 54 26 o 4.572000 1.211000  4.291000 1.453000  4.853000 1.937000  -0.5617000     2.422000  
1 1 1 10 54 28 o 3.900000 1.061000  3.302000 1.291000  4.499000 1.684000  -1.197000      2.122000  
1 1 1 10 54 30 o 4.322000 1.026000  4.527000 1.411000  4.117000 1.489000  0.4105000      2.052000  
1 1 1 10 54 32 f 2.633000 0.8685000 2.747000 1.279000  2.518000 1.175000  0.2294000      1.737000  
1 1 1 10 55 1  o 4.735000 0.9250000 4.633000 1.326000  4.836000 1.290000  -0.2030000     1.850000  
1 1 1 10 55 3  o 10.20000 0.4391000 10.16000 0.6428000 10.23000 0.5984000 -0.7401000E-01 0.8783000 
1 1 1 10 55 5  o 7.042000 0.6143000 7.007000 0.8639000 7.077000 0.8736000 -0.7014000E-01 1.229000  
1 1 1 10 55 7  o 13.24000 0.3846000 13.11000 0.5463000 13.36000 0.5416000 -0.2529000     0.7693000 
1 1 1 10 55 9  o 9.624000 0.6026000 9.187000 0.8811000 10.06000 0.8225000 -0.8738000     1.205000  
1 1 1 10 55 11 o 12.29000 0.5187000 12.51000 0.4960000 12.07000 0.9110000 0.4430000      1.037000  
1 1 1 10 55 13 f 4.209000 0.8808000 4.333000 1.243000  4.085000 1.248000  0.2488000      1.762000  
1 1 1 10 55 15 o 4.365000 0.8422000 4.176000 1.171000  4.554000 1.211000  -0.3783000     1.684000  
1 1 1 10 55 17 o 8.419000 0.6322000 8.429000 0.6727000 8.409000 1.071000  0.1987000E-01  1.264000  
1 1 1 10 55 19 o 8.307000 0.7746000 8.520000 0.6898000 8.095000 1.387000  0.4255000      1.549000  
1 1 1 10 55 21 o 4.875000 1.184000  3.429000 1.208000  6.321000 2.036000  -2.892000      2.367000  
1 1 1 10 55 23 f 4.935000 1.117000  4.841000 1.089000  5.029000 1.950000  -0.1883000     2.234000  
1 1 1 10 55 25 o 9.807000 0.8900000 9.178000 0.8736000 10.44000 1.551000  -1.259000      1.780000  
1 1 1 10 55 27 o 7.556000 0.8848000 7.328000 0.8888000 7.784000 1.530000  -0.4560000     1.770000  
1 1 1 10 55 29 o 5.823000 0.9031000 6.509000 1.211000  5.136000 1.340000  1.373000       1.806000  
1 1 1 10 56 0  o 2.979000 1.236000  2.979000 1.236000  2.979000 1.236000  0.000000       0.000000  
1 1 1 10 56 2  o 3.738000 0.8861000 4.077000 1.258000  3.399000 1.248000  0.6777000      1.772000  
1 1 1 10 56 4  o 9.544000 0.4970000 9.743000 0.6403000 9.346000 0.7605000 0.3966000      0.9941000 
1 1 1 10 56 6  o 10.58000 0.5045000 10.43000 0.6122000 10.73000 0.8021000 -0.2929000     1.009000  
1 1 1 10 56 8  o 10.15000 0.4887000 10.37000 0.7508000 9.935000 0.6257000 0.4355000      0.9773000 
1 1 1 10 56 10 o 8.823000 0.5298000 9.946000 0.6747000 7.700000 0.8170000 2.246000       1.060000  
1 1 1 10 56 12 o 3.171000 0.9192000 3.527000 1.285000  2.816000 1.315000  0.7105000      1.838000  
1 1 1 10 56 14 o 2.214000 0.7256000 2.188000 0.9970000 2.240000 1.054000  -0.5238000E-01 1.451000  
1 1 1 10 56 16 o 5.373000 1.099000  4.591000 1.094000  6.154000 1.905000  -1.564000      2.197000  
1 1 1 10 56 18 o 8.930000 0.8444000 9.270000 0.6419000 8.590000 1.562000  0.6796000      1.689000  
1 1 1 10 56 20 f 7.855000 0.6675000 7.855000 0.6675000 ?        ?         ?              ?         
1 1 1 10 56 22 o 5.381000 1.060000  5.130000 1.179000  5.632000 1.761000  -0.5024000     2.119000  
1 1 1 10 56 24 o 7.616000 0.8587000 7.234000 1.050000  7.998000 1.359000  -0.7645000     1.717000  
1 1 1 10 56 26 o 9.426000 0.7606000 9.335000 0.8719000 9.517000 1.247000  -0.1819000     1.521000  
1 1 1 10 56 28 o 5.256000 1.544000  5.256000 1.544000  ?        ?         ?              ?         
1 1 1 10 57 1  o 2.525000 0.7915000 2.419000 1.092000  2.631000 1.146000  -0.2127000     1.583000  
1 1 1 10 57 3  o 7.694000 0.5409000 7.544000 0.7646000 7.843000 0.7652000 -0.2987000     1.082000  
1 1 1 10 57 5  o 4.608000 0.8324000 5.190000 1.113000  4.026000 1.238000  1.165000       1.665000  
1 1 1 10 57 7  o 3.173000 0.9180000 3.438000 1.370000  2.908000 1.222000  0.5300000      1.836000  
1 1 1 10 57 9  o 5.156000 0.8231000 5.564000 1.091000  4.748000 1.233000  0.8157000      1.646000  
1 1 1 10 57 11 o 13.81000 0.4321000 14.74000 0.5071000 12.89000 0.6998000 1.853000       0.8642000 
1 1 1 10 57 13 o 10.06000 0.7855000 8.833000 0.6680000 11.28000 1.422000  -2.444000      1.571000  
1 1 1 10 57 15 o 4.185000 1.144000  3.592000 1.199000  4.777000 1.949000  -1.185000      2.288000  
1 1 1 10 57 17 o 2.771000 0.8423000 2.702000 1.117000  2.840000 1.261000  -0.1381000     1.685000  
1 1 1 10 57 19 o 8.139000 0.8225000 8.218000 0.8030000 8.060000 1.436000  0.1576000      1.645000  
1 1 1 10 57 21 o 7.726000 0.7917000 7.979000 0.7665000 7.472000 1.385000  0.5071000      1.583000  
1 1 1 10 57 23 o 3.378000 0.9774000 3.686000 1.305000  3.071000 1.455000  0.6150000      1.955000  
1 1 1 10 57 25 o 4.068000 1.094000  3.876000 1.419000  4.260000 1.666000  -0.3838000     2.189000  
1 1 1 10 58 0  o 14.03000 0.5272000 14.03000 0.5272000 14.03000 0.5272000 0.000000       0.000000  
1 1 1 10 58 2  o 7.987000 0.5515000 7.257000 0.8414000 8.716000 0.7133000 -1.459000      1.103000  
1 1 1 10 58 4  o 3.068000 0.8315000 3.651000 1.243000  2.485000 1.104000  1.166000       1.663000  
1 1 1 10 58 6  f 8.017000 0.6217000 7.319000 1.004000  8.715000 0.7327000 -1.395000      1.243000  
1 1 1 10 58 8  o 2.542000 0.7915000 2.929000 1.203000  2.156000 1.029000  0.7734000      1.583000  
1 1 1 10 58 10 o 4.064000 0.9143000 3.595000 1.356000  4.532000 1.226000  -0.9361000     1.829000  
1 1 1 10 58 12 o 4.343000 0.8280000 4.997000 1.017000  3.689000 1.307000  1.308000       1.656000  
1 1 1 10 58 14 o 5.263000 1.018000  4.575000 1.162000  5.952000 1.672000  -1.376000      2.037000  
1 1 1 10 58 16 o 4.164000 1.030000  4.855000 1.231000  3.473000 1.653000  1.382000       2.061000  
1 1 1 10 58 18 o 3.418000 0.9658000 3.135000 1.208000  3.700000 1.507000  -0.5649000     1.932000  
1 1 1 10 58 20 o 6.115000 1.016000  5.662000 1.192000  6.568000 1.646000  -0.9065000     2.032000  
1 1 1 10 58 22 o 4.743000 1.052000  4.819000 1.227000  4.666000 1.708000  0.1532000      2.104000  
1 1 1 10 59 1  o 4.450000 0.8241000 4.616000 1.129000  4.284000 1.201000  0.3326000      1.648000  
1 1 1 10 59 3  o 3.989000 0.8506000 3.262000 1.226000  4.716000 1.179000  -1.454000      1.701000  
1 1 1 10 59 5  o 2.610000 0.7978000 2.351000 1.102000  2.870000 1.154000  -0.5192000     1.596000  
1 1 1 10 59 7  o 7.362000 0.6136000 7.434000 0.8892000 7.289000 0.8457000 0.1447000      1.227000  
1 1 1 10 59 9  o 6.771000 0.7546000 7.783000 0.9296000 5.759000 1.189000  2.024000       1.509000  
1 1 1 10 59 11 o 7.479000 0.6685000 6.958000 0.9092000 8.000000 0.9802000 -1.042000      1.337000  
1 1 1 10 59 13 o 5.935000 0.8503000 5.561000 0.9868000 6.309000 1.385000  -0.7482000     1.701000  
1 1 1 10 59 15 o 6.793000 1.093000  6.462000 0.9042000 7.125000 1.989000  -0.6630000     2.185000  
1 1 1 10 59 17 o 4.017000 1.020000  2.394000 1.085000  5.641000 1.728000  -3.247000      2.041000  
1 1 1 10 59 19 o 3.855000 1.045000  3.179000 1.259000  4.531000 1.667000  -1.352000      2.089000  
1 1 1 10 60 0  o 5.468000 1.052000  5.468000 1.052000  5.468000 1.052000  0.000000       0.000000  
1 1 1 10 60 2  o 3.451000 0.8531000 3.855000 1.214000  3.046000 1.199000  0.8085000      1.706000  
1 1 1 10 60 4  o 3.279000 0.8995000 3.814000 1.370000  2.743000 1.166000  1.071000       1.799000  
1 1 1 10 60 6  o 5.198000 0.7775000 5.015000 1.098000  5.382000 1.101000  -0.3668000     1.555000  
1 1 1 10 60 8  o 8.067000 0.6346000 10.10000 0.7885000 6.036000 0.9946000 4.062000       1.269000  
1 1 1 10 60 10 o 7.293000 0.9187000 8.392000 0.7732000 6.193000 1.667000  2.199000       1.837000  
1 1 1 10 60 12 o 4.030000 1.138000  2.294000 1.050000  5.767000 2.020000  -3.472000      2.277000  
1 1 1 10 60 14 o 3.660000 1.028000  2.710000 1.168000  4.610000 1.691000  -1.899000      2.055000  
1 1 1 10 61 1  o 5.680000 0.7289000 5.085000 1.102000  6.274000 0.9545000 -1.190000      1.458000  
1 1 1 10 61 3  f 3.184000 0.7981000 2.349000 1.074000  4.019000 1.181000  -1.671000      1.596000  
1 1 1 10 61 5  o 2.405000 0.7812000 1.986000 0.9467000 2.823000 1.243000  -0.8370000     1.562000  
1 1 1 10 61 7  o 4.102000 1.010000  5.026000 1.435000  3.179000 1.421000  1.847000       2.019000  
1 1 1 10 61 9  o 5.384000 1.100000  5.384000 1.100000  ?        ?         ?              ?         
1 1 1 11 0  1  o 3.968000 0.7469000 3.968000 0.7469000 3.968000 0.7469000 0.000000       0.000000  
1 1 1 11 0  3  o 44.93000 0.5240000 44.93000 0.5240000 44.93000 0.5240000 0.000000       0.000000  
1 1 1 11 0  5  o 13.59000 0.2918000 13.59000 0.2918000 13.59000 0.2918000 0.000000       0.000000  
1 1 1 11 0  7  f 103.0000 1.409000  103.0000 1.409000  103.0000 1.409000  0.000000       0.000000  
1 1 1 11 0  9  o 41.26000 0.4928000 41.26000 0.4928000 41.26000 0.4928000 0.000000       0.000000  
1 1 1 11 0  11 f 39.77000 0.4154000 39.77000 0.4154000 39.77000 0.4154000 0.000000       0.000000  
1 1 1 11 0  13 o 119.7000 1.156000  119.7000 1.156000  119.7000 1.156000  0.000000       0.000000  
1 1 1 11 0  15 o 131.8000 1.468000  131.8000 1.468000  131.8000 1.468000  0.000000       0.000000  
1 1 1 11 0  17 o 43.05000 0.4579000 43.05000 0.4579000 43.05000 0.4579000 0.000000       0.000000  
1 1 1 11 0  19 o 68.64000 0.9665000 68.64000 0.9665000 68.64000 0.9665000 0.000000       0.000000  
1 1 1 11 0  21 o 2.838000 1.208000  2.838000 1.208000  2.838000 1.208000  0.000000       0.000000  
1 1 1 11 0  23 o 15.97000 0.4540000 15.97000 0.4540000 15.97000 0.4540000 0.000000       0.000000  
1 1 1 11 0  25 o 42.11000 0.5532000 42.11000 0.5532000 42.11000 0.5532000 0.000000       0.000000  
1 1 1 11 0  27 o 84.09000 0.8345000 84.09000 0.8345000 84.09000 0.8345000 0.000000       0.000000  
1 1 1 11 0  29 o 47.08000 0.5202000 47.08000 0.5202000 47.08000 0.5202000 0.000000       0.000000  
1 1 1 11 0  31 o 30.70000 0.4276000 30.70000 0.4276000 30.70000 0.4276000 0.000000       0.000000  
1 1 1 11 0  33 o 112.9000 1.102000  112.9000 1.102000  112.9000 1.102000  0.000000       0.000000  
1 1 1 11 0  35 o 15.12000 0.5024000 15.12000 0.5024000 15.12000 0.5024000 0.000000       0.000000  
1 1 1 11 0  37 o 28.55000 0.5077000 28.55000 0.5077000 28.55000 0.5077000 0.000000       0.000000  
1 1 1 11 0  39 o 24.85000 0.4995000 24.85000 0.4995000 24.85000 0.4995000 0.000000       0.000000  
1 1 1 11 0  41 o 30.88000 0.4600000 30.88000 0.4600000 30.88000 0.4600000 0.000000       0.000000  
1 1 1 11 0  43 o 5.188000 1.521000  5.188000 1.521000  5.188000 1.521000  0.000000       0.000000  
1 1 1 11 0  45 o 16.97000 0.6829000 16.97000 0.6829000 16.97000 0.6829000 0.000000       0.000000  
1 1 1 11 0  47 o 6.269000 1.349000  6.269000 1.349000  6.269000 1.349000  0.000000       0.000000  
1 1 1 11 0  49 o 12.31000 0.6742000 12.31000 0.6742000 12.31000 0.6742000 0.000000       0.000000  
1 1 1 11 0  51 o 18.69000 0.4822000 18.69000 0.4822000 18.69000 0.4822000 0.000000       0.000000  
1 1 1 11 0  53 o 26.37000 0.4575000 26.37000 0.4575000 26.37000 0.4575000 0.000000       0.000000  
1 1 1 11 0  55 o 3.296000 1.335000  3.296000 1.335000  3.296000 1.335000  0.000000       0.000000  
1 1 1 11 0  57 o 9.778000 0.9638000 9.778000 0.9638000 9.778000 0.9638000 0.000000       0.000000  
1 1 1 11 0  59 o 10.50000 0.8789000 10.50000 0.8789000 10.50000 0.8789000 0.000000       0.000000  
1 1 1 11 0  61 o 2.746000 1.240000  2.746000 1.240000  2.746000 1.240000  0.000000       0.000000  
1 1 1 11 0  63 o 9.869000 0.8230000 9.869000 0.8230000 9.869000 0.8230000 0.000000       0.000000  
1 1 1 11 0  65 o 7.126000 1.419000  7.126000 1.419000  7.126000 1.419000  0.000000       0.000000  
1 1 1 11 1  0  o 2.270000 0.8603000 2.270000 0.8603000 2.270000 0.8603000 0.000000       0.000000  
1 1 1 11 1  2  o 78.38000 0.6603000 78.68000 0.7664000 78.08000 1.075000  0.6012000      1.321000  
1 1 1 11 1  4  o 33.47000 0.2722000 33.24000 0.3539000 33.70000 0.4137000 -0.4615000     0.5444000 
1 1 1 11 1  6  o 54.46000 0.4664000 55.10000 0.5475000 53.83000 0.7551000 1.277000       0.9327000 
1 1 1 11 1  8  o 92.43000 0.7794000 93.41000 1.281000  91.46000 0.8876000 1.953000       1.559000  
1 1 1 11 1  10 f 89.36000 0.6630000 89.24000 1.001000  89.48000 0.8695000 -0.2369000     1.326000  
1 1 1 11 1  12 o 21.96000 0.2092000 21.96000 0.2972000 21.97000 0.2945000 -0.8249000E-02 0.4184000 
1 1 1 11 1  14 o 48.55000 0.3797000 48.75000 0.5758000 48.34000 0.4951000 0.4103000      0.7594000 
1 1 1 11 1  16 o 37.73000 0.3164000 37.85000 0.4151000 37.61000 0.4776000 0.2394000      0.6328000 
1 1 1 11 1  18 o 83.11000 0.6235000 82.94000 0.8142000 83.29000 0.9444000 -0.3467000     1.247000  
1 1 1 11 1  20 o 70.09000 0.4959000 70.81000 0.7078000 69.36000 0.6949000 1.454000       0.9919000 
1 1 1 11 1  22 o 74.42000 0.6385000 75.62000 0.7514000 73.21000 1.033000  2.407000       1.277000  
1 1 1 11 1  24 o 15.90000 0.3311000 16.18000 0.4584000 15.62000 0.4780000 0.5593000      0.6623000 
1 1 1 11 1  26 o 86.50000 0.6049000 86.31000 0.8524000 86.70000 0.8584000 -0.3888000     1.210000  
1 1 1 11 1  28 o 50.51000 0.4137000 50.08000 0.5386000 50.94000 0.6282000 -0.8582000     0.8275000 
1 1 1 11 1  30 o 94.60000 0.6582000 95.04000 0.9349000 94.16000 0.9269000 0.8798000      1.316000  
1 1 1 11 1  32 o 37.43000 0.3743000 37.23000 0.5298000 37.64000 0.5289000 -0.4092000     0.7486000 
1 1 1 11 1  34 o 10.95000 0.4917000 11.43000 0.7061000 10.47000 0.6845000 0.9601000      0.9835000 
1 1 1 11 1  36 o 15.10000 0.4340000 15.66000 0.6006000 14.54000 0.6268000 1.119000       0.8681000 
1 1 1 11 1  38 o 15.31000 0.3780000 15.02000 0.5259000 15.59000 0.5431000 -0.5686000     0.7560000 
1 1 1 11 1  40 o 50.23000 0.3924000 50.64000 0.5581000 49.82000 0.5516000 0.8243000      0.7848000 
1 1 1 11 1  42 o 21.14000 0.3708000 20.89000 0.4934000 21.39000 0.5537000 -0.4941000     0.7416000 
1 1 1 11 1  44 o 7.025000 0.8715000 7.342000 1.142000  6.707000 1.317000  0.6356000      1.743000  
1 1 1 11 1  46 o 5.042000 1.131000  4.825000 1.664000  5.259000 1.531000  -0.4337000     2.261000  
1 1 1 11 1  48 o 40.21000 0.4102000 39.92000 0.5800000 40.50000 0.5801000 -0.5818000     0.8203000 
1 1 1 11 1  50 f 20.11000 0.3712000 20.34000 0.5520000 19.88000 0.4965000 0.4578000      0.7425000 
1 1 1 11 1  52 o 11.28000 0.4931000 10.71000 0.7262000 11.86000 0.6674000 -1.154000      0.9863000 
1 1 1 11 1  54 o 7.774000 0.7450000 7.749000 0.9584000 7.798000 1.141000  -0.4867000E-01 1.490000  
1 1 1 11 1  56 o 13.65000 0.4729000 14.35000 0.5812000 12.95000 0.7460000 1.407000       0.9457000 
1 1 1 11 1  58 o 3.311000 0.9256000 4.133000 1.448000  2.490000 1.153000  1.643000       1.851000  
1 1 1 11 1  60 o 3.071000 0.9174000 3.513000 1.377000  2.628000 1.213000  0.8849000      1.835000  
1 1 1 11 1  62 o 3.802000 1.014000  4.595000 1.517000  3.009000 1.347000  1.586000       2.029000  
1 1 1 11 1  64 o 3.328000 1.005000  3.014000 1.345000  3.643000 1.495000  -0.6296000     2.011000  
1 1 1 11 1  66 o 2.714000 0.8878000 2.589000 1.195000  2.838000 1.313000  -0.2492000     1.776000  
1 1 1 11 2  1  o 21.76000 0.1890000 21.51000 0.2649000 22.02000 0.2697000 -0.5039000     0.3780000 
1 1 1 11 2  3  o 44.79000 0.3462000 44.97000 0.4550000 44.60000 0.5218000 0.3762000      0.6923000 
1 1 1 11 2  5  o 67.80000 0.4698000 67.88000 0.6652000 67.73000 0.6636000 0.1513000      0.9397000 
1 1 1 11 2  7  o 43.99000 0.3416000 43.77000 0.4456000 44.22000 0.5178000 -0.4539000     0.6832000 
1 1 1 11 2  9  o 13.91000 0.2101000 13.78000 0.3164000 14.03000 0.2764000 -0.2493000     0.4201000 
1 1 1 11 2  11 o 48.40000 0.4250000 48.49000 0.6948000 48.30000 0.4895000 0.1924000      0.8499000 
1 1 1 11 2  13 o 72.19000 0.5415000 72.21000 0.8182000 72.17000 0.7096000 0.3485000E-01  1.083000  
1 1 1 11 2  15 f 130.2000 1.026000  129.5000 1.444000  130.8000 1.458000  -1.299000      2.052000  
1 1 1 11 2  17 o 104.0000 0.7720000 103.9000 1.010000  104.1000 1.168000  -0.1350000     1.544000  
1 1 1 11 2  19 o 44.51000 0.3480000 44.12000 0.4239000 44.89000 0.5521000 -0.7782000     0.6961000 
1 1 1 11 2  21 o 19.76000 0.3152000 19.55000 0.4299000 19.97000 0.4610000 -0.4236000     0.6303000 
1 1 1 11 2  23 f 26.59000 0.2727000 27.11000 0.3907000 26.08000 0.3805000 1.033000       0.5453000 
1 1 1 11 2  25 o 76.25000 0.6220000 76.95000 0.8842000 75.56000 0.8749000 1.392000       1.244000  
1 1 1 11 2  27 o 47.31000 0.3928000 47.60000 0.5129000 47.03000 0.5951000 0.5640000      0.7856000 
1 1 1 11 2  29 o 55.95000 0.4477000 55.58000 0.6718000 56.32000 0.5918000 -0.7433000     0.8953000 
1 1 1 11 2  31 o 7.615000 0.7016000 7.902000 0.8524000 7.328000 1.115000  0.5737000      1.403000  
1 1 1 11 2  33 o 12.33000 0.4750000 11.73000 0.7647000 12.93000 0.5635000 -1.201000      0.9499000 
1 1 1 11 2  35 o 47.34000 0.4279000 47.85000 0.6080000 46.83000 0.6023000 1.021000       0.8558000 
1 1 1 11 2  37 o 41.87000 0.3786000 41.89000 0.5733000 41.85000 0.4945000 0.4000000E-01  0.7571000 
1 1 1 11 2  39 o 50.65000 0.4523000 50.29000 0.6334000 51.01000 0.6457000 -0.7155000     0.9045000 
1 1 1 11 2  41 o 18.26000 0.3993000 18.68000 0.5230000 17.85000 0.6035000 0.8269000      0.7986000 
1 1 1 11 2  43 o 26.93000 0.3612000 26.55000 0.5398000 27.31000 0.4801000 -0.7666000     0.7224000 
1 1 1 11 2  45 f 35.19000 0.3725000 34.76000 0.5638000 35.62000 0.4870000 -0.8671000     0.7450000 
1 1 1 11 2  47 o 11.34000 0.5577000 11.19000 0.7729000 11.48000 0.8043000 -0.2842000     1.115000  
1 1 1 11 2  49 o 17.37000 0.3794000 17.48000 0.5351000 17.25000 0.5381000 0.2211000      0.7588000 
1 1 1 11 2  51 o 14.34000 0.4391000 14.05000 0.5932000 14.64000 0.6477000 -0.5941000     0.8783000 
1 1 1 11 2  53 o 21.08000 0.3603000 20.42000 0.4816000 21.74000 0.5360000 -1.319000      0.7206000 
1 1 1 11 2  55 o 19.10000 0.3786000 19.14000 0.5671000 19.05000 0.5019000 0.9426000E-01  0.7573000 
1 1 1 11 2  57 o 6.478000 0.8381000 5.673000 1.286000  7.283000 1.076000  -1.610000      1.676000  
1 1 1 11 2  59 f 6.341000 0.9227000 5.540000 1.471000  7.143000 1.114000  -1.603000      1.845000  
1 1 1 11 2  61 o 8.704000 0.7465000 9.190000 0.9056000 8.218000 1.187000  0.9718000      1.493000  
1 1 1 11 2  63 o 6.598000 0.9205000 6.970000 1.188000  6.227000 1.406000  0.7428000      1.841000  
1 1 1 11 2  65 o 4.302000 1.061000  4.950000 1.561000  3.654000 1.439000  1.295000       2.122000  
1 1 1 11 3  0  o 5.337000 0.3999000 5.337000 0.3999000 5.337000 0.3999000 0.000000       0.000000  
1 1 1 11 3  2  o 33.07000 0.2489000 32.82000 0.3511000 33.33000 0.3530000 -0.5091000     0.4978000 
1 1 1 11 3  4  o 13.82000 0.2147000 13.66000 0.2493000 13.98000 0.3496000 -0.3289000     0.4294000 
1 1 1 11 3  6  o 26.05000 0.2278000 26.03000 0.3000000 26.07000 0.3430000 -0.3479000E-01 0.4557000 
1 1 1 11 3  8  o 34.59000 0.2611000 34.78000 0.3708000 34.41000 0.3676000 0.3664000      0.5222000 
1 1 1 11 3  10 o 99.83000 0.7387000 100.2000 1.120000  99.43000 0.9634000 0.8159000      1.477000  
1 1 1 11 3  12 o 34.81000 0.2894000 34.51000 0.4361000 35.12000 0.3806000 -0.6128000     0.5789000 
1 1 1 11 3  14 o 75.13000 0.5218000 75.52000 0.7421000 74.74000 0.7337000 0.7806000      1.044000  
1 1 1 11 3  16 f 107.1000 0.7348000 107.0000 1.039000  107.2000 1.040000  -0.1571000     1.470000  
1 1 1 11 3  18 o 33.93000 0.3038000 33.40000 0.3932000 34.46000 0.4633000 -1.058000      0.6076000 
1 1 1 11 3  20 o 93.74000 0.7001000 94.00000 0.9194000 93.48000 1.056000  0.5271000      1.400000  
1 1 1 11 3  22 o 19.20000 0.2784000 19.40000 0.3886000 19.01000 0.3987000 0.3891000      0.5567000 
1 1 1 11 3  24 o 9.522000 0.5066000 9.480000 0.6576000 9.563000 0.7707000 -0.8341000E-01 1.013000  
1 1 1 11 3  26 o 83.71000 0.7149000 84.50000 0.8347000 82.92000 1.161000  1.583000       1.430000  
1 1 1 11 3  28 o 47.13000 0.3656000 47.68000 0.5187000 46.58000 0.5155000 1.100000       0.7313000 
1 1 1 11 3  30 o 23.52000 0.3502000 23.73000 0.4828000 23.31000 0.5075000 0.4170000      0.7005000 
1 1 1 11 3  32 o 31.17000 0.3030000 31.45000 0.4285000 30.90000 0.4284000 0.5513000      0.6059000 
1 1 1 11 3  34 o 42.24000 0.3727000 42.51000 0.5663000 41.98000 0.4849000 0.5256000      0.7455000 
1 1 1 11 3  36 o 21.47000 0.3601000 21.35000 0.4955000 21.59000 0.5226000 -0.2378000     0.7202000 
1 1 1 11 3  38 o 10.80000 0.4951000 10.13000 0.7155000 11.47000 0.6846000 -1.333000      0.9902000 
1 1 1 11 3  40 o 56.42000 0.4262000 56.63000 0.6031000 56.22000 0.6025000 0.4104000      0.8525000 
1 1 1 11 3  42 o 56.37000 0.4295000 56.12000 0.6022000 56.63000 0.6126000 -0.5079000     0.8590000 
1 1 1 11 3  44 o 33.90000 0.3945000 33.59000 0.5492000 34.21000 0.5665000 -0.6185000     0.7890000 
1 1 1 11 3  46 o 3.093000 0.9608000 3.049000 1.347000  3.136000 1.371000  -0.8682000E-01 1.922000  
1 1 1 11 3  48 o 38.82000 0.4048000 39.23000 0.5721000 38.42000 0.5730000 0.8156000      0.8097000 
1 1 1 11 3  50 o 27.63000 0.3423000 27.33000 0.5100000 27.92000 0.4566000 -0.5903000     0.6846000 
1 1 1 11 3  52 o 12.98000 0.4433000 12.87000 0.6376000 13.09000 0.6161000 -0.2180000     0.8866000 
1 1 1 11 3  54 o 10.37000 0.5201000 9.818000 0.7801000 10.92000 0.6881000 -1.099000      1.040000  
1 1 1 11 3  56 o 10.53000 0.5504000 10.82000 0.8216000 10.23000 0.7327000 0.5864000      1.101000  
1 1 1 11 3  58 o 4.315000 1.038000  3.989000 1.479000  4.642000 1.457000  -0.6532000     2.076000  
1 1 1 11 3  60 o 10.03000 0.5895000 10.73000 0.8640000 9.329000 0.8023000 1.399000       1.179000  
1 1 1 11 3  62 o 8.951000 0.6956000 8.185000 1.044000  9.717000 0.9195000 -1.532000      1.391000  
1 1 1 11 3  64 o 3.838000 1.040000  4.625000 1.552000  3.051000 1.385000  1.574000       2.080000  
1 1 1 11 3  66 o 4.236000 1.075000  4.862000 1.570000  3.609000 1.467000  1.253000       2.149000  
1 1 1 11 4  1  o 48.14000 0.3415000 48.23000 0.4839000 48.06000 0.4818000 0.1682000      0.6829000 
1 1 1 11 4  3  o 33.17000 0.2691000 33.10000 0.3527000 33.24000 0.4064000 -0.1422000     0.5381000 
1 1 1 11 4  5  o 17.06000 0.2154000 17.00000 0.2521000 17.11000 0.3493000 -0.1076000     0.4308000 
1 1 1 11 4  7  o 14.80000 0.1959000 14.90000 0.2924000 14.70000 0.2607000 0.1958000      0.3917000 
1 1 1 11 4  9  o 42.15000 0.3735000 41.96000 0.6070000 42.34000 0.4354000 -0.3817000     0.7470000 
1 1 1 11 4  11 f 101.7000 0.8051000 101.2000 1.133000  102.3000 1.145000  -1.122000      1.610000  
1 1 1 11 4  13 o 184.8000 1.357000  185.6000 2.059000  183.9000 1.768000  1.651000       2.714000  
1 1 1 11 4  15 o 70.20000 0.4907000 70.37000 0.6962000 70.04000 0.6917000 0.3308000      0.9814000 
1 1 1 11 4  17 o 87.38000 0.6249000 87.49000 0.7661000 87.27000 0.9876000 0.2197000      1.250000  
1 1 1 11 4  19 o 41.69000 0.3484000 41.28000 0.4500000 42.09000 0.5321000 -0.8061000     0.6969000 
1 1 1 11 4  21 o 101.9000 0.8621000 101.7000 0.9921000 102.0000 1.410000  -0.2473000     1.724000  
1 1 1 11 4  23 o 18.25000 0.3207000 18.45000 0.4162000 18.05000 0.4879000 0.3959000      0.6413000 
1 1 1 11 4  25 o 41.94000 0.4714000 42.82000 0.6686000 41.06000 0.6648000 1.758000       0.9429000 
1 1 1 11 4  27 o 70.02000 0.4998000 70.01000 0.7050000 70.02000 0.7088000 -0.1264000E-01 0.9997000 
1 1 1 11 4  29 o 59.00000 0.4686000 59.26000 0.6135000 58.74000 0.7086000 0.5186000      0.9373000 
1 1 1 11 4  31 o 24.79000 0.3211000 25.10000 0.4775000 24.48000 0.4293000 0.6153000      0.6421000 
1 1 1 11 4  33 o 40.84000 0.3379000 40.81000 0.4725000 40.86000 0.4833000 -0.5650000E-01 0.6759000 
1 1 1 11 4  35 o 27.39000 0.3468000 27.28000 0.4831000 27.50000 0.4975000 -0.2133000     0.6935000 
1 1 1 11 4  37 o 24.12000 0.3080000 23.98000 0.4334000 24.26000 0.4379000 -0.2832000     0.6161000 
1 1 1 11 4  39 o 16.24000 0.3893000 16.44000 0.4948000 16.03000 0.6012000 0.4082000      0.7787000 
1 1 1 11 4  41 o 30.64000 0.3226000 30.86000 0.4481000 30.42000 0.4643000 0.4317000      0.6453000 
1 1 1 11 4  43 o 34.89000 0.3669000 34.58000 0.4642000 35.20000 0.5683000 -0.6206000     0.7338000 
1 1 1 11 4  45 o 28.36000 0.3332000 28.13000 0.4658000 28.58000 0.4767000 -0.4496000     0.6664000 
1 1 1 11 4  47 o 7.490000 0.8531000 8.239000 1.098000  6.742000 1.306000  1.497000       1.706000  
1 1 1 11 4  49 o 21.04000 0.3464000 21.14000 0.4799000 20.95000 0.4997000 0.1889000      0.6928000 
1 1 1 11 4  51 o 9.652000 0.5825000 9.065000 0.7744000 10.24000 0.8703000 -1.174000      1.165000  
1 1 1 11 4  53 o 18.73000 0.3797000 18.67000 0.4987000 18.79000 0.5727000 -0.1246000     0.7593000 
1 1 1 11 4  55 o 25.30000 0.3637000 25.50000 0.4643000 25.10000 0.5600000 0.4065000      0.7274000 
1 1 1 11 4  57 o 9.688000 0.5568000 9.696000 0.7787000 9.680000 0.7961000 0.1568000E-01  1.114000  
1 1 1 11 4  59 o 9.259000 0.7229000 8.054000 1.214000  10.46000 0.7846000 -2.410000      1.446000  
1 1 1 11 4  61 o 11.40000 0.5481000 11.65000 0.7607000 11.16000 0.7892000 0.4860000      1.096000  
1 1 1 11 4  63 f 6.150000 1.058000  7.045000 1.526000  5.255000 1.465000  1.790000       2.115000  
1 1 1 11 4  65 o 3.194000 0.9528000 2.785000 1.265000  3.603000 1.425000  -0.8181000     1.906000  
1 1 1 11 5  0  o 119.2000 1.326000  119.2000 1.326000  119.2000 1.326000  0.000000       0.000000  
1 1 1 11 5  2  o 70.39000 0.5610000 70.68000 0.7965000 70.10000 0.7903000 0.5804000      1.122000  
1 1 1 11 5  4  o 49.62000 0.4060000 50.00000 0.5765000 49.23000 0.5718000 0.7698000      0.8120000 
1 1 1 11 5  6  o 38.34000 0.3025000 38.18000 0.4547000 38.50000 0.3991000 -0.3205000     0.6050000 
1 1 1 11 5  8  o 40.17000 0.3819000 40.15000 0.5895000 40.19000 0.4856000 -0.4632000E-01 0.7638000 
1 1 1 11 5  10 o 75.47000 0.5643000 75.58000 0.8541000 75.37000 0.7376000 0.2091000      1.129000  
1 1 1 11 5  12 o 77.84000 0.5387000 77.95000 0.7631000 77.73000 0.7606000 0.2201000      1.077000  
1 1 1 11 5  14 o 35.48000 0.3421000 35.60000 0.5630000 35.36000 0.3887000 0.2419000      0.6841000 
1 1 1 11 5  16 o 78.14000 0.5624000 77.49000 0.6818000 78.79000 0.8946000 -1.300000      1.125000  
1 1 1 11 5  18 o 33.44000 0.2881000 33.27000 0.3465000 33.60000 0.4603000 -0.3285000     0.5762000 
1 1 1 11 5  20 o 35.50000 0.3409000 35.14000 0.4779000 35.86000 0.4863000 -0.7240000     0.6818000 
1 1 1 11 5  22 o 54.37000 0.4913000 53.88000 0.5557000 54.87000 0.8103000 -0.9902000     0.9825000 
1 1 1 11 5  24 o 85.00000 0.7280000 84.87000 0.8362000 85.13000 1.192000  -0.2603000     1.456000  
1 1 1 11 5  26 o 24.09000 0.2925000 23.86000 0.3946000 24.32000 0.4319000 -0.4598000     0.5851000 
1 1 1 11 5  28 o 5.154000 0.9523000 5.257000 1.229000  5.051000 1.455000  0.2060000      1.905000  
1 1 1 11 5  30 o 28.17000 0.3546000 28.57000 0.4145000 27.78000 0.5754000 0.7928000      0.7092000 
1 1 1 11 5  32 o 44.94000 0.3572000 44.60000 0.4970000 45.27000 0.5133000 -0.6706000     0.7145000 
1 1 1 11 5  34 o 6.505000 0.8108000 6.380000 1.221000  6.630000 1.067000  -0.2502000     1.622000  
1 1 1 11 5  36 o 18.19000 0.3632000 18.47000 0.5373000 17.91000 0.4887000 0.5652000      0.7263000 
1 1 1 11 5  38 o 44.46000 0.4137000 43.53000 0.5685000 45.40000 0.6013000 -1.869000      0.8275000 
1 1 1 11 5  40 o 26.33000 0.3386000 26.62000 0.4463000 26.05000 0.5094000 0.5704000      0.6773000 
1 1 1 11 5  42 o 23.09000 0.3464000 22.78000 0.5333000 23.40000 0.4422000 -0.6161000     0.6928000 
1 1 1 11 5  44 o 18.00000 0.4071000 17.69000 0.6131000 18.31000 0.5359000 -0.6279000     0.8143000 
1 1 1 11 5  46 o 10.16000 0.6308000 9.107000 1.064000  11.22000 0.6773000 -2.112000      1.262000  
1 1 1 11 5  48 f 7.131000 0.8634000 7.097000 1.446000  7.165000 0.9445000 -0.6746000E-01 1.727000  
1 1 1 11 5  50 o 34.92000 0.3905000 35.02000 0.6538000 34.82000 0.4273000 0.2038000      0.7810000 
1 1 1 11 5  52 o 14.09000 0.4471000 14.64000 0.6579000 13.53000 0.6055000 1.111000       0.8941000 
1 1 1 11 5  54 o 16.45000 0.3967000 16.88000 0.5754000 16.03000 0.5462000 0.8559000      0.7933000 
1 1 1 11 5  56 o 5.829000 0.9156000 4.273000 1.550000  7.385000 0.9746000 -3.113000      1.831000  
1 1 1 11 5  58 o 9.417000 0.6232000 10.30000 0.7519000 8.537000 0.9939000 1.759000       1.246000  
1 1 1 11 5  60 o 11.50000 0.5830000 11.53000 0.8681000 11.48000 0.7785000 0.5315000E-01  1.166000  
1 1 1 11 5  62 o 3.693000 1.029000  3.501000 1.442000  3.886000 1.468000  -0.3855000     2.058000  
1 1 1 11 5  64 o 3.476000 0.9913000 3.598000 1.425000  3.353000 1.378000  0.2449000      1.983000  
1 1 1 11 5  66 o 4.275000 1.016000  3.441000 1.479000  5.108000 1.392000  -1.666000      2.031000  
1 1 1 11 6  1  o 11.49000 0.1969000 11.33000 0.2767000 11.65000 0.2803000 -0.3228000     0.3938000 
1 1 1 11 6  3  o 38.91000 0.3049000 38.50000 0.4559000 39.32000 0.4051000 -0.8223000     0.6099000 
1 1 1 11 6  5  o 15.19000 0.1982000 14.73000 0.2645000 15.64000 0.2953000 -0.9141000     0.3965000 
1 1 1 11 6  7  o 26.97000 0.2404000 26.93000 0.3105000 27.01000 0.3671000 -0.8057000E-01 0.4808000 
1 1 1 11 6  9  o 71.44000 0.5346000 71.20000 0.8063000 71.68000 0.7022000 -0.4746000     1.069000  
1 1 1 11 6  11 o 95.59000 0.6565000 95.14000 0.9236000 96.04000 0.9332000 -0.9078000     1.313000  
1 1 1 11 6  13 o 108.9000 0.7455000 109.1000 1.058000  108.6000 1.051000  0.5744000      1.491000  
1 1 1 11 6  15 o 122.2000 0.9030000 121.8000 1.178000  122.6000 1.369000  -0.7800000     1.806000  
1 1 1 11 6  17 o 93.80000 0.6677000 94.30000 0.8216000 93.30000 1.053000  1.006000       1.335000  
1 1 1 11 6  19 o 63.23000 0.4651000 63.33000 0.5688000 63.13000 0.7361000 0.2013000      0.9303000 
1 1 1 11 6  21 o 43.60000 0.4146000 44.20000 0.4824000 43.00000 0.6745000 1.205000       0.8292000 
1 1 1 11 6  23 o 42.98000 0.3645000 42.56000 0.4669000 43.41000 0.5598000 -0.8495000     0.7290000 
1 1 1 11 6  25 f 53.23000 0.4278000 53.82000 0.6453000 52.65000 0.5617000 1.173000       0.8555000 
1 1 1 11 6  27 o 73.32000 0.5622000 73.30000 0.7325000 73.34000 0.8530000 -0.4035000E-01 1.124000  
1 1 1 11 6  29 o 40.77000 0.3359000 40.73000 0.4643000 40.80000 0.4856000 -0.7704000E-01 0.6718000 
1 1 1 11 6  31 o 25.92000 0.3134000 25.73000 0.4661000 26.11000 0.4192000 -0.3831000     0.6268000 
1 1 1 11 6  33 o 50.13000 0.3844000 50.23000 0.5392000 50.03000 0.5480000 0.1990000      0.7688000 
1 1 1 11 6  35 o 38.09000 0.4270000 37.90000 0.6506000 38.27000 0.5532000 -0.3686000     0.8539000 
1 1 1 11 6  37 o 41.71000 0.3592000 41.16000 0.5571000 42.27000 0.4536000 -1.107000      0.7184000 
1 1 1 11 6  39 f 42.33000 0.4071000 41.23000 0.5654000 43.44000 0.5859000 -2.213000      0.8142000 
1 1 1 11 6  41 o 33.97000 0.3384000 34.19000 0.5295000 33.75000 0.4216000 0.4408000      0.6768000 
1 1 1 11 6  43 o 16.21000 0.4201000 16.16000 0.6467000 16.27000 0.5364000 -0.1064000     0.8402000 
1 1 1 11 6  45 o 7.052000 0.9320000 7.261000 1.346000  6.844000 1.290000  0.4166000      1.864000  
1 1 1 11 6  47 o 22.01000 0.3749000 22.24000 0.5498000 21.77000 0.5098000 0.4720000      0.7498000 
1 1 1 11 6  49 o 14.00000 0.4459000 14.58000 0.6936000 13.43000 0.5606000 1.151000       0.8918000 
1 1 1 11 6  51 o 23.68000 0.3626000 22.89000 0.5445000 24.46000 0.4791000 -1.564000      0.7253000 
1 1 1 11 6  53 o 11.39000 0.5001000 10.76000 0.8081000 12.01000 0.5894000 -1.250000      1.000000  
1 1 1 11 6  55 o 8.742000 0.6146000 8.966000 0.9642000 8.518000 0.7624000 0.4475000      1.229000  
1 1 1 11 6  57 o 4.475000 1.015000  3.663000 1.476000  5.287000 1.395000  -1.623000      2.031000  
1 1 1 11 6  59 o 4.336000 1.255000  4.833000 1.987000  3.839000 1.533000  0.9937000      2.510000  
1 1 1 11 6  61 o 4.357000 1.073000  3.905000 1.454000  4.808000 1.577000  -0.9028000     2.145000  
1 1 1 11 6  63 o 10.83000 0.5554000 10.77000 0.7832000 10.90000 0.7878000 -0.1280000     1.111000  
1 1 1 11 6  65 o 3.891000 1.016000  4.054000 1.505000  3.729000 1.364000  0.3250000      2.031000  
1 1 1 11 7  0  o 66.30000 0.6508000 66.30000 0.6508000 66.30000 0.6508000 0.000000       0.000000  
1 1 1 11 7  2  o 51.38000 0.3624000 51.22000 0.5113000 51.54000 0.5138000 -0.3189000     0.7249000 
1 1 1 11 7  4  o 50.28000 0.4138000 50.17000 0.5844000 50.39000 0.5860000 -0.2259000     0.8276000 
1 1 1 11 7  6  o 63.24000 0.4762000 63.05000 0.6207000 63.43000 0.7225000 -0.3835000     0.9525000 
1 1 1 11 7  8  o 47.29000 0.3385000 47.43000 0.4802000 47.15000 0.4773000 0.2808000      0.6770000 
1 1 1 11 7  10 o 88.98000 0.6605000 88.18000 0.9908000 89.78000 0.8736000 -1.603000      1.321000  
1 1 1 11 7  12 o 137.6000 0.9375000 138.1000 1.331000  137.1000 1.321000  1.026000       1.875000  
1 1 1 11 7  14 o 80.84000 0.5791000 80.65000 0.7059000 81.04000 0.9183000 -0.3942000     1.158000  
1 1 1 11 7  16 o 94.26000 0.7026000 94.16000 0.9183000 94.37000 1.064000  -0.2052000     1.405000  
1 1 1 11 7  18 o 56.04000 0.4179000 56.17000 0.5112000 55.91000 0.6612000 0.2597000      0.8357000 
1 1 1 11 7  20 o 157.7000 1.162000  157.0000 1.513000  158.4000 1.765000  -1.432000      2.324000  
1 1 1 11 7  22 o 100.6000 0.8189000 101.6000 0.8869000 99.64000 1.377000  1.956000       1.638000  
1 1 1 11 7  24 o 30.69000 0.3321000 30.40000 0.4597000 30.99000 0.4793000 -0.5887000     0.6641000 
1 1 1 11 7  26 o 69.43000 0.4955000 69.05000 0.6924000 69.80000 0.7090000 -0.7547000     0.9910000 
1 1 1 11 7  28 o 36.29000 0.3184000 36.48000 0.4387000 36.10000 0.4616000 0.3772000      0.6368000 
1 1 1 11 7  30 o 43.13000 0.3458000 43.20000 0.4826000 43.07000 0.4955000 0.1333000      0.6917000 
1 1 1 11 7  32 o 18.45000 0.4028000 17.86000 0.6564000 19.04000 0.4669000 -1.177000      0.8055000 
1 1 1 11 7  34 o 12.76000 0.4600000 13.11000 0.6436000 12.40000 0.6574000 0.7119000      0.9200000 
1 1 1 11 7  36 f 16.66000 0.4113000 16.96000 0.6784000 16.36000 0.4651000 0.6010000      0.8225000 
1 1 1 11 7  38 o 9.060000 0.7040000 9.945000 1.023000  8.175000 0.9673000 1.771000       1.408000  
1 1 1 11 7  40 o 12.15000 0.4739000 12.15000 0.7337000 12.16000 0.6001000 -0.6893000E-02 0.9479000 
1 1 1 11 7  42 o 11.83000 0.5621000 12.68000 0.8049000 10.98000 0.7849000 1.703000       1.124000  
1 1 1 11 7  44 o 9.405000 0.6738000 9.077000 1.076000  9.732000 0.8114000 -0.6547000     1.348000  
1 1 1 11 7  46 f 21.42000 0.3825000 22.05000 0.5667000 20.80000 0.5140000 1.251000       0.7651000 
1 1 1 11 7  48 f 11.31000 0.8923000 11.23000 1.650000  11.39000 0.6806000 -0.1587000     1.785000  
1 1 1 11 7  50 o 8.830000 0.6835000 9.950000 1.034000  7.709000 0.8941000 2.241000       1.367000  
1 1 1 11 7  52 f 13.87000 0.4449000 13.82000 0.7033000 13.92000 0.5452000 -0.9994000E-01 0.8899000 
1 1 1 11 7  54 o 8.016000 0.7097000 7.858000 1.086000  8.173000 0.9137000 -0.3158000     1.419000  
1 1 1 11 7  56 o 3.722000 0.9661000 3.170000 1.375000  4.273000 1.358000  -1.103000      1.932000  
1 1 1 11 7  58 o 8.055000 0.7302000 7.989000 1.167000  8.120000 0.8783000 -0.1312000     1.460000  
1 1 1 11 7  60 o 4.373000 1.021000  5.132000 1.540000  3.614000 1.340000  1.518000       2.041000  
1 1 1 11 7  62 o 11.70000 0.6113000 11.50000 0.7762000 11.90000 0.9447000 -0.3922000     1.223000  
1 1 1 11 7  64 o 6.879000 0.9681000 7.531000 1.036000  6.227000 1.636000  1.304000       1.936000  
1 1 1 11 7  66 o 4.732000 1.342000  4.725000 1.827000  4.739000 1.966000  -0.1323000E-01 2.683000  
1 1 1 11 8  1  o 10.26000 0.2298000 10.40000 0.3161000 10.11000 0.3337000 0.2962000      0.4596000 
1 1 1 11 8  3  o 63.30000 0.4404000 63.03000 0.6201000 63.57000 0.6256000 -0.5391000     0.8808000 
1 1 1 11 8  5  o 9.915000 0.2065000 10.06000 0.2683000 9.769000 0.3140000 0.2902000      0.4130000 
1 1 1 11 8  7  o 58.67000 0.4111000 58.46000 0.5791000 58.87000 0.5837000 -0.4134000     0.8223000 
1 1 1 11 8  9  o 80.48000 0.5553000 79.35000 0.7740000 81.60000 0.7965000 -2.244000      1.111000  
1 1 1 11 8  11 o 91.99000 0.6839000 91.73000 0.8931000 92.25000 1.036000  -0.5144000     1.368000  
1 1 1 11 8  13 o 139.7000 0.9844000 139.7000 1.205000  139.8000 1.557000  -0.1621000     1.969000  
1 1 1 11 8  15 o 18.58000 0.2345000 18.30000 0.2741000 18.85000 0.3807000 -0.5474000     0.4691000 
1 1 1 11 8  17 o 29.93000 0.2856000 29.83000 0.3691000 30.03000 0.4360000 -0.1934000     0.5712000 
1 1 1 11 8  19 o 79.87000 0.6028000 79.75000 0.7856000 79.98000 0.9145000 -0.2360000     1.206000  
1 1 1 11 8  21 o 66.30000 0.7486000 66.31000 0.6674000 66.30000 1.340000  0.1007000E-01  1.497000  
1 1 1 11 8  23 o 12.89000 0.4217000 11.78000 0.4928000 14.00000 0.6844000 -2.221000      0.8434000 
1 1 1 11 8  25 o 20.47000 0.3098000 19.92000 0.4441000 21.02000 0.4322000 -1.100000      0.6197000 
1 1 1 11 8  27 o 34.57000 0.3052000 34.61000 0.4219000 34.53000 0.4411000 0.7784000E-01  0.6104000 
1 1 1 11 8  29 f 18.75000 0.3110000 18.23000 0.4257000 19.27000 0.4536000 -1.045000      0.6221000 
1 1 1 11 8  31 o 35.24000 0.3369000 35.21000 0.4969000 35.28000 0.4552000 -0.6681000E-01 0.6739000 
1 1 1 11 8  33 o 28.97000 0.3241000 28.44000 0.4758000 29.50000 0.4402000 -1.061000      0.6482000 
1 1 1 11 8  35 o 49.27000 0.4649000 49.12000 0.7477000 49.42000 0.5528000 -0.3053000     0.9299000 
1 1 1 11 8  37 o 31.87000 0.3792000 31.75000 0.6033000 32.00000 0.4595000 -0.2406000     0.7584000 
1 1 1 11 8  39 o 24.70000 0.3418000 24.42000 0.5044000 24.97000 0.4616000 -0.5533000     0.6837000 
1 1 1 11 8  41 o 5.406000 1.015000  4.191000 1.594000  6.622000 1.259000  -2.431000      2.031000  
1 1 1 11 8  43 o 27.22000 0.3417000 27.01000 0.5352000 27.43000 0.4249000 -0.4241000     0.6833000 
1 1 1 11 8  45 o 38.50000 0.3616000 38.61000 0.5642000 38.40000 0.4524000 0.2113000      0.7232000 
1 1 1 11 8  47 o 32.97000 0.4099000 33.35000 0.6566000 32.59000 0.4909000 0.7576000      0.8198000 
1 1 1 11 8  49 o 6.341000 1.010000  7.221000 1.627000  5.461000 1.196000  1.760000       2.019000  
1 1 1 11 8  51 o 24.19000 0.4133000 23.68000 0.5396000 24.69000 0.6263000 -1.014000      0.8267000 
1 1 1 11 8  53 o 2.621000 0.8613000 2.694000 1.250000  2.549000 1.185000  0.1452000      1.723000  
1 1 1 11 8  55 o 12.45000 0.5483000 12.06000 0.8935000 12.85000 0.6358000 -0.7906000     1.097000  
1 1 1 11 8  57 f 6.373000 0.9453000 5.598000 1.540000  7.148000 1.097000  -1.550000      1.891000  
1 1 1 11 8  59 f 10.10000 0.9019000 9.332000 1.670000  10.87000 0.6812000 -1.540000      1.804000  
1 1 1 11 8  61 o 5.708000 1.083000  6.162000 1.545000  5.255000 1.519000  0.9075000      2.166000  
1 1 1 11 8  63 o 3.764000 1.050000  4.307000 1.620000  3.222000 1.338000  1.084000       2.101000  
1 1 1 11 8  65 o 4.720000 0.9830000 3.826000 1.424000  5.614000 1.356000  -1.789000      1.966000  
1 1 1 11 9  0  o 11.17000 0.3011000 11.17000 0.3011000 11.17000 0.3011000 0.000000       0.000000  
1 1 1 11 9  2  o 42.86000 0.3345000 42.76000 0.4348000 42.96000 0.5084000 -0.2079000     0.6690000 
1 1 1 11 9  4  o 64.35000 0.4480000 64.10000 0.6305000 64.61000 0.6367000 -0.5133000     0.8960000 
1 1 1 11 9  6  o 42.32000 0.3319000 42.27000 0.4324000 42.36000 0.5036000 -0.8685000E-01 0.6638000 
1 1 1 11 9  8  o 53.09000 0.3759000 53.29000 0.5332000 52.90000 0.5300000 0.3847000      0.7519000 
1 1 1 11 9  10 o 122.0000 1.022000  122.7000 1.675000  121.4000 1.172000  1.287000       2.044000  
1 1 1 11 9  12 o 84.14000 0.6001000 84.25000 0.7346000 84.03000 0.9491000 0.2220000      1.200000  
1 1 1 11 9  14 o 97.98000 0.6962000 97.98000 0.8510000 97.97000 1.102000  0.1247000E-01  1.392000  
1 1 1 11 9  16 o 97.56000 0.6947000 97.62000 0.8491000 97.50000 1.100000  0.1252000      1.389000  
1 1 1 11 9  18 o 143.5000 1.132000  145.3000 1.619000  141.8000 1.582000  3.495000       2.263000  
1 1 1 11 9  20 o 115.5000 0.9346000 116.5000 1.010000  114.5000 1.573000  1.954000       1.869000  
1 1 1 11 9  22 o 76.75000 0.5841000 76.55000 0.7606000 76.95000 0.8866000 -0.3993000     1.168000  
1 1 1 11 9  24 o 27.55000 0.4365000 27.22000 0.3858000 27.89000 0.7832000 -0.6791000     0.8731000 
1 1 1 11 9  26 o 46.08000 0.3849000 46.30000 0.5001000 45.86000 0.5853000 0.4387000      0.7699000 
1 1 1 11 9  28 o 31.77000 0.2963000 31.92000 0.4057000 31.61000 0.4320000 0.3077000      0.5926000 
1 1 1 11 9  30 f 19.07000 0.3158000 19.47000 0.4829000 18.67000 0.4071000 0.8048000      0.6316000 
1 1 1 11 9  32 o 27.78000 0.3012000 27.79000 0.4657000 27.78000 0.3821000 0.1463000E-02  0.6024000 
1 1 1 11 9  34 o 38.91000 0.3403000 39.17000 0.5322000 38.66000 0.4241000 0.5080000      0.6806000 
1 1 1 11 9  36 o 45.83000 0.4360000 45.10000 0.7318000 46.57000 0.4741000 -1.472000      0.8719000 
1 1 1 11 9  38 o 41.19000 0.4865000 41.27000 0.6819000 41.12000 0.6941000 0.1449000      0.9730000 
1 1 1 11 9  40 o 28.36000 0.3430000 28.60000 0.5099000 28.11000 0.4589000 0.4947000      0.6860000 
1 1 1 11 9  42 f 30.67000 0.3419000 30.95000 0.5374000 30.38000 0.4229000 0.5725000      0.6839000 
1 1 1 11 9  44 o 17.52000 0.4077000 17.35000 0.6424000 17.69000 0.5022000 -0.3331000     0.8154000 
1 1 1 11 9  46 o 12.67000 0.5296000 12.52000 0.8220000 12.83000 0.6681000 -0.3066000     1.059000  
1 1 1 11 9  48 o 27.37000 0.3858000 27.51000 0.6480000 27.22000 0.4188000 0.2880000      0.7716000 
1 1 1 11 9  50 o 13.52000 0.4808000 13.98000 0.7082000 13.06000 0.6505000 0.9182000      0.9616000 
1 1 1 11 9  52 o 18.30000 0.3826000 18.24000 0.5834000 18.35000 0.4954000 -0.1123000     0.7653000 
1 1 1 11 9  54 o 10.15000 0.5987000 9.871000 1.002000  10.42000 0.6554000 -0.5479000     1.197000  
1 1 1 11 9  56 o 9.288000 0.6241000 9.722000 0.9794000 8.855000 0.7738000 0.8668000      1.248000  
1 1 1 11 9  58 o 3.777000 1.008000  3.342000 1.426000  4.212000 1.425000  -0.8700000     2.016000  
1 1 1 11 9  60 o 7.321000 0.9736000 7.866000 1.673000  6.776000 0.9960000 1.090000       1.947000  
1 1 1 11 9  62 o 6.456000 0.9388000 6.203000 1.521000  6.709000 1.101000  -0.5059000     1.878000  
1 1 1 11 9  64 o 11.76000 0.5595000 11.96000 0.8897000 11.55000 0.6786000 0.4015000      1.119000  
1 1 1 11 10 1  o 48.30000 0.3429000 47.98000 0.4819000 48.61000 0.4879000 -0.6263000     0.6857000 
1 1 1 11 10 3  o 12.56000 0.2038000 12.42000 0.2862000 12.69000 0.2902000 -0.2786000     0.4076000 
1 1 1 11 10 5  o 54.80000 0.3853000 55.24000 0.5489000 54.36000 0.5408000 0.8826000      0.7706000 
1 1 1 11 10 7  o 64.44000 0.4491000 64.21000 0.6324000 64.67000 0.6379000 -0.4570000     0.8982000 
1 1 1 11 10 9  o 22.47000 0.2282000 22.59000 0.3229000 22.34000 0.3225000 0.2486000      0.4563000 
1 1 1 11 10 11 f 59.38000 0.4337000 59.30000 0.5266000 59.46000 0.6892000 -0.1647000     0.8674000 
1 1 1 11 10 13 o 43.64000 0.3485000 43.93000 0.4509000 43.35000 0.5314000 0.5744000      0.6970000 
1 1 1 11 10 15 o 128.3000 0.9057000 128.4000 1.108000  128.3000 1.433000  0.8940000E-01  1.811000  
1 1 1 11 10 17 o 44.01000 0.4166000 43.16000 0.4652000 44.87000 0.6913000 -1.710000      0.8332000 
1 1 1 11 10 19 o 29.48000 0.3530000 29.03000 0.4386000 29.93000 0.5533000 -0.8940000     0.7061000 
1 1 1 11 10 21 o 81.78000 0.6804000 81.18000 0.7151000 82.38000 1.158000  -1.194000      1.361000  
1 1 1 11 10 23 o 115.6000 0.9705000 116.9000 1.136000  114.2000 1.574000  2.687000       1.941000  
1 1 1 11 10 25 o 41.08000 0.4275000 41.07000 0.6562000 41.09000 0.5480000 -0.1924000E-01 0.8549000 
1 1 1 11 10 27 o 24.52000 0.3741000 25.41000 0.5664000 23.63000 0.4888000 1.783000       0.7482000 
1 1 1 11 10 29 o 44.28000 0.3609000 44.65000 0.5657000 43.91000 0.4484000 0.7405000      0.7219000 
1 1 1 11 10 31 o 8.765000 0.5268000 8.802000 0.8031000 8.727000 0.6820000 0.7485000E-01  1.054000  
1 1 1 11 10 33 o 33.88000 0.3316000 33.61000 0.4922000 34.15000 0.4446000 -0.5456000     0.6633000 
1 1 1 11 10 35 o 17.70000 0.3935000 17.25000 0.6329000 18.14000 0.4680000 -0.8938000     0.7871000 
1 1 1 11 10 37 o 15.32000 0.4765000 14.13000 0.7995000 16.51000 0.5186000 -2.379000      0.9530000 
1 1 1 11 10 39 o 43.98000 0.4170000 44.45000 0.5905000 43.51000 0.5890000 0.9391000      0.8341000 
1 1 1 11 10 41 o 25.13000 0.3376000 25.02000 0.5296000 25.23000 0.4188000 -0.2039000     0.6752000 
1 1 1 11 10 43 o 24.61000 0.3501000 24.89000 0.5450000 24.34000 0.4397000 0.5515000      0.7003000 
1 1 1 11 10 45 o 36.00000 0.3493000 35.78000 0.5502000 36.23000 0.4307000 -0.4531000     0.6987000 
1 1 1 11 10 47 o 39.50000 0.4532000 40.12000 0.6947000 38.89000 0.5821000 1.227000       0.9064000 
1 1 1 11 10 49 o 7.914000 1.097000  8.542000 2.002000  7.286000 0.8969000 1.257000       2.194000  
1 1 1 11 10 51 o 14.17000 0.4947000 14.96000 0.8029000 13.38000 0.5784000 1.583000       0.9895000 
1 1 1 11 10 53 o 11.21000 0.4939000 12.30000 0.7432000 10.11000 0.6507000 2.190000       0.9878000 
1 1 1 11 10 55 o 7.597000 0.7850000 6.577000 1.395000  8.616000 0.7197000 -2.039000      1.570000  
1 1 1 11 10 57 o 4.979000 1.046000  4.573000 1.583000  5.385000 1.369000  -0.8118000     2.093000  
1 1 1 11 10 59 f 4.096000 1.122000  3.903000 1.771000  4.289000 1.378000  -0.3858000     2.243000  
1 1 1 11 10 61 o 4.516000 1.077000  4.571000 1.621000  4.460000 1.418000  0.1106000      2.154000  
1 1 1 11 10 63 o 3.510000 1.009000  4.186000 1.624000  2.833000 1.197000  1.353000       2.017000  
1 1 1 11 10 65 o 4.009000 1.123000  4.339000 1.778000  3.678000 1.374000  0.6617000      2.247000  
1 1 1 11 11 0  o 17.47000 0.2528000 17.47000 0.2528000 17.47000 0.2528000 0.000000       0.000000  
1 1 1 11 11 2  f 41.99000 0.3044000 41.81000 0.4284000 42.18000 0.4326000 -0.3756000     0.6088000 
1 1 1 11 11 4  o 33.52000 0.2535000 33.50000 0.3579000 33.55000 0.3591000 -0.5154000E-01 0.5070000 
1 1 1 11 11 6  o 54.80000 0.4485000 55.05000 0.6364000 54.54000 0.6320000 0.5150000      0.8969000 
1 1 1 11 11 8  o 77.15000 0.5338000 77.45000 0.7568000 76.84000 0.7530000 0.6082000      1.068000  
1 1 1 11 11 10 o 73.41000 0.5521000 73.26000 0.7181000 73.56000 0.8387000 -0.3061000     1.104000  
1 1 1 11 11 12 o 102.9000 0.7300000 103.0000 0.8925000 102.9000 1.155000  0.5793000E-01  1.460000  
1 1 1 11 11 14 o 19.92000 0.2412000 19.82000 0.2679000 20.01000 0.4011000 -0.1886000     0.4824000 
1 1 1 11 11 16 o 24.26000 0.3193000 24.68000 0.3912000 23.84000 0.5049000 0.8373000      0.6387000 
1 1 1 11 11 18 o 6.839000 0.6440000 6.610000 0.6545000 7.068000 1.109000  -0.4578000     1.288000  
1 1 1 11 11 20 o 17.62000 0.3085000 17.77000 0.3929000 17.47000 0.4757000 0.2965000      0.6170000 
1 1 1 11 11 22 o 64.49000 0.5456000 65.10000 0.5853000 63.89000 0.9210000 1.210000       1.091000  
1 1 1 11 11 24 o 50.37000 0.4365000 49.89000 0.6014000 50.85000 0.6328000 -0.9607000     0.8730000 
1 1 1 11 11 26 o 15.92000 0.4030000 16.72000 0.6846000 15.12000 0.4252000 1.599000       0.8060000 
1 1 1 11 11 28 o 57.69000 0.4370000 57.97000 0.6867000 57.42000 0.5406000 0.5494000      0.8739000 
1 1 1 11 11 30 o 35.05000 0.3164000 35.15000 0.4930000 34.95000 0.3966000 0.2036000      0.6328000 
1 1 1 11 11 32 o 35.19000 0.3188000 34.86000 0.4941000 35.52000 0.4030000 -0.6589000     0.6376000 
1 1 1 11 11 34 o 12.16000 0.4868000 11.97000 0.6731000 12.35000 0.7035000 -0.3802000     0.9737000 
1 1 1 11 11 36 o 40.61000 0.3676000 40.43000 0.5472000 40.79000 0.4910000 -0.3682000     0.7352000 
1 1 1 11 11 38 o 48.25000 0.4129000 47.91000 0.6134000 48.60000 0.5528000 -0.6803000     0.8257000 
1 1 1 11 11 40 o 29.95000 0.3357000 30.70000 0.5278000 29.20000 0.4150000 1.509000       0.6714000 
1 1 1 11 11 42 o 5.525000 1.080000  6.630000 1.488000  4.420000 1.565000  2.210000       2.160000  
1 1 1 11 11 44 o 7.738000 0.8458000 7.135000 1.432000  8.341000 0.9008000 -1.206000      1.692000  
1 1 1 11 11 46 o 41.42000 0.3907000 41.54000 0.5863000 41.30000 0.5167000 0.2447000      0.7815000 
1 1 1 11 11 48 f 21.55000 0.4146000 20.67000 0.6780000 22.42000 0.4772000 -1.748000      0.8291000 
1 1 1 11 11 50 o 13.44000 0.6852000 14.38000 1.247000  12.49000 0.5688000 1.890000       1.370000  
1 1 1 11 11 52 o 21.58000 0.3840000 22.25000 0.5688000 20.91000 0.5160000 1.342000       0.7680000 
1 1 1 11 11 54 o 12.13000 0.4744000 11.96000 0.7592000 12.30000 0.5691000 -0.3355000     0.9488000 
1 1 1 11 11 56 o 12.81000 0.4827000 12.58000 0.7772000 13.03000 0.5725000 -0.4473000     0.9653000 
1 1 1 11 11 58 o 10.08000 0.6206000 10.50000 0.9432000 9.656000 0.8068000 0.8432000      1.241000  
1 1 1 11 11 60 f 4.129000 0.9394000 5.694000 1.449000  2.564000 1.196000  3.130000       1.879000  
1 1 1 11 11 62 o 6.107000 1.026000  6.219000 1.531000  5.994000 1.366000  0.2252000      2.052000  
1 1 1 11 11 64 o 9.384000 0.7096000 9.316000 1.191000  9.452000 0.7716000 -0.1359000     1.419000  
1 1 1 11 12 1  o 22.45000 0.1953000 22.71000 0.2782000 22.19000 0.2743000 0.5198000      0.3907000 
1 1 1 11 12 3  o 41.54000 0.3018000 41.61000 0.4271000 41.47000 0.4267000 0.1374000      0.6037000 
1 1 1 11 12 5  o 84.36000 0.5809000 83.99000 0.8180000 84.72000 0.8251000 -0.7301000     1.162000  
1 1 1 11 12 7  o 83.99000 0.5802000 82.73000 0.8073000 85.25000 0.8335000 -2.521000      1.160000  
1 1 1 11 12 9  o 50.88000 0.4514000 50.92000 0.5103000 50.84000 0.7447000 0.8176000E-01  0.9028000 
1 1 1 11 12 11 o 129.7000 0.9151000 130.0000 1.124000  129.3000 1.444000  0.7206000      1.830000  
1 1 1 11 12 13 o 29.86000 0.2629000 29.50000 0.3034000 30.22000 0.4295000 -0.7262000     0.5259000 
1 1 1 11 12 15 o 36.55000 0.3520000 36.62000 0.3599000 36.49000 0.6050000 0.1223000      0.7039000 
1 1 1 11 12 17 o 51.02000 0.4589000 50.82000 0.5199000 51.21000 0.7565000 -0.3937000     0.9179000 
1 1 1 11 12 19 o 98.14000 0.7023000 97.17000 0.8472000 99.12000 1.120000  -1.952000      1.405000  
1 1 1 11 12 21 o 54.18000 0.4755000 54.51000 0.5029000 53.84000 0.8071000 0.6759000      0.9510000 
1 1 1 11 12 23 o 28.47000 0.3563000 28.03000 0.5343000 28.90000 0.4714000 -0.8713000     0.7126000 
1 1 1 11 12 25 o 66.77000 0.4775000 67.54000 0.6799000 66.00000 0.6707000 1.539000       0.9551000 
1 1 1 11 12 27 o 14.02000 0.3572000 14.40000 0.5350000 13.63000 0.4733000 0.7625000      0.7143000 
1 1 1 11 12 29 o 22.39000 0.3291000 22.56000 0.5393000 22.22000 0.3772000 0.3430000      0.6581000 
1 1 1 11 12 31 o 19.33000 0.3153000 20.18000 0.4888000 18.48000 0.3985000 1.701000       0.6306000 
1 1 1 11 12 33 o 19.76000 0.3233000 19.52000 0.5001000 20.01000 0.4098000 -0.4876000     0.6466000 
1 1 1 11 12 35 o 31.31000 0.3702000 31.53000 0.5869000 31.10000 0.4513000 0.4290000      0.7404000 
1 1 1 11 12 37 o 14.35000 0.7605000 13.00000 1.441000  15.71000 0.4853000 -2.712000      1.521000  
1 1 1 11 12 39 o 35.80000 0.3640000 35.67000 0.5471000 35.94000 0.4801000 -0.2698000     0.7279000 
1 1 1 11 12 41 o 18.55000 0.3855000 18.87000 0.6044000 18.24000 0.4787000 0.6297000      0.7710000 
1 1 1 11 12 43 o 54.45000 0.4538000 55.41000 0.6896000 53.48000 0.5902000 1.930000       0.9077000 
1 1 1 11 12 45 o 64.10000 0.4926000 64.46000 0.7765000 63.74000 0.6063000 0.7240000      0.9852000 
1 1 1 11 12 47 o 41.94000 0.4622000 41.93000 0.7035000 41.95000 0.5997000 -0.1815000E-01 0.9244000 
1 1 1 11 12 49 o 13.45000 0.5438000 12.76000 0.9447000 14.14000 0.5389000 -1.380000      1.088000  
1 1 1 11 12 51 o 8.889000 0.7145000 8.471000 1.103000  9.308000 0.9087000 -0.8370000     1.429000  
1 1 1 11 12 53 o 10.10000 0.5305000 9.720000 0.8769000 10.48000 0.5974000 -0.7620000     1.061000  
1 1 1 11 12 55 o 5.249000 0.8980000 4.279000 1.530000  6.218000 0.9407000 -1.939000      1.796000  
1 1 1 11 12 57 o 8.925000 0.7026000 8.179000 1.177000  9.672000 0.7669000 -1.493000      1.405000  
1 1 1 11 12 59 o 5.596000 1.006000  6.020000 1.685000  5.172000 1.098000  0.8474000      2.011000  
1 1 1 11 12 61 o 4.911000 1.131000  5.980000 1.816000  3.842000 1.348000  2.138000       2.262000  
1 1 1 11 12 63 o 6.255000 0.9501000 6.274000 1.573000  6.236000 1.067000  0.3784000E-01  1.900000  
1 1 1 11 12 65 o 3.839000 1.019000  3.685000 1.583000  3.993000 1.282000  -0.3087000     2.037000  
1 1 1 11 13 0  o 45.58000 0.5398000 45.58000 0.5398000 45.58000 0.5398000 0.000000       0.000000  
1 1 1 11 13 2  o 63.59000 0.4437000 63.42000 0.6249000 63.77000 0.6301000 -0.3466000     0.8874000 
1 1 1 11 13 4  o 67.47000 0.4695000 67.57000 0.6647000 67.36000 0.6632000 0.2100000      0.9390000 
1 1 1 11 13 6  o 128.7000 1.136000  128.5000 1.434000  128.8000 1.763000  -0.3712000     2.273000  
1 1 1 11 13 8  o 79.87000 0.6403000 80.04000 0.9071000 79.69000 0.9039000 0.3482000      1.281000  
1 1 1 11 13 10 o 92.57000 0.6897000 93.12000 0.9070000 92.02000 1.039000  1.095000       1.379000  
1 1 1 11 13 12 o 44.14000 0.4305000 43.98000 0.5309000 44.30000 0.6777000 -0.3164000     0.8609000 
1 1 1 11 13 14 o 80.22000 0.5778000 80.02000 0.7027000 80.42000 0.9173000 -0.3937000     1.156000  
1 1 1 11 13 16 o 82.29000 0.7022000 81.87000 0.8006000 82.72000 1.154000  -0.8482000     1.404000  
1 1 1 11 13 18 o 53.12000 0.4041000 53.23000 0.4891000 53.01000 0.6435000 0.2204000      0.8082000 
1 1 1 11 13 20 o 23.03000 0.3379000 22.77000 0.3728000 23.28000 0.5637000 -0.5136000     0.6758000 
1 1 1 11 13 22 o 55.09000 0.4951000 55.38000 0.5649000 54.81000 0.8134000 0.5692000      0.9903000 
1 1 1 11 13 24 o 10.96000 0.5486000 10.15000 0.9575000 11.76000 0.5358000 -1.610000      1.097000  
1 1 1 11 13 26 o 78.33000 0.5937000 78.32000 0.8933000 78.34000 0.7823000 -0.1905000E-01 1.187000  
1 1 1 11 13 28 o 45.77000 0.3653000 45.48000 0.5669000 46.06000 0.4608000 -0.5802000     0.7305000 
1 1 1 11 13 30 o 29.68000 0.3017000 30.14000 0.4674000 29.23000 0.3817000 0.9073000      0.6035000 
1 1 1 11 13 32 o 20.51000 0.3140000 20.31000 0.4850000 20.72000 0.3990000 -0.4177000     0.6280000 
1 1 1 11 13 34 o 43.25000 0.4936000 44.10000 0.6877000 42.41000 0.7082000 1.686000       0.9871000 
1 1 1 11 13 36 o 17.31000 0.3539000 17.22000 0.5599000 17.40000 0.4329000 -0.1828000     0.7077000 
1 1 1 11 13 38 o 13.34000 0.5577000 14.36000 0.8621000 12.32000 0.7079000 2.042000       1.115000  
1 1 1 11 13 40 o 22.53000 0.3471000 22.69000 0.5440000 22.38000 0.4313000 0.3141000      0.6942000 
1 1 1 11 13 42 o 23.51000 0.4008000 24.39000 0.6357000 22.63000 0.4885000 1.765000       0.8017000 
1 1 1 11 13 44 o 9.965000 0.6416000 10.18000 1.027000  9.745000 0.7688000 0.4401000      1.283000  
1 1 1 11 13 46 f 7.321000 1.098000  8.445000 1.373000  6.196000 1.714000  2.249000       2.196000  
1 1 1 11 13 48 o 14.52000 0.6389000 14.25000 1.087000  14.80000 0.6717000 -0.5433000     1.278000  
1 1 1 11 13 50 o 12.58000 0.5581000 12.82000 0.9841000 12.34000 0.5267000 0.4829000      1.116000  
1 1 1 11 13 52 o 7.844000 0.6804000 7.156000 1.106000  8.532000 0.7922000 -1.376000      1.361000  
1 1 1 11 13 54 o 3.524000 0.9326000 3.106000 1.370000  3.941000 1.266000  -0.8351000     1.865000  
1 1 1 11 13 56 o 16.61000 0.4019000 17.20000 0.6036000 16.03000 0.5307000 1.161000       0.8037000 
1 1 1 11 13 58 o 6.756000 0.9836000 7.041000 1.659000  6.472000 1.058000  0.5695000      1.967000  
1 1 1 11 13 60 o 6.474000 0.8983000 6.081000 1.514000  6.868000 0.9671000 -0.7879000     1.797000  
1 1 1 11 13 62 o 7.870000 0.8107000 7.715000 1.366000  8.026000 0.8733000 -0.3103000     1.621000  
1 1 1 11 13 64 o 6.372000 0.9291000 7.124000 1.498000  5.620000 1.099000  1.505000       1.858000  
1 1 1 11 14 1  o 42.26000 0.3080000 42.27000 0.4352000 42.26000 0.4360000 0.1108000E-01  0.6161000 
1 1 1 11 14 3  o 40.36000 0.3248000 39.83000 0.4151000 40.88000 0.4997000 -1.047000      0.6496000 
1 1 1 11 14 5  o 183.2000 1.605000  186.0000 2.064000  180.5000 2.458000  5.472000       3.210000  
1 1 1 11 14 7  o 99.04000 0.7872000 98.90000 1.112000  99.19000 1.115000  -0.2883000     1.574000  
1 1 1 11 14 9  o 81.67000 0.7344000 81.47000 1.137000  81.87000 0.9294000 -0.3923000     1.469000  
1 1 1 11 14 11 o 38.63000 0.3492000 38.34000 0.4916000 38.92000 0.4961000 -0.5791000     0.6984000 
1 1 1 11 14 13 o 39.76000 0.3176000 39.76000 0.3774000 39.76000 0.5110000 -0.5688000E-02 0.6353000 
1 1 1 11 14 15 o 90.78000 1.046000  87.77000 0.9866000 93.80000 1.846000  -6.033000      2.093000  
1 1 1 11 14 17 o 67.78000 0.4960000 67.69000 0.6016000 67.88000 0.7887000 -0.1854000     0.9920000 
1 1 1 11 14 19 o 63.68000 0.4927000 63.05000 0.6313000 64.30000 0.7566000 -1.249000      0.9854000 
1 1 1 11 14 21 o 129.6000 1.143000  131.4000 1.465000  127.9000 1.756000  3.484000       2.287000  
1 1 1 11 14 23 o 84.56000 0.6387000 85.06000 0.9678000 84.06000 0.8336000 1.001000       1.277000  
1 1 1 11 14 25 o 24.57000 0.3354000 24.58000 0.4809000 24.56000 0.4678000 0.2409000E-01  0.6709000 
1 1 1 11 14 27 o 24.91000 0.2943000 24.68000 0.4534000 25.15000 0.3752000 -0.4629000     0.5885000 
1 1 1 11 14 29 o 22.35000 0.3684000 22.52000 0.5978000 22.17000 0.4305000 0.3504000      0.7367000 
1 1 1 11 14 31 o 4.509000 0.8518000 5.975000 1.204000  3.042000 1.205000  2.932000       1.704000  
1 1 1 11 14 33 o 32.54000 0.3283000 32.94000 0.4839000 32.13000 0.4437000 0.8114000      0.6565000 
1 1 1 11 14 35 o 34.39000 0.3867000 34.17000 0.6138000 34.61000 0.4705000 -0.4362000     0.7734000 
1 1 1 11 14 37 o 45.50000 0.4696000 45.68000 0.7199000 45.33000 0.6031000 0.3524000      0.9391000 
1 1 1 11 14 39 o 7.471000 0.8255000 6.768000 1.411000  8.174000 0.8577000 -1.406000      1.651000  
1 1 1 11 14 41 o 6.167000 0.9847000 5.706000 1.657000  6.629000 1.064000  -0.9231000     1.969000  
1 1 1 11 14 43 o 22.99000 0.4086000 23.18000 0.6648000 22.81000 0.4754000 0.3697000      0.8173000 
1 1 1 11 14 45 f 25.50000 0.3491000 26.00000 0.5423000 25.00000 0.4397000 0.9999000      0.6982000 
1 1 1 11 14 47 o 16.59000 0.4466000 16.60000 0.6307000 16.58000 0.6325000 0.1296000E-01  0.8933000 
1 1 1 11 14 49 o 4.122000 1.049000  4.717000 1.626000  3.526000 1.325000  1.191000       2.097000  
1 1 1 11 14 51 o 8.861000 0.7002000 8.323000 1.230000  9.399000 0.6689000 -1.076000      1.400000  
1 1 1 11 14 53 o 6.214000 0.8384000 5.619000 1.425000  6.810000 0.8837000 -1.191000      1.677000  
1 1 1 11 14 55 o 7.342000 0.7016000 7.501000 1.157000  7.184000 0.7935000 0.3171000      1.403000  
1 1 1 11 14 57 o 6.016000 0.8882000 5.848000 1.475000  6.184000 0.9897000 -0.3360000     1.776000  
1 1 1 11 14 59 o 6.552000 1.156000  6.020000 2.055000  7.083000 1.062000  -1.062000      2.313000  
1 1 1 11 14 61 f 3.755000 1.056000  3.486000 1.585000  4.024000 1.396000  -0.5377000     2.112000  
1 1 1 11 14 63 o 7.130000 0.8455000 7.503000 1.357000  6.758000 1.009000  0.7454000      1.691000  
1 1 1 11 15 0  o 96.53000 0.9369000 96.53000 0.9369000 96.53000 0.9369000 0.000000       0.000000  
1 1 1 11 15 2  o 72.90000 0.5055000 73.46000 0.7195000 72.34000 0.7102000 1.118000       1.011000  
1 1 1 11 15 4  o 34.01000 0.2612000 34.07000 0.3710000 33.94000 0.3679000 0.1320000      0.5224000 
1 1 1 11 15 6  o 78.33000 0.7049000 79.05000 0.8978000 77.61000 1.087000  1.443000       1.410000  
1 1 1 11 15 8  o 58.90000 0.4862000 58.97000 0.6876000 58.82000 0.6875000 0.1466000      0.9723000 
1 1 1 11 15 10 o 160.1000 1.260000  160.7000 1.788000  159.5000 1.776000  1.116000       2.520000  
1 1 1 11 15 12 f 79.02000 0.5694000 78.67000 0.6909000 79.37000 0.9052000 -0.7044000     1.139000  
1 1 1 11 15 14 o 22.89000 0.2977000 22.11000 0.2971000 23.66000 0.5160000 -1.546000      0.5954000 
1 1 1 11 15 16 o 61.03000 0.4726000 60.58000 0.6074000 61.49000 0.7242000 -0.9119000     0.9452000 
1 1 1 11 15 18 o 51.29000 0.4689000 51.09000 0.5262000 51.49000 0.7763000 -0.4044000     0.9378000 
1 1 1 11 15 20 o 56.94000 0.6622000 57.39000 0.5808000 56.49000 1.190000  0.9092000      1.324000  
1 1 1 11 15 22 o 57.83000 0.4566000 58.32000 0.5980000 57.34000 0.6902000 0.9825000      0.9133000 
1 1 1 11 15 24 o 27.70000 0.2798000 27.93000 0.3914000 27.47000 0.4001000 0.4581000      0.5597000 
1 1 1 11 15 26 o 57.12000 0.4202000 56.94000 0.5897000 57.29000 0.5989000 -0.3505000     0.8405000 
1 1 1 11 15 28 o 65.39000 0.4848000 65.38000 0.7604000 65.40000 0.6016000 -0.2396000E-01 0.9696000 
1 1 1 11 15 30 o 23.80000 0.2976000 24.02000 0.4592000 23.58000 0.3786000 0.4461000      0.5951000 
1 1 1 11 15 32 o 24.68000 0.2982000 25.03000 0.4522000 24.33000 0.3887000 0.6966000      0.5963000 
1 1 1 11 15 34 o 30.29000 0.3548000 30.41000 0.5881000 30.18000 0.3970000 0.2257000      0.7095000 
1 1 1 11 15 36 f 26.97000 0.3728000 27.35000 0.5962000 26.59000 0.4478000 0.7648000      0.7456000 
1 1 1 11 15 38 o 56.64000 0.5289000 56.84000 0.8629000 56.44000 0.6119000 0.3983000      1.058000  
1 1 1 11 15 40 o 4.826000 1.119000  5.449000 1.665000  4.204000 1.496000  1.244000       2.238000  
1 1 1 11 15 42 o 22.59000 0.3985000 22.20000 0.6678000 22.98000 0.4349000 -0.7813000     0.7969000 
1 1 1 11 15 44 o 18.61000 0.3862000 18.99000 0.6169000 18.24000 0.4646000 0.7550000      0.7723000 
1 1 1 11 15 46 o 15.87000 0.4245000 16.20000 0.6580000 15.54000 0.5366000 0.6590000      0.8491000 
1 1 1 11 15 48 o 11.97000 0.7330000 11.80000 1.318000  12.14000 0.6413000 -0.3458000     1.466000  
1 1 1 11 15 50 o 10.13000 0.5752000 10.39000 0.8797000 9.872000 0.7414000 0.5198000      1.150000  
1 1 1 11 15 52 o 10.17000 0.5410000 9.155000 0.9198000 11.18000 0.5698000 -2.020000      1.082000  
1 1 1 11 15 54 o 5.116000 0.9889000 4.825000 1.588000  5.408000 1.179000  -0.5835000     1.978000  
1 1 1 11 15 56 o 8.922000 0.6489000 9.786000 0.9088000 8.058000 0.9265000 1.728000       1.298000  
1 1 1 11 15 58 o 5.903000 1.234000  5.684000 2.114000  6.122000 1.275000  -0.4379000     2.469000  
1 1 1 11 15 60 o 9.301000 0.7401000 9.713000 1.069000  8.888000 1.024000  0.8251000      1.480000  
1 1 1 11 15 62 o 9.325000 0.6604000 9.000000 1.076000  9.651000 0.7666000 -0.6504000     1.321000  
1 1 1 11 15 64 o 6.889000 0.8417000 8.420000 1.200000  5.358000 1.181000  3.062000       1.683000  
1 1 1 11 16 1  o 21.85000 0.2281000 21.69000 0.3524000 22.02000 0.2896000 -0.3295000     0.4561000 
1 1 1 11 16 3  f 101.7000 0.6983000 102.5000 0.9952000 100.9000 0.9798000 1.641000       1.397000  
1 1 1 11 16 5  o 110.2000 0.9776000 110.4000 1.236000  110.1000 1.515000  0.3015000      1.955000  
1 1 1 11 16 7  o 23.88000 0.3622000 23.85000 0.5105000 23.91000 0.5141000 -0.5821000E-01 0.7245000 
1 1 1 11 16 9  o 96.39000 0.8602000 95.84000 1.328000  96.93000 1.093000  -1.087000      1.720000  
1 1 1 11 16 11 o 53.77000 0.5065000 53.82000 0.6413000 53.71000 0.7842000 0.1033000      1.013000  
1 1 1 11 16 13 o 33.46000 0.3867000 32.87000 0.5175000 34.06000 0.5749000 -1.192000      0.7735000 
1 1 1 11 16 15 o 93.37000 0.6696000 92.17000 0.8036000 94.58000 1.071000  -2.412000      1.339000  
1 1 1 11 16 17 o 93.92000 0.7007000 95.15000 0.9250000 92.70000 1.053000  2.450000       1.401000  
1 1 1 11 16 19 o 55.18000 0.6675000 55.57000 0.6466000 54.79000 1.168000  0.7822000      1.335000  
1 1 1 11 16 21 o 18.92000 0.3036000 18.25000 0.4763000 19.58000 0.3765000 -1.327000      0.6072000 
1 1 1 11 16 23 o 28.99000 0.2942000 29.32000 0.4382000 28.66000 0.3927000 0.6624000      0.5884000 
1 1 1 11 16 25 o 62.42000 0.4908000 62.95000 0.7460000 61.89000 0.6380000 1.056000       0.9816000 
1 1 1 11 16 27 o 55.34000 0.4103000 56.13000 0.5816000 54.56000 0.5789000 1.571000       0.8206000 
1 1 1 11 16 29 o 75.64000 0.5524000 75.86000 0.8699000 75.43000 0.6810000 0.4317000      1.105000  
1 1 1 11 16 31 o 27.04000 0.2977000 26.75000 0.4582000 27.32000 0.3803000 -0.5721000     0.5955000 
1 1 1 11 16 33 o 38.97000 0.4035000 39.91000 0.6500000 38.04000 0.4782000 1.868000       0.8069000 
1 1 1 11 16 35 o 17.87000 0.3703000 18.36000 0.5583000 17.37000 0.4867000 0.9951000      0.7406000 
1 1 1 11 16 37 o 36.70000 0.3572000 36.47000 0.5321000 36.93000 0.4766000 -0.4608000     0.7144000 
1 1 1 11 16 39 o 45.73000 0.5937000 45.50000 1.058000  45.96000 0.5385000 -0.4688000     1.187000  
1 1 1 11 16 41 o 18.49000 0.3953000 18.40000 0.6331000 18.59000 0.4736000 -0.1845000     0.7907000 
1 1 1 11 16 43 o 19.34000 0.3737000 19.77000 0.5812000 18.91000 0.4698000 0.8636000      0.7474000 
1 1 1 11 16 45 o 13.94000 0.5108000 12.75000 0.8301000 15.12000 0.5954000 -2.366000      1.022000  
1 1 1 11 16 47 o 3.841000 1.008000  3.579000 1.545000  4.102000 1.297000  -0.5235000     2.017000  
1 1 1 11 16 49 o 16.61000 0.4017000 16.44000 0.6188000 16.77000 0.5124000 -0.3279000     0.8034000 
1 1 1 11 16 51 o 5.990000 1.115000  6.173000 1.637000  5.807000 1.514000  0.3662000      2.230000  
1 1 1 11 16 53 o 10.18000 0.5941000 9.712000 0.9727000 10.66000 0.6823000 -0.9461000     1.188000  
1 1 1 11 16 55 o 3.182000 0.9250000 3.126000 1.365000  3.238000 1.249000  -0.1127000     1.850000  
1 1 1 11 16 57 o 9.874000 0.8162000 8.229000 1.412000  11.52000 0.8185000 -3.290000      1.632000  
1 1 1 11 16 59 o 4.154000 1.089000  4.666000 1.707000  3.641000 1.352000  1.025000       2.178000  
1 1 1 11 16 61 o 6.471000 0.9750000 6.260000 1.571000  6.682000 1.156000  -0.4221000     1.950000  
1 1 1 11 16 63 o 6.179000 0.8892000 7.144000 1.386000  5.213000 1.114000  1.932000       1.778000  
1 1 1 11 17 0  o 163.9000 1.578000  163.9000 1.578000  163.9000 1.578000  0.000000       0.000000  
1 1 1 11 17 2  o 147.4000 1.085000  146.8000 1.634000  148.0000 1.427000  -1.192000      2.169000  
1 1 1 11 17 4  o 113.9000 0.9012000 114.9000 1.286000  112.9000 1.263000  1.980000       1.802000  
1 1 1 11 17 6  o 47.88000 0.4092000 47.03000 0.5682000 48.74000 0.5891000 -1.713000      0.8185000 
1 1 1 11 17 8  o 67.71000 0.5529000 66.77000 0.7717000 68.65000 0.7919000 -1.885000      1.106000  
1 1 1 11 17 10 o 99.56000 0.8894000 98.39000 1.109000  100.7000 1.390000  -2.342000      1.779000  
1 1 1 11 17 12 o 74.10000 0.6731000 73.73000 1.037000  74.47000 0.8583000 -0.7341000     1.346000  
1 1 1 11 17 14 o 69.42000 0.5691000 68.91000 0.7980000 69.93000 0.8114000 -1.018000      1.138000  
1 1 1 11 17 16 o 66.03000 0.5061000 65.41000 0.6467000 66.65000 0.7785000 -1.243000      1.012000  
1 1 1 11 17 18 o 68.11000 0.5691000 69.62000 0.6193000 66.61000 0.9549000 3.007000       1.138000  
1 1 1 11 17 20 o 56.90000 0.4459000 58.12000 0.5944000 55.68000 0.6647000 2.443000       0.8917000 
1 1 1 11 17 22 o 8.589000 0.6304000 8.946000 0.6890000 8.233000 1.056000  0.7135000      1.261000  
1 1 1 11 17 24 o 34.30000 0.2992000 34.43000 0.4197000 34.17000 0.4266000 0.2525000      0.5984000 
1 1 1 11 17 26 o 59.18000 0.4695000 58.69000 0.7055000 59.67000 0.6198000 -0.9799000     0.9391000 
1 1 1 11 17 28 o 26.48000 0.2945000 27.09000 0.4552000 25.88000 0.3736000 1.210000       0.5889000 
1 1 1 11 17 30 o 53.90000 0.4167000 54.43000 0.6544000 53.37000 0.5159000 1.061000       0.8333000 
1 1 1 11 17 32 o 39.53000 0.5247000 40.69000 0.9593000 38.37000 0.4253000 2.328000       1.049000  
1 1 1 11 17 34 o 10.57000 0.5239000 10.19000 0.8503000 10.94000 0.6122000 -0.7446000     1.048000  
1 1 1 11 17 36 o 11.29000 0.6429000 11.29000 1.022000  11.29000 0.7805000 0.2703000E-02  1.286000  
1 1 1 11 17 38 o 50.46000 0.4696000 52.08000 0.7966000 48.84000 0.4977000 3.236000       0.9393000 
1 1 1 11 17 40 o 21.03000 0.3697000 20.77000 0.5850000 21.28000 0.4521000 -0.5127000     0.7394000 
1 1 1 11 17 42 o 5.412000 0.9752000 7.374000 1.423000  3.449000 1.334000  3.925000       1.950000  
1 1 1 11 17 44 o 18.58000 0.3838000 18.78000 0.6057000 18.38000 0.4717000 0.4051000      0.7677000 
1 1 1 11 17 46 o 15.81000 0.4009000 15.89000 0.6354000 15.73000 0.4891000 0.1683000      0.8019000 
1 1 1 11 17 48 o 19.38000 0.3954000 19.26000 0.5985000 19.50000 0.5168000 -0.2396000     0.7907000 
1 1 1 11 17 50 f 18.39000 0.3803000 18.20000 0.5552000 18.59000 0.5200000 -0.3938000     0.7607000 
1 1 1 11 17 52 o 19.64000 0.3690000 19.47000 0.5825000 19.81000 0.4533000 -0.3439000     0.7381000 
1 1 1 11 17 54 o 13.29000 0.4395000 13.11000 0.6676000 13.47000 0.5717000 -0.3567000     0.8789000 
1 1 1 11 17 56 o 9.019000 0.7052000 8.368000 1.158000  9.670000 0.8054000 -1.301000      1.410000  
1 1 1 11 17 58 o 4.879000 0.9903000 4.013000 1.505000  5.745000 1.288000  -1.732000      1.981000  
1 1 1 11 17 60 o 6.313000 0.9810000 7.540000 1.347000  5.086000 1.426000  2.454000       1.962000  
1 1 1 11 17 62 o 7.726000 0.9192000 8.873000 1.427000  6.578000 1.159000  2.295000       1.838000  
1 1 1 11 18 1  o 104.2000 0.7393000 104.2000 1.170000  104.2000 0.9040000 0.1762000E-01  1.479000  
1 1 1 11 18 3  f 39.88000 0.3816000 40.35000 0.6394000 39.40000 0.4166000 0.9516000      0.7631000 
1 1 1 11 18 5  f 105.8000 0.9393000 107.5000 1.207000  104.1000 1.440000  3.410000       1.879000  
1 1 1 11 18 7  o 32.49000 0.3587000 32.30000 0.4513000 32.68000 0.5577000 -0.3836000     0.7174000 
1 1 1 11 18 9  o 97.96000 1.183000  99.37000 1.953000  96.55000 1.334000  2.823000       2.365000  
1 1 1 11 18 11 o 81.15000 0.7309000 80.99000 1.129000  81.32000 0.9291000 -0.3337000     1.462000  
1 1 1 11 18 13 o 58.57000 0.4902000 58.62000 0.6924000 58.53000 0.6940000 0.9229000E-01  0.9803000 
1 1 1 11 18 15 o 67.94000 0.5188000 67.31000 0.6638000 68.57000 0.7976000 -1.264000      1.038000  
1 1 1 11 18 17 o 53.32000 0.4074000 53.69000 0.4909000 52.94000 0.6504000 0.7499000      0.8149000 
1 1 1 11 18 19 o 20.81000 0.3040000 21.02000 0.3685000 20.61000 0.4836000 0.4096000      0.6080000 
1 1 1 11 18 21 o 5.403000 0.7115000 4.968000 1.082000  5.839000 0.9245000 -0.8709000     1.423000  
1 1 1 11 18 23 o 66.08000 0.5495000 66.91000 0.7774000 65.25000 0.7769000 1.657000       1.099000  
1 1 1 11 18 25 o 45.97000 0.4098000 46.44000 0.5786000 45.49000 0.5803000 0.9523000      0.8195000 
1 1 1 11 18 27 o 69.71000 0.4985000 69.21000 0.6977000 70.20000 0.7123000 -0.9856000     0.9971000 
1 1 1 11 18 29 o 29.02000 0.3568000 29.32000 0.6010000 28.73000 0.3847000 0.5858000      0.7136000 
1 1 1 11 18 31 o 66.91000 0.4991000 67.69000 0.7889000 66.13000 0.6117000 1.565000       0.9982000 
1 1 1 11 18 33 o 35.57000 0.3889000 36.21000 0.6252000 34.93000 0.4627000 1.280000       0.7778000 
1 1 1 11 18 35 o 17.67000 0.5054000 17.54000 0.8878000 17.81000 0.4833000 -0.2676000     1.011000  
1 1 1 11 18 37 o 37.57000 0.4252000 38.72000 0.7043000 36.42000 0.4765000 2.307000       0.8504000 
1 1 1 11 18 39 f 4.562000 1.100000  4.059000 1.726000  5.065000 1.365000  -1.007000      2.201000  
1 1 1 11 18 41 o 26.23000 0.3521000 26.09000 0.5614000 26.37000 0.4250000 -0.2807000     0.7041000 
1 1 1 11 18 43 o 15.17000 0.4526000 14.70000 0.7275000 15.63000 0.5387000 -0.9222000     0.9052000 
1 1 1 11 18 45 o 7.098000 0.9151000 6.165000 1.411000  8.031000 1.165000  -1.865000      1.830000  
1 1 1 11 18 47 o 19.31000 0.5179000 19.56000 0.8906000 19.06000 0.5290000 0.5003000      1.036000  
1 1 1 11 18 49 o 22.12000 0.3636000 22.22000 0.5477000 22.03000 0.4782000 0.1943000      0.7271000 
1 1 1 11 18 51 o 7.265000 0.7493000 7.929000 1.153000  6.600000 0.9567000 1.328000       1.499000  
1 1 1 11 18 53 o 14.42000 0.4331000 14.63000 0.6619000 14.21000 0.5587000 0.4149000      0.8662000 
1 1 1 11 18 55 f 4.443000 1.154000  4.666000 1.550000  4.219000 1.709000  0.4472000      2.307000  
1 1 1 11 18 57 o 5.053000 1.086000  5.387000 1.787000  4.719000 1.234000  0.6674000      2.172000  
1 1 1 11 18 59 o 5.938000 1.017000  6.373000 1.619000  5.504000 1.231000  0.8693000      2.034000  
1 1 1 11 18 61 o 3.454000 0.9842000 3.348000 1.468000  3.559000 1.311000  -0.2112000     1.968000  
1 1 1 11 18 63 o 2.699000 0.8402000 2.306000 1.133000  3.092000 1.241000  -0.7862000     1.680000  
1 1 1 11 19 0  o 4.845000 0.7257000 4.845000 0.7257000 4.845000 0.7257000 0.000000       0.000000  
1 1 1 11 19 2  o 30.49000 0.3227000 30.47000 0.5036000 30.52000 0.4038000 -0.5120000E-01 0.6454000 
1 1 1 11 19 4  o 22.70000 0.2497000 22.97000 0.3893000 22.43000 0.3128000 0.5318000      0.4994000 
1 1 1 11 19 6  o 47.43000 0.6264000 47.34000 0.7005000 47.53000 1.039000  -0.1876000     1.253000  
1 1 1 11 19 8  o 70.78000 0.8195000 69.88000 1.414000  71.68000 0.8289000 -1.806000      1.639000  
1 1 1 11 19 10 o 20.16000 0.3441000 20.08000 0.5278000 20.24000 0.4416000 -0.1602000     0.6882000 
1 1 1 11 19 12 o 101.0000 0.8065000 99.43000 1.124000  102.5000 1.157000  -3.048000      1.613000  
1 1 1 11 19 14 o 41.55000 0.4201000 40.97000 0.6381000 42.13000 0.5467000 -1.156000      0.8403000 
1 1 1 11 19 16 o 19.47000 0.4423000 18.16000 0.3398000 20.78000 0.8167000 -2.621000      0.8846000 
1 1 1 11 19 18 o 52.30000 0.4146000 52.36000 0.5442000 52.23000 0.6257000 0.1291000      0.8293000 
1 1 1 11 19 20 o 30.48000 0.2778000 29.89000 0.3884000 31.08000 0.3973000 -1.185000      0.5556000 
1 1 1 11 19 22 o 47.04000 0.3875000 46.95000 0.5835000 47.14000 0.5100000 -0.1891000     0.7750000 
1 1 1 11 19 24 o 16.34000 0.2913000 15.97000 0.4116000 16.71000 0.4123000 -0.7357000     0.5826000 
1 1 1 11 19 26 f 22.48000 0.3162000 22.14000 0.4917000 22.82000 0.3976000 -0.6769000     0.6324000 
1 1 1 11 19 28 f 39.44000 0.4273000 39.78000 0.5258000 39.10000 0.6736000 0.6763000      0.8545000 
1 1 1 11 19 30 o 18.08000 0.3757000 18.61000 0.4819000 17.55000 0.5767000 1.060000       0.7515000 
1 1 1 11 19 32 o 4.575000 1.050000  5.352000 1.558000  3.799000 1.407000  1.553000       2.099000  
1 1 1 11 19 34 o 20.77000 0.3747000 20.89000 0.6252000 20.65000 0.4131000 0.2411000      0.7493000 
1 1 1 11 19 36 f 16.00000 0.4050000 16.70000 0.6165000 15.30000 0.5253000 1.400000       0.8099000 
1 1 1 11 19 38 o 9.958000 0.5995000 10.58000 0.9143000 9.339000 0.7757000 1.239000       1.199000  
1 1 1 11 19 40 o 24.87000 0.3985000 24.84000 0.6715000 24.89000 0.4293000 -0.5399000E-01 0.7970000 
1 1 1 11 19 42 o 20.94000 0.3669000 21.01000 0.5674000 20.87000 0.4653000 0.1371000      0.7338000 
1 1 1 11 19 44 o 13.31000 0.4931000 12.80000 0.7399000 13.82000 0.6519000 -1.019000      0.9861000 
1 1 1 11 19 46 o 8.062000 0.6731000 8.068000 1.067000  8.056000 0.8209000 0.1193000E-01  1.346000  
1 1 1 11 19 48 o 3.358000 0.9406000 2.918000 1.334000  3.799000 1.327000  -0.8812000     1.881000  
1 1 1 11 19 50 o 9.554000 0.5919000 9.829000 0.9039000 9.280000 0.7645000 0.5496000      1.184000  
1 1 1 11 19 52 o 3.371000 1.003000  3.598000 1.584000  3.144000 1.230000  0.4537000      2.005000  
1 1 1 11 19 54 o 10.50000 0.5224000 10.00000 0.8289000 11.01000 0.6360000 -1.005000      1.045000  
1 1 1 11 19 56 o 12.99000 0.5852000 12.86000 0.8282000 13.12000 0.8270000 -0.2608000     1.170000  
1 1 1 11 19 58 o 3.357000 1.012000  3.473000 1.515000  3.242000 1.342000  0.2305000      2.024000  
1 1 1 11 19 60 o 5.356000 1.046000  4.500000 1.639000  6.211000 1.300000  -1.711000      2.092000  
1 1 1 11 19 62 o 5.895000 0.9869000 6.187000 1.605000  5.603000 1.149000  0.5840000      1.974000  
1 1 1 11 20 1  o 73.87000 0.6593000 73.37000 0.8333000 74.37000 1.022000  -0.9953000     1.319000  
1 1 1 11 20 3  o 74.52000 0.6363000 74.95000 1.045000  74.10000 0.7264000 0.8484000      1.273000  
1 1 1 11 20 5  o 33.99000 0.3680000 34.59000 0.5678000 33.40000 0.4682000 1.196000       0.7360000 
1 1 1 11 20 7  o 93.52000 0.8360000 93.36000 1.292000  93.67000 1.062000  -0.3180000     1.672000  
1 1 1 11 20 9  o 77.44000 0.6290000 78.28000 0.8977000 76.60000 0.8813000 1.687000       1.258000  
1 1 1 11 20 11 o 33.25000 0.5068000 32.69000 0.8146000 33.81000 0.6030000 -1.123000      1.014000  
1 1 1 11 20 13 o 42.78000 0.4295000 42.47000 0.6550000 43.09000 0.5558000 -0.6176000     0.8590000 
1 1 1 11 20 15 o 30.82000 0.3312000 30.47000 0.3202000 31.18000 0.5799000 -0.7133000     0.6625000 
1 1 1 11 20 17 o 24.50000 0.2662000 23.79000 0.3444000 25.21000 0.4060000 -1.414000      0.5324000 
1 1 1 11 20 19 o 18.46000 0.2683000 18.49000 0.3519000 18.42000 0.4051000 0.7016000E-01  0.5366000 
1 1 1 11 20 21 o 22.29000 0.2593000 22.40000 0.3646000 22.18000 0.3689000 0.2201000      0.5186000 
1 1 1 11 20 23 o 31.05000 0.3175000 30.72000 0.3970000 31.39000 0.4956000 -0.6690000     0.6350000 
1 1 1 11 20 25 o 43.73000 0.3438000 44.12000 0.4863000 43.34000 0.4862000 0.7827000      0.6876000 
1 1 1 11 20 27 o 6.856000 0.6978000 7.284000 1.084000  6.427000 0.8791000 0.8572000      1.396000  
1 1 1 11 20 29 o 32.64000 0.3224000 32.55000 0.4782000 32.72000 0.4325000 -0.1752000     0.6448000 
1 1 1 11 20 31 o 18.06000 0.4564000 18.80000 0.7869000 17.33000 0.4624000 1.471000       0.9127000 
1 1 1 11 20 33 o 8.741000 0.6410000 8.197000 1.097000  9.285000 0.6630000 -1.088000      1.282000  
1 1 1 11 20 35 o 12.35000 0.5723000 11.44000 0.9943000 13.26000 0.5671000 -1.813000      1.145000  
1 1 1 11 20 37 o 37.21000 0.3714000 37.02000 0.5425000 37.41000 0.5073000 -0.3827000     0.7428000 
1 1 1 11 20 39 o 8.966000 0.6947000 9.054000 1.128000  8.878000 0.8109000 0.1762000      1.389000  
1 1 1 11 20 41 o 9.840000 0.6110000 9.758000 1.018000  9.923000 0.6768000 -0.1647000     1.222000  
1 1 1 11 20 43 o 4.960000 1.080000  4.748000 1.618000  5.173000 1.432000  -0.4247000     2.161000  
1 1 1 11 20 45 o 14.45000 0.4236000 13.91000 0.6694000 14.98000 0.5191000 -1.064000      0.8471000 
1 1 1 11 20 47 o 7.827000 0.8438000 7.419000 1.474000  8.235000 0.8216000 -0.8158000     1.688000  
1 1 1 11 20 49 o 21.07000 0.3878000 20.67000 0.5353000 21.47000 0.5613000 -0.8028000     0.7756000 
1 1 1 11 20 51 o 24.76000 0.4164000 24.71000 0.6878000 24.81000 0.4696000 -0.1038000     0.8328000 
1 1 1 11 20 53 o 4.766000 1.019000  5.611000 1.485000  3.921000 1.397000  1.690000       2.039000  
1 1 1 11 20 55 o 12.35000 0.5137000 12.70000 0.7946000 12.00000 0.6513000 0.7021000      1.027000  
1 1 1 11 20 57 o 3.844000 1.061000  3.953000 1.553000  3.736000 1.447000  0.2174000      2.123000  
1 1 1 11 20 59 o 6.869000 0.8406000 7.311000 1.291000  6.427000 1.077000  0.8835000      1.681000  
1 1 1 11 20 61 o 5.004000 1.098000  4.764000 1.704000  5.245000 1.385000  -0.4804000     2.196000  
1 1 1 11 21 0  o 25.63000 0.4124000 25.63000 0.4124000 25.63000 0.4124000 0.000000       0.000000  
1 1 1 11 21 2  o 103.8000 0.7707000 105.7000 1.027000  101.9000 1.149000  3.753000       1.541000  
1 1 1 11 21 4  o 89.38000 0.6690000 89.65000 1.016000  89.11000 0.8704000 0.5457000      1.338000  
1 1 1 11 21 6  o 57.09000 0.4798000 57.69000 0.6806000 56.49000 0.6766000 1.193000       0.9597000 
1 1 1 11 21 8  o 27.20000 0.3617000 27.41000 0.5665000 26.99000 0.4497000 0.4177000      0.7233000 
1 1 1 11 21 10 o 103.2000 0.9201000 103.6000 1.427000  102.8000 1.162000  0.8687000      1.840000  
1 1 1 11 21 12 o 13.92000 0.4447000 13.79000 0.7076000 14.04000 0.5388000 -0.2490000     0.8894000 
1 1 1 11 21 14 o 25.19000 0.3554000 24.74000 0.4522000 25.63000 0.5484000 -0.8939000     0.7108000 
1 1 1 11 21 16 o 27.38000 0.3051000 27.35000 0.4606000 27.41000 0.4001000 -0.6208000E-01 0.6101000 
1 1 1 11 21 18 o 36.96000 0.3244000 36.60000 0.4228000 37.31000 0.4922000 -0.7073000     0.6489000 
1 1 1 11 21 20 o 7.822000 0.4183000 7.570000 0.6090000 8.074000 0.5736000 -0.5039000     0.8366000 
1 1 1 11 21 22 o 22.08000 0.2829000 22.29000 0.4216000 21.87000 0.3773000 0.4216000      0.5657000 
1 1 1 11 21 24 o 49.16000 0.4079000 49.03000 0.5224000 49.29000 0.6265000 -0.2516000     0.8157000 
1 1 1 11 21 26 o 37.83000 0.3149000 38.29000 0.4466000 37.37000 0.4440000 0.9223000      0.6297000 
1 1 1 11 21 28 o 32.79000 0.3769000 33.29000 0.4889000 32.30000 0.5738000 0.9907000      0.7539000 
1 1 1 11 21 30 o 28.83000 0.3014000 28.49000 0.4663000 29.17000 0.3821000 -0.6829000     0.6028000 
1 1 1 11 21 32 o 16.85000 0.4160000 16.69000 0.6337000 17.01000 0.5390000 -0.3162000     0.8319000 
1 1 1 11 21 34 o 28.59000 0.4013000 29.58000 0.6093000 27.60000 0.5224000 1.980000       0.8026000 
1 1 1 11 21 36 o 41.52000 0.3816000 41.18000 0.5654000 41.85000 0.5127000 -0.6724000     0.7633000 
1 1 1 11 21 38 o 16.40000 0.4212000 16.28000 0.6650000 16.51000 0.5170000 -0.2230000     0.8424000 
1 1 1 11 21 40 o 18.43000 0.4644000 18.13000 0.8013000 18.73000 0.4697000 -0.6061000     0.9288000 
1 1 1 11 21 42 o 13.40000 0.5097000 12.43000 0.8113000 14.36000 0.6172000 -1.926000      1.019000  
1 1 1 11 21 44 o 11.68000 0.5260000 12.47000 0.7889000 10.88000 0.6959000 1.591000       1.052000  
1 1 1 11 21 46 o 17.37000 0.5776000 16.80000 1.062000  17.94000 0.4556000 -1.142000      1.155000  
1 1 1 11 21 48 o 18.39000 0.3848000 18.29000 0.6110000 18.50000 0.4680000 -0.2100000     0.7696000 
1 1 1 11 21 50 o 26.52000 0.3632000 26.79000 0.5502000 26.26000 0.4743000 0.5357000      0.7264000 
1 1 1 11 21 52 o 5.320000 0.9231000 4.459000 1.493000  6.180000 1.086000  -1.721000      1.846000  
1 1 1 11 21 54 o 10.02000 0.6283000 10.52000 0.8125000 9.509000 0.9585000 1.016000       1.257000  
1 1 1 11 21 56 o 4.640000 1.072000  4.455000 1.769000  4.825000 1.209000  -0.3703000     2.143000  
1 1 1 11 21 58 o 5.932000 1.052000  5.629000 1.679000  6.234000 1.267000  -0.6057000     2.104000  
1 1 1 11 21 60 o 5.176000 1.181000  4.574000 1.637000  5.777000 1.704000  -1.203000      2.363000  
1 1 1 11 21 62 o 4.327000 1.093000  4.937000 1.732000  3.717000 1.335000  1.220000       2.187000  
1 1 1 11 22 1  o 61.63000 0.5434000 63.22000 0.9035000 60.05000 0.6041000 3.170000       1.087000  
1 1 1 11 22 3  o 7.762000 0.4414000 7.473000 0.7653000 8.051000 0.4399000 -0.5781000     0.8827000 
1 1 1 11 22 5  o 47.26000 0.3488000 47.37000 0.4994000 47.15000 0.4871000 0.2206000      0.6976000 
1 1 1 11 22 7  o 113.2000 1.263000  111.2000 2.170000  115.1000 1.294000  -3.906000      2.526000  
1 1 1 11 22 9  o 122.0000 1.082000  122.5000 1.679000  121.4000 1.365000  1.055000       2.164000  
1 1 1 11 22 11 o 49.61000 0.4351000 49.19000 0.6064000 50.02000 0.6242000 -0.8352000     0.8703000 
1 1 1 11 22 13 o 60.56000 0.5682000 61.02000 0.7240000 60.10000 0.8760000 0.9128000      1.136000  
1 1 1 11 22 15 o 59.81000 0.5059000 60.21000 0.7167000 59.40000 0.7143000 0.8078000      1.012000  
1 1 1 11 22 17 o 42.66000 0.3292000 43.02000 0.4664000 42.29000 0.4647000 0.7307000      0.6584000 
1 1 1 11 22 19 o 27.83000 0.2623000 27.82000 0.3705000 27.83000 0.3713000 -0.1076000E-01 0.5245000 
1 1 1 11 22 21 o 31.63000 0.3010000 31.21000 0.4470000 32.05000 0.4033000 -0.8358000     0.6020000 
1 1 1 11 22 23 o 3.663000 0.7772000 4.221000 1.097000  3.105000 1.102000  1.116000       1.554000  
1 1 1 11 22 25 o 14.47000 0.3304000 13.83000 0.4614000 15.12000 0.4731000 -1.286000      0.6609000 
1 1 1 11 22 27 o 50.00000 0.4943000 50.15000 0.7706000 49.84000 0.6194000 0.3185000      0.9887000 
1 1 1 11 22 29 o 22.84000 0.3124000 23.56000 0.4154000 22.12000 0.4666000 1.445000       0.6247000 
1 1 1 11 22 31 o 15.25000 0.4468000 14.59000 0.7171000 15.91000 0.5333000 -1.326000      0.8937000 
1 1 1 11 22 33 o 19.43000 0.3393000 20.22000 0.5207000 18.63000 0.4352000 1.594000       0.6786000 
1 1 1 11 22 35 o 47.56000 0.4107000 47.53000 0.6101000 47.60000 0.5500000 -0.6639000E-01 0.8214000 
1 1 1 11 22 37 o 4.132000 1.157000  4.011000 1.658000  4.253000 1.614000  -0.2421000     2.314000  
1 1 1 11 22 39 f 16.26000 0.4047000 15.95000 0.6374000 16.56000 0.4988000 -0.6055000     0.8093000 
1 1 1 11 22 41 o 19.27000 0.4300000 19.02000 0.7271000 19.52000 0.4593000 -0.4996000     0.8601000 
1 1 1 11 22 43 o 10.44000 0.5977000 10.04000 0.9468000 10.83000 0.7298000 -0.7963000     1.195000  
1 1 1 11 22 45 f 13.21000 0.4760000 13.60000 0.7194000 12.82000 0.6233000 0.7846000      0.9519000 
1 1 1 11 22 47 o 13.12000 0.4941000 12.83000 0.8387000 13.40000 0.5227000 -0.5657000     0.9883000 
1 1 1 11 22 49 o 12.96000 0.4977000 12.76000 0.7575000 13.15000 0.6459000 -0.3974000     0.9955000 
1 1 1 11 22 51 o 7.213000 0.7673000 7.430000 1.248000  6.997000 0.8934000 0.4339000      1.535000  
1 1 1 11 22 53 o 10.35000 0.6203000 9.865000 1.046000  10.83000 0.6671000 -0.9615000     1.241000  
1 1 1 11 22 55 o 6.829000 0.8738000 6.828000 1.446000  6.830000 0.9812000 -0.2255000E-02 1.748000  
1 1 1 11 22 57 o 3.754000 1.039000  3.913000 1.577000  3.594000 1.354000  0.3196000      2.079000  
1 1 1 11 22 59 o 8.809000 0.6677000 9.279000 1.016000  8.339000 0.8661000 0.9394000      1.335000  
1 1 1 11 22 61 o 5.416000 1.063000  6.098000 1.754000  4.733000 1.202000  1.365000       2.127000  
1 1 1 11 23 0  o 28.17000 0.3535000 28.17000 0.3535000 28.17000 0.3535000 0.000000       0.000000  
1 1 1 11 23 2  o 49.31000 0.3619000 49.78000 0.5175000 48.84000 0.5062000 0.9428000      0.7239000 
1 1 1 11 23 4  o 38.15000 0.3903000 37.89000 0.6010000 38.41000 0.4981000 -0.5139000     0.7806000 
1 1 1 11 23 6  o 35.44000 0.4007000 35.99000 0.5908000 34.89000 0.5417000 1.095000       0.8015000 
1 1 1 11 23 8  o 68.97000 0.5685000 69.07000 0.8013000 68.88000 0.8067000 0.1824000      1.137000  
1 1 1 11 23 10 o 53.73000 0.5149000 54.08000 0.6540000 53.38000 0.7955000 0.6966000      1.030000  
1 1 1 11 23 12 o 85.31000 0.7701000 85.87000 0.9809000 84.74000 1.187000  1.123000       1.540000  
1 1 1 11 23 14 o 9.812000 0.5075000 9.661000 0.7154000 9.963000 0.7201000 -0.3015000     1.015000  
1 1 1 11 23 16 o 12.86000 0.2586000 12.13000 0.3651000 13.58000 0.3664000 -1.451000      0.5172000 
1 1 1 11 23 18 f 16.85000 0.2581000 16.31000 0.3791000 17.40000 0.3503000 -1.087000      0.5161000 
1 1 1 11 23 20 o 32.76000 0.2841000 32.50000 0.3993000 33.01000 0.4042000 -0.5182000     0.5682000 
1 1 1 11 23 22 o 45.99000 0.3542000 45.63000 0.4953000 46.34000 0.5066000 -0.7089000     0.7085000 
1 1 1 11 23 24 o 13.13000 0.4581000 13.08000 0.4959000 13.18000 0.7703000 -0.1057000     0.9162000 
1 1 1 11 23 26 o 26.68000 0.2932000 27.01000 0.3922000 26.35000 0.4360000 0.6623000      0.5864000 
1 1 1 11 23 28 o 37.22000 0.3479000 37.75000 0.5357000 36.69000 0.4440000 1.058000       0.6958000 
1 1 1 11 23 30 o 47.78000 0.4496000 48.32000 0.7293000 47.23000 0.5260000 1.093000       0.8992000 
1 1 1 11 23 32 o 18.96000 0.3416000 18.30000 0.5467000 19.62000 0.4099000 -1.327000      0.6832000 
1 1 1 11 23 34 o 15.49000 0.4439000 16.06000 0.7252000 14.92000 0.5121000 1.143000       0.8878000 
1 1 1 11 23 36 o 12.41000 0.4872000 12.22000 0.7821000 12.61000 0.5811000 -0.3895000     0.9743000 
1 1 1 11 23 38 o 29.56000 0.3555000 29.69000 0.5284000 29.42000 0.4757000 0.2662000      0.7109000 
1 1 1 11 23 40 o 22.08000 0.3972000 22.16000 0.6720000 22.00000 0.4238000 0.1533000      0.7945000 
1 1 1 11 23 42 o 3.149000 0.9787000 3.109000 1.460000  3.189000 1.304000  -0.7976000E-01 1.957000  
1 1 1 11 23 44 o 15.15000 0.4332000 15.73000 0.6412000 14.58000 0.5827000 1.151000       0.8664000 
1 1 1 11 23 46 o 4.740000 1.241000  6.161000 2.113000  3.319000 1.301000  2.841000       2.482000  
1 1 1 11 23 48 o 9.679000 0.5751000 10.29000 0.8815000 9.063000 0.7389000 1.232000       1.150000  
1 1 1 11 23 50 f 10.27000 0.5783000 10.15000 0.9060000 10.39000 0.7190000 -0.2363000     1.157000  
1 1 1 11 23 52 o 7.632000 0.7687000 8.007000 1.225000  7.256000 0.9293000 0.7502000      1.537000  
1 1 1 11 23 54 o 7.531000 0.7258000 7.389000 1.180000  7.673000 0.8451000 -0.2845000     1.452000  
1 1 1 11 23 56 o 5.707000 0.9545000 7.593000 1.346000  3.821000 1.354000  3.772000       1.909000  
1 1 1 11 23 58 o 12.19000 0.5526000 12.27000 0.9323000 12.10000 0.5936000 0.1642000      1.105000  
1 1 1 11 23 60 o 7.726000 0.7939000 8.601000 1.234000  6.851000 0.9993000 1.750000       1.588000  
1 1 1 11 24 1  o 83.15000 0.6651000 83.66000 0.9464000 82.63000 0.9347000 1.029000       1.330000  
1 1 1 11 24 3  o 58.71000 0.5414000 59.51000 0.8518000 57.92000 0.6685000 1.592000       1.083000  
1 1 1 11 24 5  o 72.51000 0.5482000 72.06000 0.7180000 72.97000 0.8287000 -0.9174000     1.096000  
1 1 1 11 24 7  o 8.571000 0.8711000 9.188000 0.5728000 7.954000 1.645000  1.234000       1.742000  
1 1 1 11 24 9  f 24.74000 0.4652000 24.66000 0.4403000 24.82000 0.8197000 -0.1537000     0.9305000 
1 1 1 11 24 11 o 70.23000 0.5803000 71.42000 0.8295000 69.05000 0.8116000 2.377000       1.161000  
1 1 1 11 24 13 o 41.58000 0.3879000 41.68000 0.5460000 41.48000 0.5512000 0.2003000      0.7758000 
1 1 1 11 24 15 o 23.10000 0.3265000 22.76000 0.4569000 23.44000 0.4666000 -0.6776000     0.6531000 
1 1 1 11 24 17 f 49.93000 0.4006000 50.08000 0.5258000 49.78000 0.6045000 0.2968000      0.8012000 
1 1 1 11 24 19 o 45.71000 0.3496000 46.13000 0.4953000 45.28000 0.4935000 0.8561000      0.6992000 
1 1 1 11 24 21 o 61.44000 0.4802000 61.37000 0.6266000 61.51000 0.7278000 -0.1469000     0.9603000 
1 1 1 11 24 23 o 40.11000 0.3234000 39.26000 0.4482000 40.95000 0.4663000 -1.692000      0.6468000 
1 1 1 11 24 25 o 13.44000 0.3378000 13.35000 0.4561000 13.54000 0.4983000 -0.1946000     0.6755000 
1 1 1 11 24 27 o 16.04000 0.3579000 16.65000 0.5609000 15.42000 0.4449000 1.224000       0.7159000 
1 1 1 11 24 29 o 19.53000 0.3509000 19.05000 0.4677000 20.01000 0.5233000 -0.9627000     0.7018000 
1 1 1 11 24 31 o 4.954000 0.8092000 3.221000 1.361000  6.687000 0.8763000 -3.466000      1.618000  
1 1 1 11 24 33 o 43.01000 0.4131000 43.01000 0.6877000 43.02000 0.4579000 -0.1125000E-01 0.8262000 
1 1 1 11 24 35 o 14.99000 0.4255000 14.77000 0.6501000 15.21000 0.5491000 -0.4363000     0.8510000 
1 1 1 11 24 37 o 26.25000 0.3388000 26.00000 0.5298000 26.50000 0.4223000 -0.5009000     0.6775000 
1 1 1 11 24 39 o 33.42000 0.3378000 33.26000 0.5207000 33.58000 0.4304000 -0.3182000     0.6755000 
1 1 1 11 24 41 o 29.96000 0.3971000 30.27000 0.6660000 29.64000 0.4325000 0.6325000      0.7942000 
1 1 1 11 24 43 o 2.973000 0.9433000 3.229000 1.431000  2.717000 1.229000  0.5120000      1.887000  
1 1 1 11 24 45 o 11.97000 0.6419000 11.33000 1.052000  12.61000 0.7361000 -1.278000      1.284000  
1 1 1 11 24 47 o 6.586000 0.8634000 6.079000 1.483000  7.092000 0.8850000 -1.013000      1.727000  
1 1 1 11 24 49 o 3.467000 0.9810000 3.456000 1.435000  3.477000 1.338000  -0.2118000E-01 1.962000  
1 1 1 11 24 51 o 7.526000 0.7918000 6.842000 1.358000  8.209000 0.8140000 -1.367000      1.584000  
1 1 1 11 24 53 o 9.448000 0.7836000 8.798000 1.346000  10.10000 0.8034000 -1.300000      1.567000  
1 1 1 11 24 55 o 3.363000 1.042000  4.029000 1.679000  2.697000 1.234000  1.332000       2.084000  
1 1 1 11 24 57 o 7.469000 0.8397000 7.032000 1.389000  7.906000 0.9437000 -0.8739000     1.679000  
1 1 1 11 24 59 o 5.265000 1.010000  5.753000 1.561000  4.778000 1.282000  0.9743000      2.020000  
1 1 1 11 24 61 o 4.452000 1.090000  5.017000 1.747000  3.888000 1.304000  1.129000       2.180000  
1 1 1 11 25 0  o 53.55000 0.6318000 53.55000 0.6318000 53.55000 0.6318000 0.000000       0.000000  
1 1 1 11 25 2  o 72.10000 0.5850000 72.14000 0.8319000 72.06000 0.8226000 0.8179000E-01  1.170000  
1 1 1 11 25 4  o 15.53000 0.2521000 14.87000 0.3848000 16.20000 0.3257000 -1.329000      0.5042000 
1 1 1 11 25 6  o 46.21000 0.3985000 46.43000 0.5828000 45.99000 0.5438000 0.4425000      0.7971000 
1 1 1 11 25 8  o 25.89000 0.3497000 25.96000 0.3778000 25.82000 0.5887000 0.1368000      0.6995000 
1 1 1 11 25 10 o 51.61000 0.4777000 51.88000 0.5454000 51.35000 0.7843000 0.5322000      0.9553000 
1 1 1 11 25 12 o 39.01000 0.3741000 38.93000 0.5221000 39.10000 0.5358000 -0.1634000     0.7481000 
1 1 1 11 25 14 o 23.73000 0.3221000 23.34000 0.4449000 24.11000 0.4659000 -0.7722000     0.6442000 
1 1 1 11 25 16 o 54.06000 0.5007000 52.61000 0.5468000 55.51000 0.8390000 -2.904000      1.001000  
1 1 1 11 25 18 o 45.63000 0.3740000 45.34000 0.4882000 45.92000 0.5667000 -0.5764000     0.7480000 
1 1 1 11 25 20 o 10.55000 0.3928000 10.24000 0.6257000 10.87000 0.4750000 -0.6279000     0.7856000 
1 1 1 11 25 22 o 64.77000 0.4670000 65.00000 0.6613000 64.54000 0.6596000 0.4563000      0.9340000 
1 1 1 11 25 24 o 42.08000 0.4231000 42.29000 0.4754000 41.86000 0.7000000 0.4284000      0.8462000 
1 1 1 11 25 26 o 24.09000 0.2764000 23.95000 0.3889000 24.23000 0.3930000 -0.2816000     0.5529000 
1 1 1 11 25 28 o 22.47000 0.3642000 22.44000 0.5946000 22.51000 0.4207000 -0.6818000E-01 0.7284000 
1 1 1 11 25 30 o 4.657000 0.9055000 3.662000 1.456000  5.651000 1.077000  -1.989000      1.811000  
1 1 1 11 25 32 o 23.12000 0.3243000 22.61000 0.5035000 23.63000 0.4090000 -1.013000      0.6487000 
1 1 1 11 25 34 o 21.11000 0.3613000 21.53000 0.5307000 20.68000 0.4903000 0.8561000      0.7226000 
1 1 1 11 25 36 o 72.62000 0.5433000 73.21000 0.8567000 72.04000 0.6685000 1.168000       1.087000  
1 1 1 11 25 38 o 16.26000 0.4235000 16.65000 0.5986000 15.87000 0.5992000 0.7783000      0.8469000 
1 1 1 11 25 40 o 34.58000 0.3572000 34.41000 0.5275000 34.75000 0.4820000 -0.3396000     0.7145000 
1 1 1 11 25 42 o 4.085000 1.078000  4.116000 1.570000  4.054000 1.477000  0.6180000E-01  2.155000  
1 1 1 11 25 44 o 20.62000 0.3562000 20.00000 0.5571000 21.23000 0.4441000 -1.229000      0.7124000 
1 1 1 11 25 46 o 17.04000 0.3864000 17.05000 0.6085000 17.02000 0.4763000 0.3047000E-01  0.7727000 
1 1 1 11 25 48 o 10.26000 0.6759000 11.27000 1.046000  9.255000 0.8562000 2.012000       1.352000  
1 1 1 11 25 50 o 2.858000 0.8998000 2.857000 1.318000  2.859000 1.225000  -0.2529000E-02 1.800000  
1 1 1 11 25 52 o 6.788000 0.9055000 6.356000 1.522000  7.221000 0.9810000 -0.8653000     1.811000  
1 1 1 11 25 54 o 3.401000 0.9314000 2.545000 1.205000  4.258000 1.420000  -1.713000      1.863000  
1 1 1 11 25 56 o 14.47000 0.4702000 14.92000 0.7355000 14.03000 0.5861000 0.8940000      0.9405000 
1 1 1 11 25 58 o 3.807000 1.031000  4.283000 1.635000  3.331000 1.256000  0.9512000      2.062000  
1 1 1 11 25 60 o 3.746000 1.033000  4.740000 1.702000  2.753000 1.172000  1.987000       2.066000  
1 1 1 11 26 1  o 28.67000 0.2859000 28.62000 0.4414000 28.72000 0.3636000 -0.1007000     0.5719000 
1 1 1 11 26 3  o 49.61000 0.3671000 49.21000 0.5173000 50.01000 0.5211000 -0.7982000     0.7343000 
1 1 1 11 26 5  o 32.35000 0.3002000 32.32000 0.4706000 32.38000 0.3729000 -0.6485000E-01 0.6004000 
1 1 1 11 26 7  o 76.88000 0.5387000 76.90000 0.7652000 76.86000 0.7585000 0.3941000E-01  1.077000  
1 1 1 11 26 9  o 37.18000 0.4101000 37.55000 0.5164000 36.82000 0.6372000 0.7289000      0.8202000 
1 1 1 11 26 11 o 18.00000 0.3628000 18.30000 0.3952000 17.70000 0.6084000 0.5935000      0.7255000 
1 1 1 11 26 13 o 67.88000 0.6342000 67.03000 0.7867000 68.72000 0.9948000 -1.691000      1.268000  
1 1 1 11 26 15 o 29.00000 0.3519000 29.58000 0.5963000 28.42000 0.3737000 1.160000       0.7037000 
1 1 1 11 26 17 o 21.70000 0.3490000 21.24000 0.3757000 22.15000 0.5883000 -0.9148000     0.6980000 
1 1 1 11 26 19 o 25.87000 0.3466000 26.11000 0.5891000 25.62000 0.3653000 0.4867000      0.6932000 
1 1 1 11 26 21 o 43.18000 0.3391000 43.03000 0.4759000 43.32000 0.4831000 -0.2872000     0.6781000 
1 1 1 11 26 23 o 9.927000 0.3727000 9.756000 0.5196000 10.10000 0.5345000 -0.3437000     0.7454000 
1 1 1 11 26 25 f 28.25000 0.3200000 27.80000 0.3932000 28.70000 0.5049000 -0.9011000     0.6400000 
1 1 1 11 26 27 o 25.87000 0.2991000 25.33000 0.4361000 26.41000 0.4096000 -1.077000      0.5983000 
1 1 1 11 26 29 o 37.65000 0.3747000 37.78000 0.5298000 37.52000 0.5300000 0.2624000      0.7494000 
1 1 1 11 26 31 o 13.97000 0.3882000 14.28000 0.5954000 13.67000 0.4985000 0.6085000      0.7765000 
1 1 1 11 26 33 o 43.49000 0.4579000 43.43000 0.6959000 43.55000 0.5953000 -0.1188000     0.9158000 
1 1 1 11 26 35 o 19.10000 0.3652000 19.13000 0.5636000 19.07000 0.4647000 0.5700000E-01  0.7304000 
1 1 1 11 26 37 o 24.21000 0.3378000 23.94000 0.5220000 24.47000 0.4289000 -0.5327000     0.6755000 
1 1 1 11 26 39 o 10.61000 0.5543000 10.71000 0.8295000 10.51000 0.7356000 0.1943000      1.109000  
1 1 1 11 26 41 o 11.58000 0.6134000 11.94000 0.9988000 11.22000 0.7124000 0.7194000      1.227000  
1 1 1 11 26 43 o 5.438000 0.9591000 5.733000 1.465000  5.143000 1.238000  0.5902000      1.918000  
1 1 1 11 26 45 o 8.023000 0.8144000 7.044000 1.459000  9.001000 0.7247000 -1.957000      1.629000  
1 1 1 11 26 47 o 9.478000 0.6024000 8.527000 1.027000  10.43000 0.6303000 -1.902000      1.205000  
1 1 1 11 26 49 f 12.63000 0.4531000 12.83000 0.6938000 12.42000 0.5829000 0.4075000      0.9062000 
1 1 1 11 26 51 o 5.544000 1.186000  5.645000 1.723000  5.443000 1.631000  0.2015000      2.373000  
1 1 1 11 26 53 o 4.409000 1.049000  3.990000 1.523000  4.828000 1.444000  -0.8374000     2.099000  
1 1 1 11 26 55 o 4.321000 1.032000  5.036000 1.556000  3.605000 1.356000  1.431000       2.064000  
1 1 1 11 26 57 f 5.475000 1.076000  6.834000 1.714000  4.116000 1.299000  2.718000       2.151000  
1 1 1 11 26 59 f 7.108000 0.8743000 7.362000 1.418000  6.854000 1.024000  0.5074000      1.749000  
1 1 1 11 27 0  o 5.529000 1.461000  5.529000 1.461000  5.529000 1.461000  0.000000       0.000000  
1 1 1 11 27 2  o 37.35000 0.2988000 37.61000 0.4286000 37.09000 0.4166000 0.5122000      0.5976000 
1 1 1 11 27 4  o 14.05000 0.3105000 13.91000 0.5244000 14.19000 0.3329000 -0.2788000     0.6211000 
1 1 1 11 27 6  f 22.72000 0.2422000 23.09000 0.3698000 22.36000 0.3128000 0.7303000      0.4844000 
1 1 1 11 27 8  o 10.58000 0.3306000 10.07000 0.5295000 11.09000 0.3961000 -1.016000      0.6612000 
1 1 1 11 27 10 o 67.81000 0.4821000 67.27000 0.6796000 68.36000 0.6839000 -1.096000      0.9642000 
1 1 1 11 27 12 o 33.19000 0.3734000 33.56000 0.4191000 32.83000 0.6182000 0.7295000      0.7469000 
1 1 1 11 27 14 o 64.07000 0.5620000 63.68000 0.6533000 64.46000 0.9146000 -0.7801000     1.124000  
1 1 1 11 27 16 o 32.72000 0.2995000 32.30000 0.3898000 33.13000 0.4548000 -0.8308000     0.5990000 
1 1 1 11 27 18 o 20.22000 0.2495000 19.90000 0.3511000 20.53000 0.3546000 -0.6251000     0.4991000 
1 1 1 11 27 20 o 49.62000 0.4674000 50.39000 0.5353000 48.85000 0.7664000 1.541000       0.9348000 
1 1 1 11 27 22 o 13.20000 0.3635000 13.73000 0.5752000 12.67000 0.4447000 1.064000       0.7271000 
1 1 1 11 27 24 o 34.42000 0.3375000 34.50000 0.4245000 34.34000 0.5250000 0.1606000      0.6751000 
1 1 1 11 27 26 o 26.45000 0.3078000 26.87000 0.4604000 26.03000 0.4087000 0.8350000      0.6156000 
1 1 1 11 27 28 o 43.55000 0.4385000 43.41000 0.7177000 43.69000 0.5040000 -0.2796000     0.8770000 
1 1 1 11 27 30 o 12.33000 0.4068000 12.05000 0.5745000 12.61000 0.5761000 -0.5583000     0.8136000 
1 1 1 11 27 32 o 25.05000 0.3642000 24.64000 0.5786000 25.46000 0.4425000 -0.8179000     0.7284000 
1 1 1 11 27 34 o 33.38000 0.3350000 33.57000 0.5204000 33.19000 0.4219000 0.3768000      0.6699000 
1 1 1 11 27 36 o 18.12000 0.3741000 18.05000 0.5961000 18.20000 0.4523000 -0.1545000     0.7483000 
1 1 1 11 27 38 o 3.498000 0.9981000 4.136000 1.523000  2.860000 1.291000  1.276000       1.996000  
1 1 1 11 27 40 o 15.21000 0.4294000 15.51000 0.6216000 14.91000 0.5924000 0.5976000      0.8587000 
1 1 1 11 27 42 o 23.12000 0.3849000 23.49000 0.6402000 22.75000 0.4273000 0.7415000      0.7697000 
1 1 1 11 27 44 o 6.820000 0.8228000 5.896000 1.462000  7.745000 0.7548000 -1.849000      1.646000  
1 1 1 11 27 46 o 4.460000 0.9660000 4.279000 1.458000  4.640000 1.268000  -0.3617000     1.932000  
1 1 1 11 27 48 o 6.254000 0.8843000 5.492000 1.497000  7.017000 0.9411000 -1.525000      1.769000  
1 1 1 11 27 50 o 7.960000 0.7321000 8.136000 1.090000  7.785000 0.9772000 0.3504000      1.464000  
1 1 1 11 27 52 o 3.955000 1.029000  4.720000 1.611000  3.190000 1.282000  1.529000       2.059000  
1 1 1 11 27 54 o 5.383000 1.283000  5.779000 2.119000  4.987000 1.447000  0.7919000      2.566000  
1 1 1 11 27 56 o 4.362000 1.068000  4.287000 1.736000  4.437000 1.243000  -0.1494000     2.135000  
1 1 1 11 27 58 o 4.991000 1.009000  4.852000 1.660000  5.130000 1.147000  -0.2780000     2.018000  
1 1 1 11 28 1  o 50.54000 0.4008000 50.60000 0.5311000 50.49000 0.6003000 0.1120000      0.8015000 
1 1 1 11 28 3  o 26.11000 0.2846000 26.04000 0.3794000 26.17000 0.4244000 -0.1262000     0.5693000 
1 1 1 11 28 5  o 18.57000 0.2784000 19.03000 0.3837000 18.12000 0.4036000 0.9130000      0.5569000 
1 1 1 11 28 7  o 45.28000 0.3442000 45.51000 0.4958000 45.05000 0.4776000 0.4595000      0.6885000 
1 1 1 11 28 9  o 66.19000 0.4718000 65.85000 0.6684000 66.52000 0.6661000 -0.6611000     0.9437000 
1 1 1 11 28 11 o 58.31000 0.4540000 58.21000 0.6048000 58.41000 0.6773000 -0.2041000     0.9081000 
1 1 1 11 28 13 o 16.97000 0.2503000 16.90000 0.3314000 17.04000 0.3752000 -0.1407000     0.5006000 
1 1 1 11 28 15 f 7.108000 0.4298000 6.292000 0.6746000 7.924000 0.5329000 -1.632000      0.8597000 
1 1 1 11 28 17 o 25.87000 0.2833000 26.37000 0.3953000 25.38000 0.4058000 0.9898000      0.5665000 
1 1 1 11 28 19 o 36.95000 0.3482000 37.18000 0.4979000 36.72000 0.4870000 0.4592000      0.6965000 
1 1 1 11 28 21 o 7.602000 0.4824000 7.864000 0.6485000 7.340000 0.7144000 0.5236000      0.9649000 
1 1 1 11 28 23 o 26.13000 0.2771000 25.65000 0.3867000 26.60000 0.3970000 -0.9530000     0.5542000 
1 1 1 11 28 25 o 25.22000 0.3849000 25.50000 0.5823000 24.93000 0.5035000 0.5709000      0.7698000 
1 1 1 11 28 27 o 53.98000 0.4412000 53.61000 0.6607000 54.35000 0.5847000 -0.7414000     0.8823000 
1 1 1 11 28 29 o 19.90000 0.3280000 19.26000 0.4309000 20.54000 0.4946000 -1.278000      0.6560000 
1 1 1 11 28 31 o 20.12000 0.3566000 19.81000 0.5028000 20.43000 0.5058000 -0.6166000     0.7132000 
1 1 1 11 28 33 o 17.74000 0.3616000 17.53000 0.5709000 17.94000 0.4438000 -0.4078000     0.7231000 
1 1 1 11 28 35 o 20.66000 0.3463000 20.42000 0.5475000 20.90000 0.4243000 -0.4836000     0.6926000 
1 1 1 11 28 37 o 17.43000 0.4599000 17.35000 0.7445000 17.50000 0.5400000 -0.1458000     0.9198000 
1 1 1 11 28 39 o 18.98000 0.3791000 18.72000 0.5582000 19.23000 0.5131000 -0.5046000     0.7582000 
1 1 1 11 28 41 o 11.61000 0.5022000 12.20000 0.7316000 11.01000 0.6883000 1.187000       1.004000  
1 1 1 11 28 43 o 24.33000 0.3875000 25.00000 0.6601000 23.67000 0.4061000 1.332000       0.7750000 
1 1 1 11 28 45 o 3.477000 0.9580000 3.580000 1.428000  3.374000 1.277000  0.2054000      1.916000  
1 1 1 11 28 47 o 9.344000 0.6176000 9.889000 0.9206000 8.799000 0.8234000 1.090000       1.235000  
1 1 1 11 28 49 o 16.72000 0.3837000 16.56000 0.6035000 16.88000 0.4739000 -0.3199000     0.7673000 
1 1 1 11 28 51 o 9.742000 0.5746000 10.76000 0.8851000 8.729000 0.7329000 2.027000       1.149000  
1 1 1 11 28 53 o 5.779000 1.097000  6.679000 1.701000  4.879000 1.384000  1.800000       2.193000  
1 1 1 11 28 55 o 8.875000 0.6297000 9.242000 0.9830000 8.507000 0.7872000 0.7355000      1.259000  
1 1 1 11 28 57 o 3.998000 1.053000  3.988000 1.635000  4.008000 1.329000  -0.2070000E-01 2.107000  
1 1 1 11 28 59 o 6.684000 1.119000  6.774000 1.877000  6.594000 1.219000  0.1804000      2.238000  
1 1 1 11 29 0  o 9.141000 0.6228000 9.141000 0.6228000 9.141000 0.6228000 0.000000       0.000000  
1 1 1 11 29 2  o 17.96000 0.2526000 17.43000 0.3646000 18.49000 0.3497000 -1.064000      0.5052000 
1 1 1 11 29 4  o 45.79000 0.3465000 45.89000 0.4945000 45.68000 0.4857000 0.2058000      0.6931000 
1 1 1 11 29 6  o 40.30000 0.3167000 40.25000 0.4574000 40.36000 0.4382000 -0.1077000     0.6334000 
1 1 1 11 29 8  o 40.92000 0.3212000 40.73000 0.4609000 41.10000 0.4474000 -0.3692000     0.6423000 
1 1 1 11 29 10 f 54.20000 0.4557000 54.07000 0.6536000 54.33000 0.6352000 -0.2685000     0.9115000 
1 1 1 11 29 12 o 15.18000 0.2529000 14.68000 0.3388000 15.68000 0.3756000 -0.9991000     0.5058000 
1 1 1 11 29 14 o 49.13000 0.3983000 49.25000 0.5229000 49.02000 0.6010000 0.2240000      0.7966000 
1 1 1 11 29 16 o 15.11000 0.2525000 14.94000 0.3330000 15.28000 0.3797000 -0.3438000     0.5051000 
1 1 1 11 29 18 o 30.19000 0.3526000 30.30000 0.4844000 30.07000 0.5126000 0.2277000      0.7053000 
1 1 1 11 29 20 o 74.91000 0.5494000 74.52000 0.6684000 75.29000 0.8722000 -0.7620000     1.099000  
1 1 1 11 29 22 o 58.33000 0.4309000 58.60000 0.6100000 58.06000 0.6089000 0.5333000      0.8619000 
1 1 1 11 29 24 o 13.42000 0.4019000 13.02000 0.4701000 13.83000 0.6520000 -0.8104000     0.8037000 
1 1 1 11 29 26 o 11.12000 0.4377000 10.83000 0.6454000 11.41000 0.5915000 -0.5801000     0.8754000 
1 1 1 11 29 28 o 14.75000 0.4328000 14.84000 0.6405000 14.67000 0.5824000 0.1639000      0.8657000 
1 1 1 11 29 30 o 16.95000 0.3503000 16.82000 0.4863000 17.08000 0.5044000 -0.2564000     0.7007000 
1 1 1 11 29 32 o 38.94000 0.3658000 39.03000 0.5394000 38.86000 0.4941000 0.1773000      0.7315000 
1 1 1 11 29 34 o 25.72000 0.3247000 25.87000 0.5036000 25.56000 0.4100000 0.3101000      0.6494000 
1 1 1 11 29 36 o 4.681000 1.097000  4.204000 1.541000  5.157000 1.561000  -0.9528000     2.193000  
1 1 1 11 29 38 o 12.20000 0.4554000 12.69000 0.6979000 11.70000 0.5853000 0.9946000      0.9109000 
1 1 1 11 29 40 o 14.61000 0.4198000 14.44000 0.6412000 14.77000 0.5422000 -0.3282000     0.8397000 
1 1 1 11 29 42 o 12.17000 0.5169000 12.92000 0.8600000 11.43000 0.5737000 1.492000       1.034000  
1 1 1 11 29 44 o 3.205000 0.9495000 3.381000 1.456000  3.028000 1.218000  0.3533000      1.899000  
1 1 1 11 29 46 o 8.792000 0.5667000 8.946000 0.8806000 8.638000 0.7135000 0.3076000      1.133000  
1 1 1 11 29 48 o 8.631000 0.6505000 8.694000 1.034000  8.567000 0.7900000 0.1277000      1.301000  
1 1 1 11 29 50 o 10.34000 0.5557000 10.17000 0.9118000 10.51000 0.6356000 -0.3426000     1.111000  
1 1 1 11 29 52 o 3.454000 0.9842000 4.317000 1.596000  2.591000 1.152000  1.725000       1.968000  
1 1 1 11 29 54 o 13.96000 0.5861000 13.36000 1.038000  14.57000 0.5437000 -1.212000      1.172000  
1 1 1 11 29 56 o 7.380000 0.8583000 7.297000 1.422000  7.463000 0.9609000 -0.1661000     1.717000  
1 1 1 11 29 58 o 3.564000 1.003000  3.835000 1.575000  3.293000 1.241000  0.5422000      2.005000  
1 1 1 11 30 1  o 47.76000 0.3908000 47.82000 0.5103000 47.70000 0.5920000 0.1214000      0.7816000 
1 1 1 11 30 3  o 57.82000 0.4558000 57.67000 0.6910000 57.96000 0.5947000 -0.2934000     0.9116000 
1 1 1 11 30 5  o 55.40000 0.4348000 55.45000 0.5767000 55.35000 0.6508000 0.1017000      0.8696000 
1 1 1 11 30 7  o 17.98000 0.2830000 17.98000 0.4575000 17.98000 0.3333000 -0.4753000E-02 0.5660000 
1 1 1 11 30 9  o 8.307000 0.3767000 8.503000 0.6205000 8.111000 0.4274000 0.3919000      0.7534000 
1 1 1 11 30 11 o 62.07000 0.4864000 61.82000 0.6380000 62.32000 0.7345000 -0.4921000     0.9729000 
1 1 1 11 30 13 o 46.62000 0.3679000 46.32000 0.4491000 46.92000 0.5829000 -0.6018000     0.7358000 
1 1 1 11 30 15 o 12.77000 0.3308000 12.50000 0.5001000 13.03000 0.4330000 -0.5325000     0.6615000 
1 1 1 11 30 17 o 40.69000 0.3873000 40.78000 0.4607000 40.61000 0.6227000 0.1687000      0.7746000 
1 1 1 11 30 19 o 40.50000 0.3353000 40.59000 0.4137000 40.42000 0.5278000 0.1731000      0.6706000 
1 1 1 11 30 21 o 27.45000 0.2928000 26.69000 0.3728000 28.21000 0.4517000 -1.521000      0.5856000 
1 1 1 11 30 23 o 14.65000 0.3526000 14.62000 0.4946000 14.69000 0.5028000 -0.7138000E-01 0.7052000 
1 1 1 11 30 25 o 17.18000 0.3726000 16.83000 0.4883000 17.53000 0.5628000 -0.6949000     0.7451000 
1 1 1 11 30 27 o 28.63000 0.3010000 28.66000 0.4237000 28.60000 0.4275000 0.5605000E-01  0.6019000 
1 1 1 11 30 29 o 24.85000 0.3394000 24.77000 0.5174000 24.92000 0.4395000 -0.1474000     0.6789000 
1 1 1 11 30 31 o 30.95000 0.4173000 31.69000 0.6251000 30.22000 0.5529000 1.474000       0.8345000 
1 1 1 11 30 33 o 14.37000 0.3992000 13.83000 0.6074000 14.91000 0.5180000 -1.075000      0.7983000 
1 1 1 11 30 35 o 15.21000 0.4049000 15.92000 0.5636000 14.49000 0.5816000 1.424000       0.8099000 
1 1 1 11 30 37 o 16.70000 0.3667000 16.61000 0.5635000 16.78000 0.4693000 -0.1634000     0.7333000 
1 1 1 11 30 39 f 5.894000 0.9174000 5.268000 1.445000  6.519000 1.131000  -1.251000      1.835000  
1 1 1 11 30 41 o 14.48000 0.4090000 14.24000 0.6533000 14.71000 0.4922000 -0.4702000     0.8180000 
1 1 1 11 30 43 o 6.758000 0.8219000 8.160000 1.185000  5.356000 1.139000  2.804000       1.644000  
1 1 1 11 30 45 o 3.395000 0.9403000 3.712000 1.452000  3.078000 1.195000  0.6342000      1.881000  
1 1 1 11 30 47 o 9.190000 0.6358000 9.424000 0.9471000 8.956000 0.8484000 0.4680000      1.272000  
1 1 1 11 30 49 f 7.365000 0.7759000 6.689000 1.330000  8.041000 0.7989000 -1.351000      1.552000  
1 1 1 11 30 51 o 7.596000 0.7335000 7.479000 1.166000  7.712000 0.8907000 -0.2336000     1.467000  
1 1 1 11 30 53 o 6.689000 0.8458000 6.523000 1.413000  6.855000 0.9306000 -0.3324000     1.692000  
1 1 1 11 30 55 o 4.266000 0.9971000 3.710000 1.542000  4.821000 1.265000  -1.111000      1.994000  
1 1 1 11 30 57 o 6.644000 0.8212000 7.138000 1.269000  6.150000 1.043000  0.9878000      1.642000  
1 1 1 11 31 0  o 81.96000 0.8115000 81.96000 0.8115000 81.96000 0.8115000 0.000000       0.000000  
1 1 1 11 31 2  o 24.78000 0.3117000 24.59000 0.4453000 24.96000 0.4364000 -0.3704000     0.6235000 
1 1 1 11 31 4  o 19.33000 0.3011000 18.80000 0.3762000 19.86000 0.4703000 -1.057000      0.6023000 
1 1 1 11 31 6  o 48.74000 0.3661000 48.23000 0.5181000 49.25000 0.5176000 -1.022000      0.7323000 
1 1 1 11 31 8  o 13.50000 0.2876000 13.94000 0.4635000 13.06000 0.3407000 0.8732000      0.5752000 
1 1 1 11 31 10 o 25.67000 0.2588000 25.39000 0.3891000 25.94000 0.3413000 -0.5466000     0.5176000 
1 1 1 11 31 12 o 30.26000 0.2811000 30.11000 0.3482000 30.42000 0.4414000 -0.3105000     0.5622000 
1 1 1 11 31 14 f 48.30000 0.5408000 46.97000 0.4566000 49.64000 0.9806000 -2.673000      1.082000  
1 1 1 11 31 16 o 26.85000 0.2734000 26.79000 0.3393000 26.91000 0.4288000 -0.1149000     0.5468000 
1 1 1 11 31 18 o 19.10000 0.2643000 19.63000 0.3428000 18.56000 0.4024000 1.063000       0.5286000 
1 1 1 11 31 20 o 16.71000 0.2939000 16.49000 0.3896000 16.92000 0.4402000 -0.4274000     0.5879000 
1 1 1 11 31 22 o 13.63000 0.3365000 14.11000 0.4063000 13.16000 0.5365000 0.9510000      0.6729000 
1 1 1 11 31 24 o 35.10000 0.4205000 35.91000 0.5285000 34.29000 0.6542000 1.622000       0.8410000 
1 1 1 11 31 26 o 46.31000 0.3786000 46.41000 0.4670000 46.21000 0.5961000 0.1911000      0.7573000 
1 1 1 11 31 28 o 14.97000 0.4297000 15.15000 0.6367000 14.78000 0.5772000 0.3674000      0.8594000 
1 1 1 11 31 30 o 5.530000 0.9779000 5.139000 1.432000  5.921000 1.332000  -0.7823000     1.956000  
1 1 1 11 31 32 o 11.21000 0.6417000 10.63000 1.065000  11.80000 0.7155000 -1.171000      1.283000  
1 1 1 11 31 34 o 13.10000 0.4549000 13.23000 0.6698000 12.98000 0.6157000 0.2458000      0.9098000 
1 1 1 11 31 36 o 23.76000 0.3202000 23.70000 0.4921000 23.82000 0.4097000 -0.1212000     0.6403000 
1 1 1 11 31 38 o 10.15000 0.4999000 10.08000 0.7881000 10.22000 0.6154000 -0.1390000     0.9999000 
1 1 1 11 31 40 o 14.93000 0.3962000 14.85000 0.6106000 15.02000 0.5050000 -0.1663000     0.7924000 
1 1 1 11 31 42 o 8.896000 1.043000  8.253000 1.988000  9.538000 0.6326000 -1.285000      2.086000  
1 1 1 11 31 44 o 9.399000 0.5398000 9.337000 0.8965000 9.461000 0.6015000 -0.1242000     1.080000  
1 1 1 11 31 46 o 4.641000 1.011000  5.078000 1.488000  4.205000 1.370000  0.8732000      2.023000  
1 1 1 11 31 48 o 5.770000 0.8790000 7.197000 1.198000  4.344000 1.286000  2.853000       1.758000  
1 1 1 11 31 50 o 6.144000 0.9678000 5.613000 1.508000  6.675000 1.213000  -1.063000      1.936000  
1 1 1 11 31 52 o 11.56000 0.6409000 11.60000 1.093000  11.52000 0.6688000 0.8184000E-01  1.282000  
1 1 1 11 31 54 o 9.110000 0.6998000 7.739000 1.218000  10.48000 0.6900000 -2.741000      1.400000  
1 1 1 11 31 56 o 4.562000 1.073000  5.475000 1.751000  3.649000 1.242000  1.825000       2.147000  
1 1 1 11 32 1  o 46.35000 0.4097000 46.37000 0.5896000 46.33000 0.5689000 0.4070000E-01  0.8193000 
1 1 1 11 32 3  o 31.73000 0.3290000 32.19000 0.4601000 31.26000 0.4704000 0.9365000      0.6580000 
1 1 1 11 32 5  o 18.27000 0.2613000 18.00000 0.3871000 18.54000 0.3511000 -0.5439000     0.5226000 
1 1 1 11 32 7  o 51.26000 0.3829000 51.20000 0.5476000 51.32000 0.5352000 -0.1179000     0.7657000 
1 1 1 11 32 9  o 46.44000 0.3547000 46.35000 0.5088000 46.53000 0.4942000 -0.1768000     0.7093000 
1 1 1 11 32 11 o 17.75000 0.2582000 17.84000 0.3298000 17.66000 0.3973000 0.1794000      0.5163000 
1 1 1 11 32 13 o 48.05000 0.4411000 47.77000 0.5133000 48.34000 0.7175000 -0.5735000     0.8822000 
1 1 1 11 32 15 o 47.99000 0.3807000 47.72000 0.4641000 48.26000 0.6036000 -0.5451000     0.7614000 
1 1 1 11 32 17 o 22.95000 0.3580000 23.27000 0.3434000 22.63000 0.6282000 0.6324000      0.7159000 
1 1 1 11 32 19 o 52.01000 0.5028000 51.43000 0.6407000 52.60000 0.7751000 -1.174000      1.006000  
1 1 1 11 32 21 o 34.94000 0.3150000 34.80000 0.3876000 35.08000 0.4965000 -0.2822000     0.6299000 
1 1 1 11 32 23 o 24.62000 0.3032000 24.80000 0.3983000 24.44000 0.4574000 0.3580000      0.6065000 
1 1 1 11 32 25 o 18.51000 0.3146000 18.58000 0.4009000 18.44000 0.4849000 0.1419000      0.6292000 
1 1 1 11 32 27 o 28.34000 0.3210000 28.12000 0.4219000 28.56000 0.4840000 -0.4400000     0.6421000 
1 1 1 11 32 29 o 23.67000 0.3717000 23.88000 0.4603000 23.46000 0.5838000 0.4133000      0.7435000 
1 1 1 11 32 31 o 5.224000 0.9404000 5.545000 1.172000  4.902000 1.471000  0.6436000      1.881000  
1 1 1 11 32 33 o 23.02000 0.3576000 23.11000 0.4923000 22.92000 0.5189000 0.1868000      0.7153000 
1 1 1 11 32 35 o 9.981000 0.5203000 9.226000 0.8637000 10.74000 0.5803000 -1.511000      1.041000  
1 1 1 11 32 37 o 11.49000 0.4245000 11.42000 0.6675000 11.56000 0.5246000 -0.1477000     0.8489000 
1 1 1 11 32 39 o 9.649000 0.5687000 9.274000 0.8179000 10.02000 0.7904000 -0.7500000     1.137000  
1 1 1 11 32 41 o 6.713000 0.7278000 6.457000 1.206000  6.970000 0.8157000 -0.5138000     1.456000  
1 1 1 11 32 43 o 7.400000 0.8253000 7.138000 1.490000  7.662000 0.7099000 -0.5242000     1.651000  
1 1 1 11 32 45 o 3.283000 0.9372000 3.425000 1.393000  3.141000 1.254000  0.2836000      1.874000  
1 1 1 11 32 47 o 8.246000 0.6809000 7.694000 1.092000  8.798000 0.8141000 -1.104000      1.362000  
1 1 1 11 32 49 o 8.240000 0.7342000 8.700000 1.061000  7.779000 1.015000  0.9217000      1.468000  
1 1 1 11 32 51 o 3.514000 0.9307000 3.046000 1.357000  3.982000 1.274000  -0.9357000     1.861000  
1 1 1 11 32 53 o 7.745000 0.7254000 8.224000 1.091000  7.266000 0.9563000 0.9579000      1.451000  
1 1 1 11 32 55 o 6.265000 1.144000  6.231000 2.091000  6.300000 0.9275000 -0.6919000E-01 2.288000  
1 1 1 11 33 0  o 43.44000 0.6827000 43.44000 0.6827000 43.44000 0.6827000 0.000000       0.000000  
1 1 1 11 33 2  o 34.84000 0.3135000 34.80000 0.4704000 34.87000 0.4145000 -0.7714000E-01 0.6269000 
1 1 1 11 33 4  f 18.08000 0.2992000 18.20000 0.3966000 17.95000 0.4482000 0.2438000      0.5985000 
1 1 1 11 33 6  o 24.32000 0.2624000 24.67000 0.3864000 23.98000 0.3552000 0.6960000      0.5249000 
1 1 1 11 33 8  o 24.47000 0.2651000 24.28000 0.3952000 24.67000 0.3535000 -0.3974000     0.5302000 
1 1 1 11 33 10 o 11.10000 0.3828000 10.83000 0.5716000 11.36000 0.5093000 -0.5266000     0.7656000 
1 1 1 11 33 12 o 9.432000 0.4124000 9.403000 0.5658000 9.462000 0.6002000 -0.5974000E-01 0.8248000 
1 1 1 11 33 14 o 6.145000 0.5992000 5.685000 0.8269000 6.605000 0.8675000 -0.9204000     1.198000  
1 1 1 11 33 16 o 25.72000 0.2975000 25.59000 0.4028000 25.86000 0.4379000 -0.2651000     0.5950000 
1 1 1 11 33 18 o 17.34000 0.3870000 16.90000 0.3961000 17.78000 0.6649000 -0.8814000     0.7739000 
1 1 1 11 33 20 o 38.77000 0.3796000 38.83000 0.5491000 38.70000 0.5244000 0.1379000      0.7593000 
1 1 1 11 33 22 o 6.043000 0.7190000 6.441000 0.8489000 5.646000 1.161000  0.7954000      1.438000  
1 1 1 11 33 24 o 7.740000 0.7413000 7.596000 0.7372000 7.883000 1.286000  -0.2870000     1.483000  
1 1 1 11 33 26 o 52.21000 0.4322000 51.18000 0.5578000 53.25000 0.6604000 -2.066000      0.8644000 
1 1 1 11 33 28 f 28.07000 0.5136000 29.18000 0.4488000 26.97000 0.9241000 2.206000       1.027000  
1 1 1 11 33 30 o 6.542000 0.7616000 7.106000 0.8434000 5.979000 1.268000  1.127000       1.523000  
1 1 1 11 33 32 o 32.00000 0.3341000 32.60000 0.4370000 31.40000 0.5055000 1.199000       0.6682000 
1 1 1 11 33 34 o 5.653000 0.7889000 5.048000 1.208000  6.258000 1.015000  -1.209000      1.578000  
1 1 1 11 33 36 o 22.05000 0.3298000 22.36000 0.4323000 21.75000 0.4982000 0.6102000      0.6596000 
1 1 1 11 33 38 o 10.14000 0.5117000 10.16000 0.7856000 10.13000 0.6558000 0.2654000E-01  1.023000  
1 1 1 11 33 40 o 10.93000 0.4364000 11.51000 0.6051000 10.34000 0.6291000 1.172000       0.8729000 
1 1 1 11 33 42 o 15.17000 0.4378000 14.87000 0.7251000 15.46000 0.4909000 -0.5837000     0.8756000 
1 1 1 11 33 44 o 3.137000 0.9383000 3.559000 1.445000  2.716000 1.198000  0.8426000      1.877000  
1 1 1 11 33 46 o 3.520000 0.9483000 4.226000 1.447000  2.814000 1.226000  1.413000       1.897000  
1 1 1 11 33 48 o 4.866000 0.9752000 4.400000 1.493000  5.333000 1.255000  -0.9324000     1.950000  
1 1 1 11 33 50 o 2.837000 0.8964000 3.459000 1.462000  2.215000 1.037000  1.244000       1.793000  
1 1 1 11 33 52 o 3.878000 1.047000  4.118000 1.519000  3.639000 1.441000  0.4792000      2.094000  
1 1 1 11 33 54 o 6.396000 0.8990000 6.623000 1.409000  6.169000 1.117000  0.4542000      1.798000  
1 1 1 11 33 56 o 8.062000 1.615000  8.062000 1.615000  ?        ?         ?              ?         
1 1 1 11 34 1  o 29.67000 0.3027000 29.71000 0.3950000 29.63000 0.4588000 0.7792000E-01  0.6054000 
1 1 1 11 34 3  o 22.96000 0.2848000 23.76000 0.4105000 22.16000 0.3949000 1.595000       0.5696000 
1 1 1 11 34 5  o 23.10000 0.2982000 22.82000 0.3857000 23.38000 0.4550000 -0.5604000     0.5964000 
1 1 1 11 34 7  o 22.47000 0.2636000 22.70000 0.3897000 22.24000 0.3552000 0.4579000      0.5272000 
1 1 1 11 34 9  o 57.47000 0.4529000 56.81000 0.5963000 58.12000 0.6817000 -1.311000      0.9057000 
1 1 1 11 34 11 o 34.78000 0.3237000 35.32000 0.4313000 34.23000 0.4829000 1.089000       0.6475000 
1 1 1 11 34 13 o 32.64000 0.3134000 32.78000 0.4113000 32.50000 0.4730000 0.2862000      0.6268000 
1 1 1 11 34 15 o 25.24000 0.3105000 24.43000 0.4354000 26.05000 0.4429000 -1.621000      0.6211000 
1 1 1 11 34 17 o 12.81000 0.3485000 13.21000 0.4325000 12.41000 0.5467000 0.7994000      0.6971000 
1 1 1 11 34 19 o 43.57000 0.3742000 43.57000 0.4905000 43.57000 0.5653000 -0.7507000E-02 0.7484000 
1 1 1 11 34 21 o 10.35000 0.4855000 10.32000 0.7512000 10.38000 0.6154000 -0.6751000E-01 0.9711000 
1 1 1 11 34 23 o 12.85000 0.4680000 12.19000 0.4811000 13.50000 0.8029000 -1.312000      0.9360000 
1 1 1 11 34 25 o 13.55000 0.4576000 13.95000 0.6644000 13.14000 0.6292000 0.8103000      0.9151000 
1 1 1 11 34 27 o 9.005000 0.6217000 9.705000 0.6454000 8.305000 1.063000  1.400000       1.243000  
1 1 1 11 34 29 o 24.67000 0.3578000 24.70000 0.5197000 24.64000 0.4919000 0.5985000E-01  0.7156000 
1 1 1 11 34 31 o 15.35000 0.4018000 15.87000 0.4309000 14.82000 0.6784000 1.043000       0.8037000 
1 1 1 11 34 33 o 11.65000 0.3990000 12.07000 0.5382000 11.23000 0.5893000 0.8350000      0.7980000 
1 1 1 11 34 35 o 11.82000 0.4222000 11.61000 0.5655000 12.03000 0.6272000 -0.4204000     0.8445000 
1 1 1 11 34 37 o 14.71000 0.3620000 14.58000 0.5109000 14.85000 0.5130000 -0.2738000     0.7240000 
1 1 1 11 34 39 o 10.61000 0.4883000 10.29000 0.6618000 10.94000 0.7182000 -0.6464000     0.9767000 
1 1 1 11 34 41 o 6.880000 0.6887000 6.838000 1.113000  6.922000 0.8107000 -0.8393000E-01 1.377000  
1 1 1 11 34 43 o 3.375000 0.9526000 3.911000 1.463000  2.838000 1.220000  1.073000       1.905000  
1 1 1 11 34 45 o 5.254000 1.017000  5.170000 1.309000  5.338000 1.558000  -0.1680000     2.035000  
1 1 1 11 34 47 o 7.055000 0.7291000 7.582000 0.9289000 6.528000 1.124000  1.054000       1.458000  
1 1 1 11 34 49 o 3.972000 1.033000  4.340000 1.570000  3.604000 1.344000  0.7352000      2.067000  
1 1 1 11 34 51 o 9.378000 0.6899000 9.010000 1.163000  9.746000 0.7426000 -0.7359000     1.380000  
1 1 1 11 34 53 o 4.933000 0.9620000 5.144000 1.426000  4.723000 1.291000  0.4212000      1.924000  
1 1 1 11 34 55 o 4.916000 1.085000  4.282000 1.620000  5.550000 1.443000  -1.268000      2.170000  
1 1 1 11 35 0  o 49.27000 0.5334000 49.27000 0.5334000 49.27000 0.5334000 0.000000       0.000000  
1 1 1 11 35 2  o 31.31000 0.2841000 31.41000 0.4031000 31.20000 0.4006000 0.2103000      0.5683000 
1 1 1 11 35 4  o 18.60000 0.2747000 19.09000 0.3993000 18.11000 0.3773000 0.9779000      0.5494000 
1 1 1 11 35 6  o 42.21000 0.4317000 41.70000 0.5394000 42.73000 0.6741000 -1.034000      0.8633000 
1 1 1 11 35 8  o 6.238000 0.6122000 6.093000 0.9778000 6.384000 0.7369000 -0.2911000     1.224000  
1 1 1 11 35 10 o 40.02000 0.3835000 40.45000 0.5568000 39.58000 0.5275000 0.8677000      0.7670000 
1 1 1 11 35 12 o 82.86000 0.6747000 83.31000 0.9589000 82.40000 0.9494000 0.9054000      1.349000  
1 1 1 11 35 14 o 33.95000 0.3448000 34.25000 0.4897000 33.66000 0.4856000 0.5922000      0.6897000 
1 1 1 11 35 16 o 21.10000 0.2999000 21.01000 0.4081000 21.19000 0.4396000 -0.1806000     0.5999000 
1 1 1 11 35 18 o 37.13000 0.3400000 37.66000 0.4526000 36.61000 0.5073000 1.052000       0.6799000 
1 1 1 11 35 20 o 41.95000 0.3510000 42.65000 0.4378000 41.25000 0.5487000 1.399000       0.7019000 
1 1 1 11 35 22 o 27.74000 0.3149000 28.57000 0.4393000 26.90000 0.4512000 1.674000       0.6298000 
1 1 1 11 35 24 o 21.84000 0.3766000 22.29000 0.3795000 21.39000 0.6505000 0.9016000      0.7532000 
1 1 1 11 35 26 o 19.56000 0.3615000 19.72000 0.3945000 19.41000 0.6058000 0.3171000      0.7229000 
1 1 1 11 35 28 o 16.12000 0.4035000 16.69000 0.5936000 15.56000 0.5469000 1.131000       0.8071000 
1 1 1 11 35 30 f 26.31000 0.3423000 26.66000 0.3731000 25.96000 0.5739000 0.6947000      0.6845000 
1 1 1 11 35 32 o 4.887000 0.8301000 5.375000 1.075000  4.398000 1.265000  0.9775000      1.660000  
1 1 1 11 35 34 o 7.835000 0.5786000 7.677000 0.7511000 7.992000 0.8805000 -0.3153000     1.157000  
1 1 1 11 35 36 o 11.70000 0.4130000 12.37000 0.5539000 11.02000 0.6128000 1.348000       0.8260000 
1 1 1 11 35 38 o 14.32000 0.3670000 13.93000 0.5325000 14.71000 0.5052000 -0.7748000     0.7340000 
1 1 1 11 35 40 o 9.824000 0.5409000 9.351000 0.7572000 10.30000 0.7726000 -0.9441000     1.082000  
1 1 1 11 35 42 o 4.671000 0.8712000 5.809000 1.166000  3.533000 1.294000  2.276000       1.742000  
1 1 1 11 35 44 o 4.060000 1.052000  4.003000 1.398000  4.116000 1.572000  -0.1136000     2.104000  
1 1 1 11 35 46 o 4.715000 0.8957000 5.668000 1.241000  3.763000 1.292000  1.905000       1.791000  
1 1 1 11 35 48 o 8.044000 0.6823000 7.814000 1.033000  8.275000 0.8916000 -0.4613000     1.365000  
1 1 1 11 35 50 o 6.407000 0.8743000 5.661000 1.480000  7.154000 0.9307000 -1.493000      1.749000  
1 1 1 11 35 52 o 3.926000 1.012000  4.289000 1.458000  3.564000 1.405000  0.7250000      2.025000  
1 1 1 11 35 54 o 3.467000 0.9686000 3.780000 1.467000  3.154000 1.266000  0.6258000      1.937000  
1 1 1 11 36 1  o 29.24000 0.2983000 29.20000 0.3997000 29.29000 0.4430000 -0.9141000E-01 0.5967000 
1 1 1 11 36 3  o 28.84000 0.2953000 28.97000 0.4004000 28.72000 0.4342000 0.2509000      0.5906000 
1 1 1 11 36 5  o 12.31000 0.3410000 12.95000 0.4953000 11.67000 0.4689000 1.280000       0.6821000 
1 1 1 11 36 7  o 23.43000 0.3082000 23.88000 0.4031000 22.99000 0.4663000 0.8883000      0.6164000 
1 1 1 11 36 9  o 32.92000 0.3340000 32.82000 0.4864000 33.01000 0.4580000 -0.1919000     0.6681000 
1 1 1 11 36 11 o 32.70000 0.3263000 32.66000 0.4359000 32.74000 0.4857000 -0.8218000E-01 0.6526000 
1 1 1 11 36 13 f 19.46000 0.3134000 19.40000 0.4401000 19.52000 0.4464000 -0.1283000     0.6269000 
1 1 1 11 36 15 o 30.43000 0.3189000 30.70000 0.4258000 30.16000 0.4748000 0.5437000      0.6378000 
1 1 1 11 36 17 o 36.89000 0.3695000 37.02000 0.5281000 36.76000 0.5170000 0.2580000      0.7391000 
1 1 1 11 36 19 o 11.39000 0.4007000 10.79000 0.5363000 11.99000 0.5955000 -1.196000      0.8014000 
1 1 1 11 36 21 o 25.86000 0.3864000 26.24000 0.4345000 25.49000 0.6391000 0.7536000      0.7729000 
1 1 1 11 36 23 o 31.08000 0.4909000 31.18000 0.3860000 30.98000 0.9028000 0.2073000      0.9818000 
1 1 1 11 36 25 o 13.68000 0.4025000 13.67000 0.4709000 13.68000 0.6529000 -0.6888000E-02 0.8050000 
1 1 1 11 36 27 o 9.447000 0.4899000 9.275000 0.5940000 9.619000 0.7792000 -0.3433000     0.9798000 
1 1 1 11 36 29 o 6.296000 0.8185000 7.067000 0.8020000 5.525000 1.427000  1.542000       1.637000  
1 1 1 11 36 31 o 22.69000 0.2981000 22.94000 0.3638000 22.44000 0.4723000 0.4951000      0.5962000 
1 1 1 11 36 33 o 6.848000 0.6016000 6.386000 0.8707000 7.310000 0.8303000 -0.9234000     1.203000  
1 1 1 11 36 35 o 27.04000 0.3003000 26.45000 0.4147000 27.63000 0.4344000 -1.181000      0.6006000 
1 1 1 11 36 37 o 11.25000 0.4502000 11.45000 0.6498000 11.04000 0.6233000 0.4012000      0.9004000 
1 1 1 11 36 39 o 14.76000 0.4050000 14.52000 0.6346000 15.00000 0.5034000 -0.4835000     0.8101000 
1 1 1 11 36 41 o 9.233000 0.5182000 8.919000 0.7635000 9.547000 0.7007000 -0.6282000     1.036000  
1 1 1 11 36 43 o 10.45000 0.5475000 10.97000 0.7715000 9.926000 0.7772000 1.046000       1.095000  
1 1 1 11 36 45 o 12.29000 0.4391000 12.17000 0.6453000 12.41000 0.5958000 -0.2415000     0.8783000 
1 1 1 11 36 47 o 8.529000 0.6117000 7.569000 0.9536000 9.489000 0.7665000 -1.920000      1.223000  
1 1 1 11 36 49 o 3.120000 0.8875000 2.602000 1.164000  3.638000 1.340000  -1.036000      1.775000  
1 1 1 11 36 51 o 3.111000 0.8951000 2.686000 1.207000  3.537000 1.322000  -0.8513000     1.790000  
1 1 1 11 36 53 o 3.234000 0.9485000 3.177000 1.318000  3.291000 1.364000  -0.1132000     1.897000  
1 1 1 11 37 0  o 16.95000 0.4520000 16.95000 0.4520000 16.95000 0.4520000 0.000000       0.000000  
1 1 1 11 37 2  o 36.39000 0.4034000 37.25000 0.6387000 35.54000 0.4929000 1.710000       0.8067000 
1 1 1 11 37 4  o 19.42000 0.2963000 20.20000 0.4485000 18.64000 0.3874000 1.561000       0.5927000 
1 1 1 11 37 6  o 24.73000 0.2983000 24.58000 0.4530000 24.89000 0.3881000 -0.3047000     0.5965000 
1 1 1 11 37 8  o 13.65000 0.4031000 14.65000 0.5553000 12.66000 0.5846000 1.981000       0.8063000 
1 1 1 11 37 10 o 22.40000 0.4182000 22.31000 0.5089000 22.48000 0.6638000 -0.1681000     0.8364000 
1 1 1 11 37 12 o 37.92000 0.4019000 37.95000 0.5087000 37.89000 0.6223000 0.5882000E-01  0.8038000 
1 1 1 11 37 14 o 42.43000 0.3737000 42.61000 0.4950000 42.25000 0.5599000 0.3630000      0.7474000 
1 1 1 11 37 16 o 26.04000 0.3005000 25.55000 0.3839000 26.52000 0.4625000 -0.9764000     0.6011000 
1 1 1 11 37 18 o 19.54000 0.3254000 20.38000 0.4438000 18.70000 0.4762000 1.687000       0.6509000 
1 1 1 11 37 20 o 12.54000 0.3915000 12.56000 0.4835000 12.53000 0.6158000 0.3160000E-01  0.7829000 
1 1 1 11 37 22 o 4.463000 1.146000  3.779000 1.228000  5.147000 1.936000  -1.367000      2.293000  
1 1 1 11 37 24 o 21.16000 0.5042000 21.05000 0.4163000 21.27000 0.9184000 -0.2141000     1.008000  
1 1 1 11 37 26 f 8.537000 0.5322000 8.335000 0.6663000 8.740000 0.8300000 -0.4051000     1.064000  
1 1 1 11 37 28 o 4.278000 0.9875000 4.518000 1.293000  4.037000 1.493000  0.4806000      1.975000  
1 1 1 11 37 30 o 7.672000 0.5551000 7.386000 0.7217000 7.957000 0.8437000 -0.5712000     1.110000  
1 1 1 11 37 32 o 6.644000 0.6054000 6.605000 0.8036000 6.682000 0.9056000 -0.7704000E-01 1.211000  
1 1 1 11 37 34 o 9.251000 0.4732000 9.894000 0.5998000 8.608000 0.7320000 1.286000       0.9464000 
1 1 1 11 37 36 o 12.29000 0.4058000 12.66000 0.5812000 11.92000 0.5665000 0.7439000      0.8116000 
1 1 1 11 37 38 o 12.37000 0.3961000 12.20000 0.5533000 12.55000 0.5670000 -0.3491000     0.7922000 
1 1 1 11 37 40 o 6.937000 0.7726000 6.874000 1.126000  7.000000 1.059000  -0.1252000     1.545000  
1 1 1 11 37 42 o 6.592000 0.7660000 6.240000 1.114000  6.945000 1.052000  -0.7053000     1.532000  
1 1 1 11 37 44 o 2.704000 0.8401000 2.906000 1.252000  2.502000 1.120000  0.4040000      1.680000  
1 1 1 11 37 46 o 3.243000 0.9145000 3.441000 1.342000  3.045000 1.242000  0.3966000      1.829000  
1 1 1 11 37 48 o 3.589000 0.9238000 4.542000 1.436000  2.635000 1.162000  1.907000       1.848000  
1 1 1 11 37 50 o 5.233000 0.9051000 5.140000 1.351000  5.326000 1.205000  -0.1861000     1.810000  
1 1 1 11 37 52 o 8.373000 0.6233000 9.123000 0.8299000 7.623000 0.9302000 1.500000       1.247000  
1 1 1 11 38 1  o 25.59000 0.2885000 25.35000 0.4094000 25.83000 0.4066000 -0.4805000     0.5770000 
1 1 1 11 38 3  o 40.68000 0.3330000 40.52000 0.4718000 40.83000 0.4700000 -0.3094000     0.6659000 
1 1 1 11 38 5  o 19.96000 0.3083000 19.72000 0.4771000 20.21000 0.3907000 -0.4904000     0.6167000 
1 1 1 11 38 7  o 43.46000 0.4227000 44.34000 0.6949000 42.58000 0.4814000 1.762000       0.8454000 
1 1 1 11 38 9  o 22.42000 0.3732000 21.73000 0.5701000 23.11000 0.4818000 -1.386000      0.7464000 
1 1 1 11 38 11 o 20.86000 0.3873000 20.16000 0.3752000 21.56000 0.6777000 -1.398000      0.7747000 
1 1 1 11 38 13 o 15.92000 0.3427000 16.04000 0.4800000 15.80000 0.4892000 0.2405000      0.6854000 
1 1 1 11 38 15 o 34.51000 0.3746000 34.47000 0.4433000 34.55000 0.6040000 -0.8899000E-01 0.7492000 
1 1 1 11 38 17 o 29.29000 0.3931000 29.21000 0.3850000 29.38000 0.6855000 -0.1655000     0.7862000 
1 1 1 11 38 19 o 4.625000 0.8810000 4.910000 1.134000  4.341000 1.349000  0.5691000      1.762000  
1 1 1 11 38 21 o 14.38000 0.5697000 14.02000 0.4534000 14.74000 1.045000  -0.7235000     1.139000  
1 1 1 11 38 23 f 26.36000 0.4282000 27.11000 0.5037000 25.60000 0.6926000 1.502000       0.8564000 
1 1 1 11 38 25 o 8.301000 0.5467000 7.701000 0.7286000 8.900000 0.8153000 -1.199000      1.093000  
1 1 1 11 38 27 o 16.96000 0.3106000 17.24000 0.3919000 16.67000 0.4818000 0.5745000      0.6211000 
1 1 1 11 38 29 o 18.28000 0.3089000 18.41000 0.3856000 18.15000 0.4828000 0.2545000      0.6179000 
1 1 1 11 38 31 o 9.300000 0.4584000 9.299000 0.5654000 9.302000 0.7216000 -0.3029000E-02 0.9167000 
1 1 1 11 38 33 o 12.40000 0.3675000 12.53000 0.5014000 12.27000 0.5375000 0.2647000      0.7350000 
1 1 1 11 38 35 o 13.17000 0.3644000 13.33000 0.5000000 13.02000 0.5303000 0.3115000      0.7288000 
1 1 1 11 38 37 o 13.29000 0.3731000 13.47000 0.5265000 13.11000 0.5289000 0.3556000      0.7463000 
1 1 1 11 38 39 o 15.55000 0.3764000 15.41000 0.5623000 15.68000 0.5005000 -0.2745000     0.7527000 
1 1 1 11 38 41 o 9.791000 0.5384000 9.754000 0.7311000 9.827000 0.7906000 -0.7284000E-01 1.077000  
1 1 1 11 38 43 o 9.518000 0.6260000 8.570000 0.9752000 10.47000 0.7853000 -1.896000      1.252000  
1 1 1 11 38 45 f 5.318000 0.8370000 4.079000 1.293000  6.557000 1.063000  -2.478000      1.674000  
1 1 1 11 38 47 f 14.68000 0.4146000 14.51000 0.6100000 14.86000 0.5616000 -0.3494000     0.8292000 
1 1 1 11 38 49 o 6.498000 0.8777000 6.320000 1.443000  6.675000 0.9996000 -0.3546000     1.755000  
1 1 1 11 38 51 o 5.780000 0.9248000 5.314000 1.426000  6.246000 1.178000  -0.9314000     1.850000  
1 1 1 11 39 0  o 25.49000 0.4078000 25.49000 0.4078000 25.49000 0.4078000 0.000000       0.000000  
1 1 1 11 39 2  o 23.22000 0.2862000 22.85000 0.4065000 23.59000 0.4031000 -0.7478000     0.5725000 
1 1 1 11 39 4  o 9.855000 0.4373000 9.563000 0.6739000 10.15000 0.5575000 -0.5848000     0.8746000 
1 1 1 11 39 6  o 33.65000 0.3500000 34.56000 0.4977000 32.74000 0.4923000 1.818000       0.7000000 
1 1 1 11 39 8  f 49.41000 0.4180000 49.20000 0.6375000 49.62000 0.5408000 -0.4183000     0.8360000 
1 1 1 11 39 10 o 16.70000 0.3322000 17.36000 0.4563000 16.04000 0.4830000 1.327000       0.6645000 
1 1 1 11 39 12 o 15.67000 0.4833000 16.23000 0.4892000 15.10000 0.8336000 1.128000       0.9665000 
1 1 1 11 39 14 o 13.82000 0.5041000 13.31000 0.5753000 14.34000 0.8281000 -1.022000      1.008000  
1 1 1 11 39 16 o 22.76000 0.5364000 23.79000 0.3985000 21.73000 0.9961000 2.060000       1.073000  
1 1 1 11 39 18 o 28.98000 0.5112000 28.98000 0.5112000 ?        ?         ?              ?         
1 1 1 11 39 20 o 26.13000 0.5049000 26.53000 0.3799000 25.74000 0.9357000 0.7853000      1.010000  
1 1 1 11 39 22 o 13.54000 0.5250000 14.33000 0.5063000 12.75000 0.9198000 1.581000       1.050000  
1 1 1 11 39 24 o 27.78000 0.3116000 27.36000 0.3860000 28.20000 0.4891000 -0.8420000     0.6231000 
1 1 1 11 39 26 o 12.11000 0.4054000 11.92000 0.5353000 12.30000 0.6089000 -0.3867000     0.8107000 
1 1 1 11 39 28 o 5.662000 0.7743000 7.024000 0.9020000 4.301000 1.259000  2.723000       1.549000  
1 1 1 11 39 30 o 5.853000 0.7029000 6.000000 0.8587000 5.705000 1.113000  0.2944000      1.406000  
1 1 1 11 39 32 o 6.719000 0.6305000 6.270000 0.9867000 7.168000 0.7853000 -0.8977000     1.261000  
1 1 1 11 39 34 o 11.48000 0.3879000 11.66000 0.5306000 11.30000 0.5661000 0.3622000      0.7759000 
1 1 1 11 39 36 o 2.582000 0.8012000 2.555000 1.131000  2.609000 1.135000  -0.5394000E-01 1.602000  
1 1 1 11 39 38 o 6.026000 0.7856000 6.586000 1.117000  5.467000 1.105000  1.120000       1.571000  
1 1 1 11 39 40 o 10.68000 0.5868000 11.00000 0.6442000 10.37000 0.9809000 0.6280000      1.174000  
1 1 1 11 39 42 o 2.627000 0.8417000 2.422000 1.114000  2.832000 1.262000  -0.4101000     1.683000  
1 1 1 11 39 44 o 3.914000 0.8789000 2.907000 1.217000  4.922000 1.268000  -2.015000      1.758000  
1 1 1 11 39 46 o 6.134000 0.8703000 7.727000 1.046000  4.541000 1.391000  3.186000       1.741000  
1 1 1 11 39 48 o 3.726000 1.001000  4.276000 1.538000  3.176000 1.281000  1.100000       2.001000  
1 1 1 11 39 50 o 5.462000 0.9135000 4.877000 1.484000  6.047000 1.066000  -1.170000      1.827000  
1 1 1 11 40 1  o 38.09000 0.3667000 38.37000 0.5193000 37.82000 0.5180000 0.5451000      0.7334000 
1 1 1 11 40 3  o 15.56000 0.3476000 14.78000 0.5183000 16.33000 0.4635000 -1.553000      0.6953000 
1 1 1 11 40 5  o 6.676000 0.6309000 6.883000 0.8776000 6.470000 0.9066000 0.4131000      1.262000  
1 1 1 11 40 7  o 25.30000 0.3476000 25.76000 0.5061000 24.84000 0.4765000 0.9194000      0.6951000 
1 1 1 11 40 9  o 19.21000 0.3045000 19.35000 0.4502000 19.08000 0.4102000 0.2666000      0.6091000 
1 1 1 11 40 11 o 9.346000 0.7465000 10.06000 0.7668000 8.634000 1.281000  1.424000       1.493000  
1 1 1 11 40 13 o 15.10000 0.4682000 16.09000 0.4397000 14.11000 0.8268000 1.983000       0.9365000 
1 1 1 11 40 15 o 29.06000 0.5033000 29.05000 0.3861000 29.07000 0.9297000 -0.1823000E-01 1.007000  
1 1 1 11 40 17 o 23.83000 0.5377000 23.05000 0.3980000 24.62000 0.9989000 -1.570000      1.075000  
1 1 1 11 40 19 o 8.252000 1.136000  9.211000 0.6378000 7.292000 2.182000  1.919000       2.273000  
1 1 1 11 40 21 o 13.49000 0.4854000 13.61000 0.5105000 13.36000 0.8257000 0.2526000      0.9708000 
1 1 1 11 40 23 o 7.388000 0.6320000 7.151000 0.7650000 7.626000 1.006000  -0.4745000     1.264000  
1 1 1 11 40 25 o 18.26000 0.3315000 17.92000 0.4581000 18.60000 0.4793000 -0.6735000     0.6630000 
1 1 1 11 40 27 o 3.745000 0.9197000 3.465000 1.245000  4.025000 1.354000  -0.5593000     1.839000  
1 1 1 11 40 29 o 6.970000 0.5653000 7.379000 0.6818000 6.561000 0.9020000 0.8178000      1.131000  
1 1 1 11 40 31 o 10.64000 0.4228000 11.51000 0.4693000 9.779000 0.7033000 1.730000       0.8455000 
1 1 1 11 40 33 o 6.886000 0.6190000 7.081000 0.8886000 6.692000 0.8619000 0.3891000      1.238000  
1 1 1 11 40 35 o 14.11000 0.3684000 14.06000 0.5250000 14.15000 0.5169000 -0.8751000E-01 0.7368000 
1 1 1 11 40 37 o 4.399000 0.9487000 5.544000 1.427000  3.255000 1.251000  2.289000       1.897000  
1 1 1 11 40 39 o 6.432000 0.7576000 6.283000 0.9486000 6.581000 1.182000  -0.2976000     1.515000  
1 1 1 11 40 41 o 4.699000 0.9591000 3.827000 1.322000  5.570000 1.390000  -1.743000      1.918000  
1 1 1 11 40 43 o 7.880000 0.6602000 7.626000 1.030000  8.133000 0.8257000 -0.5072000     1.320000  
1 1 1 11 40 45 o 8.848000 0.7067000 7.464000 1.190000  10.23000 0.7629000 -2.768000      1.413000  
1 1 1 11 40 47 o 5.418000 0.9037000 5.140000 1.380000  5.695000 1.168000  -0.5546000     1.807000  
1 1 1 11 40 49 o 5.312000 0.9011000 5.566000 1.300000  5.059000 1.248000  0.5065000      1.802000  
1 1 1 11 41 0  o 10.02000 0.6957000 10.02000 0.6957000 10.02000 0.6957000 0.000000       0.000000  
1 1 1 11 41 2  o 11.79000 0.4169000 12.53000 0.5391000 11.05000 0.6362000 1.479000       0.8339000 
1 1 1 11 41 4  o 17.31000 0.3355000 17.85000 0.4507000 16.77000 0.4971000 1.084000       0.6710000 
1 1 1 11 41 6  o 23.59000 0.3366000 24.02000 0.5060000 23.16000 0.4441000 0.8568000      0.6733000 
1 1 1 11 41 8  o 30.79000 0.5018000 30.85000 0.4435000 30.73000 0.9003000 0.1271000      1.004000  
1 1 1 11 41 10 o 17.34000 0.3568000 17.74000 0.4673000 16.95000 0.5394000 0.7830000      0.7137000 
1 1 1 11 41 12 o 10.50000 0.4537000 9.876000 0.6078000 11.13000 0.6737000 -1.257000      0.9074000 
1 1 1 11 41 14 o 4.429000 0.9266000 3.604000 1.264000  5.254000 1.356000  -1.651000      1.853000  
1 1 1 11 41 16 o 11.70000 0.5451000 11.70000 0.5146000 11.71000 0.9612000 -0.1613000E-01 1.090000  
1 1 1 11 41 18 o 16.36000 0.4519000 16.45000 0.4310000 16.28000 0.7944000 0.1767000      0.9037000 
1 1 1 11 41 20 o 4.175000 0.8447000 5.190000 1.088000  3.160000 1.292000  2.030000       1.689000  
1 1 1 11 41 22 o 20.37000 0.3263000 20.63000 0.3778000 20.10000 0.5323000 0.5301000      0.6527000 
1 1 1 11 41 24 o 13.79000 0.4072000 13.62000 0.5307000 13.96000 0.6176000 -0.3429000     0.8143000 
1 1 1 11 41 26 o 10.58000 0.4328000 10.41000 0.5917000 10.76000 0.6318000 -0.3474000     0.8656000 
1 1 1 11 41 28 o 9.962000 0.4899000 9.592000 0.6988000 10.33000 0.6866000 -0.7386000     0.9797000 
1 1 1 11 41 30 f 11.54000 0.3884000 11.31000 0.4858000 11.76000 0.6062000 -0.4535000     0.7768000 
1 1 1 11 41 32 o 21.61000 0.2871000 21.62000 0.3944000 21.61000 0.4174000 0.8932000E-02  0.5743000 
1 1 1 11 41 34 o 16.94000 0.3657000 16.50000 0.5587000 17.38000 0.4721000 -0.8811000     0.7315000 
1 1 1 11 41 36 o 6.273000 0.7753000 5.764000 1.244000  6.782000 0.9261000 -1.018000      1.551000  
1 1 1 11 41 38 o 7.162000 0.6684000 8.116000 0.7443000 6.209000 1.110000  1.907000       1.337000  
1 1 1 11 41 40 o 8.572000 0.6907000 8.250000 0.7605000 8.894000 1.153000  -0.6436000     1.381000  
1 1 1 11 41 42 o 13.51000 0.3962000 12.85000 0.5683000 14.18000 0.5523000 -1.333000      0.7924000 
1 1 1 11 41 44 o 6.819000 0.8027000 7.042000 1.139000  6.597000 1.132000  0.4452000      1.605000  
1 1 1 11 41 46 o 5.459000 0.8820000 4.947000 1.395000  5.971000 1.079000  -1.024000      1.764000  
1 1 1 11 41 48 o 4.527000 0.9649000 4.765000 1.422000  4.289000 1.304000  0.4764000      1.930000  
1 1 1 11 42 1  o 4.855000 0.8544000 5.140000 1.150000  4.570000 1.264000  0.5706000      1.709000  
1 1 1 11 42 3  o 17.32000 0.3240000 17.81000 0.4575000 16.83000 0.4588000 0.9851000      0.6479000 
1 1 1 11 42 5  o 34.68000 0.3692000 35.38000 0.5337000 33.99000 0.5103000 1.396000       0.7384000 
1 1 1 11 42 7  o 21.94000 0.3166000 22.18000 0.4408000 21.71000 0.4545000 0.4683000      0.6331000 
1 1 1 11 42 9  o 15.83000 0.3825000 16.38000 0.5570000 15.28000 0.5243000 1.100000       0.7649000 
1 1 1 11 42 11 o 6.408000 0.6551000 6.134000 0.9505000 6.683000 0.9016000 -0.5497000     1.310000  
1 1 1 11 42 13 o 17.83000 0.3113000 17.35000 0.4020000 18.30000 0.4754000 -0.9497000     0.6226000 
1 1 1 11 42 15 o 9.495000 0.4650000 8.454000 0.6644000 10.54000 0.6508000 -2.082000      0.9300000 
1 1 1 11 42 17 o 14.54000 0.3498000 15.10000 0.4360000 13.99000 0.5471000 1.112000       0.6996000 
1 1 1 11 42 19 o 2.540000 0.7975000 2.142000 0.9931000 2.937000 1.248000  -0.7945000     1.595000  
1 1 1 11 42 21 f 11.50000 0.4188000 10.72000 0.5054000 12.28000 0.6679000 -1.552000      0.8376000 
1 1 1 11 42 23 o 12.20000 0.3694000 11.96000 0.4668000 12.44000 0.5727000 -0.4804000     0.7389000 
1 1 1 11 42 25 o 3.912000 0.9454000 3.598000 1.236000  4.227000 1.431000  -0.6289000     1.891000  
1 1 1 11 42 27 o 13.34000 0.4064000 13.75000 0.5805000 12.93000 0.5688000 0.8176000      0.8127000 
1 1 1 11 42 29 o 13.72000 0.4592000 12.99000 0.4541000 14.46000 0.7984000 -1.470000      0.9185000 
1 1 1 11 42 31 o 4.291000 0.8141000 4.784000 0.9567000 3.798000 1.317000  0.9861000      1.628000  
1 1 1 11 42 33 o 2.698000 0.8092000 3.104000 1.229000  2.293000 1.053000  0.8118000      1.618000  
1 1 1 11 42 35 o 4.561000 0.9251000 4.849000 1.276000  4.274000 1.340000  0.5747000      1.850000  
1 1 1 11 42 37 o 10.29000 0.5072000 10.26000 0.7052000 10.31000 0.7291000 -0.4756000E-01 1.014000  
1 1 1 11 42 39 o 3.954000 0.9441000 3.394000 1.232000  4.514000 1.431000  -1.119000      1.888000  
1 1 1 11 42 41 o 8.833000 0.5533000 8.717000 0.7968000 8.949000 0.7679000 -0.2320000     1.107000  
1 1 1 11 42 43 o 7.686000 0.6169000 7.023000 0.8766000 8.350000 0.8681000 -1.326000      1.234000  
1 1 1 11 42 45 o 4.380000 0.9219000 3.766000 1.306000  4.994000 1.302000  -1.227000      1.844000  
1 1 1 11 42 47 o 6.174000 0.8391000 5.460000 1.350000  6.888000 0.9972000 -1.428000      1.678000  
1 1 1 11 43 0  f 3.223000 1.235000  3.223000 1.235000  3.223000 1.235000  0.000000       0.000000  
1 1 1 11 43 2  o 14.58000 0.3702000 15.70000 0.4661000 13.46000 0.5752000 2.240000       0.7404000 
1 1 1 11 43 4  o 3.519000 0.9112000 3.419000 1.288000  3.619000 1.290000  -0.2002000     1.822000  
1 1 1 11 43 6  o 34.38000 0.3143000 34.76000 0.4473000 34.00000 0.4416000 0.7552000      0.6286000 
1 1 1 11 43 8  o 9.668000 0.4621000 9.450000 0.7089000 9.885000 0.5930000 -0.4342000     0.9243000 
1 1 1 11 43 10 o 9.654000 0.4735000 9.282000 0.6884000 10.03000 0.6503000 -0.7439000     0.9470000 
1 1 1 11 43 12 o 24.28000 0.2975000 23.97000 0.3774000 24.60000 0.4600000 -0.6321000     0.5950000 
1 1 1 11 43 14 o 31.69000 0.3810000 32.05000 0.3887000 31.32000 0.6555000 0.7218000      0.7621000 
1 1 1 11 43 16 o 3.863000 0.8569000 4.135000 1.133000  3.591000 1.286000  0.5432000      1.714000  
1 1 1 11 43 18 o 8.118000 0.5222000 7.448000 0.7146000 8.787000 0.7617000 -1.339000      1.044000  
1 1 1 11 43 20 o 13.58000 0.4228000 13.93000 0.5632000 13.23000 0.6309000 0.7082000      0.8457000 
1 1 1 11 43 22 o 4.101000 0.8370000 4.182000 1.084000  4.021000 1.276000  0.1611000      1.674000  
1 1 1 11 43 24 o 10.84000 0.4063000 10.77000 0.5415000 10.92000 0.6058000 -0.1517000     0.8126000 
1 1 1 11 43 26 o 14.35000 0.3731000 14.46000 0.5096000 14.24000 0.5449000 0.2289000      0.7461000 
1 1 1 11 43 28 o 4.563000 0.8094000 5.201000 1.057000  3.925000 1.226000  1.276000       1.619000  
1 1 1 11 43 30 o 4.719000 0.8038000 4.289000 1.074000  5.148000 1.197000  -0.8585000     1.608000  
1 1 1 11 43 32 o 16.63000 0.3140000 16.42000 0.4307000 16.84000 0.4570000 -0.4113000     0.6280000 
1 1 1 11 43 34 o 25.28000 0.3272000 24.93000 0.4792000 25.63000 0.4456000 -0.6990000     0.6544000 
1 1 1 11 43 36 o 12.47000 0.4506000 12.08000 0.6369000 12.87000 0.6376000 -0.7969000     0.9012000 
1 1 1 11 43 38 f 2.599000 0.7877000 3.046000 1.214000  2.152000 1.004000  0.8942000      1.575000  
1 1 1 11 43 40 f 6.287000 0.8152000 6.110000 1.046000  6.463000 1.251000  -0.3535000     1.630000  
1 1 1 11 43 42 o 5.425000 0.8292000 6.020000 1.093000  4.829000 1.247000  1.192000       1.658000  
1 1 1 11 43 44 o 3.949000 1.066000  3.790000 1.602000  4.107000 1.406000  -0.3171000     2.132000  
1 1 1 11 43 46 o 3.326000 0.9281000 2.691000 1.226000  3.960000 1.393000  -1.269000      1.856000  
1 1 1 11 44 1  o 11.61000 0.5598000 11.22000 0.9695000 12.00000 0.5600000 -0.7838000     1.120000  
1 1 1 11 44 3  o 7.433000 0.6106000 7.456000 0.8566000 7.409000 0.8705000 0.4655000E-01  1.221000  
1 1 1 11 44 5  o 7.973000 0.5369000 7.094000 0.8445000 8.851000 0.6631000 -1.757000      1.074000  
1 1 1 11 44 7  o 7.753000 0.5402000 7.361000 0.8451000 8.145000 0.6732000 -0.7838000     1.080000  
1 1 1 11 44 9  o 10.31000 0.4035000 10.34000 0.6130000 10.28000 0.5248000 0.6144000E-01  0.8070000 
1 1 1 11 44 11 o 13.96000 0.3540000 13.66000 0.5013000 14.26000 0.4999000 -0.6062000     0.7080000 
1 1 1 11 44 13 o 6.905000 0.5148000 6.527000 0.7171000 7.283000 0.7388000 -0.7564000     1.030000  
1 1 1 11 44 15 o 13.82000 0.3285000 13.87000 0.4336000 13.78000 0.4936000 0.8360000E-01  0.6570000 
1 1 1 11 44 17 o 9.010000 0.4934000 9.283000 0.5556000 8.736000 0.8155000 0.5476000      0.9868000 
1 1 1 11 44 19 o 4.199000 0.8909000 4.075000 1.243000  4.324000 1.277000  -0.2494000     1.782000  
1 1 1 11 44 21 f 5.674000 0.7073000 5.463000 0.9495000 5.886000 1.049000  -0.4224000     1.415000  
1 1 1 11 44 23 o 14.92000 0.3646000 14.99000 0.5288000 14.86000 0.5021000 0.1344000      0.7293000 
1 1 1 11 44 25 o 6.713000 0.6466000 7.109000 0.8664000 6.318000 0.9601000 0.7915000      1.293000  
1 1 1 11 44 27 o 4.004000 0.8373000 4.509000 1.060000  3.498000 1.296000  1.011000       1.675000  
1 1 1 11 44 29 o 8.418000 0.5472000 7.940000 0.7641000 8.896000 0.7835000 -0.9562000     1.094000  
1 1 1 11 44 31 o 3.111000 0.8605000 2.742000 1.101000  3.479000 1.323000  -0.7373000     1.721000  
1 1 1 11 44 33 o 7.367000 0.6622000 8.452000 0.8003000 6.282000 1.055000  2.171000       1.324000  
1 1 1 11 44 35 o 16.23000 0.3914000 15.90000 0.5269000 16.56000 0.5791000 -0.6651000     0.7829000 
1 1 1 11 44 37 o 6.107000 0.7275000 5.086000 1.176000  7.128000 0.8570000 -2.042000      1.455000  
1 1 1 11 44 39 o 9.417000 0.4956000 8.805000 0.7357000 10.03000 0.6643000 -1.224000      0.9912000 
1 1 1 11 44 41 f 5.375000 0.8613000 5.789000 1.135000  4.962000 1.296000  0.8270000      1.723000  
1 1 1 11 44 43 o 3.397000 0.9385000 3.521000 1.325000  3.272000 1.329000  0.2492000      1.877000  
1 1 1 11 44 45 o 4.289000 0.9770000 3.558000 1.394000  5.020000 1.370000  -1.462000      1.954000  
1 1 1 11 45 0  o 16.22000 0.4405000 16.22000 0.4405000 16.22000 0.4405000 0.000000       0.000000  
1 1 1 11 45 2  o 18.56000 0.3110000 18.62000 0.4379000 18.51000 0.4418000 0.1140000      0.6220000 
1 1 1 11 45 4  o 11.27000 0.5751000 10.30000 1.023000  12.25000 0.5251000 -1.948000      1.150000  
1 1 1 11 45 6  o 17.46000 0.3067000 17.36000 0.4467000 17.55000 0.4203000 -0.1898000     0.6134000 
1 1 1 11 45 8  o 16.28000 0.3139000 16.96000 0.4708000 15.61000 0.4154000 1.352000       0.6279000 
1 1 1 11 45 10 o 13.42000 0.3571000 13.32000 0.5007000 13.52000 0.5094000 -0.2026000     0.7143000 
1 1 1 11 45 12 o 10.68000 0.4074000 10.31000 0.5910000 11.04000 0.5609000 -0.7274000     0.8148000 
1 1 1 11 45 14 o 9.780000 0.4555000 9.177000 0.6870000 10.38000 0.5983000 -1.206000      0.9110000 
1 1 1 11 45 16 o 7.110000 0.5964000 7.327000 0.6719000 6.893000 0.9855000 0.4335000      1.193000  
1 1 1 11 45 18 o 2.709000 0.8108000 2.648000 1.127000  2.769000 1.166000  -0.1208000     1.622000  
1 1 1 11 45 20 o 3.759000 0.8340000 4.597000 1.136000  2.920000 1.221000  1.677000       1.668000  
1 1 1 11 45 22 o 4.564000 0.8725000 4.576000 1.191000  4.551000 1.276000  0.2516000E-01  1.745000  
1 1 1 11 45 24 o 14.84000 0.3571000 14.89000 0.4927000 14.79000 0.5171000 0.1017000      0.7142000 
1 1 1 11 45 26 o 4.332000 0.8775000 4.325000 1.231000  4.338000 1.251000  -0.1245000E-01 1.755000  
1 1 1 11 45 28 o 3.684000 0.8801000 3.256000 1.161000  4.112000 1.323000  -0.8560000     1.760000  
1 1 1 11 45 30 o 11.93000 0.4368000 11.90000 0.6024000 11.96000 0.6327000 -0.6534000E-01 0.8736000 
1 1 1 11 45 32 o 3.189000 0.8702000 3.664000 1.299000  2.714000 1.159000  0.9499000      1.740000  
1 1 1 11 45 34 o 5.757000 0.8659000 4.817000 1.275000  6.697000 1.172000  -1.880000      1.732000  
1 1 1 11 45 36 f 4.679000 0.8452000 4.364000 1.239000  4.993000 1.150000  -0.6297000     1.690000  
1 1 1 11 45 38 o 4.438000 0.9510000 3.961000 1.241000  4.915000 1.441000  -0.9539000     1.902000  
1 1 1 11 45 40 o 2.959000 0.9158000 2.464000 1.131000  3.453000 1.441000  -0.9893000     1.832000  
1 1 1 11 45 42 o 9.875000 0.6524000 8.760000 0.8144000 10.99000 1.019000  -2.229000      1.305000  
1 1 1 11 45 44 o 6.189000 0.9727000 5.252000 1.580000  7.126000 1.134000  -1.874000      1.945000  
1 1 1 11 46 1  o 11.35000 0.3978000 10.41000 0.5849000 12.28000 0.5393000 -1.864000      0.7956000 
1 1 1 11 46 3  f 20.36000 0.2946000 20.22000 0.4148000 20.51000 0.4185000 -0.2875000     0.5892000 
1 1 1 11 46 5  o 16.32000 0.3159000 16.56000 0.4607000 16.08000 0.4325000 0.4738000      0.6319000 
1 1 1 11 46 7  o 13.08000 0.4678000 12.81000 0.8146000 13.36000 0.4601000 -0.5481000     0.9356000 
1 1 1 11 46 9  o 8.880000 0.4325000 8.874000 0.6352000 8.886000 0.5871000 -0.1126000E-01 0.8649000 
1 1 1 11 46 11 o 9.576000 0.4203000 9.549000 0.5715000 9.603000 0.6165000 -0.5403000E-01 0.8407000 
1 1 1 11 46 13 o 9.858000 0.4487000 8.690000 0.6250000 11.03000 0.6439000 -2.335000      0.8974000 
1 1 1 11 46 15 o 3.732000 0.8697000 3.963000 1.247000  3.500000 1.213000  0.4631000      1.739000  
1 1 1 11 46 17 o 13.96000 0.3821000 14.45000 0.5599000 13.47000 0.5200000 0.9782000      0.7641000 
1 1 1 11 46 19 o 16.19000 0.3607000 16.31000 0.5111000 16.08000 0.5090000 0.2283000      0.7213000 
1 1 1 11 46 21 o 16.14000 0.3878000 15.62000 0.5857000 16.67000 0.5085000 -1.049000      0.7757000 
1 1 1 11 46 23 o 8.385000 0.5218000 8.254000 0.7159000 8.515000 0.7593000 -0.2616000     1.044000  
1 1 1 11 46 25 o 2.355000 0.7616000 2.398000 1.087000  2.311000 1.067000  0.8644000E-01  1.523000  
1 1 1 11 46 27 o 7.364000 0.5721000 7.974000 0.6438000 6.755000 0.9458000 1.219000       1.144000  
1 1 1 11 46 29 o 7.049000 0.5866000 7.061000 0.7671000 7.037000 0.8876000 0.2420000E-01  1.173000  
1 1 1 11 46 31 o 4.404000 1.022000  5.172000 1.534000  3.636000 1.351000  1.536000       2.044000  
1 1 1 11 46 33 o 3.520000 0.9418000 3.170000 1.248000  3.871000 1.410000  -0.7010000     1.884000  
1 1 1 11 46 35 o 7.074000 0.6462000 6.677000 0.8329000 7.471000 0.9882000 -0.7942000     1.292000  
1 1 1 11 46 37 o 4.434000 0.9473000 4.965000 1.213000  3.903000 1.456000  1.062000       1.895000  
1 1 1 11 46 39 o 5.120000 1.134000  4.868000 1.201000  5.372000 1.924000  -0.5045000     2.268000  
1 1 1 11 46 41 o 5.262000 0.8974000 6.101000 1.091000  4.423000 1.425000  1.678000       1.795000  
1 1 1 11 46 43 o 4.556000 0.9779000 4.097000 1.305000  5.014000 1.457000  -0.9166000     1.956000  
1 1 1 11 47 0  o 6.848000 0.8154000 6.848000 0.8154000 6.848000 0.8154000 0.000000       0.000000  
1 1 1 11 47 2  o 11.87000 0.4265000 12.12000 0.6420000 11.61000 0.5618000 0.5083000      0.8531000 
1 1 1 11 47 4  o 9.347000 0.4392000 9.334000 0.6132000 9.360000 0.6289000 -0.2545000E-01 0.8784000 
1 1 1 11 47 6  o 4.381000 0.8607000 5.026000 1.246000  3.737000 1.188000  1.289000       1.721000  
1 1 1 11 47 8  o 12.89000 0.3405000 12.71000 0.5009000 13.08000 0.4615000 -0.3659000     0.6811000 
1 1 1 11 47 10 o 15.98000 0.3337000 15.70000 0.4637000 16.26000 0.4799000 -0.5622000     0.6673000 
1 1 1 11 47 12 o 13.13000 0.3847000 12.60000 0.5234000 13.67000 0.5638000 -1.072000      0.7694000 
1 1 1 11 47 14 o 3.872000 0.8584000 3.720000 1.181000  4.023000 1.247000  -0.3038000     1.717000  
1 1 1 11 47 16 o 5.426000 0.7825000 4.780000 1.198000  6.073000 1.008000  -1.293000      1.565000  
1 1 1 11 47 18 o 14.81000 0.3820000 14.96000 0.5589000 14.67000 0.5209000 0.2883000      0.7640000 
1 1 1 11 47 20 o 10.42000 0.4805000 11.16000 0.6691000 9.676000 0.6898000 1.484000       0.9610000 
1 1 1 11 47 22 f 6.478000 0.7027000 7.049000 0.8620000 5.907000 1.110000  1.142000       1.405000  
1 1 1 11 47 24 o 4.220000 0.8809000 4.562000 1.187000  3.878000 1.302000  0.6844000      1.762000  
1 1 1 11 47 26 o 4.064000 0.8597000 3.659000 1.126000  4.470000 1.299000  -0.8108000     1.719000  
1 1 1 11 47 28 o 6.087000 0.6987000 6.294000 0.8890000 5.880000 1.078000  0.4135000      1.397000  
1 1 1 11 47 30 o 3.933000 0.9046000 3.013000 1.270000  4.854000 1.289000  -1.841000      1.809000  
1 1 1 11 47 32 o 10.53000 0.5241000 10.10000 0.7950000 10.96000 0.6833000 -0.8662000     1.048000  
1 1 1 11 47 34 o 6.700000 0.7628000 6.339000 0.9018000 7.062000 1.230000  -0.7231000     1.526000  
1 1 1 11 47 36 o 6.177000 0.8586000 6.248000 0.9660000 6.106000 1.420000  0.1428000      1.717000  
1 1 1 11 47 38 o 5.005000 0.8667000 5.340000 1.075000  4.670000 1.360000  0.6705000      1.733000  
1 1 1 11 47 40 o 5.273000 1.096000  5.082000 1.596000  5.464000 1.502000  -0.3827000     2.191000  
1 1 1 11 47 42 o 2.765000 0.8846000 2.804000 1.240000  2.725000 1.261000  0.7873000E-01  1.769000  
1 1 1 11 48 1  o 4.758000 0.8539000 4.772000 1.319000  4.745000 1.084000  0.2695000E-01  1.708000  
1 1 1 11 48 3  o 6.070000 0.6540000 6.499000 0.7907000 5.641000 1.042000  0.8577000      1.308000  
1 1 1 11 48 5  o 2.926000 0.8320000 3.370000 1.274000  2.483000 1.070000  0.8870000      1.664000  
1 1 1 11 48 7  o 2.527000 0.7665000 2.451000 1.080000  2.603000 1.088000  -0.1524000     1.533000  
1 1 1 11 48 9  o 5.414000 0.7128000 5.359000 1.045000  5.468000 0.9695000 -0.1092000     1.426000  
1 1 1 11 48 11 o 9.136000 0.4352000 9.714000 0.5421000 8.557000 0.6809000 1.157000       0.8703000 
1 1 1 11 48 13 o 17.80000 0.3051000 17.59000 0.4051000 18.00000 0.4564000 -0.4081000     0.6103000 
1 1 1 11 48 15 o 3.123000 0.8612000 3.265000 1.258000  2.981000 1.176000  0.2842000      1.722000  
1 1 1 11 48 17 o 9.850000 0.4769000 10.61000 0.6078000 9.093000 0.7349000 1.514000       0.9537000 
1 1 1 11 48 19 o 3.563000 0.8318000 3.506000 1.064000  3.619000 1.279000  -0.1126000     1.664000  
1 1 1 11 48 21 o 3.274000 0.8475000 2.663000 1.098000  3.886000 1.291000  -1.223000      1.695000  
1 1 1 11 48 23 o 4.943000 0.8481000 4.072000 1.241000  5.814000 1.156000  -1.742000      1.696000  
1 1 1 11 48 25 o 11.43000 0.3997000 11.62000 0.5034000 11.25000 0.6209000 0.3733000      0.7993000 
1 1 1 11 48 27 o 9.275000 0.4993000 9.729000 0.6437000 8.821000 0.7635000 0.9072000      0.9987000 
1 1 1 11 48 29 o 2.762000 0.8383000 2.538000 1.129000  2.987000 1.239000  -0.4490000     1.677000  
1 1 1 11 48 31 o 4.563000 0.9326000 4.192000 1.274000  4.934000 1.362000  -0.7421000     1.865000  
1 1 1 11 48 33 o 5.117000 0.9939000 5.067000 1.420000  5.167000 1.391000  -0.1004000     1.988000  
1 1 1 11 48 35 o 4.046000 0.9821000 3.670000 1.254000  4.422000 1.512000  -0.7528000     1.964000  
1 1 1 11 48 37 o 5.652000 1.040000  4.888000 1.416000  6.417000 1.525000  -1.528000      2.081000  
1 1 1 11 48 39 o 7.073000 0.8031000 7.302000 1.069000  6.843000 1.199000  0.4593000      1.606000  
1 1 1 11 48 41 o 6.237000 0.8559000 6.148000 1.178000  6.326000 1.242000  -0.1777000     1.712000  
1 1 1 11 49 0  o 2.566000 1.151000  2.566000 1.151000  2.566000 1.151000  0.000000       0.000000  
1 1 1 11 49 2  f 7.894000 0.5310000 7.791000 0.7240000 7.998000 0.7769000 -0.2066000     1.062000  
1 1 1 11 49 4  o 4.566000 0.8399000 5.159000 1.176000  3.973000 1.199000  1.186000       1.680000  
1 1 1 11 49 6  o 6.554000 0.6441000 7.738000 0.7030000 5.370000 1.080000  2.367000       1.288000  
1 1 1 11 49 8  o 3.032000 0.8183000 3.054000 1.152000  3.010000 1.163000  0.4397000E-01  1.637000  
1 1 1 11 49 10 f 8.767000 0.4407000 8.289000 0.6936000 9.245000 0.5441000 -0.9559000     0.8815000 
1 1 1 11 49 12 o 6.250000 0.6345000 5.212000 1.005000  7.287000 0.7748000 -2.075000      1.269000  
1 1 1 11 49 14 o 8.557000 0.4740000 8.599000 0.6597000 8.515000 0.6808000 0.8401000E-01  0.9480000 
1 1 1 11 49 16 o 5.588000 0.7030000 5.960000 0.8517000 5.217000 1.119000  0.7430000      1.406000  
1 1 1 11 49 18 o 11.50000 0.3940000 11.47000 0.5020000 11.54000 0.6073000 -0.7207000E-01 0.7879000 
1 1 1 11 49 20 o 11.37000 0.4321000 11.52000 0.5721000 11.23000 0.6478000 0.2872000      0.8643000 
1 1 1 11 49 22 o 3.159000 0.8598000 3.512000 1.228000  2.806000 1.204000  0.7067000      1.720000  
1 1 1 11 49 24 o 3.402000 0.9060000 3.264000 1.233000  3.540000 1.328000  -0.2761000     1.812000  
1 1 1 11 49 26 o 6.221000 0.9096000 5.798000 1.045000  6.645000 1.489000  -0.8471000     1.819000  
1 1 1 11 49 28 o 10.71000 0.4516000 10.86000 0.5666000 10.57000 0.7033000 0.2905000      0.9031000 
1 1 1 11 49 30 o 11.68000 0.4035000 11.57000 0.5204000 11.79000 0.6169000 -0.2158000     0.8071000 
1 1 1 11 49 32 o 10.38000 0.7975000 9.623000 0.8242000 11.13000 1.366000  -1.510000      1.595000  
1 1 1 11 49 34 o 3.113000 0.9143000 2.670000 1.219000  3.556000 1.363000  -0.8859000     1.829000  
1 1 1 11 49 36 o 3.142000 0.9583000 2.797000 1.264000  3.487000 1.441000  -0.6895000     1.917000  
1 1 1 11 49 38 o 4.286000 0.9749000 4.172000 1.413000  4.400000 1.343000  -0.2288000     1.950000  
1 1 1 11 49 40 o 5.074000 1.344000  4.293000 1.670000  5.854000 2.107000  -1.561000      2.689000  
1 1 1 11 50 1  o 6.783000 0.6798000 6.717000 0.8514000 6.850000 1.060000  -0.1324000     1.360000  
1 1 1 11 50 3  o 6.170000 0.7445000 5.729000 1.123000  6.610000 0.9780000 -0.8813000     1.489000  
1 1 1 11 50 5  o 3.721000 0.8803000 3.709000 1.207000  3.732000 1.281000  -0.2348000E-01 1.761000  
1 1 1 11 50 7  o 5.972000 0.6236000 5.632000 0.9272000 6.313000 0.8341000 -0.6814000     1.247000  
1 1 1 11 50 9  o 2.813000 0.7894000 3.140000 1.161000  2.485000 1.070000  0.6557000      1.579000  
1 1 1 11 50 11 o 8.721000 0.4841000 8.545000 0.7138000 8.898000 0.6542000 -0.3534000     0.9683000 
1 1 1 11 50 13 o 8.505000 0.4774000 8.773000 0.6057000 8.238000 0.7381000 0.5349000      0.9548000 
1 1 1 11 50 15 o 3.985000 0.8408000 4.001000 1.171000  3.969000 1.207000  0.3222000E-01  1.682000  
1 1 1 11 50 17 o 4.593000 0.8141000 4.922000 0.9906000 4.265000 1.292000  0.6571000      1.628000  
1 1 1 11 50 19 o 17.87000 0.3220000 17.51000 0.4118000 18.22000 0.4952000 -0.7068000     0.6440000 
1 1 1 11 50 21 o 10.72000 0.4649000 10.58000 0.6386000 10.85000 0.6759000 -0.2644000     0.9299000 
1 1 1 11 50 23 o 6.905000 0.6872000 7.298000 0.8174000 6.512000 1.105000  0.7860000      1.374000  
1 1 1 11 50 25 o 4.754000 1.013000  3.627000 1.210000  5.881000 1.625000  -2.254000      2.026000  
1 1 1 11 50 27 o 3.561000 0.9362000 3.501000 1.239000  3.621000 1.404000  -0.1198000     1.872000  
1 1 1 11 50 29 o 4.571000 0.8368000 3.706000 1.133000  5.436000 1.232000  -1.730000      1.674000  
1 1 1 11 50 31 o 3.522000 1.090000  2.701000 1.267000  4.342000 1.775000  -1.641000      2.181000  
1 1 1 11 50 33 o 3.420000 0.9837000 2.894000 1.313000  3.946000 1.465000  -1.052000      1.967000  
1 1 1 11 50 35 o 4.657000 1.045000  4.511000 1.445000  4.803000 1.509000  -0.2924000     2.089000  
1 1 1 11 50 37 o 10.06000 0.6024000 10.54000 0.7936000 9.571000 0.9065000 0.9731000      1.205000  
1 1 1 11 51 0  o 8.153000 0.7453000 8.153000 0.7453000 8.153000 0.7453000 0.000000       0.000000  
1 1 1 11 51 2  o 12.01000 0.5196000 11.95000 0.6904000 12.07000 0.7768000 -0.1229000     1.039000  
1 1 1 11 51 4  o 10.56000 0.4046000 11.10000 0.5528000 10.02000 0.5910000 1.083000       0.8093000 
1 1 1 11 51 6  o 14.85000 0.3229000 14.51000 0.4628000 15.20000 0.4504000 -0.6963000     0.6458000 
1 1 1 11 51 8  f 3.191000 0.8372000 3.197000 1.226000  3.185000 1.141000  0.1157000E-01  1.674000  
1 1 1 11 51 10 o 8.032000 0.5182000 8.505000 0.7849000 7.559000 0.6769000 0.9458000      1.036000  
1 1 1 11 51 12 o 2.717000 0.7860000 3.112000 1.178000  2.321000 1.041000  0.7909000      1.572000  
1 1 1 11 51 14 o 3.893000 0.8715000 4.326000 1.220000  3.460000 1.245000  0.8656000      1.743000  
1 1 1 11 51 16 o 5.866000 0.6862000 5.499000 0.9542000 6.233000 0.9864000 -0.7342000     1.372000  
1 1 1 11 51 18 o 15.09000 0.3526000 15.21000 0.4674000 14.96000 0.5281000 0.2485000      0.7052000 
1 1 1 11 51 20 o 15.22000 0.3759000 15.92000 0.4730000 14.53000 0.5843000 1.382000       0.7517000 
1 1 1 11 51 22 o 8.298000 0.7042000 8.023000 0.7214000 8.574000 1.210000  -0.5511000     1.408000  
1 1 1 11 51 24 f 3.997000 0.9239000 3.886000 1.203000  4.109000 1.403000  -0.2232000     1.848000  
1 1 1 11 51 26 o 3.945000 0.9089000 2.907000 1.126000  4.983000 1.427000  -2.076000      1.818000  
1 1 1 11 51 28 o 4.550000 1.096000  3.349000 1.163000  5.752000 1.859000  -2.403000      2.193000  
1 1 1 11 51 30 o 6.930000 1.275000  6.010000 1.911000  7.850000 1.688000  -1.840000      2.550000  
1 1 1 11 51 32 o 3.499000 1.002000  3.988000 1.499000  3.011000 1.329000  0.9773000      2.004000  
1 1 1 11 51 34 o 4.738000 1.083000  4.872000 1.567000  4.605000 1.494000  0.2676000      2.166000  
1 1 1 11 51 36 o 5.045000 1.012000  4.467000 1.447000  5.623000 1.415000  -1.156000      2.024000  
1 1 1 11 52 1  o 5.601000 0.7785000 5.240000 1.264000  5.962000 0.9087000 -0.7228000     1.557000  
1 1 1 11 52 3  o 9.340000 0.5608000 9.497000 0.7015000 9.184000 0.8753000 0.3133000      1.122000  
1 1 1 11 52 5  o 8.917000 0.5042000 9.244000 0.7320000 8.590000 0.6936000 0.6546000      1.008000  
1 1 1 11 52 7  o 12.03000 0.4155000 12.54000 0.6451000 11.51000 0.5240000 1.035000       0.8311000 
1 1 1 11 52 9  o 18.89000 0.3478000 18.81000 0.5488000 18.96000 0.4273000 -0.1543000     0.6955000 
1 1 1 11 52 11 o 2.876000 0.8219000 3.291000 1.265000  2.461000 1.049000  0.8297000      1.644000  
1 1 1 11 52 13 o 7.160000 0.6172000 7.168000 0.9342000 7.153000 0.8068000 0.1437000E-01  1.234000  
1 1 1 11 52 15 o 14.26000 0.3570000 14.14000 0.5012000 14.39000 0.5084000 -0.2448000     0.7139000 
1 1 1 11 52 17 o 14.30000 0.3684000 13.47000 0.5024000 15.13000 0.5390000 -1.660000      0.7369000 
1 1 1 11 52 19 o 10.46000 0.4628000 10.64000 0.5587000 10.28000 0.7380000 0.3512000      0.9257000 
1 1 1 11 52 21 o 3.585000 0.8501000 4.196000 1.139000  2.974000 1.262000  1.222000       1.700000  
1 1 1 11 52 23 o 6.580000 0.6826000 6.566000 0.8358000 6.595000 1.079000  -0.2861000E-01 1.365000  
1 1 1 11 52 25 o 3.964000 0.9395000 3.969000 1.174000  3.960000 1.467000  0.9271000E-02  1.879000  
1 1 1 11 52 27 o 4.395000 1.093000  3.550000 1.078000  5.241000 1.901000  -1.691000      2.185000  
1 1 1 11 52 29 o 3.913000 1.095000  3.753000 1.474000  4.074000 1.621000  -0.3214000     2.191000  
1 1 1 11 52 31 o 3.342000 0.9398000 3.660000 1.361000  3.024000 1.297000  0.6365000      1.880000  
1 1 1 11 52 33 o 3.999000 0.9666000 4.978000 1.412000  3.020000 1.320000  1.958000       1.933000  
1 1 1 11 52 35 o 10.71000 0.5584000 11.77000 0.7667000 9.648000 0.8120000 2.121000       1.117000  
1 1 1 11 53 0  o 5.494000 1.215000  5.494000 1.215000  5.494000 1.215000  0.000000       0.000000  
1 1 1 11 53 2  o 5.458000 0.6934000 6.120000 0.8468000 4.796000 1.098000  1.325000       1.387000  
1 1 1 11 53 4  o 10.86000 0.4955000 11.41000 0.5922000 10.31000 0.7945000 1.093000       0.9909000 
1 1 1 11 53 6  o 12.72000 0.3821000 12.23000 0.5410000 13.21000 0.5397000 -0.9802000     0.7641000 
1 1 1 11 53 8  f 3.140000 0.8388000 2.876000 1.194000  3.403000 1.179000  -0.5271000     1.678000  
1 1 1 11 53 10 o 3.380000 0.8557000 3.867000 1.272000  2.893000 1.145000  0.9743000      1.711000  
1 1 1 11 53 12 f 14.24000 0.4171000 14.09000 0.6564000 14.39000 0.5150000 -0.2960000     0.8343000 
1 1 1 11 53 14 o 6.141000 0.6526000 6.225000 0.8534000 6.057000 0.9876000 0.1681000      1.305000  
1 1 1 11 53 16 o 4.119000 0.8716000 3.368000 1.229000  4.869000 1.236000  -1.501000      1.743000  
1 1 1 11 53 18 o 6.390000 0.6310000 6.537000 0.8022000 6.242000 0.9743000 0.2957000      1.262000  
1 1 1 11 53 20 o 2.471000 0.7713000 2.672000 1.103000  2.270000 1.079000  0.4017000      1.543000  
1 1 1 11 53 22 o 4.382000 0.8097000 5.369000 0.8971000 3.395000 1.348000  1.974000       1.619000  
1 1 1 11 53 24 o 4.083000 1.182000  4.083000 1.182000  ?        ?         ?              ?         
1 1 1 11 53 26 o 3.485000 0.9248000 4.319000 1.362000  2.650000 1.251000  1.669000       1.850000  
1 1 1 11 53 28 o 3.916000 0.9472000 5.025000 1.356000  2.807000 1.323000  2.218000       1.894000  
1 1 1 11 53 30 o 7.399000 0.8957000 7.672000 0.9959000 7.127000 1.489000  0.5447000      1.791000  
1 1 1 11 53 32 o 6.437000 0.8388000 5.975000 1.262000  6.898000 1.106000  -0.9233000     1.678000  
1 1 1 11 54 1  o 4.293000 0.9499000 4.398000 1.217000  4.188000 1.458000  0.2094000      1.900000  
1 1 1 11 54 3  o 5.821000 0.7132000 5.899000 1.019000  5.744000 0.9986000 0.1553000      1.426000  
1 1 1 11 54 5  o 4.711000 0.8927000 4.950000 1.106000  4.472000 1.401000  0.4776000      1.785000  
1 1 1 11 54 7  o 9.483000 0.4470000 9.811000 0.6374000 9.155000 0.6267000 0.6562000      0.8939000 
1 1 1 11 54 9  o 8.429000 0.4720000 8.177000 0.6931000 8.680000 0.6409000 -0.5025000     0.9440000 
1 1 1 11 54 11 o 4.779000 0.8736000 4.586000 1.380000  4.972000 1.072000  -0.3867000     1.747000  
1 1 1 11 54 13 o 5.271000 0.7549000 5.516000 0.9898000 5.026000 1.140000  0.4899000      1.510000  
1 1 1 11 54 15 o 2.656000 0.8089000 2.577000 1.134000  2.736000 1.154000  -0.1587000     1.618000  
1 1 1 11 54 17 o 8.436000 0.5124000 8.963000 0.5744000 7.909000 0.8488000 1.054000       1.025000  
1 1 1 11 54 19 o 6.013000 0.7642000 4.314000 1.111000  7.711000 1.050000  -3.397000      1.528000  
1 1 1 11 54 21 o 2.985000 1.142000  2.985000 1.142000  ?        ?         ?              ?         
1 1 1 11 54 23 o 4.437000 1.109000  4.582000 1.289000  4.292000 1.805000  0.2898000      2.218000  
1 1 1 11 54 25 o 5.668000 1.117000  4.541000 1.555000  6.795000 1.604000  -2.254000      2.234000  
1 1 1 11 54 27 o 6.498000 0.9533000 6.212000 0.9995000 6.784000 1.624000  -0.5721000     1.907000  
1 1 1 11 54 29 o 4.360000 1.073000  3.441000 1.267000  5.280000 1.732000  -1.839000      2.146000  
1 1 1 11 54 31 o 5.371000 0.9470000 5.998000 1.175000  4.744000 1.485000  1.253000       1.894000  
1 1 1 11 55 0  o 3.387000 1.250000  3.387000 1.250000  3.387000 1.250000  0.000000       0.000000  
1 1 1 11 55 2  o 2.468000 0.7768000 2.527000 1.103000  2.410000 1.094000  0.1170000      1.554000  
1 1 1 11 55 4  o 12.16000 0.4086000 11.55000 0.5390000 12.76000 0.6143000 -1.209000      0.8172000 
1 1 1 11 55 6  o 11.92000 0.4833000 11.71000 0.6748000 12.13000 0.6921000 -0.4213000     0.9666000 
1 1 1 11 55 8  o 3.612000 0.8445000 4.308000 1.216000  2.916000 1.173000  1.392000       1.689000  
1 1 1 11 55 10 o 6.882000 0.6875000 7.170000 1.089000  6.594000 0.8402000 0.5752000      1.375000  
1 1 1 11 55 12 o 2.864000 0.8121000 2.693000 1.141000  3.036000 1.156000  -0.3428000     1.624000  
1 1 1 11 55 14 o 4.348000 0.9109000 4.360000 1.246000  4.336000 1.329000  0.2326000E-01  1.822000  
1 1 1 11 55 16 o 6.896000 1.047000  6.739000 0.8146000 7.052000 1.930000  -0.3130000     2.095000  
1 1 1 11 55 18 o 5.244000 0.9957000 5.284000 0.9559000 5.203000 1.747000  0.8127000E-01  1.991000  
1 1 1 11 55 20 o 5.254000 1.138000  5.254000 1.138000  ?        ?         ?              ?         
1 1 1 11 55 22 o 8.271000 0.8092000 8.167000 1.002000  8.375000 1.270000  -0.2074000     1.618000  
1 1 1 11 55 24 o 5.765000 1.165000  4.971000 1.620000  6.560000 1.674000  -1.589000      2.330000  
1 1 1 11 55 26 o 4.412000 1.060000  4.691000 1.328000  4.132000 1.651000  0.5596000      2.119000  
1 1 1 11 55 28 o 3.439000 1.001000  3.446000 1.307000  3.432000 1.516000  0.1370000E-01  2.001000  
1 1 1 11 56 1  o 3.115000 0.8444000 2.974000 1.217000  3.255000 1.171000  -0.2809000     1.689000  
1 1 1 11 56 3  o 3.277000 0.8842000 3.559000 1.268000  2.995000 1.232000  0.5639000      1.768000  
1 1 1 11 56 5  o 2.459000 0.7661000 2.656000 1.125000  2.261000 1.040000  0.3948000      1.532000  
1 1 1 11 56 7  o 4.885000 0.7818000 5.082000 1.103000  4.688000 1.109000  0.3946000      1.564000  
1 1 1 11 56 9  o 4.275000 0.9710000 4.948000 1.352000  3.602000 1.394000  1.345000       1.942000  
1 1 1 11 56 11 o 3.766000 0.8778000 4.576000 1.195000  2.955000 1.286000  1.621000       1.756000  
1 1 1 11 56 13 o 4.697000 0.9450000 4.827000 1.358000  4.567000 1.315000  0.2598000      1.890000  
1 1 1 11 56 15 o 3.757000 0.9512000 3.776000 1.190000  3.737000 1.484000  0.3879000E-01  1.902000  
1 1 1 11 56 17 o 5.003000 1.033000  5.802000 1.138000  4.203000 1.724000  1.599000       2.066000  
1 1 1 11 56 19 o 5.516000 1.254000  4.914000 1.395000  6.119000 2.084000  -1.205000      2.508000  
1 1 1 11 56 21 o 4.376000 1.032000  4.031000 1.286000  4.722000 1.614000  -0.6912000     2.064000  
1 1 1 11 56 23 o 4.171000 1.118000  4.033000 1.473000  4.310000 1.683000  -0.2769000     2.236000  
1 1 1 11 56 25 o 4.116000 1.087000  3.224000 1.243000  5.007000 1.785000  -1.783000      2.175000  
1 1 1 11 56 27 o 5.210000 1.189000  5.362000 1.601000  5.057000 1.757000  0.3048000      2.377000  
1 1 1 11 57 0  o 3.338000 1.223000  3.338000 1.223000  3.338000 1.223000  0.000000       0.000000  
1 1 1 11 57 2  o 2.341000 0.7432000 2.158000 0.9996000 2.524000 1.100000  -0.3651000     1.486000  
1 1 1 11 57 4  o 4.601000 0.8517000 4.966000 1.047000  4.236000 1.344000  0.7294000      1.703000  
1 1 1 11 57 6  o 6.774000 0.6269000 6.537000 0.9315000 7.011000 0.8392000 -0.4736000     1.254000  
1 1 1 11 57 8  f 5.374000 0.8523000 4.568000 1.432000  6.179000 0.9246000 -1.610000      1.705000  
1 1 1 11 57 10 o 3.845000 0.9452000 3.717000 1.250000  3.973000 1.418000  -0.2559000     1.890000  
1 1 1 11 57 12 o 4.582000 0.9646000 4.201000 1.369000  4.962000 1.359000  -0.7612000     1.929000  
1 1 1 11 57 14 o 9.237000 0.8899000 8.222000 0.7830000 10.25000 1.598000  -2.029000      1.780000  
1 1 1 11 57 16 o 5.330000 1.133000  5.782000 1.263000  4.878000 1.882000  0.9035000      2.267000  
1 1 1 11 57 18 o 5.512000 0.9546000 4.421000 1.232000  6.603000 1.458000  -2.181000      1.909000  
1 1 1 11 57 20 o 4.081000 1.099000  3.357000 1.335000  4.805000 1.746000  -1.447000      2.198000  
1 1 1 11 57 22 o 8.371000 0.7542000 7.450000 0.9311000 9.292000 1.187000  -1.842000      1.508000  
1 1 1 11 57 24 o 8.136000 0.8782000 7.411000 0.9173000 8.861000 1.498000  -1.450000      1.756000  
1 1 1 11 58 1  o 5.061000 0.7730000 4.687000 1.151000  5.435000 1.033000  -0.7476000     1.546000  
1 1 1 11 58 3  o 4.129000 0.8694000 4.182000 1.214000  4.076000 1.245000  0.1064000      1.739000  
1 1 1 11 58 5  o 7.273000 0.6292000 6.250000 0.9378000 8.297000 0.8389000 -2.047000      1.258000  
1 1 1 11 58 7  o 2.611000 0.7559000 2.962000 1.106000  2.260000 1.031000  0.7019000      1.512000  
1 1 1 11 58 9  o 6.110000 0.6468000 5.859000 0.9537000 6.361000 0.8739000 -0.5012000     1.294000  
1 1 1 11 58 11 o 5.963000 0.8680000 7.754000 1.052000  4.171000 1.381000  3.583000       1.736000  
1 1 1 11 58 13 o 3.875000 1.028000  3.407000 1.316000  4.343000 1.581000  -0.9357000     2.057000  
1 1 1 11 58 15 o 4.365000 1.230000  3.390000 1.264000  5.341000 2.109000  -1.951000      2.459000  
1 1 1 11 58 17 o 4.280000 0.9926000 4.688000 1.235000  3.872000 1.555000  0.8160000      1.985000  
1 1 1 11 58 19 o 3.228000 0.9732000 3.171000 1.287000  3.285000 1.460000  -0.1146000     1.946000  
1 1 1 11 58 21 o 3.714000 1.062000  2.878000 1.259000  4.550000 1.710000  -1.672000      2.123000  
1 1 1 11 59 0  o 11.56000 0.5879000 11.56000 0.5879000 11.56000 0.5879000 0.000000       0.000000  
1 1 1 11 59 2  o 6.835000 0.5933000 6.645000 0.8671000 7.025000 0.8099000 -0.3804000     1.187000  
1 1 1 11 59 4  o 3.845000 0.8804000 3.957000 1.242000  3.732000 1.248000  0.2249000      1.761000  
1 1 1 11 59 6  f 3.777000 0.8982000 3.381000 1.191000  4.174000 1.345000  -0.7931000     1.796000  
1 1 1 11 59 8  o 3.410000 0.9654000 3.259000 1.252000  3.560000 1.470000  -0.3012000     1.931000  
1 1 1 11 59 10 o 3.880000 1.044000  4.596000 1.520000  3.164000 1.431000  1.432000       2.088000  
1 1 1 11 59 12 o 4.082000 1.116000  3.007000 1.218000  5.156000 1.872000  -2.149000      2.233000  
1 1 1 11 59 14 o 6.503000 0.9690000 5.850000 1.078000  7.156000 1.610000  -1.306000      1.938000  
1 1 1 11 59 16 o 4.153000 1.110000  3.548000 1.346000  4.758000 1.765000  -1.210000      2.220000  
1 1 1 11 59 18 o 5.736000 1.092000  4.879000 1.612000  6.592000 1.475000  -1.713000      2.184000  
1 1 1 11 60 1  o 2.964000 0.8117000 3.060000 1.151000  2.868000 1.145000  0.1916000      1.623000  
1 1 1 11 60 3  o 3.211000 0.8398000 3.158000 1.171000  3.264000 1.204000  -0.1064000     1.680000  
1 1 1 11 60 5  o 3.256000 0.8465000 2.621000 1.116000  3.891000 1.273000  -1.270000      1.693000  
1 1 1 11 60 7  o 2.381000 0.7936000 2.210000 1.031000  2.551000 1.207000  -0.3403000     1.587000  
1 1 1 11 60 9  o 2.683000 0.9218000 2.313000 1.096000  3.053000 1.483000  -0.7400000     1.844000  
1 1 1 11 60 11 o 3.655000 1.035000  2.931000 1.209000  4.378000 1.681000  -1.448000      2.071000  
1 1 1 11 60 13 o 4.675000 1.026000  3.889000 1.239000  5.460000 1.637000  -1.571000      2.053000  
1 1 1 11 61 0  o 2.423000 1.068000  2.423000 1.068000  2.423000 1.068000  0.000000       0.000000  
1 1 1 11 61 2  o 2.853000 0.8730000 2.508000 1.086000  3.197000 1.367000  -0.6888000     1.746000  
1 1 1 11 61 4  o 2.685000 0.8736000 2.364000 1.067000  3.006000 1.383000  -0.6416000     1.747000  
1 1 1 11 61 6  o 2.034000 0.9675000 2.034000 0.9675000 ?        ?         ?              ?         
1 1 1 12 0  0  o 10.28000 0.4034000 10.28000 0.4034000 10.28000 0.4034000 0.000000       0.000000  
1 1 1 12 0  2  o 58.45000 0.5804000 58.45000 0.5804000 58.45000 0.5804000 0.000000       0.000000  
1 1 1 12 0  4  o 26.65000 0.3574000 26.65000 0.3574000 26.65000 0.3574000 0.000000       0.000000  
1 1 1 12 0  6  o 53.56000 0.6176000 53.56000 0.6176000 53.56000 0.6176000 0.000000       0.000000  
1 1 1 12 0  8  f 29.80000 0.3344000 29.80000 0.3344000 29.80000 0.3344000 0.000000       0.000000  
1 1 1 12 0  10 o 137.1000 1.320000  137.1000 1.320000  137.1000 1.320000  0.000000       0.000000  
1 1 1 12 0  12 o 106.7000 1.035000  106.7000 1.035000  106.7000 1.035000  0.000000       0.000000  
1 1 1 12 0  14 o 132.0000 1.471000  132.0000 1.471000  132.0000 1.471000  0.000000       0.000000  
1 1 1 12 0  16 o 45.03000 0.4741000 45.03000 0.4741000 45.03000 0.4741000 0.000000       0.000000  
1 1 1 12 0  18 o 68.13000 0.6800000 68.13000 0.6800000 68.13000 0.6800000 0.000000       0.000000  
1 1 1 12 0  20 o 47.15000 0.7101000 47.15000 0.7101000 47.15000 0.7101000 0.000000       0.000000  
1 1 1 12 0  22 o 8.980000 0.6936000 8.980000 0.6936000 8.980000 0.6936000 0.000000       0.000000  
1 1 1 12 0  24 o 35.99000 0.5107000 35.99000 0.5107000 35.99000 0.5107000 0.000000       0.000000  
1 1 1 12 0  26 o 21.45000 0.4257000 21.45000 0.4257000 21.45000 0.4257000 0.000000       0.000000  
1 1 1 12 0  28 o 56.59000 0.6836000 56.59000 0.6836000 56.59000 0.6836000 0.000000       0.000000  
1 1 1 12 0  30 o 43.05000 0.5712000 43.05000 0.5712000 43.05000 0.5712000 0.000000       0.000000  
1 1 1 12 0  32 o 68.49000 0.8066000 68.49000 0.8066000 68.49000 0.8066000 0.000000       0.000000  
1 1 1 12 0  34 o 31.08000 0.4338000 31.08000 0.4338000 31.08000 0.4338000 0.000000       0.000000  
1 1 1 12 0  36 o 35.49000 0.4536000 35.49000 0.4536000 35.49000 0.4536000 0.000000       0.000000  
1 1 1 12 0  38 o 24.52000 0.5103000 24.52000 0.5103000 24.52000 0.5103000 0.000000       0.000000  
1 1 1 12 0  40 o 54.11000 0.5868000 54.11000 0.5868000 54.11000 0.5868000 0.000000       0.000000  
1 1 1 12 0  42 o 33.25000 0.5397000 33.25000 0.5397000 33.25000 0.5397000 0.000000       0.000000  
1 1 1 12 0  44 o 2.862000 1.302000  2.862000 1.302000  2.862000 1.302000  0.000000       0.000000  
1 1 1 12 0  46 o 11.79000 0.7539000 11.79000 0.7539000 11.79000 0.7539000 0.000000       0.000000  
1 1 1 12 0  48 o 11.30000 0.6907000 11.30000 0.6907000 11.30000 0.6907000 0.000000       0.000000  
1 1 1 12 0  50 o 18.32000 0.5600000 18.32000 0.5600000 18.32000 0.5600000 0.000000       0.000000  
1 1 1 12 0  52 o 19.16000 0.4906000 19.16000 0.4906000 19.16000 0.4906000 0.000000       0.000000  
1 1 1 12 0  54 o 16.41000 0.6058000 16.41000 0.6058000 16.41000 0.6058000 0.000000       0.000000  
1 1 1 12 0  56 o 2.655000 1.194000  2.655000 1.194000  2.655000 1.194000  0.000000       0.000000  
1 1 1 12 0  58 o 3.514000 1.424000  3.514000 1.424000  3.514000 1.424000  0.000000       0.000000  
1 1 1 12 0  60 o 8.699000 0.9836000 8.699000 0.9836000 8.699000 0.9836000 0.000000       0.000000  
1 1 1 12 0  62 o 8.920000 1.007000  8.920000 1.007000  8.920000 1.007000  0.000000       0.000000  
1 1 1 12 0  64 o 4.595000 1.429000  4.595000 1.429000  4.595000 1.429000  0.000000       0.000000  
1 1 1 12 0  66 o 5.470000 1.698000  5.470000 1.698000  5.470000 1.698000  0.000000       0.000000  
1 1 1 12 1  1  o 97.86000 0.7232000 96.93000 1.085000  98.79000 0.9566000 -1.857000      1.446000  
1 1 1 12 1  3  o 38.03000 0.3036000 38.13000 0.4602000 37.93000 0.3961000 0.1971000      0.6072000 
1 1 1 12 1  5  o 69.43000 0.5562000 69.61000 0.7892000 69.24000 0.7841000 0.3763000      1.112000  
1 1 1 12 1  7  o 22.24000 0.2475000 22.60000 0.4053000 21.89000 0.2841000 0.7062000      0.4950000 
1 1 1 12 1  9  o 94.65000 0.6494000 94.21000 0.9142000 95.09000 0.9227000 -0.8788000     1.299000  
1 1 1 12 1  11 o 138.2000 1.016000  137.8000 1.533000  138.6000 1.335000  -0.7914000     2.033000  
1 1 1 12 1  13 o 162.3000 1.192000  161.4000 1.794000  163.1000 1.571000  -1.655000      2.385000  
1 1 1 12 1  15 o 68.70000 0.5563000 68.55000 0.7857000 68.85000 0.7878000 -0.3030000     1.113000  
1 1 1 12 1  17 o 39.50000 0.3063000 39.25000 0.4299000 39.76000 0.4363000 -0.5049000     0.6125000 
1 1 1 12 1  19 o 36.81000 0.3465000 36.53000 0.4886000 37.08000 0.4915000 -0.5538000     0.6931000 
1 1 1 12 1  21 o 89.05000 0.6688000 89.34000 0.8775000 88.76000 1.009000  0.5732000      1.338000  
1 1 1 12 1  23 o 13.25000 0.3558000 13.36000 0.4992000 13.14000 0.5072000 0.2179000      0.7117000 
1 1 1 12 1  25 o 31.56000 0.2985000 31.31000 0.4194000 31.80000 0.4249000 -0.4888000     0.5970000 
1 1 1 12 1  27 o 20.77000 0.3512000 21.07000 0.4867000 20.46000 0.5064000 0.6093000      0.7023000 
1 1 1 12 1  29 o 77.74000 0.6713000 77.08000 1.090000  78.41000 0.7838000 -1.330000      1.343000  
1 1 1 12 1  31 f 34.12000 0.3400000 34.44000 0.4423000 33.80000 0.5165000 0.6433000      0.6799000 
1 1 1 12 1  33 o 49.72000 0.3833000 50.10000 0.5442000 49.34000 0.5399000 0.7599000      0.7665000 
1 1 1 12 1  35 o 48.13000 0.4346000 48.49000 0.6162000 47.78000 0.6131000 0.7103000      0.8693000 
1 1 1 12 1  37 o 85.36000 0.6014000 85.05000 0.8478000 85.67000 0.8533000 -0.6206000     1.203000  
1 1 1 12 1  39 o 22.23000 0.3351000 22.19000 0.4671000 22.27000 0.4805000 -0.7617000E-01 0.6701000 
1 1 1 12 1  41 o 12.77000 0.4663000 12.41000 0.6775000 13.14000 0.6409000 -0.7279000     0.9326000 
1 1 1 12 1  43 o 35.51000 0.3658000 35.67000 0.5539000 35.35000 0.4780000 0.3142000      0.7316000 
1 1 1 12 1  45 o 10.65000 0.6346000 10.98000 0.8051000 10.33000 0.9812000 0.6468000      1.269000  
1 1 1 12 1  47 o 9.313000 0.6664000 9.244000 0.8289000 9.383000 1.044000  -0.1389000     1.333000  
1 1 1 12 1  49 o 21.62000 0.3402000 21.51000 0.4797000 21.74000 0.4825000 -0.2364000     0.6804000 
1 1 1 12 1  51 o 19.14000 0.3541000 19.00000 0.5015000 19.28000 0.5001000 -0.2832000     0.7082000 
1 1 1 12 1  53 o 11.52000 0.4891000 10.68000 0.7369000 12.37000 0.6435000 -1.693000      0.9783000 
1 1 1 12 1  55 o 23.23000 0.3565000 23.37000 0.5349000 23.09000 0.4715000 0.2734000      0.7131000 
1 1 1 12 1  57 o 13.34000 0.5025000 13.18000 0.7709000 13.50000 0.6447000 -0.3191000     1.005000  
1 1 1 12 1  59 o 3.121000 0.9271000 3.542000 1.388000  2.700000 1.230000  0.8420000      1.854000  
1 1 1 12 1  61 o 4.153000 1.036000  4.716000 1.481000  3.589000 1.450000  1.127000       2.072000  
1 1 1 12 1  63 o 5.644000 0.9463000 4.957000 1.372000  6.331000 1.304000  -1.375000      1.893000  
1 1 1 12 1  65 o 3.599000 1.001000  4.235000 1.557000  2.964000 1.258000  1.272000       2.002000  
1 1 1 12 2  0  o 6.421000 0.4424000 6.421000 0.4424000 6.421000 0.4424000 0.000000       0.000000  
1 1 1 12 2  2  o 42.84000 0.3358000 43.05000 0.5103000 42.64000 0.4367000 0.4122000      0.6716000 
1 1 1 12 2  4  o 76.91000 0.5733000 76.69000 0.7485000 77.13000 0.8684000 -0.4472000     1.147000  
1 1 1 12 2  6  f 104.0000 0.7690000 104.0000 1.163000  104.0000 1.007000  0.8461000E-02  1.538000  
1 1 1 12 2  8  o 27.97000 0.2458000 27.48000 0.3669000 28.46000 0.3273000 -0.9778000     0.4916000 
1 1 1 12 2  10 f 78.66000 0.6665000 78.73000 1.089000  78.59000 0.7682000 0.1390000      1.333000  
1 1 1 12 2  12 o 113.0000 0.8931000 112.8000 1.261000  113.1000 1.265000  -0.2537000     1.786000  
1 1 1 12 2  14 o 106.5000 0.7304000 107.2000 1.040000  105.8000 1.026000  1.404000       1.461000  
1 1 1 12 2  16 o 11.38000 0.3212000 11.03000 0.4284000 11.74000 0.4786000 -0.7069000     0.6423000 
1 1 1 12 2  18 o 59.87000 0.4290000 60.12000 0.6089000 59.63000 0.6045000 0.4882000      0.8580000 
1 1 1 12 2  20 o 105.8000 0.8941000 105.5000 1.028000  106.1000 1.463000  -0.6505000     1.788000  
1 1 1 12 2  22 o 29.25000 0.3097000 29.55000 0.4673000 28.96000 0.4065000 0.5886000      0.6194000 
1 1 1 12 2  24 o 67.53000 0.5582000 67.68000 0.7895000 67.38000 0.7894000 0.2991000      1.116000  
1 1 1 12 2  26 o 50.75000 0.4153000 50.44000 0.5395000 51.07000 0.6314000 -0.6308000     0.8305000 
1 1 1 12 2  28 o 16.58000 0.3400000 16.41000 0.4847000 16.76000 0.4770000 -0.3465000     0.6801000 
1 1 1 12 2  30 o 38.01000 0.3508000 38.49000 0.4625000 37.54000 0.5275000 0.9516000      0.7015000 
1 1 1 12 2  32 o 69.85000 0.5007000 69.98000 0.7085000 69.72000 0.7077000 0.2568000      1.001000  
1 1 1 12 2  34 o 29.99000 0.3029000 29.94000 0.4213000 30.04000 0.4353000 -0.9462000E-01 0.6058000 
1 1 1 12 2  36 o 54.89000 0.4136000 54.37000 0.5805000 55.42000 0.5894000 -1.056000      0.8273000 
1 1 1 12 2  38 o 26.24000 0.3575000 25.88000 0.4935000 26.60000 0.5174000 -0.7172000     0.7150000 
1 1 1 12 2  40 o 32.87000 0.3275000 32.53000 0.4536000 33.22000 0.4727000 -0.6907000     0.6551000 
1 1 1 12 2  42 o 17.89000 0.3777000 17.92000 0.5289000 17.86000 0.5393000 0.5566000E-01  0.7554000 
1 1 1 12 2  44 f 18.47000 0.4158000 18.32000 0.5512000 18.63000 0.6227000 -0.3086000     0.8316000 
1 1 1 12 2  46 o 10.35000 0.6482000 10.82000 0.9663000 9.884000 0.8642000 0.9331000      1.296000  
1 1 1 12 2  48 o 10.88000 0.5884000 11.17000 0.8674000 10.59000 0.7953000 0.5788000      1.177000  
1 1 1 12 2  50 o 13.48000 0.4590000 13.05000 0.6644000 13.91000 0.6334000 -0.8544000     0.9179000 
1 1 1 12 2  52 f 7.706000 0.6694000 8.276000 0.8769000 7.136000 1.012000  1.140000       1.339000  
1 1 1 12 2  54 o 19.41000 0.3464000 19.43000 0.4918000 19.40000 0.4880000 0.3603000E-01  0.6928000 
1 1 1 12 2  56 o 15.44000 0.4383000 15.68000 0.5555000 15.20000 0.6782000 0.4853000      0.8766000 
1 1 1 12 2  58 o 11.12000 0.5450000 10.58000 0.8115000 11.67000 0.7278000 -1.088000      1.090000  
1 1 1 12 2  60 o 4.079000 1.066000  4.448000 1.584000  3.710000 1.427000  0.7383000      2.132000  
1 1 1 12 2  62 o 4.594000 1.052000  3.676000 1.541000  5.512000 1.434000  -1.836000      2.105000  
1 1 1 12 2  64 o 4.501000 1.131000  4.290000 1.542000  4.713000 1.657000  -0.4229000     2.263000  
1 1 1 12 2  66 o 4.058000 1.173000  4.340000 1.609000  3.776000 1.709000  0.5645000      2.347000  
1 1 1 12 3  1  o 32.66000 0.3045000 32.60000 0.3507000 32.73000 0.4980000 -0.1360000     0.6091000 
1 1 1 12 3  3  o 27.31000 0.2380000 27.30000 0.3144000 27.31000 0.3575000 -0.3834000E-02 0.4761000 
1 1 1 12 3  5  o 34.52000 0.2609000 33.89000 0.3629000 35.14000 0.3749000 -1.259000      0.5218000 
1 1 1 12 3  7  o 35.12000 0.3242000 35.33000 0.5295000 34.92000 0.3744000 0.4067000      0.6485000 
1 1 1 12 3  9  o 25.27000 0.2355000 25.20000 0.3539000 25.34000 0.3108000 -0.1448000     0.4710000 
1 1 1 12 3  11 o 133.1000 1.048000  132.5000 1.476000  133.6000 1.487000  -1.088000      2.095000  
1 1 1 12 3  13 o 94.02000 0.6469000 94.65000 0.9211000 93.38000 0.9084000 1.277000       1.294000  
1 1 1 12 3  15 o 89.81000 0.6200000 89.65000 0.8754000 89.98000 0.8781000 -0.3321000     1.240000  
1 1 1 12 3  17 o 41.79000 0.3463000 41.53000 0.4518000 42.05000 0.5249000 -0.5123000     0.6926000 
1 1 1 12 3  19 o 35.25000 0.3165000 34.90000 0.4095000 35.60000 0.4826000 -0.6923000     0.6329000 
1 1 1 12 3  21 o 50.55000 0.4466000 50.72000 0.4771000 50.39000 0.7551000 0.3386000      0.8932000 
1 1 1 12 3  23 o 23.40000 0.4270000 23.11000 0.3932000 23.68000 0.7580000 -0.5699000     0.8540000 
1 1 1 12 3  25 o 72.59000 0.5568000 72.54000 0.7271000 72.64000 0.8436000 -0.9739000E-01 1.114000  
1 1 1 12 3  27 o 67.97000 0.4878000 68.05000 0.6884000 67.90000 0.6913000 0.1416000      0.9756000 
1 1 1 12 3  29 o 20.98000 0.3695000 20.39000 0.4312000 21.57000 0.6001000 -1.176000      0.7390000 
1 1 1 12 3  31 o 19.07000 0.3395000 18.63000 0.5103000 19.52000 0.4481000 -0.8902000     0.6791000 
1 1 1 12 3  33 o 19.09000 0.3477000 19.38000 0.5284000 18.81000 0.4520000 0.5672000      0.6953000 
1 1 1 12 3  35 o 13.33000 0.4804000 13.18000 0.6759000 13.48000 0.6830000 -0.2922000     0.9609000 
1 1 1 12 3  37 o 28.00000 0.3443000 28.18000 0.4425000 27.82000 0.5277000 0.3619000      0.6887000 
1 1 1 12 3  39 o 33.08000 0.3250000 33.63000 0.4583000 32.53000 0.4610000 1.099000       0.6501000 
1 1 1 12 3  41 f 9.851000 0.6516000 10.90000 0.7415000 8.797000 1.072000  2.108000       1.303000  
1 1 1 12 3  43 o 40.10000 0.3547000 40.24000 0.4965000 39.96000 0.5066000 0.2776000      0.7093000 
1 1 1 12 3  45 o 20.91000 0.3945000 20.70000 0.5015000 21.11000 0.6091000 -0.4098000     0.7890000 
1 1 1 12 3  47 o 6.875000 0.9812000 5.777000 1.604000  7.972000 1.131000  -2.195000      1.962000  
1 1 1 12 3  49 o 42.55000 0.3645000 42.28000 0.5158000 42.81000 0.5153000 -0.5285000     0.7291000 
1 1 1 12 3  51 o 22.22000 0.3363000 22.39000 0.4737000 22.04000 0.4775000 0.3520000      0.6726000 
1 1 1 12 3  53 f 6.168000 0.8837000 5.791000 1.249000  6.544000 1.250000  -0.7528000     1.767000  
1 1 1 12 3  55 o 5.455000 0.9702000 3.864000 1.411000  7.047000 1.332000  -3.183000      1.940000  
1 1 1 12 3  57 o 10.22000 0.5697000 10.20000 0.7885000 10.24000 0.8225000 -0.3965000E-01 1.139000  
1 1 1 12 3  59 o 9.353000 0.6228000 9.850000 0.8525000 8.855000 0.9081000 0.9959000      1.246000  
1 1 1 12 3  61 o 4.505000 1.074000  4.163000 1.520000  4.846000 1.519000  -0.6829000     2.149000  
1 1 1 12 3  63 o 6.735000 0.8688000 7.700000 1.128000  5.770000 1.322000  1.930000       1.738000  
1 1 1 12 3  65 o 3.604000 0.9956000 4.279000 1.496000  2.929000 1.314000  1.350000       1.991000  
1 1 1 12 4  0  o 107.2000 1.196000  107.2000 1.196000  107.2000 1.196000  0.000000       0.000000  
1 1 1 12 4  2  o 63.39000 0.5099000 63.83000 0.7246000 62.94000 0.7177000 0.8858000      1.020000  
1 1 1 12 4  4  o 4.962000 0.3839000 4.528000 0.5659000 5.397000 0.5189000 -0.8694000     0.7678000 
1 1 1 12 4  6  o 54.68000 0.4160000 54.80000 0.6292000 54.55000 0.5444000 0.2502000      0.8320000 
1 1 1 12 4  8  f 73.59000 0.6595000 73.48000 1.020000  73.70000 0.8358000 -0.2200000     1.319000  
1 1 1 12 4  10 o 95.87000 0.6582000 95.93000 0.9316000 95.80000 0.9300000 0.1314000      1.316000  
1 1 1 12 4  12 o 172.1000 1.264000  171.9000 1.909000  172.3000 1.659000  -0.4516000     2.529000  
1 1 1 12 4  14 o 134.2000 0.9155000 134.8000 1.301000  133.6000 1.288000  1.287000       1.831000  
1 1 1 12 4  16 o 84.96000 0.5886000 85.36000 0.8361000 84.55000 0.8286000 0.8104000      1.177000  
1 1 1 12 4  18 o 78.95000 0.5948000 79.26000 0.7813000 78.64000 0.8970000 0.6198000      1.190000  
1 1 1 12 4  20 o 105.0000 0.8862000 105.2000 1.025000  104.8000 1.446000  0.4318000      1.772000  
1 1 1 12 4  22 o 70.32000 0.5149000 70.26000 0.6289000 70.38000 0.8154000 -0.1181000     1.030000  
1 1 1 12 4  24 o 21.99000 0.3885000 22.01000 0.4629000 21.98000 0.6241000 0.3445000E-01  0.7770000 
1 1 1 12 4  26 o 54.45000 0.4045000 55.49000 0.5778000 53.40000 0.5662000 2.090000       0.8089000 
1 1 1 12 4  28 o 30.64000 0.3015000 30.66000 0.4159000 30.63000 0.4365000 0.3264000E-01  0.6029000 
1 1 1 12 4  30 o 20.95000 0.3231000 20.86000 0.4837000 21.03000 0.4285000 -0.1761000     0.6462000 
1 1 1 12 4  32 o 20.85000 0.3098000 20.66000 0.4258000 21.05000 0.4501000 -0.3893000     0.6196000 
1 1 1 12 4  34 o 45.80000 0.3929000 45.96000 0.5960000 45.65000 0.5122000 0.3114000      0.7858000 
1 1 1 12 4  36 o 23.72000 0.3178000 23.58000 0.4443000 23.86000 0.4545000 -0.2829000     0.6356000 
1 1 1 12 4  38 o 19.11000 0.3882000 18.62000 0.5299000 19.61000 0.5673000 -0.9833000     0.7763000 
1 1 1 12 4  40 o 15.98000 0.4326000 15.71000 0.5718000 16.25000 0.6493000 -0.5412000     0.8652000 
1 1 1 12 4  42 o 31.22000 0.3313000 30.81000 0.4619000 31.63000 0.4750000 -0.8216000     0.6626000 
1 1 1 12 4  44 o 14.57000 0.4961000 14.88000 0.7475000 14.26000 0.6525000 0.6214000      0.9922000 
1 1 1 12 4  46 o 17.84000 0.3935000 17.36000 0.5616000 18.31000 0.5513000 -0.9482000     0.7870000 
1 1 1 12 4  48 o 31.89000 0.3557000 31.73000 0.5332000 32.06000 0.4710000 -0.3228000     0.7114000 
1 1 1 12 4  50 o 3.994000 0.9993000 3.432000 1.345000  4.556000 1.478000  -1.123000      1.999000  
1 1 1 12 4  52 o 6.633000 0.7392000 6.615000 1.108000  6.650000 0.9786000 -0.3453000E-01 1.478000  
1 1 1 12 4  54 o 11.90000 0.4449000 11.91000 0.6413000 11.89000 0.6168000 0.2546000E-01  0.8898000 
1 1 1 12 4  56 o 9.868000 0.5848000 9.500000 0.9247000 10.24000 0.7162000 -0.7362000     1.170000  
1 1 1 12 4  58 o 12.48000 0.5234000 11.25000 0.7858000 13.70000 0.6915000 -2.446000      1.047000  
1 1 1 12 4  60 o 11.13000 0.5681000 10.86000 0.7983000 11.40000 0.8086000 -0.5380000     1.136000  
1 1 1 12 4  62 o 4.244000 1.052000  4.122000 1.481000  4.366000 1.496000  -0.2439000     2.105000  
1 1 1 12 4  64 o 3.636000 1.043000  3.935000 1.491000  3.337000 1.460000  0.5979000      2.087000  
1 1 1 12 5  1  o 30.59000 0.2387000 30.65000 0.3389000 30.53000 0.3363000 0.1195000      0.4774000 
1 1 1 12 5  3  o 40.90000 0.3238000 40.82000 0.4228000 40.98000 0.4905000 -0.1598000     0.6476000 
1 1 1 12 5  5  o 45.53000 0.3804000 45.06000 0.5325000 46.00000 0.5435000 -0.9430000     0.7609000 
1 1 1 12 5  7  o 28.55000 0.2302000 28.68000 0.3269000 28.41000 0.3242000 0.2617000      0.4604000 
1 1 1 12 5  9  o 67.16000 0.5058000 67.47000 0.7679000 66.84000 0.6586000 0.6210000      1.012000  
1 1 1 12 5  11 o 159.1000 1.082000  158.8000 1.527000  159.4000 1.533000  -0.5975000     2.164000  
1 1 1 12 5  13 o 167.9000 1.233000  167.4000 1.861000  168.4000 1.619000  -1.024000      2.467000  
1 1 1 12 5  15 o 91.39000 0.6308000 91.63000 0.8946000 91.14000 0.8895000 0.4924000      1.262000  
1 1 1 12 5  17 o 66.81000 0.4890000 66.04000 0.5900000 67.58000 0.7800000 -1.536000      0.9780000 
1 1 1 12 5  19 o 20.98000 0.3049000 20.48000 0.4290000 21.47000 0.4334000 -0.9833000     0.6098000 
1 1 1 12 5  21 o 115.4000 0.9395000 115.2000 1.000000  115.5000 1.590000  -0.2692000     1.879000  
1 1 1 12 5  23 o 54.12000 0.6170000 53.78000 0.5022000 54.46000 1.127000  -0.6761000     1.234000  
1 1 1 12 5  25 o 70.93000 0.5048000 71.08000 0.7116000 70.79000 0.7162000 0.2927000      1.010000  
1 1 1 12 5  27 o 30.16000 0.3675000 30.07000 0.4154000 30.24000 0.6063000 -0.1750000     0.7350000 
1 1 1 12 5  29 o 16.76000 0.3274000 16.81000 0.4538000 16.72000 0.4720000 0.9628000E-01  0.6548000 
1 1 1 12 5  31 o 10.94000 0.4819000 10.95000 0.7215000 10.94000 0.6390000 0.3526000E-02  0.9638000 
1 1 1 12 5  33 o 11.74000 0.4401000 11.09000 0.6204000 12.39000 0.6243000 -1.298000      0.8801000 
1 1 1 12 5  35 o 65.88000 0.6194000 65.92000 0.9589000 65.84000 0.7843000 0.8472000E-01  1.239000  
1 1 1 12 5  37 o 56.54000 0.4253000 56.59000 0.6005000 56.49000 0.6024000 0.1047000      0.8506000 
1 1 1 12 5  39 o 32.88000 0.3474000 33.22000 0.4481000 32.54000 0.5310000 0.6773000      0.6948000 
1 1 1 12 5  41 o 22.22000 0.3462000 22.26000 0.4781000 22.18000 0.5009000 0.7225000E-01  0.6924000 
1 1 1 12 5  43 o 19.92000 0.3939000 19.91000 0.5095000 19.92000 0.6008000 -0.2731000E-02 0.7877000 
1 1 1 12 5  45 o 16.44000 0.4516000 16.67000 0.6758000 16.21000 0.5993000 0.4622000      0.9033000 
1 1 1 12 5  47 o 4.017000 1.037000  4.384000 1.418000  3.650000 1.514000  0.7343000      2.075000  
1 1 1 12 5  49 o 3.911000 1.015000  3.765000 1.468000  4.057000 1.402000  -0.2920000     2.029000  
1 1 1 12 5  51 o 19.98000 0.3537000 19.59000 0.4861000 20.37000 0.5140000 -0.7803000     0.7075000 
1 1 1 12 5  53 o 5.726000 0.8811000 4.427000 1.376000  7.026000 1.101000  -2.600000      1.762000  
1 1 1 12 5  55 o 3.104000 0.9071000 3.594000 1.370000  2.614000 1.190000  0.9800000      1.814000  
1 1 1 12 5  57 o 4.759000 1.001000  4.754000 1.423000  4.764000 1.407000  -0.9634000E-02 2.001000  
1 1 1 12 5  59 o 4.235000 1.034000  4.883000 1.522000  3.587000 1.400000  1.296000       2.069000  
1 1 1 12 5  61 o 7.802000 0.7808000 7.814000 1.068000  7.789000 1.139000  0.2494000E-01  1.562000  
1 1 1 12 5  63 o 4.056000 1.082000  3.173000 1.413000  4.939000 1.639000  -1.766000      2.164000  
1 1 1 12 5  65 o 2.612000 0.8528000 2.987000 1.319000  2.237000 1.082000  0.7502000      1.706000  
1 1 1 12 6  0  o 59.79000 0.5922000 59.79000 0.5922000 59.79000 0.5922000 0.000000       0.000000  
1 1 1 12 6  2  o 34.37000 0.2589000 34.01000 0.3630000 34.73000 0.3692000 -0.7144000     0.5177000 
1 1 1 12 6  4  o 40.31000 0.3686000 39.98000 0.4139000 40.64000 0.6100000 -0.6646000     0.7372000 
1 1 1 12 6  6  o 20.84000 0.1956000 21.07000 0.2755000 20.61000 0.2776000 0.4601000      0.3911000 
1 1 1 12 6  8  o 38.51000 0.3098000 38.31000 0.4659000 38.71000 0.4083000 -0.4013000     0.6195000 
1 1 1 12 6  10 o 114.9000 0.7857000 115.5000 1.116000  114.4000 1.106000  1.021000       1.571000  
1 1 1 12 6  12 o 148.1000 1.009000  149.1000 1.436000  147.0000 1.417000  2.017000       2.017000  
1 1 1 12 6  14 o 42.05000 0.3426000 41.66000 0.5188000 42.43000 0.4476000 -0.7721000     0.6852000 
1 1 1 12 6  16 o 132.3000 0.9318000 133.1000 1.150000  131.4000 1.466000  1.752000       1.864000  
1 1 1 12 6  18 o 75.95000 0.5745000 76.14000 0.7517000 75.77000 0.8690000 0.3708000      1.149000  
1 1 1 12 6  20 o 52.49000 0.4771000 52.57000 0.5479000 52.40000 0.7813000 0.1755000      0.9542000 
1 1 1 12 6  22 o 19.60000 0.3621000 19.92000 0.4038000 19.28000 0.6011000 0.6364000      0.7242000 
1 1 1 12 6  24 o 39.94000 0.3998000 40.45000 0.6498000 39.43000 0.4659000 1.026000       0.7996000 
1 1 1 12 6  26 o 51.36000 0.3874000 51.29000 0.5417000 51.44000 0.5540000 -0.1495000     0.7748000 
1 1 1 12 6  28 o 40.95000 0.3614000 41.26000 0.4699000 40.65000 0.5492000 0.6156000      0.7228000 
1 1 1 12 6  30 o 37.92000 0.3892000 38.45000 0.4538000 37.38000 0.6325000 1.069000       0.7784000 
1 1 1 12 6  32 o 22.93000 0.3897000 22.16000 0.5960000 23.70000 0.5022000 -1.530000      0.7794000 
1 1 1 12 6  34 o 13.39000 0.3753000 13.66000 0.5212000 13.13000 0.5401000 0.5272000      0.7505000 
1 1 1 12 6  36 o 15.44000 0.3750000 15.61000 0.5312000 15.27000 0.5294000 0.3397000      0.7499000 
1 1 1 12 6  38 o 32.04000 0.4094000 31.66000 0.5024000 32.41000 0.6465000 -0.7529000     0.8187000 
1 1 1 12 6  40 o 22.85000 0.3430000 22.61000 0.4743000 23.08000 0.4957000 -0.4692000     0.6861000 
1 1 1 12 6  42 o 27.79000 0.3596000 27.23000 0.4612000 28.36000 0.5519000 -1.136000      0.7192000 
1 1 1 12 6  44 o 21.12000 0.3547000 21.24000 0.5011000 21.00000 0.5021000 0.2418000      0.7094000 
1 1 1 12 6  46 o 23.17000 0.3384000 23.16000 0.4788000 23.19000 0.4782000 -0.2972000E-01 0.6767000 
1 1 1 12 6  48 f 20.81000 0.4320000 20.48000 0.7075000 21.13000 0.4959000 -0.6496000     0.8640000 
1 1 1 12 6  50 o 27.01000 0.3528000 26.83000 0.4616000 27.20000 0.5337000 -0.3707000     0.7056000 
1 1 1 12 6  52 o 6.246000 0.8162000 6.609000 1.114000  5.883000 1.194000  0.7269000      1.632000  
1 1 1 12 6  54 o 8.301000 0.6673000 8.587000 0.8527000 8.015000 1.027000  0.5719000      1.335000  
1 1 1 12 6  56 o 5.146000 0.9223000 4.456000 1.412000  5.836000 1.186000  -1.381000      1.845000  
1 1 1 12 6  58 o 3.667000 0.9628000 3.531000 1.336000  3.803000 1.387000  -0.2724000     1.926000  
1 1 1 12 6  60 o 3.231000 0.9679000 3.391000 1.430000  3.070000 1.304000  0.3212000      1.936000  
1 1 1 12 6  62 o 5.538000 1.063000  4.586000 1.569000  6.491000 1.435000  -1.905000      2.126000  
1 1 1 12 6  64 o 3.028000 0.9385000 2.239000 1.077000  3.817000 1.538000  -1.578000      1.877000  
1 1 1 12 7  1  o 17.48000 0.2178000 17.56000 0.3112000 17.41000 0.3049000 0.1466000      0.4356000 
1 1 1 12 7  3  o 106.1000 0.7259000 106.3000 1.028000  106.0000 1.025000  0.3008000      1.452000  
1 1 1 12 7  5  o 32.71000 0.2723000 32.65000 0.3540000 32.77000 0.4138000 -0.1221000     0.5446000 
1 1 1 12 7  7  o 44.34000 0.3215000 44.40000 0.4556000 44.27000 0.4536000 0.1361000      0.6429000 
1 1 1 12 7  9  o 41.86000 0.3331000 42.12000 0.5058000 41.60000 0.4337000 0.5209000      0.6663000 
1 1 1 12 7  11 o 15.42000 0.2347000 15.62000 0.3350000 15.22000 0.3289000 0.3989000      0.4695000 
1 1 1 12 7  13 o 20.20000 0.2495000 20.62000 0.3570000 19.77000 0.3488000 0.8443000      0.4991000 
1 1 1 12 7  15 o 82.43000 0.5898000 83.28000 0.7293000 81.58000 0.9270000 1.705000       1.180000  
1 1 1 12 7  17 o 44.03000 0.3619000 44.12000 0.4722000 43.93000 0.5485000 0.1963000      0.7237000 
1 1 1 12 7  19 o 67.28000 0.5158000 67.24000 0.6727000 67.32000 0.7820000 -0.8218000E-01 1.032000  
1 1 1 12 7  21 f 50.58000 0.4661000 50.57000 0.5341000 50.60000 0.7640000 -0.3020000E-01 0.9322000 
1 1 1 12 7  23 o 32.39000 0.3473000 32.63000 0.3706000 32.14000 0.5874000 0.4811000      0.6946000 
1 1 1 12 7  25 o 37.42000 0.3152000 36.92000 0.4296000 37.92000 0.4614000 -0.9985000     0.6304000 
1 1 1 12 7  27 f 69.99000 0.5390000 70.52000 0.7071000 69.45000 0.8137000 1.063000       1.078000  
1 1 1 12 7  29 o 44.00000 0.3503000 44.15000 0.4883000 43.85000 0.5023000 0.2988000      0.7005000 
1 1 1 12 7  31 o 35.67000 0.3827000 35.83000 0.4388000 35.51000 0.6270000 0.3142000      0.7653000 
1 1 1 12 7  33 o 29.57000 0.3029000 30.01000 0.4229000 29.12000 0.4337000 0.8922000      0.6057000 
1 1 1 12 7  35 o 24.48000 0.4020000 24.70000 0.6240000 24.26000 0.5068000 0.4324000      0.8039000 
1 1 1 12 7  37 o 56.37000 0.4567000 56.31000 0.6852000 56.43000 0.6040000 -0.1177000     0.9135000 
1 1 1 12 7  39 o 11.55000 0.4824000 11.57000 0.6827000 11.53000 0.6817000 0.4445000E-01  0.9648000 
1 1 1 12 7  41 o 22.58000 0.3675000 22.08000 0.4865000 23.08000 0.5510000 -0.9917000     0.7350000 
1 1 1 12 7  43 o 36.51000 0.3431000 36.07000 0.4766000 36.95000 0.4936000 -0.8871000     0.6862000 
1 1 1 12 7  45 o 14.88000 0.4701000 14.46000 0.7223000 15.29000 0.6019000 -0.8327000     0.9402000 
1 1 1 12 7  47 o 33.94000 0.3919000 33.89000 0.5361000 33.98000 0.5718000 -0.8802000E-01 0.7838000 
1 1 1 12 7  49 o 20.82000 0.3535000 19.98000 0.5306000 21.66000 0.4671000 -1.679000      0.7069000 
1 1 1 12 7  51 o 10.43000 0.5514000 10.27000 0.7123000 10.58000 0.8419000 -0.3083000     1.103000  
1 1 1 12 7  53 o 8.087000 0.6287000 7.683000 0.9113000 8.491000 0.8663000 -0.8086000     1.257000  
1 1 1 12 7  55 o 8.517000 0.6370000 7.897000 0.9274000 9.138000 0.8736000 -1.242000      1.274000  
1 1 1 12 7  57 o 4.046000 1.079000  3.722000 1.479000  4.371000 1.571000  -0.6493000     2.158000  
1 1 1 12 7  59 o 4.322000 1.147000  3.732000 1.681000  4.913000 1.559000  -1.181000      2.293000  
1 1 1 12 7  61 f 8.235000 0.7278000 7.980000 1.048000  8.489000 1.011000  -0.5090000     1.456000  
1 1 1 12 7  63 o 7.647000 0.7797000 7.726000 1.101000  7.568000 1.104000  0.1574000      1.559000  
1 1 1 12 7  65 o 3.320000 0.9812000 3.727000 1.498000  2.914000 1.268000  0.8135000      1.962000  
1 1 1 12 8  0  o 4.651000 0.5132000 4.651000 0.5132000 4.651000 0.5132000 0.000000       0.000000  
1 1 1 12 8  2  o 16.84000 0.2123000 17.10000 0.3026000 16.59000 0.2979000 0.5056000      0.4246000 
1 1 1 12 8  4  o 53.58000 0.4100000 53.17000 0.5314000 53.98000 0.6246000 -0.8143000     0.8200000 
1 1 1 12 8  6  o 25.99000 0.2174000 26.20000 0.3092000 25.79000 0.3058000 0.4096000      0.4348000 
1 1 1 12 8  8  o 78.51000 0.5425000 78.10000 0.7630000 78.91000 0.7715000 -0.8133000     1.085000  
1 1 1 12 8  10 o 98.78000 0.6784000 98.22000 0.9534000 99.34000 0.9655000 -1.123000      1.357000  
1 1 1 12 8  12 o 118.1000 0.8074000 118.8000 1.149000  117.4000 1.135000  1.420000       1.615000  
1 1 1 12 8  14 o 116.2000 0.8206000 116.9000 1.012000  115.5000 1.293000  1.346000       1.641000  
1 1 1 12 8  16 o 118.1000 0.8348000 118.4000 1.025000  117.7000 1.318000  0.7128000      1.670000  
1 1 1 12 8  18 o 112.9000 0.8377000 113.2000 1.099000  112.6000 1.265000  0.6341000      1.675000  
1 1 1 12 8  20 o 64.70000 0.7194000 64.58000 0.5817000 64.82000 1.316000  -0.2404000     1.439000  
1 1 1 12 8  22 o 87.09000 0.7183000 87.22000 0.7669000 86.95000 1.215000  0.2666000      1.437000  
1 1 1 12 8  24 o 32.86000 0.3163000 32.85000 0.4077000 32.88000 0.4836000 -0.3185000E-01 0.6326000 
1 1 1 12 8  26 o 25.56000 0.3077000 25.76000 0.3884000 25.36000 0.4774000 0.3988000      0.6155000 
1 1 1 12 8  28 o 21.30000 0.3037000 21.54000 0.4042000 21.06000 0.4533000 0.4772000      0.6074000 
1 1 1 12 8  30 o 25.97000 0.2948000 25.72000 0.3988000 26.21000 0.4342000 -0.4826000     0.5895000 
1 1 1 12 8  32 f 35.40000 0.3411000 35.41000 0.5081000 35.38000 0.4553000 0.2840000E-01  0.6823000 
1 1 1 12 8  34 o 15.05000 0.6208000 15.51000 0.5550000 14.59000 1.111000  0.9222000      1.242000  
1 1 1 12 8  36 f 16.46000 0.4050000 16.19000 0.6188000 16.72000 0.5226000 -0.5347000     0.8099000 
1 1 1 12 8  38 o 41.57000 0.4469000 41.64000 0.5655000 41.49000 0.6922000 0.1480000      0.8938000 
1 1 1 12 8  40 o 17.45000 0.3656000 17.57000 0.4882000 17.33000 0.5442000 0.2473000      0.7311000 
1 1 1 12 8  42 o 9.064000 0.6350000 9.106000 0.8856000 9.023000 0.9103000 0.8289000E-01  1.270000  
1 1 1 12 8  44 o 32.08000 0.3599000 32.07000 0.5347000 32.09000 0.4820000 -0.2569000E-01 0.7199000 
1 1 1 12 8  46 o 25.33000 0.4178000 25.64000 0.5349000 25.03000 0.6420000 0.6134000      0.8356000 
1 1 1 12 8  48 o 19.81000 0.4192000 19.95000 0.7022000 19.66000 0.4582000 0.2914000      0.8385000 
1 1 1 12 8  50 o 11.76000 0.6056000 12.19000 0.7902000 11.32000 0.9179000 0.8760000      1.211000  
1 1 1 12 8  52 f 4.966000 0.9789000 3.857000 1.510000  6.075000 1.246000  -2.218000      1.958000  
1 1 1 12 8  54 o 11.07000 0.4699000 10.70000 0.6450000 11.44000 0.6836000 -0.7457000     0.9399000 
1 1 1 12 8  56 o 11.14000 0.5099000 10.76000 0.7055000 11.51000 0.7364000 -0.7539000     1.020000  
1 1 1 12 8  58 o 3.465000 0.9531000 3.250000 1.300000  3.681000 1.394000  -0.4311000     1.906000  
1 1 1 12 8  60 o 3.654000 1.040000  3.337000 1.439000  3.970000 1.502000  -0.6332000     2.080000  
1 1 1 12 8  62 o 8.342000 0.7185000 8.146000 1.065000  8.537000 0.9648000 -0.3910000     1.437000  
1 1 1 12 8  64 o 4.181000 1.010000  4.460000 1.469000  3.903000 1.386000  0.5576000      2.020000  
1 1 1 12 9  1  o 97.74000 0.6696000 96.98000 0.9396000 98.50000 0.9542000 -1.519000      1.339000  
1 1 1 12 9  3  o 93.53000 0.6417000 94.14000 0.9135000 92.91000 0.9014000 1.229000       1.283000  
1 1 1 12 9  5  o 56.34000 0.4296000 56.70000 0.5663000 55.97000 0.6462000 0.7250000      0.8592000 
1 1 1 12 9  7  o 87.36000 0.6013000 88.27000 0.8588000 86.46000 0.8419000 1.806000       1.203000  
1 1 1 12 9  9  o 102.6000 0.7604000 102.7000 1.151000  102.5000 0.9944000 0.2831000      1.521000  
1 1 1 12 9  11 o 52.80000 0.3782000 52.70000 0.5337000 52.91000 0.5359000 -0.2156000     0.7564000 
1 1 1 12 9  13 o 14.79000 0.2633000 14.82000 0.3240000 14.76000 0.4151000 0.6295000E-01  0.5266000 
1 1 1 12 9  15 o 88.39000 0.6315000 88.65000 0.7744000 88.14000 0.9978000 0.5072000      1.263000  
1 1 1 12 9  17 f 57.48000 0.4790000 57.23000 0.6722000 57.72000 0.6826000 -0.4853000     0.9581000 
1 1 1 12 9  19 o 54.52000 0.4735000 53.79000 0.4957000 55.26000 0.8069000 -1.470000      0.9470000 
1 1 1 12 9  21 o 49.76000 0.4459000 49.43000 0.4659000 50.08000 0.7604000 -0.6528000     0.8918000 
1 1 1 12 9  23 o 10.97000 0.4429000 12.23000 0.4667000 9.711000 0.7528000 2.520000       0.8857000 
1 1 1 12 9  25 o 37.32000 0.3398000 37.14000 0.4355000 37.51000 0.5217000 -0.3742000     0.6796000 
1 1 1 12 9  27 o 23.89000 0.3116000 24.06000 0.4624000 23.72000 0.4180000 0.3353000      0.6233000 
1 1 1 12 9  29 o 34.82000 0.3107000 35.03000 0.4283000 34.60000 0.4502000 0.4279000      0.6214000 
1 1 1 12 9  31 o 37.53000 0.3217000 37.19000 0.4442000 37.88000 0.4654000 -0.6910000     0.6433000 
1 1 1 12 9  33 o 20.39000 0.3363000 19.54000 0.5037000 21.25000 0.4456000 -1.709000      0.6725000 
1 1 1 12 9  35 o 22.78000 0.3782000 22.28000 0.4336000 23.28000 0.6197000 -0.9992000     0.7564000 
1 1 1 12 9  37 o 32.79000 0.4522000 32.28000 0.6232000 33.30000 0.6554000 -1.019000      0.9044000 
1 1 1 12 9  39 o 14.78000 0.4263000 14.02000 0.6928000 15.55000 0.4970000 -1.528000      0.8526000 
1 1 1 12 9  41 f 16.31000 0.4012000 16.14000 0.6436000 16.48000 0.4793000 -0.3362000     0.8025000 
1 1 1 12 9  43 o 32.03000 0.3425000 32.07000 0.5357000 31.99000 0.4269000 0.8244000E-01  0.6849000 
1 1 1 12 9  45 o 20.47000 0.3705000 20.68000 0.5826000 20.25000 0.4578000 0.4327000      0.7409000 
1 1 1 12 9  47 o 8.813000 0.7593000 9.922000 1.189000  7.705000 0.9448000 2.217000       1.519000  
1 1 1 12 9  49 o 13.54000 0.6458000 13.61000 1.167000  13.47000 0.5543000 0.1347000      1.292000  
1 1 1 12 9  51 o 8.331000 0.6431000 9.068000 0.9998000 7.594000 0.8092000 1.474000       1.286000  
1 1 1 12 9  53 o 11.19000 0.5035000 11.37000 0.8050000 11.01000 0.6051000 0.3632000      1.007000  
1 1 1 12 9  55 o 7.521000 0.8672000 7.849000 1.420000  7.192000 0.9964000 0.6576000      1.734000  
1 1 1 12 9  57 o 3.722000 1.057000  3.299000 1.415000  4.145000 1.570000  -0.8457000     2.114000  
1 1 1 12 9  59 o 4.306000 1.040000  4.344000 1.473000  4.267000 1.468000  0.7762000E-01  2.079000  
1 1 1 12 9  61 o 5.756000 1.039000  6.816000 1.263000  4.697000 1.651000  2.119000       2.078000  
1 1 1 12 9  63 o 3.199000 0.9970000 3.176000 1.363000  3.222000 1.456000  -0.4590000E-01 1.994000  
1 1 1 12 9  65 o 8.246000 0.7303000 7.986000 1.132000  8.505000 0.9236000 -0.5197000     1.461000  
1 1 1 12 10 0  o 94.44000 0.9157000 94.44000 0.9157000 94.44000 0.9157000 0.000000       0.000000  
1 1 1 12 10 2  o 94.13000 0.6458000 95.03000 0.9217000 93.23000 0.9049000 1.794000       1.292000  
1 1 1 12 10 4  o 133.7000 0.9112000 134.4000 1.295000  133.0000 1.282000  1.335000       1.822000  
1 1 1 12 10 6  f 23.46000 0.2605000 23.60000 0.3361000 23.32000 0.3981000 0.2828000      0.5210000 
1 1 1 12 10 8  o 92.18000 0.6865000 91.59000 0.8909000 92.77000 1.045000  -1.182000      1.373000  
1 1 1 12 10 10 o 125.4000 0.8569000 125.5000 1.212000  125.4000 1.212000  0.1156000      1.714000  
1 1 1 12 10 12 o 78.78000 0.5658000 78.56000 0.6884000 79.01000 0.8980000 -0.4475000     1.132000  
1 1 1 12 10 14 o 134.1000 0.9456000 134.1000 1.158000  134.0000 1.495000  0.1369000      1.891000  
1 1 1 12 10 16 o 32.34000 0.2965000 32.11000 0.3751000 32.57000 0.4592000 -0.4633000     0.5930000 
1 1 1 12 10 18 o 66.71000 0.5794000 66.94000 0.6708000 66.49000 0.9449000 0.4442000      1.159000  
1 1 1 12 10 20 f 46.33000 0.4217000 46.42000 0.4436000 46.23000 0.7174000 0.1889000      0.8435000 
1 1 1 12 10 22 o 32.05000 0.3600000 31.69000 0.4109000 32.42000 0.5913000 -0.7322000     0.7201000 
1 1 1 12 10 24 o 38.28000 0.3610000 37.83000 0.4919000 38.72000 0.5285000 -0.8834000     0.7220000 
1 1 1 12 10 26 o 50.82000 0.3833000 50.53000 0.5314000 51.10000 0.5524000 -0.5731000     0.7665000 
1 1 1 12 10 28 o 27.60000 0.2909000 27.41000 0.3878000 27.78000 0.4338000 -0.3656000     0.5819000 
1 1 1 12 10 30 o 41.95000 0.3406000 42.02000 0.4741000 41.87000 0.4890000 0.1455000      0.6811000 
1 1 1 12 10 32 o 31.39000 0.3042000 31.11000 0.4143000 31.68000 0.4456000 -0.5736000     0.6084000 
1 1 1 12 10 34 o 28.73000 0.3837000 28.35000 0.5632000 29.11000 0.5212000 -0.7628000     0.7674000 
1 1 1 12 10 36 o 38.07000 0.3581000 37.35000 0.5303000 38.78000 0.4812000 -1.431000      0.7161000 
1 1 1 12 10 38 o 24.62000 0.4076000 25.50000 0.5243000 23.74000 0.6242000 1.765000       0.8152000 
1 1 1 12 10 40 o 28.80000 0.3452000 29.03000 0.5180000 28.56000 0.4564000 0.4691000      0.6904000 
1 1 1 12 10 42 o 31.28000 0.3364000 31.06000 0.5248000 31.50000 0.4211000 -0.4448000     0.6729000 
1 1 1 12 10 44 o 11.23000 0.5910000 10.41000 1.008000  12.06000 0.6176000 -1.657000      1.182000  
1 1 1 12 10 46 o 15.83000 0.4374000 16.33000 0.6609000 15.32000 0.5730000 1.016000       0.8747000 
1 1 1 12 10 48 o 14.38000 0.4457000 14.06000 0.7419000 14.70000 0.4942000 -0.6343000     0.8915000 
1 1 1 12 10 50 o 7.847000 0.7011000 7.811000 1.056000  7.882000 0.9230000 -0.7118000E-01 1.402000  
1 1 1 12 10 52 o 4.833000 1.037000  4.991000 1.523000  4.675000 1.408000  0.3165000      2.074000  
1 1 1 12 10 54 o 3.490000 1.010000  3.887000 1.583000  3.092000 1.255000  0.7949000      2.020000  
1 1 1 12 10 56 o 9.781000 0.5808000 9.507000 0.9600000 10.05000 0.6539000 -0.5483000     1.162000  
1 1 1 12 10 58 o 7.733000 0.7732000 6.607000 1.289000  8.859000 0.8548000 -2.252000      1.546000  
1 1 1 12 10 60 o 5.580000 1.205000  6.553000 1.782000  4.608000 1.623000  1.945000       2.410000  
1 1 1 12 10 62 o 5.532000 0.9315000 6.770000 1.063000  4.293000 1.530000  2.477000       1.863000  
1 1 1 12 10 64 o 6.254000 0.9020000 5.863000 1.449000  6.646000 1.075000  -0.7834000     1.804000  
1 1 1 12 11 1  o 75.38000 0.5219000 76.10000 0.7447000 74.65000 0.7313000 1.448000       1.044000  
1 1 1 12 11 3  f 41.07000 0.3009000 40.97000 0.4239000 41.17000 0.4272000 -0.2087000     0.6018000 
1 1 1 12 11 5  o 8.539000 0.2463000 8.862000 0.3114000 8.217000 0.3816000 0.6456000      0.4925000 
1 1 1 12 11 7  o 103.4000 0.7085000 103.3000 1.001000  103.5000 1.003000  -0.1551000     1.417000  
1 1 1 12 11 9  o 69.32000 0.5594000 69.45000 0.7913000 69.20000 0.7909000 0.2458000      1.119000  
1 1 1 12 11 11 o 129.3000 0.9110000 130.5000 1.126000  128.2000 1.432000  2.289000       1.822000  
1 1 1 12 11 13 o 98.90000 0.7058000 97.93000 0.8511000 99.86000 1.126000  -1.926000      1.412000  
1 1 1 12 11 15 o 106.0000 0.7864000 106.7000 1.035000  105.3000 1.185000  1.347000       1.573000  
1 1 1 12 11 17 f 42.69000 0.3866000 43.06000 0.4132000 42.32000 0.6535000 0.7363000      0.7732000 
1 1 1 12 11 19 o 40.24000 0.4232000 39.51000 0.5254000 40.97000 0.6635000 -1.463000      0.8464000 
1 1 1 12 11 21 o 74.24000 0.6214000 73.87000 0.6570000 74.60000 1.055000  -0.7355000     1.243000  
1 1 1 12 11 23 o 57.19000 0.5401000 57.20000 0.8328000 57.18000 0.6878000 0.1678000E-01  1.080000  
1 1 1 12 11 25 o 45.56000 0.3660000 45.52000 0.4422000 45.59000 0.5833000 -0.7215000E-01 0.7319000 
1 1 1 12 11 27 o 49.39000 0.3767000 49.78000 0.5246000 49.00000 0.5408000 0.7813000      0.7534000 
1 1 1 12 11 29 o 48.10000 0.3707000 47.97000 0.5135000 48.24000 0.5348000 -0.2764000     0.7414000 
1 1 1 12 11 31 o 42.65000 0.3454000 43.16000 0.4812000 42.15000 0.4956000 1.018000       0.6908000 
1 1 1 12 11 33 o 33.10000 0.4965000 32.91000 0.8831000 33.28000 0.4539000 -0.3719000     0.9929000 
1 1 1 12 11 35 o 34.65000 0.3832000 35.13000 0.6187000 34.16000 0.4524000 0.9680000      0.7665000 
1 1 1 12 11 37 o 38.33000 0.5401000 38.67000 0.9691000 37.99000 0.4773000 0.6752000      1.080000  
1 1 1 12 11 39 o 28.05000 0.3689000 27.64000 0.5180000 28.45000 0.5255000 -0.8098000     0.7379000 
1 1 1 12 11 41 o 18.33000 0.3865000 18.53000 0.6035000 18.13000 0.4830000 0.3980000      0.7729000 
1 1 1 12 11 43 o 20.96000 0.3691000 21.40000 0.5763000 20.52000 0.4612000 0.8776000      0.7382000 
1 1 1 12 11 45 o 31.72000 0.3494000 31.45000 0.5494000 31.99000 0.4318000 -0.5427000     0.6988000 
1 1 1 12 11 47 o 31.06000 0.3960000 31.12000 0.6442000 31.00000 0.4608000 0.1256000      0.7920000 
1 1 1 12 11 49 o 11.65000 0.5371000 11.51000 0.8208000 11.80000 0.6929000 -0.2872000     1.074000  
1 1 1 12 11 51 o 24.27000 0.4159000 24.26000 0.6371000 24.28000 0.5349000 -0.2169000E-01 0.8318000 
1 1 1 12 11 53 o 5.253000 0.9123000 6.240000 1.368000  4.266000 1.207000  1.974000       1.825000  
1 1 1 12 11 55 o 3.943000 1.007000  4.062000 1.549000  3.824000 1.288000  0.2378000      2.015000  
1 1 1 12 11 57 o 9.232000 0.6200000 10.03000 0.9573000 8.436000 0.7882000 1.594000       1.240000  
1 1 1 12 11 59 o 5.991000 0.9382000 6.113000 1.468000  5.868000 1.169000  0.2450000      1.876000  
1 1 1 12 11 61 o 5.773000 1.076000  5.149000 1.880000  6.397000 1.046000  -1.248000      2.151000  
1 1 1 12 11 63 o 3.166000 0.9470000 3.321000 1.389000  3.011000 1.287000  0.3095000      1.894000  
1 1 1 12 11 65 o 5.681000 1.387000  6.699000 2.165000  4.663000 1.732000  2.037000       2.773000  
1 1 1 12 12 0  o 12.16000 0.2668000 12.16000 0.2668000 12.16000 0.2668000 0.000000       0.000000  
1 1 1 12 12 2  o 70.07000 0.4872000 70.10000 0.6901000 70.04000 0.6879000 0.6013000E-01  0.9744000 
1 1 1 12 12 4  o 111.6000 0.7632000 112.6000 1.089000  110.5000 1.070000  2.025000       1.526000  
1 1 1 12 12 6  o 56.87000 0.4014000 56.66000 0.5654000 57.08000 0.5698000 -0.4275000     0.8027000 
1 1 1 12 12 8  o 37.99000 0.2868000 37.62000 0.4023000 38.36000 0.4089000 -0.7408000     0.5736000 
1 1 1 12 12 10 o 80.19000 0.5748000 80.21000 0.7011000 80.17000 0.9111000 0.3861000E-01  1.150000  
1 1 1 12 12 12 o 54.69000 0.4866000 53.58000 0.5394000 55.79000 0.8100000 -2.216000      0.9732000 
1 1 1 12 12 14 o 96.00000 0.7162000 95.27000 0.9269000 96.74000 1.092000  -1.469000      1.432000  
1 1 1 12 12 16 o 52.26000 0.4666000 52.48000 0.5343000 52.04000 0.7650000 0.4393000      0.9331000 
1 1 1 12 12 18 o 67.36000 0.4935000 67.67000 0.6032000 67.05000 0.7812000 0.6227000      0.9870000 
1 1 1 12 12 20 o 32.26000 0.4662000 31.94000 0.3954000 32.58000 0.8444000 -0.6398000     0.9324000 
1 1 1 12 12 22 o 67.90000 0.5212000 68.36000 0.6809000 67.44000 0.7891000 0.9225000      1.042000  
1 1 1 12 12 24 o 28.83000 0.3336000 28.57000 0.4590000 29.08000 0.4843000 -0.5065000     0.6673000 
1 1 1 12 12 26 o 21.33000 0.3064000 21.34000 0.3510000 21.32000 0.5022000 0.1776000E-01  0.6127000 
1 1 1 12 12 28 o 7.490000 0.5791000 8.023000 0.7081000 6.958000 0.9165000 1.065000       1.158000  
1 1 1 12 12 30 o 23.49000 0.2912000 23.56000 0.3935000 23.42000 0.4293000 0.1414000      0.5824000 
1 1 1 12 12 32 o 30.60000 0.3204000 31.00000 0.4785000 30.20000 0.4264000 0.7947000      0.6409000 
1 1 1 12 12 34 o 32.45000 0.4386000 31.65000 0.5856000 33.24000 0.6532000 -1.588000      0.8772000 
1 1 1 12 12 36 o 32.26000 0.3226000 32.13000 0.4973000 32.39000 0.4111000 -0.2667000     0.6452000 
1 1 1 12 12 38 o 45.64000 0.4591000 45.71000 0.7489000 45.57000 0.5312000 0.1385000      0.9182000 
1 1 1 12 12 40 o 35.10000 0.3458000 35.02000 0.5389000 35.18000 0.4335000 -0.1674000     0.6917000 
1 1 1 12 12 42 o 16.42000 0.4089000 16.62000 0.6555000 16.23000 0.4890000 0.3979000      0.8178000 
1 1 1 12 12 44 o 15.91000 0.4246000 15.92000 0.6795000 15.90000 0.5094000 0.2089000E-01  0.8493000 
1 1 1 12 12 46 o 32.53000 0.4399000 32.29000 0.6788000 32.78000 0.5599000 -0.4851000     0.8799000 
1 1 1 12 12 48 o 25.83000 0.3921000 25.88000 0.6395000 25.77000 0.4537000 0.1082000      0.7841000 
1 1 1 12 12 50 o 18.99000 0.5614000 20.12000 1.007000  17.86000 0.4971000 2.267000       1.123000  
1 1 1 12 12 52 o 19.08000 0.3684000 19.19000 0.5690000 18.98000 0.4682000 0.2030000      0.7369000 
1 1 1 12 12 54 o 10.33000 0.5433000 11.12000 0.8452000 9.550000 0.6828000 1.569000       1.087000  
1 1 1 12 12 56 o 14.49000 0.4501000 15.10000 0.6920000 13.89000 0.5759000 1.216000       0.9003000 
1 1 1 12 12 58 o 6.755000 1.109000  7.043000 1.998000  6.467000 0.9629000 0.5761000      2.218000  
1 1 1 12 12 60 o 6.239000 1.088000  5.656000 1.866000  6.822000 1.120000  -1.167000      2.176000  
1 1 1 12 12 62 f 7.493000 0.7712000 8.220000 1.222000  6.766000 0.9418000 1.454000       1.542000  
1 1 1 12 12 64 o 7.069000 0.8513000 8.432000 1.341000  5.707000 1.050000  2.725000       1.703000  
1 1 1 12 13 1  o 31.40000 0.2450000 31.67000 0.3484000 31.13000 0.3446000 0.5380000      0.4900000 
1 1 1 12 13 3  o 47.02000 0.3381000 46.76000 0.4757000 47.27000 0.4807000 -0.5079000     0.6762000 
1 1 1 12 13 5  o 58.45000 0.4466000 58.15000 0.5792000 58.75000 0.6799000 -0.5979000     0.8932000 
1 1 1 12 13 7  o 122.1000 0.8354000 121.1000 1.171000  123.1000 1.191000  -2.045000      1.671000  
1 1 1 12 13 9  o 58.96000 0.4524000 59.13000 0.5888000 58.79000 0.6869000 0.3392000      0.9048000 
1 1 1 12 13 11 o 77.15000 0.5553000 77.34000 0.6783000 76.97000 0.8793000 0.3696000      1.111000  
1 1 1 12 13 13 o 81.75000 0.5892000 80.79000 0.7087000 82.71000 0.9414000 -1.919000      1.178000  
1 1 1 12 13 15 o 66.64000 0.7735000 67.07000 0.7657000 66.21000 1.344000  0.8646000      1.547000  
1 1 1 12 13 17 o 90.99000 0.6542000 89.66000 0.7834000 92.32000 1.048000  -2.652000      1.308000  
1 1 1 12 13 19 o 94.64000 0.6789000 94.18000 0.8227000 95.11000 1.080000  -0.9295000     1.358000  
1 1 1 12 13 21 o 75.36000 0.6844000 76.41000 0.8735000 74.31000 1.054000  2.107000       1.369000  
1 1 1 12 13 23 o 66.76000 0.5160000 66.55000 0.6683000 66.98000 0.7864000 -0.4296000     1.032000  
1 1 1 12 13 25 o 66.26000 0.4921000 66.50000 0.5989000 66.02000 0.7809000 0.4852000      0.9841000 
1 1 1 12 13 27 o 11.59000 0.4038000 11.11000 0.4754000 12.08000 0.6529000 -0.9753000     0.8077000 
1 1 1 12 13 29 o 17.28000 0.3165000 17.81000 0.4831000 16.76000 0.4090000 1.050000       0.6330000 
1 1 1 12 13 31 o 25.39000 0.2972000 25.47000 0.4578000 25.32000 0.3791000 0.1495000      0.5944000 
1 1 1 12 13 33 f 12.51000 0.4769000 11.88000 0.7541000 13.13000 0.5840000 -1.252000      0.9538000 
1 1 1 12 13 35 f 31.04000 0.3967000 30.02000 0.5893000 32.05000 0.5313000 -2.027000      0.7935000 
1 1 1 12 13 37 o 19.51000 0.3820000 19.21000 0.5340000 19.80000 0.5464000 -0.5959000     0.7640000 
1 1 1 12 13 39 o 31.96000 0.3577000 32.05000 0.5326000 31.87000 0.4775000 0.1751000      0.7153000 
1 1 1 12 13 41 o 29.74000 0.3443000 29.91000 0.5386000 29.57000 0.4292000 0.3449000      0.6887000 
1 1 1 12 13 43 o 42.43000 0.4200000 42.28000 0.5871000 42.58000 0.6008000 -0.2963000     0.8400000 
1 1 1 12 13 45 o 21.06000 0.3824000 21.18000 0.5634000 20.94000 0.5171000 0.2378000      0.7647000 
1 1 1 12 13 47 o 18.86000 0.6095000 18.92000 1.072000  18.79000 0.5800000 0.1359000      1.219000  
1 1 1 12 13 49 o 13.05000 0.4745000 12.24000 0.7942000 13.87000 0.5194000 -1.628000      0.9490000 
1 1 1 12 13 51 o 6.816000 0.7875000 6.812000 1.226000  6.821000 0.9888000 -0.8920000E-02 1.575000  
1 1 1 12 13 53 o 8.680000 0.6001000 8.927000 0.9758000 8.433000 0.6988000 0.4936000      1.200000  
1 1 1 12 13 55 o 12.21000 0.4713000 11.97000 0.7683000 12.44000 0.5460000 -0.4606000     0.9426000 
1 1 1 12 13 57 o 11.26000 0.5568000 11.32000 0.9066000 11.20000 0.6466000 0.1157000      1.114000  
1 1 1 12 13 59 o 7.493000 0.9845000 8.086000 1.557000  6.900000 1.205000  1.187000       1.969000  
1 1 1 12 13 61 o 4.134000 1.169000  4.806000 1.832000  3.462000 1.452000  1.345000       2.337000  
1 1 1 12 13 63 o 4.860000 1.078000  4.677000 1.665000  5.043000 1.368000  -0.3662000     2.155000  
1 1 1 12 14 0  o 6.364000 0.4251000 6.364000 0.4251000 6.364000 0.4251000 0.000000       0.000000  
1 1 1 12 14 2  o 44.38000 0.3225000 43.89000 0.4517000 44.88000 0.4604000 -0.9945000     0.6449000 
1 1 1 12 14 4  o 55.65000 0.3944000 55.62000 0.5569000 55.68000 0.5587000 -0.6715000E-01 0.7888000 
1 1 1 12 14 6  o 125.8000 0.9934000 126.2000 1.409000  125.3000 1.400000  0.8511000      1.987000  
1 1 1 12 14 8  o 74.28000 0.6007000 74.22000 0.8495000 74.34000 0.8496000 -0.1227000     1.201000  
1 1 1 12 14 10 f 95.98000 0.7659000 96.52000 1.089000  95.43000 1.078000  1.094000       1.532000  
1 1 1 12 14 12 o 78.99000 0.6725000 78.86000 0.7704000 79.11000 1.103000  -0.2549000     1.345000  
1 1 1 12 14 14 o 81.89000 0.7366000 81.72000 0.9264000 82.06000 1.145000  -0.3389000     1.473000  
1 1 1 12 14 16 o 54.13000 0.4102000 53.37000 0.4878000 54.90000 0.6597000 -1.531000      0.8204000 
1 1 1 12 14 18 o 98.04000 0.8283000 99.55000 0.9701000 96.53000 1.343000  3.019000       1.657000  
1 1 1 12 14 20 o 46.45000 0.5785000 45.62000 0.4798000 47.27000 1.053000  -1.657000      1.157000  
1 1 1 12 14 22 o 46.77000 0.3701000 46.90000 0.4472000 46.65000 0.5898000 0.2429000      0.7401000 
1 1 1 12 14 24 o 57.01000 0.4338000 56.22000 0.5175000 57.81000 0.6965000 -1.590000      0.8677000 
1 1 1 12 14 26 o 49.42000 0.3883000 50.16000 0.4751000 48.68000 0.6144000 1.482000       0.7767000 
1 1 1 12 14 28 o 42.68000 0.3492000 42.79000 0.5446000 42.57000 0.4371000 0.2244000      0.6983000 
1 1 1 12 14 30 o 31.61000 0.3070000 31.62000 0.4735000 31.59000 0.3908000 0.2950000E-01  0.6139000 
1 1 1 12 14 32 f 14.02000 0.3762000 14.15000 0.5745000 13.89000 0.4858000 0.2530000      0.7524000 
1 1 1 12 14 34 o 17.36000 0.3442000 17.43000 0.5342000 17.29000 0.4343000 0.1373000      0.6885000 
1 1 1 12 14 36 o 12.79000 0.7066000 12.29000 1.320000  13.29000 0.5038000 -0.9965000     1.413000  
1 1 1 12 14 38 o 21.56000 0.4263000 21.03000 0.7387000 22.09000 0.4255000 -1.057000      0.8525000 
1 1 1 12 14 40 o 33.40000 0.3425000 33.53000 0.5357000 33.28000 0.4270000 0.2475000      0.6851000 
1 1 1 12 14 42 o 11.49000 0.5391000 11.87000 0.8455000 11.10000 0.6690000 0.7750000      1.078000  
1 1 1 12 14 44 o 19.56000 0.3853000 19.65000 0.6018000 19.47000 0.4813000 0.1813000      0.7706000 
1 1 1 12 14 46 o 28.91000 0.3851000 29.36000 0.6377000 28.46000 0.4318000 0.8992000      0.7701000 
1 1 1 12 14 48 o 34.46000 0.4148000 34.50000 0.6738000 34.42000 0.4842000 0.7436000E-01  0.8297000 
1 1 1 12 14 50 o 6.150000 0.9290000 7.022000 1.226000  5.278000 1.396000  1.744000       1.858000  
1 1 1 12 14 52 o 7.337000 0.7910000 6.783000 1.346000  7.890000 0.8307000 -1.106000      1.582000  
1 1 1 12 14 54 o 3.539000 0.8987000 2.941000 1.300000  4.138000 1.242000  -1.197000      1.797000  
1 1 1 12 14 56 o 9.181000 0.6431000 9.817000 0.9304000 8.546000 0.8882000 1.271000       1.286000  
1 1 1 12 14 58 o 3.783000 1.470000  ?        ?         3.783000 1.470000  ?              ?         
1 1 1 12 14 60 o 4.073000 1.040000  3.367000 1.480000  4.778000 1.461000  -1.411000      2.080000  
1 1 1 12 14 62 o 3.859000 1.039000  4.009000 1.559000  3.709000 1.373000  0.2994000      2.078000  
1 1 1 12 14 64 o 3.689000 1.048000  4.074000 1.636000  3.304000 1.312000  0.7704000      2.097000  
1 1 1 12 15 1  o 24.80000 0.2168000 24.46000 0.3055000 25.15000 0.3077000 -0.6872000     0.4336000 
1 1 1 12 15 3  o 86.27000 0.5950000 86.34000 0.8419000 86.19000 0.8411000 0.1512000      1.190000  
1 1 1 12 15 5  o 39.90000 0.3476000 39.42000 0.4856000 40.38000 0.4974000 -0.9650000     0.6952000 
1 1 1 12 15 7  o 42.71000 0.3744000 42.69000 0.5284000 42.73000 0.5306000 -0.4130000E-01 0.7489000 
1 1 1 12 15 9  o 43.09000 0.4284000 42.78000 0.6634000 43.40000 0.5422000 -0.6227000     0.8568000 
1 1 1 12 15 11 o 49.29000 0.7153000 49.38000 1.012000  49.21000 1.011000  0.1623000      1.431000  
1 1 1 12 15 13 o 12.51000 0.3020000 12.72000 0.2745000 12.30000 0.5381000 0.4195000      0.6041000 
1 1 1 12 15 15 o 33.67000 0.3439000 33.05000 0.3396000 34.28000 0.5981000 -1.233000      0.6878000 
1 1 1 12 15 17 o 39.08000 0.3983000 38.32000 0.5951000 39.83000 0.5296000 -1.509000      0.7966000 
1 1 1 12 15 19 o 100.4000 1.094000  101.7000 0.9885000 99.22000 1.951000  2.428000       2.187000  
1 1 1 12 15 21 o 103.5000 0.9270000 102.8000 1.159000  104.2000 1.447000  -1.383000      1.854000  
1 1 1 12 15 23 f 70.10000 0.5386000 70.53000 0.7045000 69.68000 0.8148000 0.8471000      1.077000  
1 1 1 12 15 25 o 40.54000 0.3610000 40.09000 0.4609000 40.98000 0.5556000 -0.8884000     0.7219000 
1 1 1 12 15 27 o 19.61000 0.2923000 19.41000 0.4122000 19.81000 0.4147000 -0.4012000     0.5847000 
1 1 1 12 15 29 f 30.68000 0.3025000 30.32000 0.4672000 31.04000 0.3843000 -0.7238000     0.6049000 
1 1 1 12 15 31 o 20.01000 0.3092000 20.26000 0.4778000 19.76000 0.3924000 0.5040000      0.6183000 
1 1 1 12 15 33 o 18.53000 0.3789000 19.30000 0.5764000 17.76000 0.4921000 1.541000       0.7579000 
1 1 1 12 15 35 o 16.01000 0.4099000 15.32000 0.6110000 16.70000 0.5465000 -1.385000      0.8198000 
1 1 1 12 15 37 o 49.46000 0.4224000 50.20000 0.6387000 48.72000 0.5528000 1.488000       0.8447000 
1 1 1 12 15 39 o 39.88000 0.4357000 41.04000 0.7175000 38.72000 0.4946000 2.322000       0.8714000 
1 1 1 12 15 41 o 27.84000 0.3420000 27.44000 0.5301000 28.23000 0.4322000 -0.7890000     0.6839000 
1 1 1 12 15 43 o 21.02000 0.3830000 20.37000 0.5983000 21.68000 0.4784000 -1.310000      0.7661000 
1 1 1 12 15 45 o 4.228000 1.074000  3.960000 1.571000  4.497000 1.465000  -0.5374000     2.148000  
1 1 1 12 15 47 o 23.72000 0.5282000 24.36000 0.8874000 23.08000 0.5733000 1.274000       1.056000  
1 1 1 12 15 49 o 3.999000 1.004000  3.554000 1.463000  4.444000 1.376000  -0.8902000     2.008000  
1 1 1 12 15 51 o 2.923000 0.9353000 3.331000 1.489000  2.514000 1.132000  0.8167000      1.871000  
1 1 1 12 15 53 o 13.18000 0.4440000 12.92000 0.7249000 13.45000 0.5130000 -0.5243000     0.8881000 
1 1 1 12 15 55 o 4.344000 0.7991000 2.660000 1.244000  6.027000 1.003000  -3.366000      1.598000  
1 1 1 12 15 57 f 4.520000 1.044000  4.639000 1.508000  4.401000 1.443000  0.2382000      2.087000  
1 1 1 12 15 59 f 4.714000 1.006000  4.046000 1.594000  5.381000 1.227000  -1.335000      2.011000  
1 1 1 12 15 61 o 7.113000 0.8829000 7.027000 1.458000  7.200000 0.9957000 -0.1729000     1.766000  
1 1 1 12 15 63 o 2.957000 0.9465000 3.487000 1.526000  2.427000 1.120000  1.060000       1.893000  
1 1 1 12 16 0  f 112.7000 1.091000  112.7000 1.091000  112.7000 1.091000  0.000000       0.000000  
1 1 1 12 16 2  o 57.54000 0.4073000 57.40000 0.5749000 57.68000 0.5772000 -0.2868000     0.8147000 
1 1 1 12 16 4  o 156.8000 1.069000  155.6000 1.501000  158.1000 1.524000  -2.478000      2.139000  
1 1 1 12 16 6  o 105.7000 0.8395000 105.3000 1.183000  106.1000 1.191000  -0.7858000     1.679000  
1 1 1 12 16 8  o 52.97000 0.5485000 53.24000 0.7877000 52.70000 0.7634000 0.5406000      1.097000  
1 1 1 12 16 10 o 64.64000 0.8058000 63.34000 0.9010000 65.93000 1.336000  -2.593000      1.612000  
1 1 1 12 16 12 o 37.59000 0.3919000 37.26000 0.6020000 37.91000 0.5019000 -0.6554000     0.7838000 
1 1 1 12 16 14 o 74.16000 0.5648000 73.50000 0.7277000 74.82000 0.8639000 -1.319000      1.130000  
1 1 1 12 16 16 o 84.12000 0.6323000 83.46000 0.8147000 84.78000 0.9670000 -1.322000      1.265000  
1 1 1 12 16 18 o 81.16000 0.6736000 80.84000 0.7123000 81.48000 1.144000  -0.6349000     1.347000  
1 1 1 12 16 20 o 49.16000 0.3846000 48.78000 0.4580000 49.55000 0.6181000 -0.7687000     0.7693000 
1 1 1 12 16 22 o 6.666000 0.6853000 6.352000 0.9362000 6.979000 1.001000  -0.6275000     1.371000  
1 1 1 12 16 24 o 57.55000 0.5202000 57.71000 0.5898000 57.39000 0.8572000 0.3248000      1.040000  
1 1 1 12 16 26 o 56.33000 0.4519000 56.02000 0.6818000 56.63000 0.5933000 -0.6074000     0.9039000 
1 1 1 12 16 28 o 49.70000 0.3786000 50.10000 0.5331000 49.30000 0.5379000 0.7958000      0.7573000 
1 1 1 12 16 30 o 66.63000 0.4949000 66.61000 0.7760000 66.65000 0.6144000 -0.3354000E-01 0.9898000 
1 1 1 12 16 32 o 9.047000 0.6395000 8.989000 1.034000  9.105000 0.7530000 -0.1166000     1.279000  
1 1 1 12 16 34 o 24.72000 0.3179000 25.14000 0.4933000 24.29000 0.4010000 0.8444000      0.6357000 
1 1 1 12 16 36 o 14.52000 0.5058000 15.08000 0.7685000 13.96000 0.6580000 1.116000       1.012000  
1 1 1 12 16 38 o 8.288000 0.7141000 8.488000 1.169000  8.087000 0.8198000 0.4010000      1.428000  
1 1 1 12 16 40 o 5.050000 1.040000  4.445000 1.650000  5.656000 1.267000  -1.212000      2.081000  
1 1 1 12 16 42 o 16.16000 0.4842000 15.99000 0.8275000 16.34000 0.5029000 -0.3487000     0.9684000 
1 1 1 12 16 44 o 17.43000 0.3973000 17.30000 0.6151000 17.56000 0.5029000 -0.2597000     0.7945000 
1 1 1 12 16 46 o 27.26000 0.3848000 27.08000 0.6119000 27.44000 0.4669000 -0.3547000     0.7697000 
1 1 1 12 16 48 f 29.76000 0.3581000 29.49000 0.5332000 30.03000 0.4782000 -0.5363000     0.7162000 
1 1 1 12 16 50 o 19.12000 0.3534000 19.79000 0.5450000 18.45000 0.4501000 1.342000       0.7069000 
1 1 1 12 16 52 o 7.771000 0.7029000 7.700000 1.159000  7.841000 0.7955000 -0.1410000     1.406000  
1 1 1 12 16 54 o 7.789000 0.7346000 6.764000 1.265000  8.813000 0.7476000 -2.049000      1.469000  
1 1 1 12 16 56 o 5.273000 1.019000  5.824000 1.516000  4.722000 1.361000  1.102000       2.037000  
1 1 1 12 16 58 o 7.576000 0.8490000 9.477000 1.196000  5.676000 1.205000  3.801000       1.698000  
1 1 1 12 16 60 o 6.350000 1.017000  6.996000 1.435000  5.705000 1.441000  1.291000       2.034000  
1 1 1 12 16 62 o 8.426000 0.8331000 8.523000 1.446000  8.329000 0.8274000 0.1938000      1.666000  
1 1 1 12 17 1  o 42.74000 0.3171000 42.63000 0.4476000 42.85000 0.4494000 -0.2210000     0.6343000 
1 1 1 12 17 3  o 46.50000 0.4425000 46.82000 0.5683000 46.19000 0.6786000 0.6316000      0.8851000 
1 1 1 12 17 5  o 37.67000 0.5102000 36.40000 0.4759000 38.94000 0.9025000 -2.540000      1.020000  
1 1 1 12 17 7  o 49.20000 0.5112000 48.25000 0.7104000 50.15000 0.7354000 -1.891000      1.022000  
1 1 1 12 17 9  o 62.75000 0.7381000 62.57000 1.279000  62.93000 0.7366000 -0.3554000     1.476000  
1 1 1 12 17 11 o 119.0000 0.9429000 118.1000 1.324000  119.8000 1.343000  -1.693000      1.886000  
1 1 1 12 17 13 o 97.44000 0.7793000 98.25000 1.110000  96.63000 1.094000  1.614000       1.559000  
1 1 1 12 17 15 f 96.62000 0.7214000 96.17000 0.9346000 97.06000 1.099000  -0.8830000     1.443000  
1 1 1 12 17 17 o 92.90000 0.7638000 92.56000 0.8090000 93.24000 1.296000  -0.6834000     1.528000  
1 1 1 12 17 19 o 119.8000 0.9737000 120.3000 1.043000  119.2000 1.645000  1.066000       1.947000  
1 1 1 12 17 21 o 59.90000 0.4494000 60.27000 0.5471000 59.52000 0.7131000 0.7543000      0.8987000 
1 1 1 12 17 23 o 78.68000 0.6404000 78.04000 0.8939000 79.33000 0.9172000 -1.292000      1.281000  
1 1 1 12 17 25 o 38.12000 0.3396000 38.40000 0.5110000 37.85000 0.4473000 0.5464000      0.6792000 
1 1 1 12 17 27 o 7.035000 0.6537000 6.195000 1.102000  7.875000 0.7035000 -1.680000      1.307000  
1 1 1 12 17 29 o 41.89000 0.3959000 40.93000 0.5335000 42.86000 0.5849000 -1.936000      0.7917000 
1 1 1 12 17 31 o 45.24000 0.3856000 45.07000 0.5701000 45.42000 0.5193000 -0.3527000     0.7712000 
1 1 1 12 17 33 o 50.95000 0.4240000 51.89000 0.6411000 50.02000 0.5550000 1.869000       0.8480000 
1 1 1 12 17 35 o 10.98000 0.5800000 10.66000 0.9856000 11.30000 0.6116000 -0.6454000     1.160000  
1 1 1 12 17 37 o 36.29000 0.3470000 37.04000 0.5450000 35.54000 0.4295000 1.497000       0.6939000 
1 1 1 12 17 39 o 32.14000 0.5273000 32.45000 0.9430000 31.82000 0.4721000 0.6312000      1.055000  
1 1 1 12 17 41 o 30.01000 0.3437000 30.21000 0.5378000 29.80000 0.4280000 0.4089000      0.6873000 
1 1 1 12 17 43 o 35.76000 0.3536000 35.82000 0.5514000 35.69000 0.4428000 0.1277000      0.7072000 
1 1 1 12 17 45 o 7.480000 0.7793000 8.392000 1.053000  6.569000 1.149000  1.822000       1.559000  
1 1 1 12 17 47 o 20.73000 0.4025000 20.68000 0.6667000 20.78000 0.4514000 -0.9351000E-01 0.8051000 
1 1 1 12 17 49 f 3.115000 0.9062000 2.642000 1.231000  3.588000 1.330000  -0.9460000     1.812000  
1 1 1 12 17 51 o 4.467000 1.116000  4.233000 1.556000  4.701000 1.601000  -0.4679000     2.232000  
1 1 1 12 17 53 o 5.669000 0.9170000 4.498000 1.608000  6.840000 0.8824000 -2.343000      1.834000  
1 1 1 12 17 55 o 3.659000 1.010000  3.640000 1.487000  3.678000 1.367000  -0.3810000E-01 2.020000  
1 1 1 12 17 57 o 9.109000 0.8310000 8.911000 1.378000  9.307000 0.9295000 -0.3951000     1.662000  
1 1 1 12 17 59 o 10.11000 0.6738000 10.01000 1.038000  10.21000 0.8591000 -0.1971000     1.348000  
1 1 1 12 17 61 o 4.067000 1.061000  4.248000 1.574000  3.886000 1.424000  0.3626000      2.122000  
1 1 1 12 17 63 o 4.371000 1.029000  3.872000 1.611000  4.870000 1.279000  -0.9986000     2.057000  
1 1 1 12 18 0  o 95.96000 1.076000  95.96000 1.076000  95.96000 1.076000  0.000000       0.000000  
1 1 1 12 18 2  o 90.82000 0.7215000 89.90000 1.011000  91.73000 1.030000  -1.832000      1.443000  
1 1 1 12 18 4  o 60.67000 0.5544000 61.30000 0.8699000 60.03000 0.6877000 1.278000       1.109000  
1 1 1 12 18 6  o 79.15000 0.7804000 79.29000 1.104000  79.02000 1.104000  0.2607000      1.561000  
1 1 1 12 18 8  o 63.12000 0.7435000 63.18000 1.291000  63.06000 0.7387000 0.1227000      1.487000  
1 1 1 12 18 10 o 120.2000 0.9528000 119.4000 1.338000  121.0000 1.357000  -1.633000      1.906000  
1 1 1 12 18 12 o 46.68000 0.4120000 46.81000 0.5827000 46.56000 0.5826000 0.2462000      0.8240000 
1 1 1 12 18 14 o 63.30000 0.7781000 62.98000 1.259000  63.61000 0.9146000 -0.6333000     1.556000  
1 1 1 12 18 16 o 68.12000 0.5712000 68.36000 0.6081000 67.89000 0.9671000 0.4737000      1.142000  
1 1 1 12 18 18 o 69.61000 0.5098000 70.02000 0.6233000 69.19000 0.8070000 0.8276000      1.020000  
1 1 1 12 18 20 o 33.50000 0.3555000 33.50000 0.3540000 33.49000 0.6166000 0.7793000E-02  0.7110000 
1 1 1 12 18 22 o 9.854000 0.5108000 9.033000 0.5253000 10.67000 0.8762000 -1.642000      1.022000  
1 1 1 12 18 24 o 69.39000 0.4946000 69.65000 0.6988000 69.13000 0.7002000 0.5180000      0.9892000 
1 1 1 12 18 26 o 46.74000 0.4220000 46.44000 0.5966000 47.04000 0.5970000 -0.5995000     0.8440000 
1 1 1 12 18 28 o 23.31000 0.3024000 23.45000 0.4550000 23.16000 0.3985000 0.2869000      0.6048000 
1 1 1 12 18 30 o 23.23000 0.3411000 23.59000 0.5386000 22.87000 0.4186000 0.7174000      0.6822000 
1 1 1 12 18 32 f 33.15000 0.3784000 33.87000 0.6096000 32.43000 0.4484000 1.441000       0.7567000 
1 1 1 12 18 34 o 21.71000 0.3490000 21.61000 0.5244000 21.82000 0.4606000 -0.2148000     0.6980000 
1 1 1 12 18 36 o 11.29000 0.5368000 10.69000 0.8493000 11.89000 0.6566000 -1.204000      1.074000  
1 1 1 12 18 38 o 26.43000 0.3829000 26.06000 0.6443000 26.81000 0.4139000 -0.7566000     0.7658000 
1 1 1 12 18 40 o 4.941000 1.067000  4.132000 1.713000  5.751000 1.274000  -1.619000      2.135000  
1 1 1 12 18 42 o 25.58000 0.3503000 26.15000 0.5502000 25.01000 0.4337000 1.140000       0.7005000 
1 1 1 12 18 44 o 9.597000 0.7106000 9.142000 1.047000  10.05000 0.9610000 -0.9105000     1.421000  
1 1 1 12 18 46 o 20.08000 0.3785000 20.24000 0.6204000 19.91000 0.4338000 0.3268000      0.7570000 
1 1 1 12 18 48 o 20.01000 0.3700000 19.82000 0.5733000 20.21000 0.4679000 -0.3882000     0.7400000 
1 1 1 12 18 50 o 5.061000 0.9861000 4.861000 1.572000  5.260000 1.191000  -0.3990000     1.972000  
1 1 1 12 18 52 o 11.10000 0.6791000 12.07000 0.9849000 10.12000 0.9354000 1.951000       1.358000  
1 1 1 12 18 54 o 10.32000 0.5961000 9.620000 0.9898000 11.03000 0.6644000 -1.406000      1.192000  
1 1 1 12 18 56 o 5.582000 0.9835000 4.091000 1.566000  7.073000 1.190000  -2.981000      1.967000  
1 1 1 12 18 58 f 8.786000 0.8951000 7.909000 1.556000  9.662000 0.8856000 -1.753000      1.790000  
1 1 1 12 18 60 o 2.758000 0.8833000 2.711000 1.281000  2.805000 1.216000  -0.9427000E-01 1.767000  
1 1 1 12 18 62 o 5.338000 1.026000  5.703000 1.606000  4.973000 1.279000  0.7303000      2.053000  
1 1 1 12 19 1  o 55.92000 0.5143000 55.51000 0.7957000 56.33000 0.6520000 -0.8157000     1.029000  
1 1 1 12 19 3  o 112.6000 0.9138000 112.8000 1.546000  112.4000 0.9742000 0.3866000      1.828000  
1 1 1 12 19 5  o 106.0000 0.8435000 106.2000 1.194000  105.8000 1.191000  0.3103000      1.687000  
1 1 1 12 19 7  o 142.4000 1.124000  143.1000 1.598000  141.6000 1.582000  1.527000       2.249000  
1 1 1 12 19 9  o 63.80000 0.5279000 64.11000 0.7482000 63.50000 0.7449000 0.6057000      1.056000  
1 1 1 12 19 11 o 16.42000 0.3604000 16.29000 0.5511000 16.54000 0.4645000 -0.2527000     0.7207000 
1 1 1 12 19 13 o 14.43000 0.5446000 13.29000 0.8750000 15.56000 0.6485000 -2.272000      1.089000  
1 1 1 12 19 15 o 37.42000 0.4418000 37.07000 0.6194000 37.77000 0.6302000 -0.6947000     0.8836000 
1 1 1 12 19 17 f 27.05000 0.2792000 27.15000 0.3084000 26.94000 0.4654000 0.2148000      0.5583000 
1 1 1 12 19 19 o 24.78000 0.4512000 25.86000 0.3403000 23.70000 0.8358000 2.161000       0.9024000 
1 1 1 12 19 21 o 44.07000 0.3566000 44.03000 0.4245000 44.11000 0.5730000 -0.7550000E-01 0.7131000 
1 1 1 12 19 23 o 34.69000 0.3291000 34.53000 0.4172000 34.86000 0.5091000 -0.3243000     0.6582000 
1 1 1 12 19 25 o 35.10000 0.3030000 35.59000 0.4285000 34.61000 0.4286000 0.9845000      0.6061000 
1 1 1 12 19 27 f 36.53000 0.3427000 36.79000 0.5240000 36.28000 0.4418000 0.5089000      0.6854000 
1 1 1 12 19 29 o 5.170000 0.8348000 5.800000 1.028000  4.539000 1.316000  1.262000       1.670000  
1 1 1 12 19 31 o 47.14000 0.5532000 47.89000 1.000000  46.39000 0.4725000 1.499000       1.106000  
1 1 1 12 19 33 o 36.29000 0.4146000 37.04000 0.6384000 35.53000 0.5291000 1.511000       0.8291000 
1 1 1 12 19 35 o 31.08000 0.4687000 30.66000 0.8178000 31.51000 0.4579000 -0.8546000     0.9373000 
1 1 1 12 19 37 o 48.71000 0.4224000 49.33000 0.6334000 48.09000 0.5590000 1.239000       0.8448000 
1 1 1 12 19 39 o 21.91000 0.3633000 21.84000 0.5667000 21.97000 0.4547000 -0.1296000     0.7266000 
1 1 1 12 19 41 o 21.09000 0.3598000 21.21000 0.5681000 20.96000 0.4418000 0.2560000      0.7196000 
1 1 1 12 19 43 o 25.91000 0.3539000 26.65000 0.5264000 25.16000 0.4730000 1.491000       0.7077000 
1 1 1 12 19 45 f 6.978000 0.8058000 5.980000 1.374000  7.976000 0.8428000 -1.996000      1.612000  
1 1 1 12 19 47 o 3.329000 0.9689000 3.196000 1.408000  3.463000 1.332000  -0.2665000     1.938000  
1 1 1 12 19 49 o 25.52000 0.3509000 24.82000 0.5240000 26.23000 0.4668000 -1.415000      0.7018000 
1 1 1 12 19 51 o 15.08000 0.5248000 15.39000 0.8357000 14.77000 0.6351000 0.6195000      1.050000  
1 1 1 12 19 53 o 11.04000 0.4984000 11.23000 0.7614000 10.84000 0.6433000 0.3926000      0.9968000 
1 1 1 12 19 55 o 11.63000 0.5695000 11.49000 0.8521000 11.76000 0.7558000 -0.2777000     1.139000  
1 1 1 12 19 57 o 2.504000 0.8227000 2.756000 1.262000  2.251000 1.056000  0.5050000      1.645000  
1 1 1 12 19 59 o 5.644000 1.021000  6.055000 1.575000  5.234000 1.298000  0.8208000      2.041000  
1 1 1 12 19 61 o 3.532000 0.9849000 2.873000 1.334000  4.191000 1.449000  -1.318000      1.970000  
1 1 1 12 20 0  o 32.54000 0.3751000 32.54000 0.3751000 32.54000 0.3751000 0.000000       0.000000  
1 1 1 12 20 2  o 18.98000 0.2617000 18.94000 0.4160000 19.02000 0.3175000 -0.7797000E-01 0.5233000 
1 1 1 12 20 4  o 14.97000 0.2647000 15.53000 0.4447000 14.42000 0.2873000 1.108000       0.5294000 
1 1 1 12 20 6  o 97.44000 0.7786000 98.26000 1.109000  96.62000 1.093000  1.639000       1.557000  
1 1 1 12 20 8  o 96.03000 0.8610000 95.71000 1.332000  96.35000 1.092000  -0.6482000     1.722000  
1 1 1 12 20 10 o 104.4000 0.9288000 104.1000 1.433000  104.7000 1.182000  -0.5733000     1.858000  
1 1 1 12 20 12 o 60.26000 0.5635000 60.23000 0.7129000 60.29000 0.8728000 -0.6063000E-01 1.127000  
1 1 1 12 20 14 o 63.45000 0.5893000 63.86000 0.7514000 63.03000 0.9079000 0.8275000      1.179000  
1 1 1 12 20 16 o 44.32000 0.4011000 44.09000 0.5640000 44.56000 0.5705000 -0.4701000     0.8023000 
1 1 1 12 20 18 o 75.97000 0.6393000 75.04000 0.6648000 76.89000 1.092000  -1.849000      1.279000  
1 1 1 12 20 20 o 14.80000 0.2976000 14.81000 0.3149000 14.79000 0.5050000 0.1187000E-01  0.5952000 
1 1 1 12 20 22 o 35.37000 0.3214000 35.27000 0.4822000 35.47000 0.4251000 -0.1929000     0.6428000 
1 1 1 12 20 24 o 50.29000 0.4135000 50.24000 0.5339000 50.34000 0.6316000 -0.9265000E-01 0.8270000 
1 1 1 12 20 26 o 13.72000 0.3254000 14.04000 0.4650000 13.40000 0.4554000 0.6420000      0.6509000 
1 1 1 12 20 28 o 37.97000 0.3433000 38.76000 0.4536000 37.18000 0.5155000 1.579000       0.6867000 
1 1 1 12 20 30 o 46.87000 0.4312000 47.93000 0.7260000 45.82000 0.4654000 2.115000       0.8624000 
1 1 1 12 20 32 o 22.31000 0.4478000 22.23000 0.6667000 22.40000 0.5980000 -0.1725000     0.8956000 
1 1 1 12 20 34 o 35.62000 0.4739000 35.96000 0.8522000 35.28000 0.4147000 0.6866000      0.9477000 
1 1 1 12 20 36 o 21.84000 0.4146000 21.71000 0.6675000 21.97000 0.4919000 -0.2659000     0.8292000 
1 1 1 12 20 38 o 7.388000 0.8319000 8.493000 1.180000  6.283000 1.173000  2.210000       1.664000  
1 1 1 12 20 40 o 17.75000 0.4821000 18.05000 0.8363000 17.46000 0.4797000 0.5904000      0.9642000 
1 1 1 12 20 42 o 22.90000 0.3554000 22.27000 0.5574000 23.52000 0.4412000 -1.249000      0.7109000 
1 1 1 12 20 44 o 12.02000 0.5207000 11.90000 0.7925000 12.13000 0.6755000 -0.2270000     1.041000  
1 1 1 12 20 46 o 20.36000 0.5236000 20.32000 0.9185000 20.40000 0.5028000 -0.7357000E-01 1.047000  
1 1 1 12 20 48 o 17.02000 0.3977000 17.43000 0.6079000 16.62000 0.5129000 0.8146000      0.7954000 
1 1 1 12 20 50 o 8.996000 0.6706000 8.758000 1.057000  9.234000 0.8251000 -0.4767000     1.341000  
1 1 1 12 20 52 o 11.60000 0.4908000 11.32000 0.7756000 11.88000 0.6018000 -0.5573000     0.9817000 
1 1 1 12 20 54 o 4.385000 1.055000  4.536000 1.592000  4.235000 1.384000  0.3007000      2.110000  
1 1 1 12 20 56 o 5.452000 1.210000  5.556000 1.749000  5.349000 1.671000  0.2065000      2.419000  
1 1 1 12 20 58 o 7.202000 0.9081000 5.886000 1.623000  8.518000 0.8161000 -2.632000      1.816000  
1 1 1 12 20 60 o 3.311000 0.9548000 2.832000 1.324000  3.791000 1.376000  -0.9589000     1.910000  
1 1 1 12 20 62 o 3.493000 0.9998000 3.694000 1.555000  3.292000 1.258000  0.4019000      2.000000  
1 1 1 12 21 1  o 37.40000 0.2923000 37.33000 0.4151000 37.46000 0.4115000 -0.1307000     0.5845000 
1 1 1 12 21 3  f 40.97000 0.3403000 41.13000 0.5238000 40.81000 0.4346000 0.3182000      0.6806000 
1 1 1 12 21 5  o 73.67000 0.5996000 73.90000 0.8490000 73.44000 0.8469000 0.4622000      1.199000  
1 1 1 12 21 7  f 131.4000 1.469000  130.8000 2.539000  132.0000 1.479000  -1.191000      2.939000  
1 1 1 12 21 9  o 150.8000 1.329000  150.4000 2.051000  151.1000 1.689000  -0.7448000     2.657000  
1 1 1 12 21 11 o 34.45000 0.4339000 35.54000 0.6345000 33.36000 0.5920000 2.180000       0.8678000 
1 1 1 12 21 13 o 75.92000 0.6910000 76.62000 0.8831000 75.23000 1.063000  1.384000       1.382000  
1 1 1 12 21 15 o 28.93000 0.3285000 29.11000 0.4618000 28.75000 0.4672000 0.3511000      0.6569000 
1 1 1 12 21 17 o 24.22000 0.2762000 24.21000 0.2908000 24.23000 0.4696000 -0.1185000E-01 0.5523000 
1 1 1 12 21 19 o 16.17000 0.2905000 15.61000 0.2912000 16.73000 0.5028000 -1.117000      0.5810000 
1 1 1 12 21 21 o 19.01000 0.2745000 18.85000 0.4052000 19.18000 0.3705000 -0.3309000     0.5490000 
1 1 1 12 21 23 o 37.92000 0.3121000 37.83000 0.4364000 38.01000 0.4463000 -0.1828000     0.6242000 
1 1 1 12 21 25 o 35.02000 0.3020000 35.15000 0.4245000 34.89000 0.4297000 0.2585000      0.6040000 
1 1 1 12 21 27 o 67.32000 0.5603000 67.99000 0.7999000 66.65000 0.7847000 1.334000       1.121000  
1 1 1 12 21 29 o 41.85000 0.3430000 42.03000 0.4831000 41.68000 0.4870000 0.3458000      0.6860000 
1 1 1 12 21 31 o 23.03000 0.3717000 23.39000 0.5710000 22.66000 0.4760000 0.7219000      0.7434000 
1 1 1 12 21 33 o 29.20000 0.3176000 29.75000 0.4962000 28.65000 0.3966000 1.096000       0.6352000 
1 1 1 12 21 35 o 30.65000 0.3509000 30.87000 0.5254000 30.42000 0.4652000 0.4533000      0.7017000 
1 1 1 12 21 37 o 9.042000 0.6775000 9.686000 1.057000  8.397000 0.8480000 1.289000       1.355000  
1 1 1 12 21 39 o 9.087000 0.8554000 8.069000 1.500000  10.11000 0.8230000 -2.036000      1.711000  
1 1 1 12 21 41 o 34.32000 0.4031000 34.86000 0.6792000 33.78000 0.4344000 1.079000       0.8063000 
1 1 1 12 21 43 o 12.33000 0.5139000 12.14000 0.8017000 12.53000 0.6431000 -0.3890000     1.028000  
1 1 1 12 21 45 o 18.90000 0.4266000 18.20000 0.6885000 19.61000 0.5038000 -1.411000      0.8531000 
1 1 1 12 21 47 o 10.78000 0.6545000 11.27000 1.122000  10.29000 0.6744000 0.9806000      1.309000  
1 1 1 12 21 49 o 4.285000 0.9961000 3.958000 1.542000  4.612000 1.262000  -0.6540000     1.992000  
1 1 1 12 21 51 o 19.76000 0.3826000 19.58000 0.6049000 19.94000 0.4687000 -0.3659000     0.7652000 
1 1 1 12 21 53 o 8.352000 0.7414000 9.278000 1.189000  7.426000 0.8861000 1.852000       1.483000  
1 1 1 12 21 55 o 12.11000 0.5409000 11.22000 0.8958000 12.99000 0.6066000 -1.767000      1.082000  
1 1 1 12 21 57 o 3.220000 0.9543000 3.293000 1.457000  3.147000 1.233000  0.1459000      1.909000  
1 1 1 12 21 59 o 4.388000 0.9927000 3.621000 1.529000  5.155000 1.266000  -1.534000      1.985000  
1 1 1 12 21 61 o 5.286000 0.9373000 3.438000 1.503000  7.134000 1.120000  -3.696000      1.875000  
1 1 1 12 22 0  o 30.69000 0.3663000 30.69000 0.3663000 30.69000 0.3663000 0.000000       0.000000  
1 1 1 12 22 2  o 134.5000 0.9912000 133.4000 1.487000  135.6000 1.312000  -2.244000      1.982000  
1 1 1 12 22 4  o 90.03000 1.004000  91.97000 1.812000  88.09000 0.8627000 3.880000       2.007000  
1 1 1 12 22 6  o 90.36000 0.8872000 92.16000 1.276000  88.56000 1.233000  3.596000       1.774000  
1 1 1 12 22 8  o 24.56000 0.4697000 24.27000 0.4420000 24.84000 0.8289000 -0.5727000     0.9394000 
1 1 1 12 22 10 o 84.61000 0.7663000 83.99000 0.9613000 85.22000 1.194000  -1.235000      1.533000  
1 1 1 12 22 12 o 74.45000 0.6103000 74.60000 0.8641000 74.29000 0.8622000 0.3071000      1.221000  
1 1 1 12 22 14 o 30.08000 0.3358000 30.88000 0.4799000 29.28000 0.4698000 1.608000       0.6715000 
1 1 1 12 22 16 o 69.71000 0.5771000 69.29000 0.8081000 70.14000 0.8242000 -0.8546000     1.154000  
1 1 1 12 22 18 o 15.80000 0.3503000 15.71000 0.2763000 15.89000 0.6438000 -0.1804000     0.7006000 
1 1 1 12 22 20 o 9.383000 0.3608000 8.317000 0.5485000 10.45000 0.4689000 -2.133000      0.7216000 
1 1 1 12 22 22 o 24.61000 0.2626000 24.71000 0.3701000 24.51000 0.3726000 0.2059000      0.5252000 
1 1 1 12 22 24 o 30.18000 0.3451000 29.85000 0.4787000 30.52000 0.4971000 -0.6782000     0.6902000 
1 1 1 12 22 26 o 65.14000 0.5071000 65.05000 0.6623000 65.22000 0.7681000 -0.1781000     1.014000  
1 1 1 12 22 28 o 47.86000 0.4324000 48.01000 0.6182000 47.71000 0.6047000 0.2946000      0.8648000 
1 1 1 12 22 30 o 46.28000 0.4403000 46.74000 0.7131000 45.83000 0.5168000 0.9161000      0.8806000 
1 1 1 12 22 32 o 24.15000 0.3191000 24.41000 0.4953000 23.89000 0.4025000 0.5246000      0.6383000 
1 1 1 12 22 34 o 31.16000 0.3867000 31.54000 0.6129000 30.78000 0.4717000 0.7562000      0.7734000 
1 1 1 12 22 36 o 24.09000 0.3414000 23.70000 0.5305000 24.48000 0.4297000 -0.7867000     0.6827000 
1 1 1 12 22 38 o 22.11000 0.3777000 22.46000 0.5522000 21.76000 0.5156000 0.6959000      0.7555000 
1 1 1 12 22 40 o 22.23000 0.3552000 21.62000 0.5604000 22.84000 0.4366000 -1.220000      0.7104000 
1 1 1 12 22 42 o 16.72000 0.4785000 16.54000 0.8033000 16.89000 0.5200000 -0.3459000     0.9569000 
1 1 1 12 22 44 o 9.064000 0.6686000 8.893000 1.032000  9.236000 0.8499000 -0.3435000     1.337000  
1 1 1 12 22 46 o 6.458000 1.033000  5.962000 1.804000  6.954000 1.008000  -0.9915000     2.067000  
1 1 1 12 22 48 o 12.22000 0.4887000 12.71000 0.7439000 11.73000 0.6339000 0.9753000      0.9773000 
1 1 1 12 22 50 o 12.51000 0.4894000 12.92000 0.7780000 12.11000 0.5940000 0.8129000      0.9789000 
1 1 1 12 22 52 o 5.039000 0.9705000 5.043000 1.517000  5.035000 1.211000  0.7500000E-02  1.941000  
1 1 1 12 22 54 o 5.119000 1.051000  5.609000 1.628000  4.628000 1.329000  0.9810000      2.101000  
1 1 1 12 22 56 o 4.047000 1.056000  3.697000 1.524000  4.397000 1.463000  -0.7002000     2.113000  
1 1 1 12 22 58 f 5.577000 1.013000  4.964000 1.603000  6.190000 1.239000  -1.226000      2.026000  
1 1 1 12 22 60 o 4.763000 1.118000  5.380000 1.775000  4.147000 1.360000  1.233000       2.236000  
1 1 1 12 23 1  o 66.50000 0.5385000 66.74000 0.7662000 66.26000 0.7569000 0.4815000      1.077000  
1 1 1 12 23 3  o 39.75000 0.4335000 39.75000 0.6187000 39.74000 0.6072000 0.1136000E-01  0.8669000 
1 1 1 12 23 5  o 45.07000 0.4459000 44.56000 0.7091000 45.58000 0.5407000 -1.025000      0.8918000 
1 1 1 12 23 7  o 25.30000 0.4008000 24.92000 0.5831000 25.67000 0.5500000 -0.7512000     0.8016000 
1 1 1 12 23 9  o 52.65000 0.4545000 53.41000 0.6463000 51.89000 0.6393000 1.521000       0.9091000 
1 1 1 12 23 11 o 23.06000 0.3232000 22.81000 0.4536000 23.32000 0.4605000 -0.5193000     0.6464000 
1 1 1 12 23 13 o 67.34000 0.5587000 67.16000 0.7872000 67.52000 0.7931000 -0.3619000     1.117000  
1 1 1 12 23 15 o 53.54000 0.4619000 52.97000 0.6449000 54.10000 0.6615000 -1.134000      0.9239000 
1 1 1 12 23 17 o 16.28000 0.4008000 15.75000 0.4955000 16.80000 0.6302000 -1.051000      0.8017000 
1 1 1 12 23 19 o 27.11000 0.2952000 27.14000 0.4606000 27.08000 0.3691000 0.5827000E-01  0.5903000 
1 1 1 12 23 21 f 27.00000 0.2838000 26.92000 0.4233000 27.07000 0.3781000 -0.1497000     0.5676000 
1 1 1 12 23 23 o 22.30000 0.3072000 22.41000 0.4847000 22.20000 0.3776000 0.2113000      0.6144000 
1 1 1 12 23 25 o 20.44000 0.4711000 19.54000 0.3919000 21.35000 0.8568000 -1.812000      0.9422000 
1 1 1 12 23 27 o 15.18000 0.3422000 14.85000 0.5167000 15.51000 0.4488000 -0.6590000     0.6844000 
1 1 1 12 23 29 o 30.63000 0.3520000 30.93000 0.5648000 30.32000 0.4202000 0.6131000      0.7040000 
1 1 1 12 23 31 o 18.91000 0.3471000 19.14000 0.5245000 18.67000 0.4547000 0.4711000      0.6942000 
1 1 1 12 23 33 o 28.53000 0.3756000 28.02000 0.5989000 29.04000 0.4535000 -1.022000      0.7512000 
1 1 1 12 23 35 o 22.54000 0.3433000 22.10000 0.5365000 22.99000 0.4284000 -0.8917000     0.6865000 
1 1 1 12 23 37 o 19.91000 0.3648000 21.06000 0.5618000 18.76000 0.4655000 2.304000       0.7296000 
1 1 1 12 23 39 o 30.73000 0.3375000 31.23000 0.5308000 30.24000 0.4171000 0.9881000      0.6750000 
1 1 1 12 23 41 o 27.47000 0.4170000 27.60000 0.6891000 27.33000 0.4696000 0.2661000      0.8339000 
1 1 1 12 23 43 o 9.690000 0.6315000 10.97000 0.9010000 8.408000 0.8851000 2.566000       1.263000  
1 1 1 12 23 45 o 28.70000 0.5118000 28.48000 0.9047000 28.93000 0.4789000 -0.4536000     1.024000  
1 1 1 12 23 47 o 7.581000 0.7610000 7.112000 1.302000  8.049000 0.7874000 -0.9367000     1.522000  
1 1 1 12 23 49 o 7.034000 0.8233000 6.115000 1.387000  7.954000 0.8878000 -1.839000      1.647000  
1 1 1 12 23 51 o 14.18000 0.4796000 13.61000 0.7610000 14.76000 0.5839000 -1.146000      0.9592000 
1 1 1 12 23 53 o 10.88000 0.6774000 10.95000 1.071000  10.82000 0.8299000 0.1344000      1.355000  
1 1 1 12 23 55 f 6.535000 1.090000  6.380000 1.786000  6.690000 1.249000  -0.3094000     2.179000  
1 1 1 12 23 57 o 6.340000 0.9420000 6.369000 1.568000  6.311000 1.044000  0.5749000E-01  1.884000  
1 1 1 12 23 59 o 2.936000 0.9390000 3.208000 1.439000  2.664000 1.206000  0.5434000      1.878000  
1 1 1 12 23 61 o 3.836000 1.087000  4.213000 1.642000  3.459000 1.424000  0.7544000      2.173000  
1 1 1 12 24 0  o 35.20000 0.4043000 35.20000 0.4043000 35.20000 0.4043000 0.000000       0.000000  
1 1 1 12 24 2  o 48.29000 0.4194000 48.00000 0.5907000 48.59000 0.5954000 -0.5912000     0.8387000 
1 1 1 12 24 4  o 15.09000 0.2756000 14.33000 0.3832000 15.84000 0.3963000 -1.504000      0.5513000 
1 1 1 12 24 6  o 69.20000 0.6397000 69.59000 0.8097000 68.82000 0.9906000 0.7703000      1.279000  
1 1 1 12 24 8  o 51.95000 0.4492000 51.32000 0.6259000 52.59000 0.6444000 -1.267000      0.8984000 
1 1 1 12 24 10 o 11.13000 0.4650000 11.33000 0.6402000 10.93000 0.6746000 0.3940000      0.9300000 
1 1 1 12 24 12 o 64.55000 0.5388000 65.23000 0.7665000 63.87000 0.7573000 1.354000       1.078000  
1 1 1 12 24 14 o 37.29000 0.3631000 37.48000 0.5105000 37.09000 0.5165000 0.3910000      0.7262000 
1 1 1 12 24 16 o 42.49000 0.3949000 42.70000 0.5555000 42.27000 0.5613000 0.4260000      0.7897000 
1 1 1 12 24 18 o 40.96000 0.3543000 40.98000 0.5423000 40.95000 0.4562000 0.3192000E-01  0.7087000 
1 1 1 12 24 20 o 39.08000 0.3386000 38.61000 0.5058000 39.55000 0.4503000 -0.9361000     0.6772000 
1 1 1 12 24 22 o 71.49000 0.5091000 71.16000 0.7144000 71.83000 0.7255000 -0.6675000     1.018000  
1 1 1 12 24 24 o 37.83000 0.3954000 38.09000 0.5081000 37.57000 0.6058000 0.5184000      0.7907000 
1 1 1 12 24 26 o 62.25000 0.4541000 61.82000 0.6354000 62.67000 0.6490000 -0.8491000     0.9083000 
1 1 1 12 24 28 o 15.93000 0.5261000 15.78000 0.9528000 16.07000 0.4465000 -0.2933000     1.052000  
1 1 1 12 24 30 o 32.48000 0.3309000 32.10000 0.4311000 32.85000 0.5021000 -0.7424000     0.6618000 
1 1 1 12 24 32 o 25.03000 0.3109000 24.77000 0.4806000 25.29000 0.3945000 -0.5210000     0.6217000 
1 1 1 12 24 34 o 21.18000 0.3437000 20.74000 0.5372000 21.63000 0.4288000 -0.8855000     0.6874000 
1 1 1 12 24 36 o 33.95000 0.3353000 34.04000 0.5194000 33.86000 0.4242000 0.1732000      0.6706000 
1 1 1 12 24 38 o 20.06000 0.3780000 20.77000 0.5641000 19.35000 0.5033000 1.421000       0.7559000 
1 1 1 12 24 40 o 40.85000 0.3800000 41.28000 0.5671000 40.42000 0.5060000 0.8541000      0.7601000 
1 1 1 12 24 42 o 8.364000 0.8357000 8.185000 1.425000  8.543000 0.8738000 -0.3578000     1.671000  
1 1 1 12 24 44 o 5.304000 1.029000  5.268000 1.718000  5.339000 1.132000  -0.7035000E-01 2.057000  
1 1 1 12 24 46 o 16.04000 0.4039000 16.09000 0.6413000 15.99000 0.4914000 0.1021000      0.8079000 
1 1 1 12 24 48 o 5.731000 1.067000  4.982000 1.768000  6.479000 1.197000  -1.497000      2.135000  
1 1 1 12 24 50 o 9.750000 0.6004000 9.585000 0.9634000 9.916000 0.7170000 -0.3315000     1.201000  
1 1 1 12 24 52 o 3.107000 0.8992000 4.101000 1.482000  2.113000 1.018000  1.988000       1.798000  
1 1 1 12 24 54 o 4.134000 1.137000  4.446000 1.791000  3.822000 1.402000  0.6242000      2.274000  
1 1 1 12 24 56 o 10.14000 0.6143000 9.776000 1.013000  10.51000 0.6954000 -0.7315000     1.229000  
1 1 1 12 24 58 f 3.687000 1.014000  3.838000 1.528000  3.536000 1.333000  0.3018000      2.028000  
1 1 1 12 24 60 o 4.067000 1.088000  4.781000 1.747000  3.353000 1.299000  1.428000       2.177000  
1 1 1 12 25 1  o 79.08000 0.5995000 80.35000 0.9209000 77.81000 0.7679000 2.545000       1.199000  
1 1 1 12 25 3  o 68.71000 0.4849000 67.64000 0.6782000 69.77000 0.6933000 -2.136000      0.9698000 
1 1 1 12 25 5  o 45.87000 0.3440000 45.69000 0.4909000 46.05000 0.4820000 -0.3603000     0.6879000 
1 1 1 12 25 7  o 29.35000 0.3501000 29.82000 0.3898000 28.88000 0.5816000 0.9345000      0.7002000 
1 1 1 12 25 9  o 34.43000 0.3973000 34.69000 0.4936000 34.17000 0.6227000 0.5192000      0.7946000 
1 1 1 12 25 11 o 23.25000 0.3199000 23.12000 0.4502000 23.38000 0.4546000 -0.2657000     0.6398000 
1 1 1 12 25 13 o 58.55000 0.4985000 58.80000 0.7047000 58.30000 0.7052000 0.4997000      0.9970000 
1 1 1 12 25 15 o 61.07000 0.5167000 61.05000 0.7274000 61.08000 0.7340000 -0.3035000E-01 1.033000  
1 1 1 12 25 17 o 38.83000 0.3762000 38.46000 0.5199000 39.21000 0.5438000 -0.7507000     0.7523000 
1 1 1 12 25 19 o 12.58000 0.2804000 12.24000 0.4099000 12.93000 0.3826000 -0.6923000     0.5608000 
1 1 1 12 25 21 o 41.41000 0.3527000 41.31000 0.4612000 41.51000 0.5336000 -0.2019000     0.7053000 
1 1 1 12 25 23 o 28.19000 0.2760000 27.30000 0.3825000 29.08000 0.3979000 -1.780000      0.5520000 
1 1 1 12 25 25 o 14.42000 0.3739000 14.65000 0.4314000 14.18000 0.6108000 0.4673000      0.7478000 
1 1 1 12 25 27 f 15.04000 0.3688000 14.60000 0.5790000 15.48000 0.4571000 -0.8723000     0.7377000 
1 1 1 12 25 29 o 26.02000 0.3305000 25.81000 0.5077000 26.24000 0.4232000 -0.4283000     0.6610000 
1 1 1 12 25 31 o 26.99000 0.3240000 26.62000 0.4755000 27.36000 0.4402000 -0.7328000     0.6480000 
1 1 1 12 25 33 o 6.770000 0.8828000 7.171000 1.375000  6.369000 1.108000  0.8016000      1.766000  
1 1 1 12 25 35 o 14.24000 0.4201000 14.10000 0.6588000 14.37000 0.5214000 -0.2649000     0.8401000 
1 1 1 12 25 37 f 16.86000 0.3935000 15.76000 0.6301000 17.96000 0.4713000 -2.197000      0.7869000 
1 1 1 12 25 39 o 17.69000 0.4334000 17.08000 0.6005000 18.30000 0.6251000 -1.217000      0.8668000 
1 1 1 12 25 41 o 8.105000 0.8764000 7.936000 1.498000  8.275000 0.9103000 -0.3390000     1.753000  
1 1 1 12 25 43 o 5.778000 0.9024000 4.353000 1.588000  7.203000 0.8570000 -2.850000      1.805000  
1 1 1 12 25 45 o 16.11000 0.4117000 15.46000 0.6741000 16.77000 0.4729000 -1.310000      0.8234000 
1 1 1 12 25 47 o 15.75000 0.4099000 15.20000 0.6488000 16.29000 0.5012000 -1.092000      0.8199000 
1 1 1 12 25 49 o 2.687000 0.8652000 3.303000 1.413000  2.072000 0.9986000 1.231000       1.730000  
1 1 1 12 25 51 o 8.127000 0.9967000 6.752000 1.763000  9.502000 0.9309000 -2.750000      1.993000  
1 1 1 12 25 53 o 3.795000 1.094000  4.373000 1.764000  3.218000 1.295000  1.155000       2.188000  
1 1 1 12 25 55 o 4.210000 0.8812000 2.801000 1.315000  5.619000 1.173000  -2.818000      1.762000  
1 1 1 12 25 57 o 5.866000 0.9750000 5.977000 1.551000  5.755000 1.182000  0.2223000      1.950000  
1 1 1 12 25 59 o 7.689000 0.7775000 8.386000 1.320000  6.992000 0.8213000 1.393000       1.555000  
1 1 1 12 26 0  o 30.56000 0.3780000 30.56000 0.3780000 30.56000 0.3780000 0.000000       0.000000  
1 1 1 12 26 2  o 10.90000 0.3355000 11.64000 0.5269000 10.16000 0.4155000 1.478000       0.6710000 
1 1 1 12 26 4  f 34.72000 0.2821000 35.16000 0.4110000 34.28000 0.3864000 0.8845000      0.5641000 
1 1 1 12 26 6  o 16.29000 0.2671000 15.88000 0.3906000 16.70000 0.3644000 -0.8167000     0.5342000 
1 1 1 12 26 8  o 34.20000 0.3722000 34.49000 0.4148000 33.92000 0.6182000 0.5636000      0.7445000 
1 1 1 12 26 10 o 41.72000 0.4162000 41.49000 0.4659000 41.96000 0.6897000 -0.4754000     0.8323000 
1 1 1 12 26 12 o 55.57000 0.4785000 56.22000 0.6783000 54.91000 0.6752000 1.309000       0.9571000 
1 1 1 12 26 14 o 39.52000 0.3789000 39.07000 0.5242000 39.97000 0.5472000 -0.8921000     0.7577000 
1 1 1 12 26 16 o 8.294000 0.6764000 8.447000 0.8528000 8.140000 1.050000  0.3065000      1.353000  
1 1 1 12 26 18 o 25.48000 0.3019000 25.88000 0.4587000 25.09000 0.3927000 0.7920000      0.6039000 
1 1 1 12 26 20 o 9.645000 0.3517000 9.398000 0.5080000 9.892000 0.4865000 -0.4934000     0.7034000 
1 1 1 12 26 22 o 34.19000 0.3296000 34.03000 0.5036000 34.34000 0.4253000 -0.3116000     0.6591000 
1 1 1 12 26 24 o 21.72000 0.3178000 21.93000 0.5000000 21.51000 0.3925000 0.4196000      0.6356000 
1 1 1 12 26 26 o 40.57000 0.4240000 40.75000 0.6361000 40.38000 0.5608000 0.3636000      0.8480000 
1 1 1 12 26 28 o 15.24000 0.3387000 15.76000 0.4661000 14.72000 0.4916000 1.039000       0.6774000 
1 1 1 12 26 30 o 11.97000 0.4353000 11.64000 0.6249000 12.30000 0.6062000 -0.6567000     0.8706000 
1 1 1 12 26 32 o 5.267000 1.017000  6.004000 1.455000  4.530000 1.420000  1.474000       2.033000  
1 1 1 12 26 34 o 18.80000 0.3574000 18.60000 0.5547000 19.00000 0.4510000 -0.3957000     0.7149000 
1 1 1 12 26 36 o 13.51000 0.4486000 14.12000 0.6804000 12.91000 0.5847000 1.215000       0.8971000 
1 1 1 12 26 38 o 7.404000 0.8513000 6.172000 1.453000  8.637000 0.8875000 -2.465000      1.703000  
1 1 1 12 26 40 o 10.13000 0.5421000 10.15000 0.8827000 10.10000 0.6297000 0.4909000E-01  1.084000  
1 1 1 12 26 42 o 16.18000 0.4692000 16.41000 0.8035000 15.95000 0.4847000 0.4633000      0.9384000 
1 1 1 12 26 44 f 8.180000 0.9120000 7.774000 1.675000  8.585000 0.7225000 -0.8112000     1.824000  
1 1 1 12 26 46 o 9.144000 0.6000000 8.431000 1.035000  9.857000 0.6072000 -1.427000      1.200000  
1 1 1 12 26 48 o 5.755000 0.8850000 4.720000 1.509000  6.791000 0.9246000 -2.071000      1.770000  
1 1 1 12 26 50 o 3.639000 0.9640000 3.295000 1.428000  3.984000 1.295000  -0.6886000     1.928000  
1 1 1 12 26 52 f 6.749000 0.8948000 6.553000 1.407000  6.945000 1.106000  -0.3920000     1.790000  
1 1 1 12 26 54 o 5.065000 1.346000  6.171000 2.360000  3.960000 1.295000  2.211000       2.692000  
1 1 1 12 26 56 o 5.062000 1.268000  5.470000 2.085000  4.655000 1.444000  0.8146000      2.537000  
1 1 1 12 26 58 f 5.144000 0.9482000 3.746000 1.504000  6.541000 1.156000  -2.796000      1.896000  
1 1 1 12 27 1  o 21.97000 0.3562000 21.43000 0.5780000 22.50000 0.4163000 -1.067000      0.7124000 
1 1 1 12 27 3  o 55.09000 0.4007000 54.60000 0.5656000 55.57000 0.5677000 -0.9740000     0.8013000 
1 1 1 12 27 5  o 63.18000 0.4902000 63.65000 0.7509000 62.70000 0.6304000 0.9535000      0.9804000 
1 1 1 12 27 7  o 26.35000 0.2495000 26.54000 0.3755000 26.16000 0.3285000 0.3782000      0.4989000 
1 1 1 12 27 9  o 21.50000 0.3781000 21.97000 0.4299000 21.03000 0.6220000 0.9443000      0.7561000 
1 1 1 12 27 11 o 33.67000 0.3784000 33.63000 0.4141000 33.71000 0.6335000 -0.8093000E-01 0.7568000 
1 1 1 12 27 13 o 29.45000 0.3837000 29.27000 0.4656000 29.63000 0.6100000 -0.3624000     0.7674000 
1 1 1 12 27 15 o 16.77000 0.4187000 17.13000 0.5054000 16.40000 0.6678000 0.7335000      0.8375000 
1 1 1 12 27 17 o 28.92000 0.4112000 28.78000 0.5708000 29.07000 0.5921000 -0.2875000     0.8224000 
1 1 1 12 27 19 o 26.32000 0.2925000 25.72000 0.4103000 26.93000 0.4171000 -1.211000      0.5851000 
1 1 1 12 27 21 o 26.19000 0.2663000 26.27000 0.3756000 26.10000 0.3776000 0.1680000      0.5326000 
1 1 1 12 27 23 o 22.27000 0.2701000 22.40000 0.3801000 22.14000 0.3839000 0.2605000      0.5403000 
1 1 1 12 27 25 o 29.15000 0.3671000 28.85000 0.5311000 29.44000 0.5070000 -0.5912000     0.7342000 
1 1 1 12 27 27 o 40.06000 0.3328000 39.56000 0.4630000 40.56000 0.4781000 -1.002000      0.6655000 
1 1 1 12 27 29 o 9.013000 0.6158000 9.204000 0.9445000 8.822000 0.7905000 0.3819000      1.232000  
1 1 1 12 27 31 o 31.31000 0.3372000 31.38000 0.4290000 31.24000 0.5205000 0.1366000      0.6745000 
1 1 1 12 27 33 o 19.03000 0.3545000 18.85000 0.5471000 19.21000 0.4510000 -0.3610000     0.7090000 
1 1 1 12 27 35 o 8.519000 0.6350000 9.281000 0.9268000 7.757000 0.8681000 1.524000       1.270000  
1 1 1 12 27 37 o 6.106000 1.034000  6.721000 1.622000  5.491000 1.283000  1.230000       2.068000  
1 1 1 12 27 39 o 16.62000 0.3871000 16.65000 0.5738000 16.60000 0.5198000 0.5339000E-01  0.7742000 
1 1 1 12 27 41 o 18.65000 0.3768000 18.50000 0.5732000 18.80000 0.4892000 -0.3019000     0.7536000 
1 1 1 12 27 43 o 7.260000 0.7398000 6.598000 1.254000  7.922000 0.7846000 -1.324000      1.480000  
1 1 1 12 27 45 o 4.761000 0.9596000 4.822000 1.493000  4.700000 1.206000  0.1214000      1.919000  
1 1 1 12 27 47 o 10.57000 0.5327000 10.74000 0.8109000 10.39000 0.6911000 0.3561000      1.065000  
1 1 1 12 27 49 o 15.32000 0.4062000 15.58000 0.6562000 15.06000 0.4787000 0.5205000      0.8123000 
1 1 1 12 27 51 o 7.183000 0.8522000 6.559000 1.454000  7.807000 0.8894000 -1.248000      1.704000  
1 1 1 12 27 53 o 6.589000 0.8661000 6.029000 1.439000  7.150000 0.9643000 -1.121000      1.732000  
1 1 1 12 27 55 o 6.148000 0.9912000 6.285000 1.477000  6.010000 1.322000  0.2749000      1.982000  
1 1 1 12 27 57 o 4.911000 1.042000  4.970000 1.651000  4.852000 1.271000  0.1178000      2.084000  
1 1 1 12 27 59 o 6.698000 1.048000  7.472000 1.788000  5.924000 1.093000  1.548000       2.096000  
1 1 1 12 28 0  o 31.11000 0.4583000 31.11000 0.4583000 31.11000 0.4583000 0.000000       0.000000  
1 1 1 12 28 2  o 27.00000 0.2564000 26.95000 0.3702000 27.06000 0.3550000 -0.1145000     0.5129000 
1 1 1 12 28 4  o 36.67000 0.3256000 36.87000 0.5057000 36.47000 0.4102000 0.4043000      0.6511000 
1 1 1 12 28 6  o 11.16000 0.2943000 10.82000 0.4917000 11.49000 0.3235000 -0.6699000     0.5885000 
1 1 1 12 28 8  o 27.84000 0.2826000 28.11000 0.3854000 27.56000 0.4135000 0.5528000      0.5652000 
1 1 1 12 28 10 o 64.59000 0.5796000 63.79000 0.6504000 65.39000 0.9595000 -1.594000      1.159000  
1 1 1 12 28 12 o 29.55000 0.3672000 29.07000 0.3978000 30.03000 0.6174000 -0.9696000     0.7344000 
1 1 1 12 28 14 o 15.11000 0.5260000 14.44000 0.4255000 15.79000 0.9620000 -1.354000      1.052000  
1 1 1 12 28 16 o 11.93000 0.4270000 11.64000 0.6090000 12.23000 0.5986000 -0.5934000     0.8540000 
1 1 1 12 28 18 o 26.36000 0.4257000 26.17000 0.5970000 26.55000 0.6071000 -0.3734000     0.8515000 
1 1 1 12 28 20 o 51.10000 0.4219000 50.90000 0.6398000 51.31000 0.5502000 -0.4172000     0.8438000 
1 1 1 12 28 22 o 41.59000 0.3333000 41.31000 0.4664000 41.87000 0.4764000 -0.5574000     0.6667000 
1 1 1 12 28 24 o 13.88000 0.3141000 13.19000 0.4430000 14.57000 0.4453000 -1.378000      0.6281000 
1 1 1 12 28 26 o 11.40000 0.4834000 10.97000 0.6475000 11.82000 0.7178000 -0.8531000     0.9667000 
1 1 1 12 28 28 o 21.96000 0.3163000 21.93000 0.4279000 21.98000 0.4660000 -0.4836000E-01 0.6326000 
1 1 1 12 28 30 o 16.65000 0.3546000 16.78000 0.4561000 16.51000 0.5431000 0.2731000      0.7092000 
1 1 1 12 28 32 o 11.29000 0.4628000 11.83000 0.6802000 10.75000 0.6279000 1.086000       0.9257000 
1 1 1 12 28 34 o 27.54000 0.3240000 27.32000 0.5019000 27.76000 0.4099000 -0.4451000     0.6480000 
1 1 1 12 28 36 o 16.54000 0.4390000 16.60000 0.5994000 16.48000 0.6416000 0.1239000      0.8780000 
1 1 1 12 28 38 o 13.79000 0.4236000 13.61000 0.6754000 13.96000 0.5114000 -0.3510000     0.8472000 
1 1 1 12 28 40 o 10.77000 0.5126000 11.31000 0.7536000 10.24000 0.6950000 1.075000       1.025000  
1 1 1 12 28 42 o 21.91000 0.4055000 21.49000 0.6963000 22.32000 0.4158000 -0.8313000     0.8110000 
1 1 1 12 28 44 o 11.24000 0.5062000 11.19000 0.8335000 11.30000 0.5747000 -0.1163000     1.012000  
1 1 1 12 28 46 o 3.975000 1.005000  4.186000 1.507000  3.764000 1.329000  0.4228000      2.009000  
1 1 1 12 28 48 o 5.595000 0.8936000 5.875000 1.399000  5.315000 1.112000  0.5599000      1.787000  
1 1 1 12 28 50 o 3.494000 0.9634000 3.770000 1.476000  3.218000 1.239000  0.5525000      1.927000  
1 1 1 12 28 52 o 4.148000 0.9982000 3.709000 1.515000  4.588000 1.300000  -0.8788000     1.996000  
1 1 1 12 28 54 o 12.05000 0.6130000 12.24000 1.025000  11.87000 0.6727000 0.3712000      1.226000  
1 1 1 12 28 56 o 3.372000 1.012000  4.057000 1.654000  2.687000 1.166000  1.370000       2.024000  
1 1 1 12 28 58 o 7.287000 0.7849000 8.861000 1.121000  5.713000 1.099000  3.148000       1.570000  
1 1 1 12 29 1  f 36.35000 0.2927000 36.17000 0.4143000 36.53000 0.4136000 -0.3644000     0.5854000 
1 1 1 12 29 3  f 36.14000 0.2942000 35.92000 0.4191000 36.36000 0.4129000 -0.4383000     0.5883000 
1 1 1 12 29 5  o 30.05000 0.2969000 29.80000 0.3905000 30.30000 0.4473000 -0.4934000     0.5938000 
1 1 1 12 29 7  o 9.848000 0.3187000 10.15000 0.5273000 9.543000 0.3581000 0.6104000      0.6374000 
1 1 1 12 29 9  o 26.98000 0.2821000 27.50000 0.3884000 26.46000 0.4092000 1.042000       0.5642000 
1 1 1 12 29 11 o 13.16000 0.5938000 12.77000 0.4714000 13.55000 1.090000  -0.7872000     1.188000  
1 1 1 12 29 13 o 26.50000 0.3771000 26.85000 0.4537000 26.16000 0.6025000 0.6952000      0.7542000 
1 1 1 12 29 15 o 4.154000 0.9112000 5.019000 1.124000  3.288000 1.434000  1.732000       1.822000  
1 1 1 12 29 17 o 29.26000 0.4696000 29.70000 0.4076000 28.83000 0.8461000 0.8670000      0.9392000 
1 1 1 12 29 19 o 22.52000 0.3031000 22.30000 0.4803000 22.75000 0.3700000 -0.4464000     0.6063000 
1 1 1 12 29 21 o 6.975000 0.4854000 6.022000 0.7379000 7.928000 0.6308000 -1.906000      0.9708000 
1 1 1 12 29 23 f 29.04000 0.3050000 29.22000 0.4540000 28.86000 0.4075000 0.3542000      0.6101000 
1 1 1 12 29 25 o 7.840000 0.6129000 9.638000 0.6984000 6.042000 1.007000  3.596000       1.226000  
1 1 1 12 29 27 o 62.78000 0.5014000 62.96000 0.7601000 62.60000 0.6542000 0.3592000      1.003000  
1 1 1 12 29 29 o 17.01000 0.4018000 16.74000 0.5963000 17.27000 0.5388000 -0.5280000     0.8036000 
1 1 1 12 29 31 o 3.198000 0.9302000 3.445000 1.360000  2.950000 1.269000  0.4948000      1.860000  
1 1 1 12 29 33 o 24.75000 0.3859000 25.08000 0.6514000 24.42000 0.4138000 0.6626000      0.7718000 
1 1 1 12 29 35 o 19.15000 0.3688000 19.17000 0.5393000 19.12000 0.5032000 0.5391000E-01  0.7376000 
1 1 1 12 29 37 o 6.868000 0.7347000 6.763000 1.218000  6.973000 0.8219000 -0.2098000     1.469000  
1 1 1 12 29 39 o 11.72000 0.4669000 11.66000 0.7237000 11.78000 0.5902000 -0.1293000     0.9338000 
1 1 1 12 29 41 o 2.473000 0.8055000 2.588000 1.209000  2.359000 1.065000  0.2290000      1.611000  
1 1 1 12 29 43 o 5.097000 1.191000  ?        ?         5.097000 1.191000  ?              ?         
1 1 1 12 29 45 o 11.12000 0.4957000 11.12000 0.7919000 11.13000 0.5966000 -0.4698000E-02 0.9914000 
1 1 1 12 29 47 o 3.592000 0.9258000 2.929000 1.320000  4.255000 1.299000  -1.326000      1.852000  
1 1 1 12 29 49 o 5.287000 0.9769000 5.110000 1.468000  5.464000 1.290000  -0.3550000     1.954000  
1 1 1 12 29 51 f 6.606000 0.9549000 5.729000 1.556000  7.482000 1.107000  -1.754000      1.910000  
1 1 1 12 29 53 o 4.158000 1.096000  4.301000 1.728000  4.015000 1.350000  0.2862000      2.193000  
1 1 1 12 29 55 o 4.644000 1.155000  5.556000 1.916000  3.733000 1.291000  1.823000       2.311000  
1 1 1 12 29 57 o 5.982000 0.9438000 5.511000 1.653000  6.454000 0.9106000 -0.9435000     1.888000  
1 1 1 12 30 0  o 11.78000 0.8003000 11.78000 0.8003000 11.78000 0.8003000 0.000000       0.000000  
1 1 1 12 30 2  o 18.71000 0.2465000 18.43000 0.3554000 18.99000 0.3417000 -0.5639000     0.4930000 
1 1 1 12 30 4  f 33.29000 0.2827000 33.51000 0.4080000 33.08000 0.3914000 0.4279000      0.5654000 
1 1 1 12 30 6  o 52.13000 0.3848000 52.14000 0.5501000 52.12000 0.5380000 0.1941000E-01  0.7695000 
1 1 1 12 30 8  o 43.22000 0.3335000 43.22000 0.4808000 43.22000 0.4622000 0.2323000E-02  0.6670000 
1 1 1 12 30 10 o 31.91000 0.3520000 32.01000 0.4678000 31.81000 0.5262000 0.2011000      0.7041000 
1 1 1 12 30 12 o 22.96000 0.3692000 23.17000 0.3928000 22.75000 0.6252000 0.4129000      0.7384000 
1 1 1 12 30 14 o 44.14000 0.5821000 44.53000 0.5746000 43.75000 1.012000  0.7814000      1.164000  
1 1 1 12 30 16 o 22.32000 0.3615000 22.50000 0.3988000 22.14000 0.6030000 0.3601000      0.7230000 
1 1 1 12 30 18 o 22.61000 0.3138000 23.30000 0.4871000 21.92000 0.3957000 1.384000       0.6275000 
1 1 1 12 30 20 o 27.30000 0.2912000 26.68000 0.3675000 27.92000 0.4519000 -1.238000      0.5824000 
1 1 1 12 30 22 o 12.50000 0.3482000 12.01000 0.5266000 12.99000 0.4559000 -0.9799000     0.6965000 
1 1 1 12 30 24 o 27.70000 0.3047000 27.73000 0.4533000 27.67000 0.4072000 0.6463000E-01  0.6093000 
1 1 1 12 30 26 o 18.46000 0.3709000 18.11000 0.4488000 18.80000 0.5905000 -0.6822000     0.7417000 
1 1 1 12 30 28 o 25.02000 0.3541000 24.93000 0.4212000 25.12000 0.5692000 -0.1893000     0.7081000 
1 1 1 12 30 30 o 3.322000 0.9674000 3.342000 1.409000  3.302000 1.326000  0.4073000E-01  1.935000  
1 1 1 12 30 32 o 41.58000 0.3919000 42.20000 0.5836000 40.96000 0.5231000 1.235000       0.7837000 
1 1 1 12 30 34 o 25.59000 0.3321000 25.42000 0.4860000 25.76000 0.4527000 -0.3427000     0.6642000 
1 1 1 12 30 36 o 11.74000 0.4501000 11.63000 0.7047000 11.85000 0.5601000 -0.2264000     0.9002000 
1 1 1 12 30 38 o 16.29000 0.3669000 16.48000 0.5619000 16.09000 0.4720000 0.3945000      0.7338000 
1 1 1 12 30 40 o 8.900000 0.6245000 8.731000 0.9410000 9.070000 0.8212000 -0.3390000     1.249000  
1 1 1 12 30 42 o 21.46000 0.4799000 21.97000 0.8591000 20.95000 0.4279000 1.021000       0.9597000 
1 1 1 12 30 44 o 16.08000 0.3789000 15.93000 0.5945000 16.23000 0.4698000 -0.2975000     0.7577000 
1 1 1 12 30 46 o 2.906000 0.8614000 2.489000 1.188000  3.323000 1.247000  -0.8338000     1.723000  
1 1 1 12 30 48 o 3.862000 1.027000  3.691000 1.480000  4.034000 1.423000  -0.3436000     2.053000  
1 1 1 12 30 50 o 4.703000 1.031000  5.423000 1.498000  3.984000 1.418000  1.439000       2.063000  
1 1 1 12 30 52 f 7.927000 0.9161000 6.665000 1.646000  9.189000 0.8050000 -2.524000      1.832000  
1 1 1 12 30 54 o 6.751000 0.8820000 6.050000 1.500000  7.453000 0.9275000 -1.403000      1.764000  
1 1 1 12 30 56 o 7.954000 0.6988000 8.920000 1.106000  6.989000 0.8540000 1.931000       1.398000  
1 1 1 12 31 1  o 28.68000 0.2922000 28.46000 0.3729000 28.89000 0.4498000 -0.4342000     0.5843000 
1 1 1 12 31 3  o 48.34000 0.3963000 48.50000 0.6062000 48.19000 0.5107000 0.3085000      0.7926000 
1 1 1 12 31 5  o 33.87000 0.2872000 33.40000 0.4103000 34.34000 0.4019000 -0.9372000     0.5743000 
1 1 1 12 31 7  o 13.90000 0.3291000 14.02000 0.4985000 13.79000 0.4298000 0.2355000      0.6582000 
1 1 1 12 31 9  o 40.17000 0.3183000 40.17000 0.4624000 40.18000 0.4374000 -0.9819000E-02 0.6365000 
1 1 1 12 31 11 o 19.34000 0.2498000 19.40000 0.4038000 19.28000 0.2942000 0.1203000      0.4996000 
1 1 1 12 31 13 o 6.820000 1.098000  7.190000 1.019000  6.450000 1.946000  0.7406000      2.196000  
1 1 1 12 31 15 o 19.40000 0.3960000 19.17000 0.4122000 19.62000 0.6762000 -0.4464000     0.7919000 
1 1 1 12 31 17 o 21.75000 0.3134000 22.08000 0.4852000 21.42000 0.3968000 0.6566000      0.6268000 
1 1 1 12 31 19 o 23.55000 0.3133000 23.45000 0.4690000 23.65000 0.4154000 -0.1942000     0.6265000 
1 1 1 12 31 21 o 16.03000 0.3034000 15.96000 0.3979000 16.11000 0.4580000 -0.1469000     0.6067000 
1 1 1 12 31 23 o 32.79000 0.3067000 32.41000 0.3761000 33.17000 0.4847000 -0.7550000     0.6135000 
1 1 1 12 31 25 o 31.63000 0.3411000 31.65000 0.4258000 31.60000 0.5329000 0.4805000E-01  0.6821000 
1 1 1 12 31 27 o 15.05000 0.4158000 16.04000 0.4754000 14.07000 0.6823000 1.962000       0.8316000 
1 1 1 12 31 29 o 9.180000 0.6183000 10.36000 0.8766000 7.998000 0.8723000 2.366000       1.237000  
1 1 1 12 31 31 o 13.65000 0.4051000 14.18000 0.5554000 13.12000 0.5898000 1.064000       0.8102000 
1 1 1 12 31 33 o 6.147000 0.8650000 7.291000 1.125000  5.003000 1.314000  2.288000       1.730000  
1 1 1 12 31 35 o 22.86000 0.3139000 22.89000 0.4802000 22.83000 0.4043000 0.5608000E-01  0.6277000 
1 1 1 12 31 37 o 4.098000 0.9594000 4.459000 1.396000  3.736000 1.317000  0.7228000      1.919000  
1 1 1 12 31 39 o 9.298000 0.5460000 9.249000 0.8342000 9.346000 0.7047000 -0.9622000E-01 1.092000  
1 1 1 12 31 41 o 4.211000 1.026000  4.917000 1.605000  3.505000 1.278000  1.412000       2.051000  
1 1 1 12 31 43 o 5.700000 0.9840000 5.479000 1.684000  5.922000 1.019000  -0.4431000     1.968000  
1 1 1 12 31 45 o 12.69000 0.4708000 12.46000 0.7448000 12.92000 0.5760000 -0.4593000     0.9416000 
1 1 1 12 31 47 o 11.84000 0.5183000 11.46000 0.7905000 12.21000 0.6705000 -0.7488000     1.037000  
1 1 1 12 31 49 o 7.060000 0.8192000 6.920000 1.293000  7.200000 1.007000  -0.2797000     1.638000  
1 1 1 12 31 51 o 7.402000 0.8049000 7.031000 1.360000  7.774000 0.8616000 -0.7431000     1.610000  
1 1 1 12 31 53 o 4.852000 1.041000  5.283000 1.619000  4.421000 1.310000  0.8612000      2.083000  
1 1 1 12 31 55 f 3.691000 1.078000  3.852000 1.700000  3.529000 1.326000  0.3227000      2.156000  
1 1 1 12 32 0  f 18.53000 0.3570000 18.53000 0.3570000 18.53000 0.3570000 0.000000       0.000000  
1 1 1 12 32 2  o 9.136000 0.4594000 9.315000 0.6505000 8.957000 0.6488000 0.3577000      0.9188000 
1 1 1 12 32 4  o 18.90000 0.2628000 18.19000 0.3778000 19.60000 0.3654000 -1.410000      0.5256000 
1 1 1 12 32 6  o 31.39000 0.2760000 31.27000 0.4009000 31.50000 0.3794000 -0.2305000     0.5520000 
1 1 1 12 32 8  o 25.89000 0.2776000 26.66000 0.4436000 25.13000 0.3338000 1.536000       0.5552000 
1 1 1 12 32 10 o 53.04000 0.4207000 52.65000 0.5608000 53.43000 0.6273000 -0.7785000     0.8414000 
1 1 1 12 32 12 o 20.78000 0.2682000 20.12000 0.4065000 21.44000 0.3501000 -1.324000      0.5365000 
1 1 1 12 32 14 o 22.82000 0.2848000 22.65000 0.3992000 22.99000 0.4063000 -0.3327000     0.5696000 
1 1 1 12 32 16 o 33.32000 0.3124000 33.61000 0.4183000 33.03000 0.4642000 0.5765000      0.6248000 
1 1 1 12 32 18 o 14.55000 0.2963000 14.83000 0.3989000 14.27000 0.4383000 0.5656000      0.5926000 
1 1 1 12 32 20 o 22.07000 0.2847000 21.74000 0.3807000 22.40000 0.4233000 -0.6611000     0.5693000 
1 1 1 12 32 22 o 26.37000 0.2843000 26.28000 0.3519000 26.45000 0.4465000 -0.1784000     0.5685000 
1 1 1 12 32 24 o 26.48000 0.2983000 25.93000 0.3653000 27.03000 0.4716000 -1.099000      0.5966000 
1 1 1 12 32 26 o 31.83000 0.5117000 30.99000 0.4253000 32.67000 0.9308000 -1.677000      1.023000  
1 1 1 12 32 28 o 25.48000 0.3961000 25.75000 0.4175000 25.22000 0.6733000 0.5250000      0.7922000 
1 1 1 12 32 30 o 11.19000 0.5615000 12.22000 0.9034000 10.17000 0.6672000 2.056000       1.123000  
1 1 1 12 32 32 o 33.34000 0.3640000 33.82000 0.5124000 32.86000 0.5170000 0.9657000      0.7280000 
1 1 1 12 32 34 o 21.75000 0.3162000 21.69000 0.4886000 21.81000 0.4014000 -0.1239000     0.6323000 
1 1 1 12 32 36 o 7.882000 0.6297000 8.488000 0.8784000 7.276000 0.9026000 1.212000       1.259000  
1 1 1 12 32 38 f 11.90000 0.4232000 12.32000 0.6390000 11.48000 0.5551000 0.8369000      0.8464000 
1 1 1 12 32 40 o 6.592000 0.8194000 7.041000 1.163000  6.143000 1.154000  0.8975000      1.639000  
1 1 1 12 32 42 o 11.67000 0.4958000 10.71000 0.8425000 12.62000 0.5229000 -1.912000      0.9916000 
1 1 1 12 32 44 o 18.00000 0.4252000 18.08000 0.6967000 17.93000 0.4877000 0.1510000      0.8504000 
1 1 1 12 32 46 o 6.653000 0.8663000 6.217000 1.351000  7.090000 1.085000  -0.8726000     1.733000  
1 1 1 12 32 48 o 4.010000 1.037000  4.119000 1.548000  3.900000 1.381000  0.2191000      2.075000  
1 1 1 12 32 50 o 10.00000 0.5838000 9.966000 0.9402000 10.04000 0.6923000 -0.7724000E-01 1.168000  
1 1 1 12 32 52 o 5.465000 0.9441000 6.494000 1.396000  4.436000 1.272000  2.058000       1.888000  
1 1 1 12 32 54 o 5.537000 1.060000  5.423000 1.773000  5.652000 1.162000  -0.2289000     2.120000  
1 1 1 12 32 56 o 4.283000 1.018000  4.837000 1.545000  3.728000 1.325000  1.110000       2.035000  
1 1 1 12 33 1  o 10.42000 0.4013000 10.33000 0.6240000 10.51000 0.5048000 -0.1751000     0.8027000 
1 1 1 12 33 3  o 22.27000 0.3055000 22.78000 0.4241000 21.76000 0.4398000 1.018000       0.6110000 
1 1 1 12 33 5  o 26.66000 0.2637000 26.80000 0.3854000 26.51000 0.3602000 0.2944000      0.5275000 
1 1 1 12 33 7  o 26.68000 0.2766000 26.76000 0.3949000 26.61000 0.3874000 0.1445000      0.5532000 
1 1 1 12 33 9  o 26.27000 0.2771000 26.40000 0.4030000 26.13000 0.3805000 0.2726000      0.5543000 
1 1 1 12 33 11 o 36.32000 0.3350000 36.50000 0.4475000 36.13000 0.4987000 0.3708000      0.6700000 
1 1 1 12 33 13 o 39.88000 0.3234000 39.27000 0.4649000 40.49000 0.4495000 -1.216000      0.6467000 
1 1 1 12 33 15 o 42.25000 0.3621000 41.96000 0.4674000 42.53000 0.5531000 -0.5695000     0.7242000 
1 1 1 12 33 17 o 8.222000 0.4585000 7.917000 0.6805000 8.528000 0.6148000 -0.6109000     0.9171000 
1 1 1 12 33 19 f 55.49000 0.4472000 55.46000 0.5824000 55.51000 0.6788000 -0.5393000E-01 0.8944000 
1 1 1 12 33 21 o 33.76000 0.3317000 33.50000 0.4426000 34.03000 0.4942000 -0.5345000     0.6634000 
1 1 1 12 33 23 o 21.91000 0.3171000 22.19000 0.4443000 21.63000 0.4525000 0.5611000      0.6342000 
1 1 1 12 33 25 o 31.95000 0.5070000 32.76000 0.4548000 31.14000 0.9063000 1.614000       1.014000  
1 1 1 12 33 27 o 13.57000 0.3901000 14.26000 0.4615000 12.87000 0.6290000 1.388000       0.7801000 
1 1 1 12 33 29 o 15.98000 0.3665000 15.94000 0.4794000 16.03000 0.5546000 -0.9178000E-01 0.7331000 
1 1 1 12 33 31 o 30.50000 0.3503000 30.69000 0.3882000 30.31000 0.5832000 0.3812000      0.7006000 
1 1 1 12 33 33 o 14.15000 0.3807000 13.64000 0.5765000 14.66000 0.4975000 -1.024000      0.7615000 
1 1 1 12 33 35 o 13.74000 0.3863000 13.67000 0.5845000 13.80000 0.5053000 -0.1253000     0.7727000 
1 1 1 12 33 37 o 5.410000 0.8550000 5.482000 1.347000  5.338000 1.053000  0.1446000      1.710000  
1 1 1 12 33 39 o 8.945000 0.5477000 8.669000 0.8692000 9.222000 0.6666000 -0.5525000     1.095000  
1 1 1 12 33 41 o 9.746000 0.7543000 10.19000 1.284000  9.302000 0.7921000 0.8889000      1.509000  
1 1 1 12 33 43 o 5.052000 0.9039000 4.481000 1.503000  5.623000 1.004000  -1.142000      1.808000  
1 1 1 12 33 45 o 8.973000 0.6393000 8.823000 0.9534000 9.124000 0.8519000 -0.3006000     1.279000  
1 1 1 12 33 47 o 4.527000 0.9689000 5.322000 1.436000  3.731000 1.301000  1.590000       1.938000  
1 1 1 12 33 49 o 6.151000 0.9046000 6.503000 1.396000  5.799000 1.151000  0.7032000      1.809000  
1 1 1 12 33 51 o 7.488000 0.9162000 7.277000 1.630000  7.700000 0.8370000 -0.4230000     1.832000  
1 1 1 12 33 53 o 4.493000 1.085000  4.766000 1.641000  4.220000 1.421000  0.5461000      2.171000  
1 1 1 12 33 55 o 4.930000 1.015000  4.731000 1.671000  5.129000 1.152000  -0.3977000     2.030000  
1 1 1 12 34 0  o 2.734000 1.206000  2.734000 1.206000  2.734000 1.206000  0.000000       0.000000  
1 1 1 12 34 2  o 46.56000 0.3823000 46.75000 0.5772000 46.37000 0.5013000 0.3761000      0.7645000 
1 1 1 12 34 4  o 49.83000 0.4638000 49.37000 0.5315000 50.29000 0.7602000 -0.9200000     0.9276000 
1 1 1 12 34 6  o 25.50000 0.2751000 25.61000 0.3900000 25.39000 0.3882000 0.2216000      0.5503000 
1 1 1 12 34 8  o 23.25000 0.2647000 23.49000 0.4042000 23.01000 0.3419000 0.4799000      0.5294000 
1 1 1 12 34 10 o 37.61000 0.3140000 37.75000 0.4587000 37.48000 0.4290000 0.2701000      0.6281000 
1 1 1 12 34 12 f 28.72000 0.3058000 28.58000 0.4867000 28.86000 0.3702000 -0.2769000     0.6115000 
1 1 1 12 34 14 o 6.529000 0.5266000 5.888000 0.7687000 7.170000 0.7200000 -1.282000      1.053000  
1 1 1 12 34 16 o 9.079000 0.4276000 9.187000 0.6192000 8.970000 0.5899000 0.2166000      0.8552000 
1 1 1 12 34 18 o 28.59000 0.3137000 28.33000 0.4314000 28.85000 0.4554000 -0.5164000     0.6273000 
1 1 1 12 34 20 o 30.05000 0.2998000 29.60000 0.3674000 30.50000 0.4738000 -0.9062000     0.5996000 
1 1 1 12 34 22 o 40.62000 0.3648000 40.52000 0.4843000 40.72000 0.5458000 -0.1969000     0.7296000 
1 1 1 12 34 24 o 18.58000 0.5514000 18.56000 0.3929000 18.59000 1.030000  -0.2531000E-01 1.103000  
1 1 1 12 34 26 o 12.41000 0.5013000 12.09000 0.5021000 12.73000 0.8678000 -0.6329000     1.003000  
1 1 1 12 34 28 o 13.69000 0.3868000 13.74000 0.4659000 13.65000 0.6175000 0.8564000E-01  0.7735000 
1 1 1 12 34 30 o 17.91000 0.3820000 18.40000 0.4812000 17.43000 0.5934000 0.9751000      0.7640000 
1 1 1 12 34 32 o 12.56000 0.3752000 12.59000 0.4699000 12.54000 0.5850000 0.5058000E-01  0.7503000 
1 1 1 12 34 34 o 16.93000 0.3401000 17.50000 0.4391000 16.36000 0.5195000 1.140000       0.6802000 
1 1 1 12 34 36 o 7.944000 0.5557000 7.141000 0.8517000 8.747000 0.7139000 -1.606000      1.111000  
1 1 1 12 34 38 o 3.631000 0.8734000 2.737000 1.233000  4.525000 1.237000  -1.788000      1.747000  
1 1 1 12 34 40 f 9.057000 0.6138000 9.123000 0.9995000 8.991000 0.7126000 0.1321000      1.228000  
1 1 1 12 34 42 o 8.358000 0.6272000 7.797000 1.060000  8.918000 0.6701000 -1.121000      1.254000  
1 1 1 12 34 44 o 4.068000 1.017000  5.608000 1.670000  2.528000 1.162000  3.080000       2.034000  
1 1 1 12 34 46 o 2.937000 0.8369000 2.304000 1.102000  3.570000 1.260000  -1.266000      1.674000  
1 1 1 12 34 48 o 10.14000 0.5576000 10.31000 0.8885000 9.973000 0.6739000 0.3338000      1.115000  
1 1 1 12 34 50 o 5.481000 0.9459000 4.353000 1.571000  6.609000 1.054000  -2.256000      1.892000  
1 1 1 12 34 52 o 3.612000 1.000000  3.736000 1.502000  3.489000 1.321000  0.2469000      2.000000  
1 1 1 12 34 54 o 4.627000 1.079000  5.373000 1.719000  3.882000 1.305000  1.492000       2.158000  
1 1 1 12 35 1  o 42.33000 0.3805000 42.45000 0.5438000 42.22000 0.5324000 0.2233000      0.7610000 
1 1 1 12 35 3  o 35.76000 0.3404000 36.56000 0.4953000 34.97000 0.4671000 1.586000       0.6809000 
1 1 1 12 35 5  o 33.89000 0.3262000 33.75000 0.4262000 34.03000 0.4940000 -0.2852000     0.6525000 
1 1 1 12 35 7  o 30.10000 0.2832000 30.09000 0.4167000 30.10000 0.3836000 -0.7944000E-02 0.5664000 
1 1 1 12 35 9  o 37.53000 0.3382000 38.03000 0.5253000 37.03000 0.4261000 0.9967000      0.6764000 
1 1 1 12 35 11 o 43.40000 0.5294000 43.39000 0.9453000 43.40000 0.4771000 -0.6447000E-03 1.059000  
1 1 1 12 35 13 o 17.66000 0.3681000 17.53000 0.5968000 17.79000 0.4312000 -0.2539000     0.7362000 
1 1 1 12 35 15 o 15.06000 0.3333000 14.96000 0.4886000 15.16000 0.4535000 -0.1933000     0.6666000 
1 1 1 12 35 17 o 64.46000 0.4830000 64.93000 0.5992000 63.98000 0.7576000 0.9467000      0.9660000 
1 1 1 12 35 19 o 25.93000 0.3167000 25.97000 0.4413000 25.89000 0.4543000 0.8373000E-01  0.6333000 
1 1 1 12 35 21 o 19.56000 0.4265000 19.69000 0.4601000 19.43000 0.7183000 0.2569000      0.8530000 
1 1 1 12 35 23 o 16.83000 0.3791000 17.20000 0.4971000 16.47000 0.5726000 0.7272000      0.7583000 
1 1 1 12 35 25 o 23.47000 0.3139000 23.60000 0.4096000 23.33000 0.4759000 0.2770000      0.6279000 
1 1 1 12 35 27 o 13.88000 0.3657000 14.38000 0.4421000 13.38000 0.5827000 0.9934000      0.7314000 
1 1 1 12 35 29 o 23.56000 0.3529000 24.42000 0.4408000 22.71000 0.5511000 1.710000       0.7057000 
1 1 1 12 35 31 o 12.97000 0.3661000 12.78000 0.4439000 13.17000 0.5822000 -0.3841000     0.7322000 
1 1 1 12 35 33 o 20.63000 0.3192000 21.13000 0.4182000 20.13000 0.4824000 0.9992000      0.6384000 
1 1 1 12 35 35 o 7.459000 0.5478000 7.331000 0.7668000 7.588000 0.7826000 -0.2570000     1.096000  
1 1 1 12 35 37 o 4.720000 0.9077000 5.502000 1.293000  3.937000 1.274000  1.565000       1.815000  
1 1 1 12 35 39 o 7.806000 0.6071000 8.004000 0.9005000 7.607000 0.8146000 0.3967000      1.214000  
1 1 1 12 35 41 o 9.583000 0.5306000 9.629000 0.7365000 9.537000 0.7639000 0.9150000E-01  1.061000  
1 1 1 12 35 43 o 9.549000 0.6379000 9.495000 0.8012000 9.604000 0.9929000 -0.1099000     1.276000  
1 1 1 12 35 45 o 12.73000 0.4404000 11.96000 0.6723000 13.50000 0.5690000 -1.540000      0.8808000 
1 1 1 12 35 47 o 6.370000 0.7810000 7.418000 0.9536000 5.321000 1.237000  2.097000       1.562000  
1 1 1 12 35 49 o 3.753000 0.9564000 3.580000 1.390000  3.926000 1.314000  -0.3460000     1.913000  
1 1 1 12 35 51 o 3.742000 0.9954000 3.821000 1.441000  3.662000 1.374000  0.1589000      1.991000  
1 1 1 12 35 53 o 4.508000 1.012000  4.203000 1.497000  4.812000 1.361000  -0.6083000     2.024000  
1 1 1 12 36 0  o 24.91000 0.4340000 24.91000 0.4340000 24.91000 0.4340000 0.000000       0.000000  
1 1 1 12 36 2  o 35.54000 0.3458000 35.83000 0.4937000 35.25000 0.4842000 0.5804000      0.6916000 
1 1 1 12 36 4  o 39.92000 0.3482000 40.15000 0.5281000 39.68000 0.4539000 0.4655000      0.6963000 
1 1 1 12 36 6  f 26.25000 0.3706000 25.98000 0.5096000 26.51000 0.5383000 -0.5281000     0.7413000 
1 1 1 12 36 8  f 37.17000 0.3395000 37.41000 0.5262000 36.94000 0.4292000 0.4757000      0.6790000 
1 1 1 12 36 10 o 24.27000 0.4204000 24.17000 0.7601000 24.38000 0.3597000 -0.2163000     0.8409000 
1 1 1 12 36 12 o 31.76000 0.2974000 31.05000 0.4368000 32.48000 0.4036000 -1.430000      0.5947000 
1 1 1 12 36 14 o 12.47000 0.3657000 12.22000 0.5129000 12.72000 0.5215000 -0.4997000     0.7315000 
1 1 1 12 36 16 o 34.07000 0.3143000 33.79000 0.3885000 34.34000 0.4943000 -0.5556000     0.6287000 
1 1 1 12 36 18 o 21.87000 0.3085000 21.79000 0.4406000 21.96000 0.4320000 -0.1721000     0.6170000 
1 1 1 12 36 20 o 17.14000 0.3405000 17.96000 0.3853000 16.31000 0.5617000 1.649000       0.6811000 
1 1 1 12 36 22 o 20.91000 0.3311000 20.27000 0.3835000 21.56000 0.5399000 -1.282000      0.6622000 
1 1 1 12 36 24 o 19.28000 0.3362000 19.96000 0.4563000 18.61000 0.4940000 1.349000       0.6725000 
1 1 1 12 36 26 o 8.636000 0.6506000 8.245000 0.6592000 9.026000 1.122000  -0.7808000     1.301000  
1 1 1 12 36 28 o 7.165000 0.7274000 7.786000 0.7594000 6.545000 1.241000  1.241000       1.455000  
1 1 1 12 36 30 o 9.912000 0.4743000 9.812000 0.6543000 10.01000 0.6869000 -0.2000000     0.9487000 
1 1 1 12 36 32 o 12.16000 0.3935000 12.03000 0.5126000 12.29000 0.5973000 -0.2593000     0.7871000 
1 1 1 12 36 34 o 18.02000 0.3074000 18.22000 0.4315000 17.81000 0.4379000 0.4066000      0.6148000 
1 1 1 12 36 36 o 5.133000 0.8005000 4.866000 1.170000  5.400000 1.092000  -0.5342000     1.601000  
1 1 1 12 36 38 o 3.086000 0.8695000 3.622000 1.326000  2.551000 1.125000  1.072000       1.739000  
1 1 1 12 36 40 o 13.69000 0.3775000 14.26000 0.5348000 13.13000 0.5329000 1.126000       0.7550000 
1 1 1 12 36 42 o 7.032000 0.7226000 7.751000 0.8994000 6.314000 1.131000  1.437000       1.445000  
1 1 1 12 36 44 o 5.409000 0.9292000 4.248000 1.521000  6.569000 1.068000  -2.321000      1.858000  
1 1 1 12 36 46 o 3.439000 0.9270000 2.874000 1.263000  4.003000 1.358000  -1.129000      1.854000  
1 1 1 12 36 48 o 4.688000 0.9095000 4.015000 1.393000  5.361000 1.170000  -1.347000      1.819000  
1 1 1 12 36 50 o 2.898000 0.8776000 2.515000 1.148000  3.280000 1.327000  -0.7650000     1.755000  
1 1 1 12 36 52 o 8.521000 0.5949000 8.775000 0.9029000 8.266000 0.7749000 0.5095000      1.190000  
1 1 1 12 37 1  o 8.989000 0.4177000 9.847000 0.5722000 8.130000 0.6086000 1.717000       0.8354000 
1 1 1 12 37 3  o 41.21000 0.3342000 40.90000 0.4720000 41.52000 0.4731000 -0.6167000     0.6683000 
1 1 1 12 37 5  o 26.16000 0.2769000 26.23000 0.4050000 26.10000 0.3778000 0.1308000      0.5538000 
1 1 1 12 37 7  o 10.64000 0.4625000 10.78000 0.6459000 10.50000 0.6620000 0.2716000      0.9250000 
1 1 1 12 37 9  o 59.92000 0.5053000 60.43000 0.7261000 59.42000 0.7030000 1.008000       1.011000  
1 1 1 12 37 11 o 41.57000 0.3722000 41.43000 0.5756000 41.70000 0.4720000 -0.2677000     0.7444000 
1 1 1 12 37 13 o 21.40000 0.3445000 20.90000 0.5290000 21.89000 0.4416000 -0.9889000     0.6891000 
1 1 1 12 37 15 o 10.85000 0.4078000 10.23000 0.5819000 11.47000 0.5714000 -1.236000      0.8156000 
1 1 1 12 37 17 o 39.15000 0.4159000 39.54000 0.4244000 38.76000 0.7153000 0.7740000      0.8317000 
1 1 1 12 37 19 o 19.83000 0.3449000 20.39000 0.4491000 19.28000 0.5237000 1.113000       0.6899000 
1 1 1 12 37 21 o 11.95000 0.5129000 13.00000 0.4601000 10.90000 0.9168000 2.105000       1.026000  
1 1 1 12 37 23 o 14.10000 0.3635000 14.14000 0.4524000 14.06000 0.5690000 0.7502000E-01  0.7269000 
1 1 1 12 37 25 o 20.41000 0.3984000 21.29000 0.3737000 19.53000 0.7038000 1.766000       0.7969000 
1 1 1 12 37 27 o 4.150000 0.8817000 4.943000 1.112000  3.356000 1.369000  1.587000       1.763000  
1 1 1 12 37 29 o 9.370000 0.4526000 9.576000 0.5699000 9.163000 0.7032000 0.4124000      0.9052000 
1 1 1 12 37 31 o 13.69000 0.3581000 13.97000 0.4482000 13.41000 0.5586000 0.5582000      0.7162000 
1 1 1 12 37 33 o 3.232000 0.8264000 2.716000 1.125000  3.748000 1.211000  -1.032000      1.653000  
1 1 1 12 37 35 o 5.277000 0.7869000 5.027000 1.181000  5.526000 1.040000  -0.4993000     1.574000  
1 1 1 12 37 37 o 10.14000 0.4804000 9.120000 0.7541000 11.16000 0.5955000 -2.038000      0.9608000 
1 1 1 12 37 39 f 3.742000 0.9162000 4.297000 1.359000  3.187000 1.229000  1.109000       1.832000  
1 1 1 12 37 41 o 3.906000 1.017000  3.887000 1.341000  3.925000 1.530000  -0.3811000E-01 2.034000  
1 1 1 12 37 43 o 5.559000 0.8646000 6.407000 1.112000  4.711000 1.324000  1.696000       1.729000  
1 1 1 12 37 45 o 2.771000 0.8490000 2.540000 1.154000  3.001000 1.245000  -0.4612000     1.698000  
1 1 1 12 37 47 o 4.181000 1.035000  4.137000 1.583000  4.225000 1.333000  -0.8825000E-01 2.069000  
1 1 1 12 37 49 o 5.750000 0.8971000 7.407000 1.163000  4.092000 1.367000  3.315000       1.794000  
1 1 1 12 37 51 o 8.216000 0.6151000 7.817000 0.9350000 8.614000 0.7994000 -0.7968000     1.230000  
1 1 1 12 38 0  o 11.95000 0.5137000 11.95000 0.5137000 11.95000 0.5137000 0.000000       0.000000  
1 1 1 12 38 2  o 30.72000 0.3231000 31.34000 0.4233000 30.09000 0.4883000 1.258000       0.6463000 
1 1 1 12 38 4  o 41.17000 0.4371000 41.90000 0.6777000 40.45000 0.5521000 1.453000       0.8742000 
1 1 1 12 38 6  o 33.50000 0.3201000 33.03000 0.4799000 33.97000 0.4235000 -0.9434000     0.6401000 
1 1 1 12 38 8  o 11.93000 0.6191000 12.67000 0.5723000 11.20000 1.098000  1.472000       1.238000  
1 1 1 12 38 10 o 11.10000 0.4085000 10.82000 0.6682000 11.39000 0.4700000 -0.5661000     0.8169000 
1 1 1 12 38 12 o 15.59000 0.3452000 15.93000 0.5670000 15.24000 0.3940000 0.6872000      0.6905000 
1 1 1 12 38 14 o 23.67000 0.4060000 24.21000 0.4456000 23.13000 0.6789000 1.080000       0.8121000 
1 1 1 12 38 16 o 27.95000 0.4961000 28.29000 0.3847000 27.61000 0.9145000 0.6845000      0.9921000 
1 1 1 12 38 18 f 16.93000 0.3450000 16.83000 0.4183000 17.04000 0.5487000 -0.2153000     0.6900000 
1 1 1 12 38 20 o 13.18000 0.3566000 13.14000 0.4625000 13.21000 0.5429000 -0.7091000E-01 0.7132000 
1 1 1 12 38 22 o 10.80000 0.4136000 11.54000 0.4852000 10.06000 0.6700000 1.481000       0.8272000 
1 1 1 12 38 24 o 15.05000 0.3900000 15.63000 0.5276000 14.46000 0.5745000 1.176000       0.7800000 
1 1 1 12 38 26 o 19.68000 0.3924000 19.59000 0.4105000 19.77000 0.6688000 -0.1785000     0.7848000 
1 1 1 12 38 28 o 11.61000 0.3762000 12.18000 0.4487000 11.05000 0.6040000 1.136000       0.7524000 
1 1 1 12 38 30 o 13.03000 0.3885000 13.97000 0.5162000 12.10000 0.5808000 1.870000       0.7771000 
1 1 1 12 38 32 o 11.51000 0.3930000 11.68000 0.4951000 11.35000 0.6104000 0.3351000      0.7859000 
1 1 1 12 38 34 f 17.15000 0.3111000 17.61000 0.4217000 16.69000 0.4576000 0.9239000      0.6223000 
1 1 1 12 38 36 o 9.747000 0.4770000 9.173000 0.7226000 10.32000 0.6229000 -1.148000      0.9541000 
1 1 1 12 38 38 o 13.58000 0.3951000 13.36000 0.6031000 13.81000 0.5107000 -0.4444000     0.7903000 
1 1 1 12 38 40 o 4.547000 0.8705000 5.512000 1.161000  3.583000 1.298000  1.928000       1.741000  
1 1 1 12 38 42 o 7.696000 0.6567000 6.885000 1.022000  8.507000 0.8245000 -1.622000      1.313000  
1 1 1 12 38 44 o 4.490000 0.9095000 5.704000 1.306000  3.276000 1.266000  2.429000       1.819000  
1 1 1 12 38 46 o 8.032000 0.7027000 8.310000 1.101000  7.755000 0.8737000 0.5555000      1.405000  
1 1 1 12 38 48 o 9.772000 0.5274000 9.460000 0.7797000 10.08000 0.7103000 -0.6232000     1.055000  
1 1 1 12 38 50 o 8.679000 0.6002000 8.857000 0.8448000 8.500000 0.8529000 0.3573000      1.200000  
1 1 1 12 39 1  o 10.99000 0.4269000 11.08000 0.6180000 10.89000 0.5892000 0.1862000      0.8539000 
1 1 1 12 39 3  o 20.85000 0.3541000 21.03000 0.4585000 20.68000 0.5397000 0.3466000      0.7082000 
1 1 1 12 39 5  o 21.04000 0.2963000 20.83000 0.4138000 21.25000 0.4243000 -0.4189000     0.5927000 
1 1 1 12 39 7  o 36.90000 0.3400000 37.03000 0.4646000 36.77000 0.4965000 0.2590000      0.6799000 
1 1 1 12 39 9  o 9.496000 0.5831000 10.01000 0.8314000 8.979000 0.8177000 1.033000       1.166000  
1 1 1 12 39 11 o 20.98000 0.5150000 20.80000 0.4539000 21.16000 0.9247000 -0.3519000     1.030000  
1 1 1 12 39 13 o 28.28000 0.3994000 28.43000 0.4410000 28.14000 0.6660000 0.2840000      0.7988000 
1 1 1 12 39 15 o 18.31000 0.3453000 17.69000 0.4271000 18.92000 0.5427000 -1.229000      0.6906000 
1 1 1 12 39 17 o 41.56000 0.4390000 42.64000 0.4870000 40.49000 0.7307000 2.149000       0.8781000 
1 1 1 12 39 19 o 36.98000 0.3355000 36.87000 0.4147000 37.09000 0.5276000 -0.2160000     0.6710000 
1 1 1 12 39 21 o 26.29000 0.2924000 26.43000 0.3680000 26.16000 0.4546000 0.2686000      0.5848000 
1 1 1 12 39 23 o 22.59000 0.3351000 22.10000 0.3998000 23.07000 0.5379000 -0.9707000     0.6702000 
1 1 1 12 39 25 f 32.84000 0.4215000 32.67000 0.4523000 33.02000 0.7114000 -0.3475000     0.8430000 
1 1 1 12 39 27 o 27.95000 0.2977000 28.44000 0.3732000 27.46000 0.4638000 0.9756000      0.5953000 
1 1 1 12 39 29 o 11.41000 0.3854000 11.86000 0.4693000 10.97000 0.6115000 0.8914000      0.7708000 
1 1 1 12 39 31 o 5.964000 0.6262000 5.099000 0.8295000 6.829000 0.9384000 -1.730000      1.252000  
1 1 1 12 39 33 o 4.923000 0.8131000 5.106000 1.162000  4.740000 1.138000  0.3664000      1.626000  
1 1 1 12 39 35 o 4.264000 0.8658000 3.298000 1.291000  5.230000 1.154000  -1.932000      1.732000  
1 1 1 12 39 37 o 2.935000 0.8239000 2.146000 1.019000  3.724000 1.295000  -1.578000      1.648000  
1 1 1 12 39 39 o 2.769000 0.7997000 2.223000 1.032000  3.315000 1.222000  -1.092000      1.599000  
1 1 1 12 39 41 o 4.204000 0.9748000 4.495000 1.291000  3.913000 1.461000  0.5825000      1.950000  
1 1 1 12 39 43 o 7.347000 0.6582000 7.528000 0.9180000 7.166000 0.9436000 0.3618000      1.316000  
1 1 1 12 39 45 o 5.753000 0.8891000 6.419000 1.224000  5.087000 1.290000  1.332000       1.778000  
1 1 1 12 39 47 o 8.754000 0.5577000 9.126000 0.8135000 8.381000 0.7629000 0.7452000      1.115000  
1 1 1 12 39 49 o 4.199000 0.8504000 2.696000 1.215000  5.701000 1.190000  -3.005000      1.701000  
1 1 1 12 40 0  o 2.771000 1.154000  2.771000 1.154000  2.771000 1.154000  0.000000       0.000000  
1 1 1 12 40 2  o 15.40000 0.3393000 15.08000 0.4697000 15.71000 0.4898000 -0.6343000     0.6787000 
1 1 1 12 40 4  o 7.081000 0.7228000 7.798000 0.7877000 6.365000 1.212000  1.433000       1.446000  
1 1 1 12 40 6  o 18.32000 0.3075000 18.50000 0.4427000 18.14000 0.4270000 0.3575000      0.6150000 
1 1 1 12 40 8  o 17.83000 0.5650000 18.62000 0.5455000 17.05000 0.9896000 1.565000       1.130000  
1 1 1 12 40 10 f 31.33000 0.3677000 31.03000 0.4421000 31.63000 0.5876000 -0.5967000     0.7353000 
1 1 1 12 40 12 o 37.65000 0.4179000 37.16000 0.6642000 38.15000 0.5074000 -0.9974000     0.8358000 
1 1 1 12 40 14 o 5.807000 0.7539000 7.141000 0.7780000 4.472000 1.292000  2.669000       1.508000  
1 1 1 12 40 16 o 17.33000 0.3438000 16.67000 0.4151000 17.99000 0.5482000 -1.326000      0.6877000 
1 1 1 12 40 18 o 14.31000 0.3543000 14.72000 0.4645000 13.90000 0.5351000 0.8198000      0.7086000 
1 1 1 12 40 20 o 17.49000 0.3081000 18.00000 0.3983000 16.99000 0.4703000 1.010000       0.6163000 
1 1 1 12 40 22 o 19.08000 0.3279000 19.07000 0.4161000 19.10000 0.5067000 -0.2997000E-01 0.6557000 
1 1 1 12 40 24 o 19.40000 0.4019000 19.50000 0.3675000 19.30000 0.7149000 0.1960000      0.8038000 
1 1 1 12 40 26 o 20.00000 0.4413000 19.56000 0.5057000 20.43000 0.7233000 -0.8667000     0.8826000 
1 1 1 12 40 28 o 17.38000 0.3072000 18.18000 0.3793000 16.58000 0.4834000 1.596000       0.6144000 
1 1 1 12 40 30 o 2.937000 0.8593000 2.755000 1.180000  3.119000 1.249000  -0.3644000     1.719000  
1 1 1 12 40 32 o 7.816000 0.5424000 8.672000 0.5401000 6.960000 0.9407000 1.712000       1.085000  
1 1 1 12 40 34 o 14.34000 0.3922000 14.41000 0.6022000 14.26000 0.5026000 0.1569000      0.7844000 
1 1 1 12 40 36 o 29.41000 0.3154000 29.23000 0.4400000 29.59000 0.4520000 -0.3553000     0.6308000 
1 1 1 12 40 38 o 19.70000 0.3442000 19.80000 0.4519000 19.60000 0.5194000 0.2056000      0.6885000 
1 1 1 12 40 40 o 3.030000 0.8778000 2.268000 1.050000  3.791000 1.407000  -1.523000      1.756000  
1 1 1 12 40 42 f 7.917000 0.6856000 6.838000 0.9817000 8.997000 0.9573000 -2.158000      1.371000  
1 1 1 12 40 44 o 7.258000 0.6776000 7.504000 0.8947000 7.011000 1.018000  0.4930000      1.355000  
1 1 1 12 40 46 o 3.647000 0.9097000 3.237000 1.290000  4.057000 1.283000  -0.8202000     1.819000  
1 1 1 12 40 48 o 3.236000 0.9058000 2.790000 1.234000  3.682000 1.327000  -0.8924000     1.812000  
1 1 1 12 40 50 f 8.912000 1.374000  8.912000 1.374000  ?        ?         ?              ?         
1 1 1 12 41 1  o 9.663000 0.4525000 10.09000 0.6243000 9.240000 0.6553000 0.8467000      0.9050000 
1 1 1 12 41 3  o 24.90000 0.2890000 24.72000 0.4112000 25.08000 0.4064000 -0.3620000     0.5781000 
1 1 1 12 41 5  o 11.78000 0.3945000 12.13000 0.5515000 11.42000 0.5642000 0.7094000      0.7890000 
1 1 1 12 41 7  f 10.36000 0.4754000 10.74000 0.7440000 9.972000 0.5919000 0.7691000      0.9508000 
1 1 1 12 41 9  o 15.16000 0.3354000 15.22000 0.5089000 15.11000 0.4371000 0.1134000      0.6708000 
1 1 1 12 41 11 o 16.66000 0.3771000 16.84000 0.5460000 16.49000 0.5203000 0.3541000      0.7542000 
1 1 1 12 41 13 o 14.59000 0.3674000 14.18000 0.5324000 15.01000 0.5063000 -0.8286000     0.7347000 
1 1 1 12 41 15 o 18.50000 0.3072000 18.30000 0.3904000 18.70000 0.4744000 -0.4013000     0.6144000 
1 1 1 12 41 17 o 20.78000 0.2956000 20.59000 0.3799000 20.96000 0.4530000 -0.3634000     0.5912000 
1 1 1 12 41 19 o 14.06000 0.3664000 13.98000 0.4570000 14.14000 0.5728000 -0.1593000     0.7327000 
1 1 1 12 41 21 o 26.96000 0.3943000 26.93000 0.5855000 26.98000 0.5281000 -0.5225000E-01 0.7885000 
1 1 1 12 41 23 o 3.386000 0.7946000 3.191000 1.140000  3.581000 1.107000  -0.3900000     1.589000  
1 1 1 12 41 25 o 12.63000 0.5594000 13.29000 0.5360000 11.97000 0.9821000 1.318000       1.119000  
1 1 1 12 41 27 o 8.504000 0.5314000 8.400000 0.6645000 8.608000 0.8294000 -0.2084000     1.063000  
1 1 1 12 41 29 o 17.54000 0.3067000 18.18000 0.3783000 16.90000 0.4829000 1.277000       0.6135000 
1 1 1 12 41 31 o 8.832000 0.5173000 8.790000 0.7029000 8.874000 0.7592000 -0.8382000E-01 1.035000  
1 1 1 12 41 33 o 7.876000 0.5153000 7.604000 0.7446000 8.148000 0.7124000 -0.5444000     1.031000  
1 1 1 12 41 35 o 9.161000 0.4948000 9.089000 0.6715000 9.232000 0.7269000 -0.1427000     0.9896000 
1 1 1 12 41 37 o 3.776000 0.9361000 3.719000 1.366000  3.833000 1.280000  -0.1133000     1.872000  
1 1 1 12 41 39 o 3.415000 0.9235000 3.280000 1.234000  3.549000 1.374000  -0.2682000     1.847000  
1 1 1 12 41 41 o 7.089000 0.6081000 6.794000 0.8673000 7.384000 0.8526000 -0.5895000     1.216000  
1 1 1 12 41 43 o 11.57000 0.4459000 11.78000 0.6130000 11.36000 0.6477000 0.4226000      0.8918000 
1 1 1 12 41 45 o 4.606000 1.031000  3.963000 1.664000  5.250000 1.216000  -1.286000      2.061000  
1 1 1 12 41 47 o 6.042000 0.8366000 5.396000 1.392000  6.688000 0.9281000 -1.292000      1.673000  
1 1 1 12 41 49 o 5.012000 1.737000  5.012000 1.737000  ?        ?         ?              ?         
1 1 1 12 42 0  o 7.091000 0.8648000 7.091000 0.8648000 7.091000 0.8648000 0.000000       0.000000  
1 1 1 12 42 2  o 35.67000 0.4145000 35.42000 0.4481000 35.91000 0.6974000 -0.4948000     0.8289000 
1 1 1 12 42 4  o 30.48000 0.3020000 30.71000 0.4300000 30.24000 0.4241000 0.4722000      0.6039000 
1 1 1 12 42 6  o 37.86000 0.3852000 38.03000 0.5491000 37.69000 0.5403000 0.3380000      0.7703000 
1 1 1 12 42 8  o 17.32000 0.3075000 17.60000 0.4522000 17.03000 0.4168000 0.5607000      0.6150000 
1 1 1 12 42 10 o 8.573000 0.5487000 9.004000 0.8794000 8.141000 0.6566000 0.8635000      1.097000  
1 1 1 12 42 12 o 16.90000 0.3430000 16.77000 0.4657000 17.03000 0.5036000 -0.2572000     0.6859000 
1 1 1 12 42 14 o 24.94000 0.3786000 25.02000 0.3695000 24.85000 0.6609000 0.1723000      0.7572000 
1 1 1 12 42 16 o 18.18000 0.3062000 17.73000 0.3874000 18.64000 0.4744000 -0.9120000     0.6124000 
1 1 1 12 42 18 o 16.44000 0.3135000 16.52000 0.3873000 16.36000 0.4930000 0.1597000      0.6270000 
1 1 1 12 42 20 o 16.63000 0.3290000 16.96000 0.3970000 16.30000 0.5247000 0.6534000      0.6580000 
1 1 1 12 42 22 o 7.372000 0.5010000 7.766000 0.6452000 6.978000 0.7665000 0.7878000      1.002000  
1 1 1 12 42 24 o 16.32000 0.4477000 15.53000 0.5606000 17.11000 0.6981000 -1.580000      0.8953000 
1 1 1 12 42 26 o 32.08000 0.3238000 32.62000 0.3967000 31.54000 0.5120000 1.073000       0.6477000 
1 1 1 12 42 28 o 18.19000 0.3222000 18.32000 0.4049000 18.06000 0.5013000 0.2614000      0.6444000 
1 1 1 12 42 30 o 8.164000 0.5616000 8.977000 0.6568000 7.351000 0.9111000 1.626000       1.123000  
1 1 1 12 42 32 o 5.521000 0.6793000 5.179000 0.8391000 5.863000 1.069000  -0.6841000     1.359000  
1 1 1 12 42 34 o 4.660000 0.8484000 4.842000 1.145000  4.478000 1.253000  0.3636000      1.697000  
1 1 1 12 42 36 o 8.891000 0.6136000 8.572000 0.9501000 9.211000 0.7768000 -0.6394000     1.227000  
1 1 1 12 42 38 o 6.276000 0.7667000 6.637000 0.9053000 5.916000 1.238000  0.7206000      1.533000  
1 1 1 12 42 40 o 2.398000 0.7721000 2.512000 1.113000  2.284000 1.071000  0.2283000      1.544000  
1 1 1 12 42 42 o 4.979000 0.9453000 5.120000 1.183000  4.838000 1.475000  0.2820000      1.891000  
1 1 1 12 42 44 o 7.123000 0.7129000 6.948000 1.100000  7.299000 0.9072000 -0.3506000     1.426000  
1 1 1 12 42 46 o 4.918000 0.8802000 4.078000 1.391000  5.757000 1.079000  -1.680000      1.760000  
1 1 1 12 42 48 f 7.209000 1.819000  7.209000 1.819000  ?        ?         ?              ?         
1 1 1 12 43 1  o 12.80000 0.5305000 12.42000 0.9199000 13.18000 0.5287000 -0.7624000     1.061000  
1 1 1 12 43 3  o 4.421000 0.8952000 4.828000 1.269000  4.014000 1.263000  0.8140000      1.790000  
1 1 1 12 43 5  o 15.75000 0.3579000 15.75000 0.5728000 15.75000 0.4293000 0.4963000E-02  0.7158000 
1 1 1 12 43 7  o 5.097000 0.8216000 5.369000 1.118000  4.826000 1.204000  0.5431000      1.643000  
1 1 1 12 43 9  o 16.64000 0.3414000 16.97000 0.5432000 16.31000 0.4139000 0.6607000      0.6829000 
1 1 1 12 43 11 o 14.83000 0.3188000 14.52000 0.4984000 15.14000 0.3978000 -0.6166000     0.6376000 
1 1 1 12 43 13 o 12.22000 0.5224000 12.01000 0.5629000 12.43000 0.8803000 -0.4216000     1.045000  
1 1 1 12 43 15 o 12.53000 0.4994000 12.50000 0.4612000 12.56000 0.8859000 -0.6472000E-01 0.9987000 
1 1 1 12 43 17 o 8.310000 0.9568000 7.812000 0.6414000 8.808000 1.803000  -0.9954000     1.914000  
1 1 1 12 43 19 o 2.698000 0.7627000 3.128000 1.131000  2.269000 1.024000  0.8588000      1.525000  
1 1 1 12 43 21 o 15.96000 0.4418000 15.90000 0.4042000 16.02000 0.7857000 -0.1177000     0.8836000 
1 1 1 12 43 23 o 12.14000 0.5352000 12.08000 0.5953000 12.20000 0.8896000 -0.1151000     1.070000  
1 1 1 12 43 25 o 11.96000 0.4005000 11.94000 0.4639000 11.97000 0.6530000 -0.3483000E-01 0.8010000 
1 1 1 12 43 27 o 7.892000 0.5343000 8.269000 0.7052000 7.515000 0.8027000 0.7545000      1.069000  
1 1 1 12 43 29 o 2.935000 0.8437000 2.745000 1.124000  3.124000 1.258000  -0.3791000     1.687000  
1 1 1 12 43 31 o 5.594000 0.6898000 5.195000 0.7877000 5.993000 1.133000  -0.7978000     1.380000  
1 1 1 12 43 33 o 6.547000 0.6446000 6.772000 0.9241000 6.321000 0.8988000 0.4514000      1.289000  
1 1 1 12 43 35 o 11.32000 0.4540000 10.60000 0.6400000 12.05000 0.6441000 -1.444000      0.9080000 
1 1 1 12 43 37 o 3.777000 0.9651000 3.769000 1.349000  3.785000 1.380000  -0.1584000E-01 1.930000  
1 1 1 12 43 39 o 3.840000 0.9112000 4.298000 1.286000  3.383000 1.291000  0.9150000      1.822000  
1 1 1 12 43 41 o 7.128000 0.7584000 5.904000 1.112000  8.353000 1.031000  -2.449000      1.517000  
1 1 1 12 43 43 o 11.52000 0.4759000 10.84000 0.6180000 12.21000 0.7238000 -1.365000      0.9517000 
1 1 1 12 43 45 o 3.764000 0.9738000 3.427000 1.336000  4.100000 1.417000  -0.6737000     1.948000  
1 1 1 12 43 47 o 5.031000 1.846000  5.031000 1.846000  ?        ?         ?              ?         
1 1 1 12 44 0  o 3.785000 1.259000  3.785000 1.259000  3.785000 1.259000  0.000000       0.000000  
1 1 1 12 44 2  o 30.10000 0.2995000 29.84000 0.4236000 30.35000 0.4234000 -0.5119000     0.5989000 
1 1 1 12 44 4  o 33.44000 0.3948000 33.00000 0.6573000 33.89000 0.4376000 -0.8923000     0.7897000 
1 1 1 12 44 6  o 30.40000 0.2974000 30.72000 0.4269000 30.07000 0.4143000 0.6562000      0.5948000 
1 1 1 12 44 8  o 34.17000 0.3406000 34.28000 0.4500000 34.05000 0.5113000 0.2225000      0.6811000 
1 1 1 12 44 10 o 24.37000 0.3092000 24.21000 0.4775000 24.53000 0.3931000 -0.3189000     0.6184000 
1 1 1 12 44 12 f 16.46000 0.3084000 16.07000 0.4767000 16.85000 0.3914000 -0.7805000     0.6168000 
1 1 1 12 44 14 o 20.67000 0.3783000 20.35000 0.3664000 20.98000 0.6620000 -0.6308000     0.7566000 
1 1 1 12 44 16 o 15.26000 0.6291000 15.73000 0.4035000 14.80000 1.192000  0.9327000      1.258000  
1 1 1 12 44 18 o 7.926000 0.6731000 6.877000 0.7553000 8.974000 1.114000  -2.097000      1.346000  
1 1 1 12 44 20 o 7.010000 0.7694000 7.014000 0.6748000 7.007000 1.383000  0.7454000E-02  1.539000  
1 1 1 12 44 22 o 5.207000 0.9401000 5.567000 0.8967000 4.847000 1.653000  0.7204000      1.880000  
1 1 1 12 44 24 o 5.161000 0.7515000 5.960000 0.8123000 4.363000 1.265000  1.597000       1.503000  
1 1 1 12 44 26 o 7.217000 0.5426000 7.566000 0.6598000 6.867000 0.8616000 0.6988000      1.085000  
1 1 1 12 44 28 o 8.961000 0.5268000 10.15000 0.5485000 7.773000 0.8996000 2.377000       1.054000  
1 1 1 12 44 30 o 8.667000 0.6184000 8.151000 0.9699000 9.184000 0.7675000 -1.033000      1.237000  
1 1 1 12 44 32 o 11.55000 0.4311000 11.28000 0.5388000 11.81000 0.6732000 -0.5285000     0.8622000 
1 1 1 12 44 34 o 13.27000 0.3982000 13.51000 0.4859000 13.02000 0.6310000 0.4882000      0.7964000 
1 1 1 12 44 36 o 5.350000 0.8161000 3.776000 1.246000  6.924000 1.054000  -3.148000      1.632000  
1 1 1 12 44 38 o 7.480000 0.6101000 7.771000 0.8446000 7.190000 0.8808000 0.5816000      1.220000  
1 1 1 12 44 40 o 4.364000 0.9814000 3.131000 1.279000  5.598000 1.488000  -2.466000      1.963000  
1 1 1 12 44 42 o 4.912000 0.9681000 4.998000 1.268000  4.827000 1.463000  0.1706000      1.936000  
1 1 1 12 44 44 o 7.580000 0.6640000 6.320000 0.9672000 8.840000 0.9100000 -2.520000      1.328000  
1 1 1 12 45 1  o 8.361000 0.5020000 9.058000 0.6557000 7.663000 0.7604000 1.395000       1.004000  
1 1 1 12 45 3  f 10.33000 0.4061000 10.52000 0.5710000 10.14000 0.5777000 0.3896000      0.8122000 
1 1 1 12 45 5  o 2.355000 0.7381000 2.284000 1.040000  2.426000 1.048000  -0.1419000     1.476000  
1 1 1 12 45 7  o 12.14000 0.4205000 12.01000 0.6995000 12.26000 0.4670000 -0.2494000     0.8411000 
1 1 1 12 45 9  o 13.46000 0.3682000 13.72000 0.5191000 13.20000 0.5222000 0.5213000      0.7363000 
1 1 1 12 45 11 o 9.393000 0.4239000 9.288000 0.6536000 9.497000 0.5401000 -0.2091000     0.8479000 
1 1 1 12 45 13 o 16.85000 0.3230000 16.15000 0.4742000 17.55000 0.4385000 -1.392000      0.6459000 
1 1 1 12 45 15 o 24.77000 0.3027000 24.59000 0.3942000 24.94000 0.4595000 -0.3517000     0.6054000 
1 1 1 12 45 17 f 13.09000 0.4628000 13.15000 0.4370000 13.03000 0.8160000 0.1113000      0.9256000 
1 1 1 12 45 19 o 17.63000 0.4259000 17.62000 0.4580000 17.65000 0.7183000 -0.2336000E-01 0.8519000 
1 1 1 12 45 21 o 4.325000 1.019000  3.865000 1.196000  4.785000 1.651000  -0.9197000     2.039000  
1 1 1 12 45 23 o 10.08000 0.4469000 10.63000 0.6116000 9.536000 0.6518000 1.093000       0.8938000 
1 1 1 12 45 25 o 9.306000 0.4301000 8.785000 0.5934000 9.827000 0.6226000 -1.043000      0.8601000 
1 1 1 12 45 27 o 6.288000 0.6455000 6.771000 0.7718000 5.806000 1.035000  0.9650000      1.291000  
1 1 1 12 45 29 o 4.398000 0.9727000 4.716000 1.403000  4.080000 1.348000  0.6353000      1.945000  
1 1 1 12 45 31 o 4.732000 0.9768000 4.532000 1.445000  4.931000 1.315000  -0.3984000     1.954000  
1 1 1 12 45 33 f 9.007000 1.168000  10.19000 0.5727000 7.823000 2.265000  2.369000       2.336000  
1 1 1 12 45 35 o 9.499000 0.5086000 9.906000 0.5989000 9.091000 0.8221000 0.8151000      1.017000  
1 1 1 12 45 37 o 6.965000 0.6731000 6.764000 0.9185000 7.167000 0.9842000 -0.4037000     1.346000  
1 1 1 12 45 39 o 9.231000 0.5817000 8.839000 0.6883000 9.623000 0.9380000 -0.7837000     1.163000  
1 1 1 12 45 41 o 5.772000 0.8616000 5.437000 1.136000  6.107000 1.296000  -0.6699000     1.723000  
1 1 1 12 45 43 o 2.816000 0.8822000 3.035000 1.302000  2.597000 1.191000  0.4382000      1.764000  
1 1 1 12 46 0  o 20.45000 0.4077000 20.45000 0.4077000 20.45000 0.4077000 0.000000       0.000000  
1 1 1 12 46 2  o 6.561000 0.5849000 7.036000 0.7701000 6.086000 0.8806000 0.9496000      1.170000  
1 1 1 12 46 4  o 15.67000 0.3162000 15.34000 0.4559000 16.01000 0.4384000 -0.6733000     0.6325000 
1 1 1 12 46 6  o 7.200000 0.5460000 7.237000 0.8112000 7.163000 0.7310000 0.7412000E-01  1.092000  
1 1 1 12 46 8  o 19.37000 0.2885000 19.65000 0.4253000 19.09000 0.3899000 0.5586000      0.5769000 
1 1 1 12 46 10 o 22.68000 0.3148000 22.72000 0.4266000 22.64000 0.4630000 0.8423000E-01  0.6296000 
1 1 1 12 46 12 o 24.02000 0.3919000 24.64000 0.6488000 23.39000 0.4398000 1.249000       0.7838000 
1 1 1 12 46 14 o 16.91000 0.3077000 16.84000 0.4014000 16.98000 0.4664000 -0.1419000     0.6153000 
1 1 1 12 46 16 o 7.280000 0.5167000 7.179000 0.6872000 7.380000 0.7719000 -0.2010000     1.033000  
1 1 1 12 46 18 o 9.068000 0.5032000 8.874000 0.7097000 9.261000 0.7136000 -0.3873000     1.006000  
1 1 1 12 46 20 o 9.106000 0.4539000 8.996000 0.5684000 9.217000 0.7077000 -0.2207000     0.9077000 
1 1 1 12 46 22 o 3.089000 0.8139000 3.637000 1.183000  2.542000 1.119000  1.095000       1.628000  
1 1 1 12 46 24 o 4.196000 0.8665000 3.417000 1.300000  4.975000 1.146000  -1.558000      1.733000  
1 1 1 12 46 26 o 3.741000 0.8048000 4.528000 1.086000  2.954000 1.188000  1.574000       1.610000  
1 1 1 12 46 28 o 4.830000 0.7689000 6.240000 0.8809000 3.421000 1.260000  2.819000       1.538000  
1 1 1 12 46 30 f 3.137000 0.8933000 3.556000 1.325000  2.717000 1.199000  0.8396000      1.787000  
1 1 1 12 46 32 o 4.832000 1.093000  5.289000 1.034000  4.376000 1.926000  0.9126000      2.186000  
1 1 1 12 46 34 o 9.271000 0.5061000 9.144000 0.6098000 9.398000 0.8079000 -0.2542000     1.012000  
1 1 1 12 46 36 o 2.768000 0.8310000 2.788000 1.127000  2.748000 1.222000  0.4004000E-01  1.662000  
1 1 1 12 46 38 o 2.400000 0.7825000 2.155000 1.004000  2.644000 1.201000  -0.4890000     1.565000  
1 1 1 12 46 40 o 3.149000 0.9652000 3.170000 1.365000  3.128000 1.365000  0.4215000E-01  1.930000  
1 1 1 12 46 42 o 3.528000 1.060000  4.026000 1.646000  3.031000 1.335000  0.9948000      2.119000  
1 1 1 12 47 1  o 14.01000 0.3310000 14.20000 0.4657000 13.82000 0.4706000 0.3759000      0.6620000 
1 1 1 12 47 3  o 18.77000 0.3271000 19.07000 0.4919000 18.47000 0.4312000 0.5970000      0.6541000 
1 1 1 12 47 5  o 18.49000 0.2936000 18.78000 0.4224000 18.19000 0.4080000 0.5862000      0.5873000 
1 1 1 12 47 7  o 26.38000 0.3153000 26.55000 0.4869000 26.21000 0.4006000 0.3422000      0.6305000 
1 1 1 12 47 9  o 5.727000 0.6602000 5.930000 0.9106000 5.524000 0.9562000 0.4059000      1.320000  
1 1 1 12 47 11 o 5.234000 0.7219000 5.747000 0.9518000 4.721000 1.086000  1.026000       1.444000  
1 1 1 12 47 13 o 20.86000 0.3176000 20.31000 0.4358000 21.41000 0.4621000 -1.096000      0.6352000 
1 1 1 12 47 15 o 12.44000 0.3992000 12.09000 0.5955000 12.78000 0.5318000 -0.6828000     0.7984000 
1 1 1 12 47 17 o 10.18000 0.4948000 10.27000 0.7340000 10.10000 0.6636000 0.1693000      0.9896000 
1 1 1 12 47 19 o 14.15000 0.3324000 14.13000 0.4300000 14.17000 0.5070000 -0.4281000E-01 0.6648000 
1 1 1 12 47 21 o 7.996000 0.5283000 7.509000 0.7510000 8.482000 0.7431000 -0.9722000     1.057000  
1 1 1 12 47 23 o 6.804000 0.6443000 7.751000 0.7173000 5.856000 1.070000  1.894000       1.289000  
1 1 1 12 47 25 o 8.548000 0.5201000 8.789000 0.7355000 8.306000 0.7357000 0.4835000      1.040000  
1 1 1 12 47 27 o 7.810000 0.5631000 7.457000 0.8196000 8.163000 0.7724000 -0.7055000     1.126000  
1 1 1 12 47 29 o 4.130000 1.018000  4.053000 1.299000  4.208000 1.567000  -0.1543000     2.036000  
1 1 1 12 47 31 o 4.910000 1.057000  5.479000 0.9581000 4.340000 1.884000  1.140000       2.114000  
1 1 1 12 47 33 o 4.208000 1.060000  4.750000 1.549000  3.667000 1.447000  1.083000       2.119000  
1 1 1 12 47 35 o 3.560000 0.9245000 3.906000 1.228000  3.214000 1.382000  0.6918000      1.849000  
1 1 1 12 47 37 o 5.537000 1.012000  5.879000 1.342000  5.194000 1.515000  0.6851000      2.024000  
1 1 1 12 47 39 o 7.093000 1.113000  7.637000 0.9980000 6.549000 1.990000  1.088000       2.226000  
1 1 1 12 47 41 f 4.574000 1.143000  4.419000 1.757000  4.728000 1.462000  -0.3086000     2.286000  
1 1 1 12 48 0  o 7.243000 0.7762000 7.243000 0.7762000 7.243000 0.7762000 0.000000       0.000000  
1 1 1 12 48 2  o 2.583000 0.8044000 2.738000 1.190000  2.428000 1.082000  0.3103000      1.609000  
1 1 1 12 48 4  o 9.226000 0.4154000 9.062000 0.6046000 9.390000 0.5698000 -0.3279000     0.8308000 
1 1 1 12 48 6  o 2.792000 0.8258000 2.762000 1.201000  2.822000 1.134000  -0.6048000E-01 1.652000  
1 1 1 12 48 8  o 11.89000 0.3690000 11.64000 0.5403000 12.13000 0.5028000 -0.4941000     0.7380000 
1 1 1 12 48 10 o 6.350000 0.6174000 5.424000 1.044000  7.276000 0.6592000 -1.852000      1.235000  
1 1 1 12 48 12 o 12.67000 0.3463000 12.73000 0.5292000 12.61000 0.4469000 0.1252000      0.6926000 
1 1 1 12 48 14 o 21.61000 0.3360000 21.68000 0.4850000 21.54000 0.4652000 0.1390000      0.6720000 
1 1 1 12 48 16 o 14.02000 0.3577000 13.26000 0.5303000 14.78000 0.4803000 -1.521000      0.7155000 
1 1 1 12 48 18 o 2.115000 0.6970000 2.231000 1.005000  1.999000 0.9663000 0.2318000      1.394000  
1 1 1 12 48 20 o 6.392000 0.7293000 5.956000 1.138000  6.827000 0.9122000 -0.8707000     1.459000  
1 1 1 12 48 22 o 13.23000 0.3564000 12.80000 0.4814000 13.66000 0.5256000 -0.8668000     0.7127000 
1 1 1 12 48 24 o 3.991000 0.9022000 4.307000 1.276000  3.676000 1.276000  0.6315000      1.804000  
1 1 1 12 48 26 o 6.851000 0.7771000 6.287000 0.8731000 7.415000 1.286000  -1.128000      1.554000  
1 1 1 12 48 28 o 6.207000 0.8995000 7.115000 0.6635000 5.298000 1.672000  1.816000       1.799000  
1 1 1 12 48 30 o 6.707000 1.086000  7.147000 0.9079000 6.267000 1.972000  0.8801000      2.171000  
1 1 1 12 48 32 o 5.635000 0.8493000 5.983000 1.108000  5.288000 1.288000  0.6945000      1.699000  
1 1 1 12 48 34 o 4.360000 1.019000  3.791000 1.416000  4.929000 1.466000  -1.138000      2.038000  
1 1 1 12 48 36 f 6.933000 0.8018000 6.214000 1.119000  7.651000 1.149000  -1.437000      1.604000  
1 1 1 12 48 38 o 6.616000 0.9547000 5.621000 1.386000  7.611000 1.313000  -1.991000      1.909000  
1 1 1 12 48 40 o 4.651000 0.9831000 4.851000 1.304000  4.451000 1.471000  0.4001000      1.966000  
1 1 1 12 49 1  o 22.53000 0.3407000 21.91000 0.5031000 23.15000 0.4595000 -1.241000      0.6814000 
1 1 1 12 49 3  o 4.508000 0.8007000 4.758000 1.072000  4.258000 1.190000  0.4994000      1.601000  
1 1 1 12 49 5  o 6.234000 0.6819000 6.054000 1.090000  6.415000 0.8195000 -0.3614000     1.364000  
1 1 1 12 49 7  o 8.096000 0.4547000 7.774000 0.6964000 8.419000 0.5849000 -0.6451000     0.9094000 
1 1 1 12 49 9  o 11.65000 0.3545000 11.15000 0.5292000 12.15000 0.4718000 -1.005000      0.7090000 
1 1 1 12 49 11 o 10.58000 0.3888000 10.16000 0.6096000 10.99000 0.4826000 -0.8262000     0.7775000 
1 1 1 12 49 13 o 17.25000 0.3017000 16.95000 0.4499000 17.54000 0.4022000 -0.5841000     0.6035000 
1 1 1 12 49 15 o 10.07000 0.4420000 9.715000 0.6309000 10.42000 0.6192000 -0.7026000     0.8840000 
1 1 1 12 49 17 o 6.227000 0.6574000 6.498000 0.8330000 5.955000 1.017000  0.5434000      1.315000  
1 1 1 12 49 19 o 11.97000 0.4326000 11.47000 0.6729000 12.47000 0.5440000 -1.001000      0.8653000 
1 1 1 12 49 21 o 12.12000 0.3975000 12.26000 0.5383000 11.97000 0.5849000 0.2876000      0.7950000 
1 1 1 12 49 23 o 4.132000 0.9288000 2.532000 1.056000  5.733000 1.528000  -3.200000      1.858000  
1 1 1 12 49 25 o 5.630000 0.9550000 5.372000 1.059000  5.888000 1.590000  -0.5161000     1.910000  
1 1 1 12 49 27 o 5.125000 0.9707000 5.444000 1.039000  4.806000 1.640000  0.6383000      1.941000  
1 1 1 12 49 29 o 4.421000 1.170000  3.514000 1.388000  5.327000 1.885000  -1.813000      2.341000  
1 1 1 12 49 31 o 9.450000 0.6099000 9.330000 0.6475000 9.569000 1.034000  -0.2394000     1.220000  
1 1 1 12 49 33 o 9.539000 0.6251000 9.860000 0.8513000 9.218000 0.9155000 0.6418000      1.250000  
1 1 1 12 49 35 o 3.521000 0.9722000 3.591000 1.356000  3.451000 1.394000  0.1399000      1.944000  
1 1 1 12 49 37 o 8.134000 0.7350000 8.400000 1.030000  7.868000 1.049000  0.5319000      1.470000  
1 1 1 12 49 39 o 3.634000 0.9598000 3.967000 1.382000  3.302000 1.332000  0.6652000      1.920000  
1 1 1 12 50 0  o 16.03000 0.6722000 16.03000 0.6722000 16.03000 0.6722000 0.000000       0.000000  
1 1 1 12 50 2  o 8.282000 0.5200000 8.301000 0.7450000 8.264000 0.7257000 0.3788000E-01  1.040000  
1 1 1 12 50 4  o 10.66000 0.4832000 11.61000 0.7801000 9.697000 0.5703000 1.917000       0.9664000 
1 1 1 12 50 6  o 8.856000 0.4541000 8.613000 0.6804000 9.098000 0.6016000 -0.4849000     0.9083000 
1 1 1 12 50 8  o 11.85000 0.3832000 11.52000 0.5954000 12.18000 0.4826000 -0.6676000     0.7664000 
1 1 1 12 50 10 o 5.006000 0.7391000 5.163000 1.097000  4.850000 0.9903000 0.3128000      1.478000  
1 1 1 12 50 12 o 5.928000 0.6326000 6.239000 0.9130000 5.616000 0.8757000 0.6226000      1.265000  
1 1 1 12 50 14 o 4.404000 0.8805000 4.913000 1.367000  3.895000 1.110000  1.018000       1.761000  
1 1 1 12 50 16 o 4.209000 0.8994000 4.185000 1.329000  4.233000 1.213000  -0.4811000E-01 1.799000  
1 1 1 12 50 18 o 11.65000 0.4812000 11.47000 0.7733000 11.83000 0.5730000 -0.3600000     0.9625000 
1 1 1 12 50 20 o 2.809000 0.8169000 2.294000 1.023000  3.325000 1.274000  -1.031000      1.634000  
1 1 1 12 50 22 o 10.66000 0.5921000 11.64000 0.4893000 9.686000 1.078000  1.949000       1.184000  
1 1 1 12 50 24 o 3.738000 0.9893000 3.309000 1.156000  4.167000 1.606000  -0.8582000     1.979000  
1 1 1 12 50 26 o 3.254000 0.9274000 2.650000 1.022000  3.857000 1.548000  -1.206000      1.855000  
1 1 1 12 50 28 o 4.497000 1.135000  4.705000 1.455000  4.289000 1.744000  0.4156000      2.271000  
1 1 1 12 50 30 o 5.923000 1.093000  6.818000 1.400000  5.029000 1.678000  1.789000       2.186000  
1 1 1 12 50 32 o 7.007000 0.8720000 7.092000 1.312000  6.922000 1.149000  0.1692000      1.744000  
1 1 1 12 50 34 o 3.248000 1.005000  3.297000 1.422000  3.199000 1.420000  0.9766000E-01  2.009000  
1 1 1 12 50 36 o 3.992000 1.012000  3.835000 1.392000  4.149000 1.470000  -0.3144000     2.025000  
1 1 1 12 50 38 o 3.522000 1.193000  3.867000 1.831000  3.178000 1.530000  0.6886000      2.386000  
1 1 1 12 51 1  o 4.663000 0.8502000 5.453000 1.021000  3.874000 1.360000  1.578000       1.700000  
1 1 1 12 51 3  o 5.505000 0.7434000 5.525000 1.129000  5.485000 0.9675000 0.4067000E-01  1.487000  
1 1 1 12 51 5  o 5.706000 0.7368000 6.620000 1.038000  4.793000 1.046000  1.827000       1.474000  
1 1 1 12 51 7  o 6.102000 0.7469000 6.461000 1.177000  5.744000 0.9194000 0.7169000      1.494000  
1 1 1 12 51 9  o 7.904000 0.5525000 7.845000 0.8727000 7.963000 0.6780000 -0.1186000     1.105000  
1 1 1 12 51 11 o 4.905000 0.8075000 4.749000 1.319000  5.060000 0.9318000 -0.3116000     1.615000  
1 1 1 12 51 13 o 8.777000 0.4934000 9.403000 0.7848000 8.151000 0.5982000 1.252000       0.9867000 
1 1 1 12 51 15 o 8.000000 0.5253000 7.608000 0.7526000 8.393000 0.7331000 -0.7852000     1.051000  
1 1 1 12 51 17 o 9.641000 0.4893000 9.483000 0.6837000 9.799000 0.7002000 -0.3155000     0.9786000 
1 1 1 12 51 19 o 6.446000 0.7900000 5.389000 1.063000  7.502000 1.169000  -2.113000      1.580000  
1 1 1 12 51 21 o 9.208000 0.6075000 8.100000 0.6123000 10.32000 1.049000  -2.216000      1.215000  
1 1 1 12 51 23 o 3.307000 0.8471000 3.873000 1.107000  2.740000 1.283000  1.133000       1.694000  
1 1 1 12 51 25 o 6.504000 0.9445000 6.504000 0.9445000 ?        ?         ?              ?         
1 1 1 12 51 27 o 8.201000 0.8847000 9.267000 0.8674000 7.136000 1.542000  2.130000       1.769000  
1 1 1 12 51 29 o 3.589000 1.021000  3.669000 1.388000  3.509000 1.496000  0.1604000      2.041000  
1 1 1 12 51 31 o 4.146000 1.054000  4.577000 1.286000  3.714000 1.670000  0.8631000      2.108000  
1 1 1 12 51 33 f 4.468000 1.070000  4.856000 1.521000  4.081000 1.506000  0.7752000      2.141000  
1 1 1 12 51 35 o 3.259000 0.9229000 2.887000 1.246000  3.630000 1.362000  -0.7423000     1.846000  
1 1 1 12 52 0  o 7.210000 0.7512000 7.210000 0.7512000 7.210000 0.7512000 0.000000       0.000000  
1 1 1 12 52 2  o 11.67000 0.4712000 12.46000 0.6511000 10.88000 0.6814000 1.579000       0.9425000 
1 1 1 12 52 4  o 15.29000 0.3316000 15.25000 0.4915000 15.33000 0.4454000 -0.7253000E-01 0.6633000 
1 1 1 12 52 6  o 14.37000 0.3319000 14.52000 0.4747000 14.21000 0.4641000 0.3097000      0.6638000 
1 1 1 12 52 8  o 14.99000 0.3185000 14.51000 0.4655000 15.46000 0.4348000 -0.9554000     0.6369000 
1 1 1 12 52 10 o 7.090000 0.5449000 6.379000 0.8633000 7.800000 0.6650000 -1.420000      1.090000  
1 1 1 12 52 12 o 3.831000 0.7790000 2.911000 1.188000  4.750000 1.008000  -1.840000      1.558000  
1 1 1 12 52 14 o 4.528000 0.8274000 4.544000 1.240000  4.513000 1.096000  0.3147000E-01  1.655000  
1 1 1 12 52 16 o 4.369000 0.9488000 4.795000 1.186000  3.942000 1.481000  0.8530000      1.898000  
1 1 1 12 52 18 o 12.58000 0.5544000 13.19000 0.5487000 11.98000 0.9635000 1.207000       1.109000  
1 1 1 12 52 20 o 7.861000 0.7799000 8.377000 0.7778000 7.344000 1.352000  1.033000       1.560000  
1 1 1 12 52 22 o 3.382000 1.026000  2.809000 1.167000  3.955000 1.688000  -1.145000      2.052000  
1 1 1 12 52 24 o 6.252000 1.025000  6.252000 1.025000  ?        ?         ?              ?         
1 1 1 12 52 26 o 6.969000 0.8325000 6.060000 0.9209000 7.877000 1.387000  -1.817000      1.665000  
1 1 1 12 52 28 o 6.061000 1.026000  5.688000 1.146000  6.435000 1.701000  -0.7470000     2.051000  
1 1 1 12 52 30 o 5.078000 1.110000  4.701000 1.428000  5.455000 1.700000  -0.7538000     2.220000  
1 1 1 12 52 32 o 5.119000 0.9625000 4.760000 1.442000  5.479000 1.275000  -0.7185000     1.925000  
1 1 1 12 52 34 o 5.466000 0.9275000 6.700000 1.107000  4.233000 1.489000  2.467000       1.855000  
1 1 1 12 53 1  o 4.282000 0.9802000 4.138000 1.438000  4.426000 1.333000  -0.2878000     1.960000  
1 1 1 12 53 3  f 5.798000 0.8385000 6.483000 0.8473000 5.113000 1.447000  1.370000       1.677000  
1 1 1 12 53 5  o 2.630000 0.7859000 2.457000 1.077000  2.803000 1.145000  -0.3464000     1.572000  
1 1 1 12 53 7  o 4.352000 0.8121000 4.407000 1.149000  4.298000 1.148000  0.1084000      1.624000  
1 1 1 12 53 9  o 2.987000 0.8295000 3.242000 1.237000  2.733000 1.106000  0.5090000      1.659000  
1 1 1 12 53 11 o 5.011000 0.7402000 4.897000 1.141000  5.125000 0.9428000 -0.2277000     1.480000  
1 1 1 12 53 13 o 2.429000 0.7723000 2.776000 1.216000  2.082000 0.9521000 0.6938000      1.545000  
1 1 1 12 53 15 o 7.676000 0.5662000 8.914000 0.7249000 6.438000 0.8700000 2.476000       1.132000  
1 1 1 12 53 17 o 11.03000 0.7353000 10.70000 0.5113000 11.36000 1.379000  -0.6578000     1.471000  
1 1 1 12 53 19 o 10.40000 0.6292000 9.920000 0.5504000 10.88000 1.132000  -0.9619000     1.258000  
1 1 1 12 53 21 o 5.853000 1.117000  5.853000 1.117000  ?        ?         ?              ?         
1 1 1 12 53 23 o 4.809000 0.9790000 3.296000 1.234000  6.322000 1.520000  -3.027000      1.958000  
1 1 1 12 53 25 o 4.978000 1.012000  5.902000 1.225000  4.055000 1.611000  1.847000       2.024000  
1 1 1 12 53 27 o 10.33000 0.8354000 9.417000 0.7272000 11.24000 1.504000  -1.823000      1.671000  
1 1 1 12 53 29 o 4.802000 1.141000  3.878000 1.452000  5.725000 1.762000  -1.847000      2.283000  
1 1 1 12 53 31 o 4.239000 0.9850000 4.700000 1.216000  3.778000 1.550000  0.9226000      1.970000  
1 1 1 12 54 0  o 3.579000 1.327000  3.579000 1.327000  3.579000 1.327000  0.000000       0.000000  
1 1 1 12 54 2  o 4.695000 0.8247000 5.186000 1.139000  4.205000 1.193000  0.9808000      1.649000  
1 1 1 12 54 4  o 5.975000 0.8323000 4.603000 1.155000  7.347000 1.199000  -2.744000      1.665000  
1 1 1 12 54 6  o 8.282000 0.4988000 8.224000 0.6755000 8.339000 0.7341000 -0.1140000     0.9976000 
1 1 1 12 54 8  o 7.214000 0.5742000 7.231000 0.8076000 7.197000 0.8165000 0.3427000E-01  1.148000  
1 1 1 12 54 10 o 8.752000 0.4850000 9.536000 0.6698000 7.967000 0.7016000 1.570000       0.9700000 
1 1 1 12 54 12 o 14.84000 0.3846000 14.32000 0.6046000 15.37000 0.4756000 -1.053000      0.7692000 
1 1 1 12 54 14 o 9.334000 0.4692000 9.314000 0.6979000 9.353000 0.6272000 -0.3898000E-01 0.9383000 
1 1 1 12 54 16 f 4.778000 0.7920000 4.364000 1.247000  5.192000 0.9764000 -0.8285000     1.584000  
1 1 1 12 54 18 o 3.949000 0.8374000 2.804000 1.129000  5.094000 1.237000  -2.290000      1.675000  
1 1 1 12 54 20 o 8.410000 1.178000  8.129000 0.7207000 8.690000 2.243000  -0.5615000     2.356000  
1 1 1 12 54 22 o 3.414000 0.9660000 3.505000 1.319000  3.322000 1.412000  0.1833000      1.932000  
1 1 1 12 54 24 o 4.676000 1.111000  4.993000 1.320000  4.360000 1.788000  0.6333000      2.223000  
1 1 1 12 54 26 o 7.152000 0.9372000 7.151000 1.042000  7.152000 1.558000  -0.5732000E-03 1.874000  
1 1 1 12 54 28 o 7.044000 0.9712000 6.044000 1.224000  8.044000 1.508000  -2.000000      1.942000  
1 1 1 12 54 30 o 5.605000 1.045000  5.909000 1.114000  5.302000 1.769000  0.6071000      2.090000  
1 1 1 12 55 1  o 3.382000 0.9201000 3.172000 1.253000  3.593000 1.348000  -0.4203000     1.840000  
1 1 1 12 55 3  o 8.903000 0.4822000 9.032000 0.6667000 8.774000 0.6967000 0.2581000      0.9643000 
1 1 1 12 55 5  f 4.768000 0.8569000 4.829000 1.036000  4.707000 1.365000  0.1217000      1.714000  
1 1 1 12 55 7  o 5.585000 0.6919000 5.769000 1.007000  5.401000 0.9489000 0.3676000      1.384000  
1 1 1 12 55 9  o 4.987000 0.7817000 4.246000 1.266000  5.728000 0.9177000 -1.482000      1.563000  
1 1 1 12 55 11 o 2.700000 0.8142000 3.067000 1.271000  2.334000 1.017000  0.7334000      1.628000  
1 1 1 12 55 13 o 2.392000 0.7464000 2.496000 1.099000  2.288000 1.010000  0.2081000      1.493000  
1 1 1 12 55 15 o 4.175000 0.8043000 5.901000 1.201000  2.449000 1.071000  3.452000       1.609000  
1 1 1 12 55 17 o 3.631000 0.9840000 3.847000 1.309000  3.416000 1.470000  0.4315000      1.968000  
1 1 1 12 55 19 o 6.571000 1.131000  6.833000 1.004000  6.309000 2.028000  0.5242000      2.263000  
1 1 1 12 55 21 o 3.696000 1.053000  3.094000 1.232000  4.299000 1.708000  -1.206000      2.106000  
1 1 1 12 55 23 o 3.012000 0.9354000 3.016000 1.288000  3.009000 1.357000  0.7077000E-02  1.871000  
1 1 1 12 55 25 o 4.755000 1.078000  4.723000 1.260000  4.788000 1.750000  -0.6537000E-01 2.157000  
1 1 1 12 55 27 o 2.979000 0.9588000 2.550000 1.184000  3.407000 1.509000  -0.8567000     1.918000  
1 1 1 12 56 0  o 4.665000 1.187000  4.665000 1.187000  4.665000 1.187000  0.000000       0.000000  
1 1 1 12 56 2  o 4.467000 0.7710000 5.657000 0.9609000 3.277000 1.206000  2.380000       1.542000  
1 1 1 12 56 4  o 3.303000 0.8330000 2.828000 1.148000  3.777000 1.207000  -0.9487000     1.666000  
1 1 1 12 56 6  o 2.741000 0.8238000 3.007000 1.190000  2.475000 1.140000  0.5311000      1.648000  
1 1 1 12 56 8  o 8.608000 0.5874000 9.307000 0.6473000 7.908000 0.9805000 1.399000       1.175000  
1 1 1 12 56 10 o 2.898000 0.8540000 2.534000 1.132000  3.263000 1.279000  -0.7290000     1.708000  
1 1 1 12 56 12 o 6.186000 0.7699000 6.500000 0.9410000 5.871000 1.219000  0.6287000      1.540000  
1 1 1 12 56 14 o 9.654000 0.5882000 10.50000 0.8016000 8.808000 0.8611000 1.694000       1.176000  
1 1 1 12 56 16 o 5.391000 1.166000  4.393000 1.210000  6.389000 1.993000  -1.996000      2.331000  
1 1 1 12 56 18 o 7.272000 0.8311000 6.491000 1.038000  8.054000 1.298000  -1.563000      1.662000  
1 1 1 12 56 20 o 3.243000 1.025000  3.026000 1.362000  3.461000 1.531000  -0.4346000     2.049000  
1 1 1 12 56 22 o 3.593000 1.025000  2.666000 1.150000  4.521000 1.697000  -1.856000      2.050000  
1 1 1 12 56 24 o 3.354000 0.9999000 2.826000 1.200000  3.882000 1.600000  -1.056000      2.000000  
1 1 1 12 56 26 o 6.669000 1.349000  8.083000 2.020000  5.255000 1.788000  2.828000       2.698000  
1 1 1 12 57 1  o 2.651000 0.7969000 2.915000 1.177000  2.386000 1.075000  0.5293000      1.594000  
1 1 1 12 57 3  o 3.859000 0.8448000 4.446000 1.200000  3.272000 1.189000  1.174000       1.690000  
1 1 1 12 57 5  o 3.903000 0.8328000 3.423000 1.201000  4.383000 1.154000  -0.9598000     1.666000  
1 1 1 12 57 7  o 7.942000 0.6450000 8.877000 0.6833000 7.007000 1.094000  1.870000       1.290000  
1 1 1 12 57 9  o 5.686000 0.8893000 5.739000 1.158000  5.634000 1.350000  0.1052000      1.779000  
1 1 1 12 57 11 o 3.229000 0.8913000 3.558000 1.276000  2.899000 1.245000  0.6595000      1.783000  
1 1 1 12 57 13 o 3.660000 0.9887000 3.954000 1.375000  3.367000 1.421000  0.5863000      1.977000  
1 1 1 12 57 15 o 5.853000 1.216000  4.622000 1.279000  7.083000 2.069000  -2.462000      2.432000  
1 1 1 12 57 17 o 6.409000 1.218000  6.329000 1.030000  6.489000 2.207000  -0.1599000     2.435000  
1 1 1 12 57 19 o 4.489000 1.048000  3.860000 1.354000  5.118000 1.599000  -1.258000      2.095000  
1 1 1 12 57 21 o 6.316000 0.9933000 5.608000 1.132000  7.023000 1.633000  -1.415000      1.987000  
1 1 1 12 57 23 o 5.233000 1.008000  6.085000 1.155000  4.381000 1.651000  1.704000       2.015000  
1 1 1 12 58 0  o 2.990000 1.187000  2.990000 1.187000  2.990000 1.187000  0.000000       0.000000  
1 1 1 12 58 2  o 7.208000 0.5660000 7.275000 0.8087000 7.141000 0.7921000 0.1338000      1.132000  
1 1 1 12 58 4  o 4.514000 0.8270000 4.137000 1.188000  4.891000 1.150000  -0.7537000     1.654000  
1 1 1 12 58 6  o 8.131000 0.4912000 8.038000 0.7221000 8.223000 0.6662000 -0.1848000     0.9824000 
1 1 1 12 58 8  o 5.833000 0.7568000 6.009000 0.8165000 5.657000 1.275000  0.3515000      1.514000  
1 1 1 12 58 10 o 3.416000 0.9737000 3.486000 1.263000  3.345000 1.482000  0.1414000      1.947000  
1 1 1 12 58 12 o 5.718000 1.212000  6.210000 1.294000  5.227000 2.050000  0.9832000      2.424000  
1 1 1 12 58 14 f 10.82000 0.7907000 9.418000 0.6716000 12.22000 1.432000  -2.803000      1.581000  
1 1 1 12 58 16 o 5.157000 1.060000  5.587000 1.211000  4.726000 1.739000  0.8608000      2.119000  
1 1 1 12 58 18 o 4.387000 1.012000  4.818000 1.231000  3.955000 1.606000  0.8630000      2.023000  
1 1 1 12 58 20 o 3.795000 1.039000  3.421000 1.254000  4.169000 1.656000  -0.7485000     2.077000  
1 1 1 12 59 1  o 3.975000 0.8646000 3.771000 1.243000  4.179000 1.202000  -0.4082000     1.729000  
1 1 1 12 59 3  o 5.227000 0.7664000 5.129000 1.064000  5.324000 1.104000  -0.1949000     1.533000  
1 1 1 12 59 5  o 3.701000 0.9055000 2.990000 1.165000  4.413000 1.387000  -1.423000      1.811000  
1 1 1 12 59 7  o 3.466000 0.9655000 3.197000 1.215000  3.735000 1.501000  -0.5373000     1.931000  
1 1 1 12 59 9  o 4.118000 1.116000  3.296000 1.252000  4.939000 1.849000  -1.643000      2.233000  
1 1 1 12 59 11 o 4.081000 1.189000  3.679000 1.383000  4.483000 1.934000  -0.8040000     2.377000  
1 1 1 12 59 13 o 4.507000 1.063000  4.420000 1.234000  4.594000 1.731000  -0.1743000     2.126000  
1 1 1 12 59 15 o 3.300000 0.9775000 2.533000 1.148000  4.067000 1.582000  -1.534000      1.955000  
1 1 1 12 59 17 o 5.632000 2.065000  5.632000 2.065000  ?        ?         ?              ?         
1 1 1 12 60 0  o 8.494000 0.7113000 8.494000 0.7113000 8.494000 0.7113000 0.000000       0.000000  
1 1 1 12 60 2  f 6.783000 0.5822000 6.223000 0.8313000 7.344000 0.8152000 -1.121000      1.164000  
1 1 1 12 60 4  o 5.538000 0.7746000 6.597000 0.8672000 4.479000 1.284000  2.119000       1.549000  
1 1 1 12 60 6  o 3.595000 1.121000  2.624000 1.135000  4.566000 1.933000  -1.942000      2.241000  
1 1 1 12 60 8  o 2.028000 0.9559000 2.028000 0.9559000 ?        ?         ?              ?         
1 1 1 12 60 10 o 5.055000 1.040000  5.531000 1.344000  4.579000 1.587000  0.9524000      2.079000  
1 1 1 12 60 12 o 4.672000 1.284000  4.096000 1.781000  5.248000 1.849000  -1.152000      2.567000  
1 1 1 12 61 1  o 3.475000 1.140000  3.788000 1.713000  3.162000 1.505000  0.6256000      2.280000  
1 1 1 12 61 3  f 4.034000 1.504000  4.034000 1.504000  ?        ?         ?              ?         
1 1 1 13 0  1  o 84.40000 0.8225000 84.40000 0.8225000 84.40000 0.8225000 0.000000       0.000000  
1 1 1 13 0  3  o 219.4000 2.431000  219.4000 2.431000  219.4000 2.431000  0.000000       0.000000  
1 1 1 13 0  5  o 90.27000 0.8780000 90.27000 0.8780000 90.27000 0.8780000 0.000000       0.000000  
1 1 1 13 0  7  o 4.142000 0.6745000 4.142000 0.6745000 4.142000 0.6745000 0.000000       0.000000  
1 1 1 13 0  9  o 49.87000 0.5065000 49.87000 0.5065000 49.87000 0.5065000 0.000000       0.000000  
1 1 1 13 0  11 o 43.13000 0.5227000 43.13000 0.5227000 43.13000 0.5227000 0.000000       0.000000  
1 1 1 13 0  13 o 99.30000 1.115000  99.30000 1.115000  99.30000 1.115000  0.000000       0.000000  
1 1 1 13 0  15 f 22.52000 0.4918000 22.52000 0.4918000 22.52000 0.4918000 0.000000       0.000000  
1 1 1 13 0  17 o 46.43000 0.4943000 46.43000 0.4943000 46.43000 0.4943000 0.000000       0.000000  
1 1 1 13 0  19 o 73.57000 0.8448000 73.57000 0.8448000 73.57000 0.8448000 0.000000       0.000000  
1 1 1 13 0  21 o 153.1000 1.477000  153.1000 1.477000  153.1000 1.477000  0.000000       0.000000  
1 1 1 13 0  23 o 7.631000 0.9611000 7.631000 0.9611000 7.631000 0.9611000 0.000000       0.000000  
1 1 1 13 0  25 o 3.423000 1.309000  3.423000 1.309000  3.423000 1.309000  0.000000       0.000000  
1 1 1 13 0  27 o 4.345000 1.502000  4.345000 1.502000  4.345000 1.502000  0.000000       0.000000  
1 1 1 13 0  29 f 33.45000 0.4340000 33.45000 0.4340000 33.45000 0.4340000 0.000000       0.000000  
1 1 1 13 0  31 o 51.07000 0.6398000 51.07000 0.6398000 51.07000 0.6398000 0.000000       0.000000  
1 1 1 13 0  33 o 38.53000 0.4643000 38.53000 0.4643000 38.53000 0.4643000 0.000000       0.000000  
1 1 1 13 0  35 f 11.21000 0.6535000 11.21000 0.6535000 11.21000 0.6535000 0.000000       0.000000  
1 1 1 13 0  37 o 45.90000 0.5978000 45.90000 0.5978000 45.90000 0.5978000 0.000000       0.000000  
1 1 1 13 0  39 o 7.755000 1.013000  7.755000 1.013000  7.755000 1.013000  0.000000       0.000000  
1 1 1 13 0  41 o 10.21000 0.8192000 10.21000 0.8192000 10.21000 0.8192000 0.000000       0.000000  
1 1 1 13 0  43 o 28.45000 0.5732000 28.45000 0.5732000 28.45000 0.5732000 0.000000       0.000000  
1 1 1 13 0  45 o 3.440000 1.487000  3.440000 1.487000  3.440000 1.487000  0.000000       0.000000  
1 1 1 13 0  47 f 30.79000 0.5387000 30.79000 0.5387000 30.79000 0.5387000 0.000000       0.000000  
1 1 1 13 0  49 o 35.40000 0.5352000 35.40000 0.5352000 35.40000 0.5352000 0.000000       0.000000  
1 1 1 13 0  51 o 20.98000 0.4793000 20.98000 0.4793000 20.98000 0.4793000 0.000000       0.000000  
1 1 1 13 0  53 o 7.312000 1.005000  7.312000 1.005000  7.312000 1.005000  0.000000       0.000000  
1 1 1 13 0  55 o 2.627000 1.207000  2.627000 1.207000  2.627000 1.207000  0.000000       0.000000  
1 1 1 13 0  57 f 5.314000 1.579000  5.314000 1.579000  5.314000 1.579000  0.000000       0.000000  
1 1 1 13 0  59 o 9.100000 0.8848000 9.100000 0.8848000 9.100000 0.8848000 0.000000       0.000000  
1 1 1 13 0  61 o 10.35000 0.8671000 10.35000 0.8671000 10.35000 0.8671000 0.000000       0.000000  
1 1 1 13 0  63 o 9.311000 0.8758000 9.311000 0.8758000 9.311000 0.8758000 0.000000       0.000000  
1 1 1 13 0  65 o 4.609000 1.642000  4.609000 1.642000  4.609000 1.642000  0.000000       0.000000  
1 1 1 13 1  0  o 15.59000 0.2616000 15.59000 0.2616000 15.59000 0.2616000 0.000000       0.000000  
1 1 1 13 1  2  o 32.84000 0.2733000 32.69000 0.3582000 32.99000 0.4127000 -0.2927000     0.5465000 
1 1 1 13 1  4  o 45.91000 0.3581000 46.11000 0.5429000 45.71000 0.4671000 0.3953000      0.7162000 
1 1 1 13 1  6  o 82.37000 0.5686000 81.98000 0.8003000 82.76000 0.8079000 -0.7764000     1.137000  
1 1 1 13 1  8  o 65.44000 0.4942000 65.34000 0.7465000 65.54000 0.6479000 -0.2017000     0.9884000 
1 1 1 13 1  10 o 115.0000 0.8491000 114.9000 1.282000  115.1000 1.113000  -0.1909000     1.698000  
1 1 1 13 1  12 o 175.9000 1.382000  176.1000 1.956000  175.7000 1.952000  0.4033000      2.764000  
1 1 1 13 1  14 o 55.94000 0.4333000 55.32000 0.5609000 56.57000 0.6606000 -1.258000      0.8666000 
1 1 1 13 1  16 o 37.59000 0.3434000 37.60000 0.4846000 37.57000 0.4868000 0.3035000E-01  0.6869000 
1 1 1 13 1  18 o 42.88000 0.3302000 42.73000 0.4658000 43.02000 0.4682000 -0.2891000     0.6604000 
1 1 1 13 1  20 o 85.45000 0.6431000 85.56000 0.8425000 85.33000 0.9719000 0.2322000      1.286000  
1 1 1 13 1  22 o 53.12000 0.3943000 53.03000 0.5558000 53.22000 0.5596000 -0.1869000     0.7887000 
1 1 1 13 1  24 o 54.04000 0.4344000 54.06000 0.6550000 54.03000 0.5707000 0.3360000E-01  0.8688000 
1 1 1 13 1  26 o 16.87000 0.3552000 16.94000 0.4604000 16.80000 0.5411000 0.1336000      0.7104000 
1 1 1 13 1  28 o 13.50000 0.4243000 13.58000 0.6557000 13.41000 0.5387000 0.1749000      0.8487000 
1 1 1 13 1  30 o 29.03000 0.3258000 28.61000 0.4195000 29.45000 0.4986000 -0.8397000     0.6516000 
1 1 1 13 1  32 o 38.06000 0.3535000 38.11000 0.5323000 38.02000 0.4652000 0.9295000E-01  0.7070000 
1 1 1 13 1  34 f 45.47000 0.4206000 46.02000 0.6004000 44.92000 0.5892000 1.101000       0.8412000 
1 1 1 13 1  36 o 35.73000 0.3262000 35.68000 0.4589000 35.78000 0.4637000 -0.1025000     0.6524000 
1 1 1 13 1  38 o 48.55000 0.4416000 47.81000 0.6171000 49.30000 0.6317000 -1.495000      0.8832000 
1 1 1 13 1  40 o 16.33000 0.3940000 16.45000 0.5620000 16.21000 0.5522000 0.2379000      0.7879000 
1 1 1 13 1  42 o 25.86000 0.3947000 26.20000 0.5498000 25.53000 0.5663000 0.6643000      0.7893000 
1 1 1 13 1  44 o 30.07000 0.3684000 30.10000 0.4776000 30.04000 0.5611000 0.5533000E-01  0.7369000 
1 1 1 13 1  46 o 21.53000 0.3919000 21.23000 0.6040000 21.83000 0.4997000 -0.6008000     0.7839000 
1 1 1 13 1  48 o 11.04000 0.5206000 11.02000 0.7332000 11.06000 0.7392000 -0.4869000E-01 1.041000  
1 1 1 13 1  50 o 7.460000 0.7377000 7.822000 0.9793000 7.098000 1.103000  0.7241000      1.475000  
1 1 1 13 1  52 o 13.47000 0.4126000 13.76000 0.5711000 13.18000 0.5958000 0.5834000      0.8253000 
1 1 1 13 1  54 o 8.638000 0.6526000 8.430000 0.8926000 8.846000 0.9522000 -0.4154000     1.305000  
1 1 1 13 1  56 o 5.415000 0.9528000 5.257000 1.318000  5.573000 1.376000  -0.3166000     1.906000  
1 1 1 13 1  58 o 11.56000 0.5144000 11.82000 0.7954000 11.30000 0.6526000 0.5186000      1.029000  
1 1 1 13 1  60 f 12.60000 0.4706000 12.82000 0.6915000 12.37000 0.6384000 0.4475000      0.9412000 
1 1 1 13 1  62 o 14.69000 0.4954000 14.48000 0.7701000 14.89000 0.6235000 -0.4034000     0.9909000 
1 1 1 13 1  64 o 5.064000 1.107000  4.658000 1.513000  5.471000 1.616000  -0.8126000     2.214000  
1 1 1 13 2  1  o 128.8000 1.014000  130.3000 1.450000  127.4000 1.418000  2.886000       2.028000  
1 1 1 13 2  3  o 145.9000 1.216000  145.7000 1.984000  146.2000 1.407000  -0.5054000     2.433000  
1 1 1 13 2  5  o 85.09000 0.9324000 85.80000 1.674000  84.38000 0.8218000 1.417000       1.865000  
1 1 1 13 2  7  o 88.16000 0.7446000 88.54000 1.220000  87.77000 0.8545000 0.7723000      1.489000  
1 1 1 13 2  9  o 107.4000 0.9018000 107.6000 1.475000  107.2000 1.038000  0.3824000      1.804000  
1 1 1 13 2  11 o 72.41000 0.5044000 71.93000 0.7087000 72.89000 0.7180000 -0.9653000     1.009000  
1 1 1 13 2  13 o 82.35000 0.5708000 82.02000 0.8046000 82.68000 0.8100000 -0.6604000     1.142000  
1 1 1 13 2  15 o 55.24000 0.4294000 55.07000 0.5604000 55.42000 0.6509000 -0.3559000     0.8589000 
1 1 1 13 2  17 o 40.11000 0.3372000 40.02000 0.5102000 40.19000 0.4410000 -0.1691000     0.6743000 
1 1 1 13 2  19 o 102.6000 1.000000  102.9000 1.418000  102.2000 1.411000  0.6582000      2.000000  
1 1 1 13 2  21 o 28.44000 0.2879000 28.03000 0.3515000 28.84000 0.4560000 -0.8082000     0.5757000 
1 1 1 13 2  23 o 26.96000 0.3306000 26.91000 0.4605000 27.01000 0.4744000 -0.1020000     0.6612000 
1 1 1 13 2  25 o 47.57000 0.3947000 47.87000 0.5185000 47.27000 0.5952000 0.5985000      0.7893000 
1 1 1 13 2  27 o 18.87000 0.3250000 18.90000 0.4522000 18.84000 0.4670000 0.6068000E-01  0.6501000 
1 1 1 13 2  29 o 50.38000 0.4151000 50.16000 0.6234000 50.61000 0.5482000 -0.4455000     0.8302000 
1 1 1 13 2  31 o 17.65000 0.3255000 17.67000 0.4611000 17.63000 0.4597000 0.4061000E-01  0.6510000 
1 1 1 13 2  33 o 38.69000 0.3593000 38.91000 0.5443000 38.47000 0.4690000 0.4464000      0.7185000 
1 1 1 13 2  35 o 43.43000 0.3552000 43.22000 0.5007000 43.64000 0.5040000 -0.4203000     0.7104000 
1 1 1 13 2  37 o 37.48000 0.3811000 37.75000 0.5371000 37.20000 0.5407000 0.5472000      0.7621000 
1 1 1 13 2  39 o 47.68000 0.3806000 47.73000 0.5379000 47.63000 0.5386000 0.1062000      0.7612000 
1 1 1 13 2  41 o 35.09000 0.4106000 35.36000 0.4725000 34.81000 0.6717000 0.5508000      0.8213000 
1 1 1 13 2  43 o 47.79000 0.4190000 47.60000 0.6285000 47.99000 0.5542000 -0.3945000     0.8379000 
1 1 1 13 2  45 o 5.164000 1.036000  5.895000 1.402000  4.432000 1.525000  1.462000       2.071000  
1 1 1 13 2  47 o 5.342000 1.087000  5.654000 1.503000  5.031000 1.571000  0.6235000      2.174000  
1 1 1 13 2  49 o 12.96000 0.4839000 12.85000 0.6946000 13.07000 0.6741000 -0.2244000     0.9679000 
1 1 1 13 2  51 o 3.432000 0.9423000 4.105000 1.417000  2.759000 1.242000  1.346000       1.885000  
1 1 1 13 2  53 o 8.637000 0.6328000 8.799000 0.8562000 8.475000 0.9319000 0.3240000      1.266000  
1 1 1 13 2  55 o 12.19000 0.4909000 12.65000 0.7251000 11.74000 0.6619000 0.9060000      0.9818000 
1 1 1 13 2  57 o 9.593000 0.5583000 9.429000 0.8460000 9.757000 0.7286000 -0.3279000     1.117000  
1 1 1 13 2  59 o 6.276000 0.9425000 7.134000 1.280000  5.418000 1.384000  1.715000       1.885000  
1 1 1 13 2  61 o 3.808000 1.003000  4.610000 1.510000  3.006000 1.319000  1.604000       2.005000  
1 1 1 13 2  63 o 5.234000 0.9904000 5.462000 1.349000  5.007000 1.451000  0.4543000      1.981000  
1 1 1 13 2  65 o 3.888000 1.014000  4.996000 1.624000  2.780000 1.215000  2.216000       2.028000  
1 1 1 13 3  0  o 37.59000 0.4608000 37.59000 0.4608000 37.59000 0.4608000 0.000000       0.000000  
1 1 1 13 3  2  o 18.85000 0.2359000 18.80000 0.3845000 18.91000 0.2735000 -0.1048000     0.4718000 
1 1 1 13 3  4  o 65.80000 0.5640000 66.34000 0.9255000 65.26000 0.6448000 1.081000       1.128000  
1 1 1 13 3  6  o 58.92000 0.6630000 59.85000 1.194000  57.99000 0.5775000 1.857000       1.326000  
1 1 1 13 3  8  o 67.40000 0.5439000 67.30000 0.7685000 67.50000 0.7699000 -0.1958000     1.088000  
1 1 1 13 3  10 o 155.8000 1.146000  155.6000 1.730000  156.1000 1.502000  -0.4692000     2.292000  
1 1 1 13 3  12 o 88.35000 0.6097000 88.02000 0.8593000 88.69000 0.8652000 -0.6631000     1.219000  
1 1 1 13 3  14 o 29.74000 0.2554000 29.56000 0.3612000 29.92000 0.3612000 -0.3534000     0.5108000 
1 1 1 13 3  16 o 58.69000 0.4550000 57.83000 0.5860000 59.56000 0.6962000 -1.732000      0.9100000 
1 1 1 13 3  18 o 77.57000 0.5861000 77.48000 0.8854000 77.67000 0.7681000 -0.1955000     1.172000  
1 1 1 13 3  20 o 21.75000 0.4519000 21.48000 0.3474000 22.01000 0.8344000 -0.5220000     0.9039000 
1 1 1 13 3  22 o 67.18000 0.5694000 66.52000 0.6012000 67.85000 0.9671000 -1.337000      1.139000  
1 1 1 13 3  24 o 26.48000 0.3124000 26.36000 0.4668000 26.59000 0.4154000 -0.2250000     0.6249000 
1 1 1 13 3  26 o 51.59000 0.3897000 51.50000 0.5469000 51.68000 0.5552000 -0.1833000     0.7794000 
1 1 1 13 3  28 o 56.60000 0.4202000 56.39000 0.5910000 56.80000 0.5973000 -0.4075000     0.8403000 
1 1 1 13 3  30 o 55.21000 0.4459000 55.68000 0.6751000 54.74000 0.5827000 0.9344000      0.8917000 
1 1 1 13 3  32 o 47.76000 0.3715000 48.08000 0.5262000 47.44000 0.5246000 0.6402000      0.7430000 
1 1 1 13 3  34 o 47.26000 0.4288000 47.65000 0.6079000 46.87000 0.6050000 0.7866000      0.8577000 
1 1 1 13 3  36 o 51.05000 0.3935000 51.53000 0.5585000 50.57000 0.5544000 0.9643000      0.7869000 
1 1 1 13 3  38 o 51.32000 0.3988000 51.30000 0.5607000 51.35000 0.5673000 -0.4996000E-01 0.7976000 
1 1 1 13 3  40 o 15.59000 0.4233000 15.52000 0.5579000 15.67000 0.6369000 -0.1467000     0.8467000 
1 1 1 13 3  42 o 18.72000 0.3793000 18.53000 0.5273000 18.91000 0.5455000 -0.3731000     0.7587000 
1 1 1 13 3  44 o 18.08000 0.4490000 17.85000 0.6256000 18.31000 0.6442000 -0.4665000     0.8980000 
1 1 1 13 3  46 o 22.91000 0.3805000 22.98000 0.5960000 22.85000 0.4733000 0.1282000      0.7611000 
1 1 1 13 3  48 o 41.36000 0.3589000 42.02000 0.5103000 40.71000 0.5049000 1.309000       0.7178000 
1 1 1 13 3  50 o 20.96000 0.3410000 20.86000 0.4828000 21.07000 0.4817000 -0.2085000     0.6820000 
1 1 1 13 3  52 o 2.710000 0.8559000 2.449000 1.129000  2.971000 1.287000  -0.5217000     1.712000  
1 1 1 13 3  54 o 3.655000 0.9340000 4.244000 1.368000  3.067000 1.271000  1.177000       1.868000  
1 1 1 13 3  56 o 10.96000 0.5337000 11.51000 0.7833000 10.41000 0.7252000 1.097000       1.067000  
1 1 1 13 3  58 o 6.636000 0.9737000 6.019000 1.662000  7.253000 1.016000  -1.234000      1.947000  
1 1 1 13 3  60 o 12.96000 0.5162000 12.88000 0.7189000 13.04000 0.7410000 -0.1549000     1.032000  
1 1 1 13 3  62 o 12.09000 0.5323000 11.74000 0.7928000 12.43000 0.7104000 -0.6806000     1.065000  
1 1 1 13 3  64 o 11.33000 0.5591000 10.46000 0.8228000 12.21000 0.7574000 -1.745000      1.118000  
1 1 1 13 4  1  o 40.13000 0.3438000 40.30000 0.4884000 39.96000 0.4841000 0.3435000      0.6877000 
1 1 1 13 4  3  o 59.30000 0.4169000 59.26000 0.5893000 59.34000 0.5899000 -0.7843000E-01 0.8339000 
1 1 1 13 4  5  o 11.71000 0.2802000 11.84000 0.3543000 11.58000 0.4341000 0.2583000      0.5604000 
1 1 1 13 4  7  o 120.2000 0.8854000 119.2000 1.329000  121.2000 1.170000  -2.001000      1.771000  
1 1 1 13 4  9  o 126.5000 0.9331000 126.9000 1.414000  126.1000 1.218000  0.7319000      1.866000  
1 1 1 13 4  11 o 89.59000 0.6674000 89.59000 1.009000  89.60000 0.8734000 -0.8423000E-02 1.335000  
1 1 1 13 4  13 o 14.97000 0.2501000 15.21000 0.3363000 14.72000 0.3702000 0.4949000      0.5002000 
1 1 1 13 4  15 o 54.47000 0.3926000 54.10000 0.5517000 54.84000 0.5586000 -0.7424000     0.7851000 
1 1 1 13 4  17 o 101.8000 0.7583000 101.6000 0.9898000 102.1000 1.149000  -0.5077000     1.517000  
1 1 1 13 4  19 o 45.05000 0.4095000 45.15000 0.4367000 44.96000 0.6928000 0.1876000      0.8190000 
1 1 1 13 4  21 o 35.57000 0.3130000 35.06000 0.3784000 36.09000 0.4988000 -1.029000      0.6261000 
1 1 1 13 4  23 o 45.87000 0.5842000 44.85000 0.5662000 46.89000 1.022000  -2.047000      1.168000  
1 1 1 13 4  25 o 10.52000 0.4696000 10.29000 0.6722000 10.75000 0.6559000 -0.4525000     0.9392000 
1 1 1 13 4  27 f 86.58000 0.6062000 86.72000 0.8558000 86.44000 0.8587000 0.2800000      1.212000  
1 1 1 13 4  29 o 50.13000 0.4152000 50.10000 0.5389000 50.15000 0.6318000 -0.5230000E-01 0.8304000 
1 1 1 13 4  31 o 26.43000 0.2950000 26.24000 0.4112000 26.62000 0.4233000 -0.3806000     0.5901000 
1 1 1 13 4  33 o 52.41000 0.3985000 52.64000 0.5632000 52.17000 0.5639000 0.4719000      0.7970000 
1 1 1 13 4  35 o 67.84000 0.4917000 68.00000 0.6956000 67.68000 0.6950000 0.3171000      0.9833000 
1 1 1 13 4  37 o 61.05000 0.5208000 60.81000 0.7302000 61.29000 0.7427000 -0.4763000     1.042000  
1 1 1 13 4  39 o 48.30000 0.3836000 48.36000 0.5404000 48.24000 0.5446000 0.1200000      0.7672000 
1 1 1 13 4  41 o 19.00000 0.3647000 18.70000 0.5181000 19.31000 0.5135000 -0.6114000     0.7295000 
1 1 1 13 4  43 o 27.24000 0.3603000 27.66000 0.4736000 26.81000 0.5430000 0.8505000      0.7205000 
1 1 1 13 4  45 o 24.99000 0.3413000 24.76000 0.4738000 25.23000 0.4913000 -0.4734000     0.6825000 
1 1 1 13 4  47 o 15.64000 0.5453000 15.69000 0.8507000 15.58000 0.6826000 0.1062000      1.091000  
1 1 1 13 4  49 o 23.63000 0.3754000 23.64000 0.5482000 23.62000 0.5130000 0.1843000E-01  0.7508000 
1 1 1 13 4  51 o 17.36000 0.3653000 17.36000 0.5141000 17.36000 0.5190000 -0.3876000E-02 0.7306000 
1 1 1 13 4  53 o 9.071000 0.5882000 9.233000 0.7809000 8.908000 0.8797000 0.3252000      1.176000  
1 1 1 13 4  55 o 12.88000 0.5013000 12.95000 0.6226000 12.81000 0.7858000 0.1393000      1.003000  
1 1 1 13 4  57 o 15.75000 0.4455000 14.94000 0.6119000 16.56000 0.6477000 -1.620000      0.8910000 
1 1 1 13 4  59 o 7.434000 0.8442000 7.034000 1.349000  7.834000 1.016000  -0.8002000     1.688000  
1 1 1 13 4  61 o 5.535000 1.019000  4.691000 1.483000  6.379000 1.397000  -1.688000      2.038000  
1 1 1 13 4  63 o 4.178000 1.069000  3.253000 1.345000  5.103000 1.663000  -1.850000      2.139000  
1 1 1 13 4  65 o 3.847000 1.055000  3.425000 1.419000  4.268000 1.563000  -0.8423000     2.111000  
1 1 1 13 5  0  o 32.20000 0.5127000 32.20000 0.5127000 32.20000 0.5127000 0.000000       0.000000  
1 1 1 13 5  2  o 52.20000 0.4830000 52.09000 0.6077000 52.31000 0.7510000 -0.2214000     0.9661000 
1 1 1 13 5  4  o 120.4000 0.8219000 120.6000 1.165000  120.1000 1.160000  0.4891000      1.644000  
1 1 1 13 5  6  o 43.01000 0.3146000 43.01000 0.4447000 43.01000 0.4450000 0.3227000E-02  0.6291000 
1 1 1 13 5  8  o 103.1000 0.7068000 103.3000 1.001000  103.0000 0.9978000 0.2725000      1.414000  
1 1 1 13 5  10 o 42.96000 0.3175000 42.79000 0.4489000 43.13000 0.4492000 -0.3318000     0.6351000 
1 1 1 13 5  12 o 55.16000 0.4263000 55.48000 0.6486000 54.84000 0.5534000 0.6441000      0.8527000 
1 1 1 13 5  14 o 80.06000 0.5560000 79.97000 0.7855000 80.15000 0.7871000 -0.1787000     1.112000  
1 1 1 13 5  16 o 40.54000 0.3128000 40.61000 0.4432000 40.47000 0.4416000 0.1405000      0.6257000 
1 1 1 13 5  18 o 53.50000 0.4535000 53.16000 0.6344000 53.85000 0.6484000 -0.6928000     0.9071000 
1 1 1 13 5  20 o 33.54000 0.3497000 33.15000 0.3664000 33.93000 0.5958000 -0.7842000     0.6994000 
1 1 1 13 5  22 o 41.39000 0.5214000 41.49000 0.4202000 41.29000 0.9544000 0.1935000      1.043000  
1 1 1 13 5  24 o 22.79000 0.3573000 22.99000 0.3905000 22.59000 0.5984000 0.4029000      0.7146000 
1 1 1 13 5  26 o 8.648000 0.5645000 9.020000 0.7021000 8.276000 0.8842000 0.7438000      1.129000  
1 1 1 13 5  28 o 11.46000 0.4751000 10.84000 0.6276000 12.07000 0.7136000 -1.223000      0.9503000 
1 1 1 13 5  30 o 24.15000 0.2962000 23.75000 0.4064000 24.56000 0.4311000 -0.8046000     0.5924000 
1 1 1 13 5  32 o 30.67000 0.3016000 30.25000 0.4198000 31.08000 0.4331000 -0.8331000     0.6032000 
1 1 1 13 5  34 o 29.76000 0.4034000 29.61000 0.6273000 29.90000 0.5075000 -0.2928000     0.8069000 
1 1 1 13 5  36 o 72.24000 0.5196000 72.67000 0.7357000 71.81000 0.7340000 0.8651000      1.039000  
1 1 1 13 5  38 o 12.88000 0.4468000 12.67000 0.6305000 13.08000 0.6332000 -0.4021000     0.8936000 
1 1 1 13 5  40 o 24.58000 0.3325000 25.07000 0.4636000 24.10000 0.4769000 0.9670000      0.6651000 
1 1 1 13 5  42 o 8.443000 0.7712000 7.287000 1.125000  9.599000 1.055000  -2.312000      1.542000  
1 1 1 13 5  44 o 15.13000 0.4341000 14.91000 0.6046000 15.34000 0.6231000 -0.4249000     0.8682000 
1 1 1 13 5  46 o 19.01000 0.3995000 18.61000 0.5321000 19.41000 0.5961000 -0.7990000     0.7990000 
1 1 1 13 5  48 o 17.42000 0.4069000 17.16000 0.6207000 17.67000 0.5262000 -0.5100000     0.8137000 
1 1 1 13 5  50 o 5.470000 0.9304000 6.147000 1.213000  4.792000 1.411000  1.355000       1.861000  
1 1 1 13 5  52 o 21.53000 0.3589000 21.55000 0.4611000 21.51000 0.5500000 0.3338000E-01  0.7177000 
1 1 1 13 5  54 f 14.24000 0.4462000 13.45000 0.6085000 15.02000 0.6529000 -1.573000      0.8925000 
1 1 1 13 5  56 o 10.04000 0.6021000 9.918000 0.9355000 10.16000 0.7581000 -0.2385000     1.204000  
1 1 1 13 5  58 o 7.386000 0.7954000 7.412000 1.198000  7.361000 1.046000  0.5075000E-01  1.591000  
1 1 1 13 5  60 o 15.91000 0.4387000 15.70000 0.6060000 16.13000 0.6343000 -0.4327000     0.8773000 
1 1 1 13 5  62 o 7.916000 0.7356000 8.461000 1.049000  7.370000 1.031000  1.091000       1.471000  
1 1 1 13 5  64 o 7.195000 0.9229000 7.135000 1.215000  7.254000 1.390000  -0.1192000     1.846000  
1 1 1 13 6  1  o 41.08000 0.3734000 41.12000 0.4272000 41.03000 0.6126000 0.8854000E-01  0.7469000 
1 1 1 13 6  3  o 69.87000 0.5251000 69.88000 0.6866000 69.85000 0.7946000 0.3012000E-01  1.050000  
1 1 1 13 6  5  o 25.42000 0.2189000 25.42000 0.3096000 25.42000 0.3095000 -0.1162000E-02 0.4378000 
1 1 1 13 6  7  o 74.79000 0.5600000 74.71000 0.8461000 74.86000 0.7338000 -0.1422000     1.120000  
1 1 1 13 6  9  o 167.2000 1.137000  167.0000 1.606000  167.5000 1.611000  -0.5116000     2.275000  
1 1 1 13 6  11 o 56.39000 0.4011000 56.22000 0.5654000 56.57000 0.5691000 -0.3471000     0.8022000 
1 1 1 13 6  13 o 74.89000 0.5639000 74.45000 0.8499000 75.34000 0.7415000 -0.8893000     1.128000  
1 1 1 13 6  15 o 51.94000 0.4089000 51.79000 0.6191000 52.09000 0.5342000 -0.3045000     0.8177000 
1 1 1 13 6  17 o 64.49000 0.4944000 64.52000 0.6459000 64.46000 0.7487000 0.5853000E-01  0.9888000 
1 1 1 13 6  19 o 102.5000 0.7638000 103.1000 1.005000  102.0000 1.151000  1.086000       1.528000  
1 1 1 13 6  21 o 33.86000 0.3647000 33.62000 0.4184000 34.09000 0.5974000 -0.4615000     0.7294000 
1 1 1 13 6  23 o 66.05000 0.5123000 65.86000 0.6662000 66.25000 0.7785000 -0.3988000     1.025000  
1 1 1 13 6  25 o 19.57000 0.2965000 19.88000 0.4109000 19.26000 0.4275000 0.6268000      0.5930000 
1 1 1 13 6  27 o 16.04000 0.4219000 16.14000 0.4516000 15.93000 0.7127000 0.2085000      0.8437000 
1 1 1 13 6  29 o 14.55000 0.3605000 15.05000 0.4836000 14.06000 0.5347000 0.9929000      0.7209000 
1 1 1 13 6  31 o 20.37000 0.3323000 20.52000 0.4924000 20.22000 0.4465000 0.2967000      0.6647000 
1 1 1 13 6  33 o 14.95000 0.3663000 14.87000 0.5067000 15.03000 0.5291000 -0.1535000     0.7326000 
1 1 1 13 6  35 o 19.14000 0.3601000 18.99000 0.5459000 19.28000 0.4697000 -0.2900000     0.7202000 
1 1 1 13 6  37 o 19.28000 0.3928000 19.60000 0.5313000 18.96000 0.5788000 0.6420000      0.7856000 
1 1 1 13 6  39 o 22.51000 0.3486000 22.84000 0.4465000 22.18000 0.5355000 0.6578000      0.6973000 
1 1 1 13 6  41 o 35.12000 0.3347000 34.95000 0.4689000 35.29000 0.4778000 -0.3408000     0.6695000 
1 1 1 13 6  43 o 10.89000 0.5348000 11.01000 0.7627000 10.77000 0.7499000 0.2364000      1.070000  
1 1 1 13 6  45 o 7.465000 0.8638000 7.820000 1.277000  7.110000 1.164000  0.7100000      1.728000  
1 1 1 13 6  47 o 9.479000 0.6554000 9.117000 1.010000  9.841000 0.8352000 -0.7239000     1.311000  
1 1 1 13 6  49 o 17.86000 0.3931000 17.84000 0.5625000 17.88000 0.5492000 -0.3934000E-01 0.7861000 
1 1 1 13 6  51 o 9.094000 0.6282000 8.807000 0.8560000 9.382000 0.9196000 -0.5748000     1.256000  
1 1 1 13 6  53 o 3.863000 0.9401000 4.695000 1.358000  3.032000 1.301000  1.663000       1.880000  
1 1 1 13 6  55 o 11.31000 0.4879000 10.92000 0.6942000 11.69000 0.6858000 -0.7713000     0.9758000 
1 1 1 13 6  57 o 9.662000 0.6889000 10.19000 0.8837000 9.133000 1.057000  1.058000       1.378000  
1 1 1 13 6  59 o 3.335000 1.023000  3.602000 1.563000  3.067000 1.320000  0.5352000      2.046000  
1 1 1 13 6  61 o 3.477000 1.008000  3.729000 1.461000  3.224000 1.390000  0.5056000      2.017000  
1 1 1 13 6  63 o 3.429000 1.015000  3.948000 1.536000  2.910000 1.327000  1.038000       2.030000  
1 1 1 13 6  65 o 2.724000 0.8861000 2.309000 1.123000  3.139000 1.371000  -0.8297000     1.772000  
1 1 1 13 7  0  o 116.3000 1.123000  116.3000 1.123000  116.3000 1.123000  0.000000       0.000000  
1 1 1 13 7  2  o 79.51000 0.6349000 79.88000 0.9018000 79.13000 0.8941000 0.7511000      1.270000  
1 1 1 13 7  4  o 40.17000 0.3213000 40.11000 0.4192000 40.23000 0.4871000 -0.1178000     0.6426000 
1 1 1 13 7  6  o 78.50000 0.5428000 79.26000 0.7747000 77.74000 0.7606000 1.519000       1.086000  
1 1 1 13 7  8  o 35.86000 0.3175000 35.64000 0.4464000 36.07000 0.4515000 -0.4388000     0.6350000 
1 1 1 13 7  10 o 36.58000 0.3063000 36.53000 0.3973000 36.63000 0.4664000 -0.9783000E-01 0.6127000 
1 1 1 13 7  12 o 85.93000 0.5938000 85.74000 0.8381000 86.13000 0.8415000 -0.3920000     1.188000  
1 1 1 13 7  14 f 78.64000 0.5469000 78.68000 0.7734000 78.60000 0.7735000 0.8640000E-01  1.094000  
1 1 1 13 7  16 o 25.84000 0.2967000 25.69000 0.4134000 25.99000 0.4257000 -0.3073000     0.5933000 
1 1 1 13 7  18 o 53.33000 0.4046000 53.29000 0.4932000 53.36000 0.6416000 -0.6930000E-01 0.8093000 
1 1 1 13 7  20 o 21.46000 0.3467000 21.58000 0.3889000 21.33000 0.5741000 0.2523000      0.6934000 
1 1 1 13 7  22 o 99.62000 1.060000  100.4000 0.8780000 98.88000 1.930000  1.472000       2.120000  
1 1 1 13 7  24 o 73.76000 0.5659000 73.02000 0.7307000 74.50000 0.8643000 -1.478000      1.132000  
1 1 1 13 7  26 o 13.01000 0.4085000 12.42000 0.5169000 13.61000 0.6326000 -1.187000      0.8170000 
1 1 1 13 7  28 o 35.90000 0.3150000 35.71000 0.4354000 36.08000 0.4554000 -0.3751000     0.6300000 
1 1 1 13 7  30 o 24.96000 0.2938000 24.74000 0.4025000 25.18000 0.4281000 -0.4402000     0.5876000 
1 1 1 13 7  32 o 93.95000 0.7077000 93.87000 1.065000  94.03000 0.9319000 -0.1553000     1.415000  
1 1 1 13 7  34 o 17.34000 0.3927000 17.84000 0.5250000 16.84000 0.5842000 1.003000       0.7854000 
1 1 1 13 7  36 o 18.61000 0.3811000 18.82000 0.5757000 18.41000 0.4996000 0.4147000      0.7622000 
1 1 1 13 7  38 o 37.82000 0.3597000 37.90000 0.4712000 37.74000 0.5437000 0.1540000      0.7195000 
1 1 1 13 7  40 o 19.41000 0.3548000 19.51000 0.4886000 19.31000 0.5146000 0.1988000      0.7096000 
1 1 1 13 7  42 f 21.23000 0.3546000 20.63000 0.4998000 21.83000 0.5032000 -1.201000      0.7092000 
1 1 1 13 7  44 o 26.15000 0.3260000 26.27000 0.4615000 26.03000 0.4607000 0.2412000      0.6521000 
1 1 1 13 7  46 o 40.61000 0.4124000 40.88000 0.5796000 40.33000 0.5869000 0.5473000      0.8249000 
1 1 1 13 7  48 o 13.72000 0.4711000 12.63000 0.7577000 14.82000 0.5600000 -2.189000      0.9422000 
1 1 1 13 7  50 o 12.08000 0.4710000 12.11000 0.6616000 12.04000 0.6705000 0.7150000E-01  0.9420000 
1 1 1 13 7  52 o 6.040000 0.8666000 5.015000 1.376000  7.065000 1.054000  -2.050000      1.733000  
1 1 1 13 7  54 f 6.399000 0.8118000 6.840000 1.055000  5.958000 1.234000  0.8821000      1.624000  
1 1 1 13 7  56 o 2.701000 0.8564000 2.646000 1.203000  2.756000 1.219000  -0.1097000     1.713000  
1 1 1 13 7  58 o 3.307000 0.9154000 2.426000 1.177000  4.188000 1.402000  -1.762000      1.831000  
1 1 1 13 7  60 o 8.989000 0.6781000 8.287000 1.057000  9.691000 0.8493000 -1.405000      1.356000  
1 1 1 13 7  62 o 4.588000 1.033000  3.817000 1.429000  5.360000 1.491000  -1.543000      2.065000  
1 1 1 13 7  64 o 9.381000 0.5904000 9.758000 0.8333000 9.003000 0.8365000 0.7544000      1.181000  
1 1 1 13 8  1  o 36.64000 0.2752000 36.67000 0.3900000 36.61000 0.3885000 0.6102000E-01  0.5504000 
1 1 1 13 8  3  o 102.4000 0.7569000 104.1000 1.008000  100.8000 1.129000  3.311000       1.514000  
1 1 1 13 8  5  o 103.7000 0.8215000 104.1000 1.166000  103.4000 1.158000  0.6769000      1.643000  
1 1 1 13 8  7  o 80.88000 0.5591000 80.66000 0.7882000 81.11000 0.7931000 -0.4498000     1.118000  
1 1 1 13 8  9  o 78.28000 0.5432000 79.14000 0.7766000 77.43000 0.7598000 1.705000       1.086000  
1 1 1 13 8  11 o 78.52000 0.5452000 78.32000 0.7687000 78.71000 0.7733000 -0.3917000     1.090000  
1 1 1 13 8  13 o 47.15000 0.3463000 47.28000 0.4915000 47.03000 0.4879000 0.2500000      0.6926000 
1 1 1 13 8  15 o 47.22000 0.3802000 47.66000 0.5001000 46.77000 0.5727000 0.8854000      0.7604000 
1 1 1 13 8  17 o 16.16000 0.3900000 16.14000 0.6067000 16.19000 0.4901000 -0.4580000E-01 0.7799000 
1 1 1 13 8  19 f 17.69000 0.3637000 17.36000 0.4141000 18.02000 0.5980000 -0.6538000     0.7274000 
1 1 1 13 8  21 o 43.62000 0.4188000 43.35000 0.4785000 43.88000 0.6875000 -0.5333000     0.8376000 
1 1 1 13 8  23 o 42.63000 0.3933000 42.34000 0.5492000 42.93000 0.5631000 -0.5868000     0.7866000 
1 1 1 13 8  25 o 49.51000 0.4057000 49.61000 0.5263000 49.41000 0.6176000 0.1968000      0.8114000 
1 1 1 13 8  27 o 7.372000 0.6155000 7.012000 0.8494000 7.732000 0.8910000 -0.7193000     1.231000  
1 1 1 13 8  29 o 15.76000 0.3418000 15.36000 0.4512000 16.16000 0.5134000 -0.8034000     0.6835000 
1 1 1 13 8  31 o 17.95000 0.4325000 17.78000 0.5426000 18.12000 0.6738000 -0.3452000     0.8651000 
1 1 1 13 8  33 o 25.03000 0.3634000 24.68000 0.5767000 25.39000 0.4423000 -0.7131000     0.7268000 
1 1 1 13 8  35 o 15.60000 0.3735000 15.60000 0.5162000 15.60000 0.5399000 0.1769000E-02  0.7469000 
1 1 1 13 8  37 o 49.36000 0.4956000 49.63000 0.6270000 49.08000 0.7676000 0.5516000      0.9911000 
1 1 1 13 8  39 o 25.69000 0.3181000 25.49000 0.4418000 25.88000 0.4579000 -0.3892000     0.6363000 
1 1 1 13 8  41 o 30.73000 0.3853000 31.00000 0.5464000 30.47000 0.5433000 0.5334000      0.7705000 
1 1 1 13 8  43 o 24.63000 0.3363000 24.89000 0.4709000 24.37000 0.4803000 0.5240000      0.6727000 
1 1 1 13 8  45 o 7.941000 0.7248000 6.901000 1.175000  8.981000 0.8497000 -2.080000      1.450000  
1 1 1 13 8  47 o 12.23000 0.5221000 10.98000 0.8469000 13.48000 0.6109000 -2.503000      1.044000  
1 1 1 13 8  49 o 7.623000 0.8309000 7.396000 1.235000  7.851000 1.112000  -0.4543000     1.662000  
1 1 1 13 8  51 o 3.457000 0.9166000 2.903000 1.260000  4.012000 1.331000  -1.109000      1.833000  
1 1 1 13 8  53 o 5.312000 0.9857000 5.308000 1.306000  5.315000 1.476000  -0.7600000E-02 1.971000  
1 1 1 13 8  55 f 11.54000 0.4943000 11.20000 0.6987000 11.88000 0.6995000 -0.6712000     0.9887000 
1 1 1 13 8  57 o 10.74000 0.5770000 10.17000 0.7770000 11.32000 0.8533000 -1.155000      1.154000  
1 1 1 13 8  59 f 5.803000 0.9890000 4.185000 1.526000  7.421000 1.258000  -3.236000      1.978000  
1 1 1 13 8  61 o 7.267000 0.9204000 7.953000 1.111000  6.580000 1.468000  1.373000       1.841000  
1 1 1 13 8  63 o 3.522000 1.026000  3.715000 1.463000  3.329000 1.439000  0.3860000      2.052000  
1 1 1 13 8  65 o 4.134000 1.131000  4.055000 1.587000  4.213000 1.612000  -0.1579000     2.262000  
1 1 1 13 9  0  o 155.5000 1.496000  155.5000 1.496000  155.5000 1.496000  0.000000       0.000000  
1 1 1 13 9  2  o 141.4000 0.9633000 143.1000 1.378000  139.7000 1.347000  3.303000       1.927000  
1 1 1 13 9  4  o 178.3000 1.312000  176.3000 1.695000  180.2000 2.003000  -3.870000      2.624000  
1 1 1 13 9  6  o 25.09000 0.2211000 25.60000 0.3164000 24.57000 0.3090000 1.025000       0.4423000 
1 1 1 13 9  8  o 119.8000 0.9461000 119.2000 1.331000  120.4000 1.345000  -1.233000      1.892000  
1 1 1 13 9  10 o 95.60000 0.6576000 95.21000 0.9261000 95.99000 0.9339000 -0.7757000     1.315000  
1 1 1 13 9  12 o 82.29000 0.5702000 82.42000 0.8076000 82.17000 0.8053000 0.2534000      1.140000  
1 1 1 13 9  14 f 100.8000 0.7516000 99.47000 0.9685000 102.1000 1.150000  -2.650000      1.503000  
1 1 1 13 9  16 o 14.56000 0.3337000 14.52000 0.4511000 14.60000 0.4919000 -0.8742000E-01 0.6674000 
1 1 1 13 9  18 o 107.4000 0.9027000 108.6000 1.056000  106.2000 1.464000  2.366000       1.805000  
1 1 1 13 9  20 o 13.50000 0.5542000 12.77000 0.4265000 14.22000 1.023000  -1.444000      1.108000  
1 1 1 13 9  22 o 72.23000 0.5530000 72.43000 0.7255000 72.03000 0.8349000 0.4046000      1.106000  
1 1 1 13 9  24 o 59.85000 0.5006000 59.56000 0.6982000 60.15000 0.7177000 -0.5884000     1.001000  
1 1 1 13 9  26 o 45.36000 0.3678000 45.21000 0.4422000 45.51000 0.5879000 -0.3052000     0.7356000 
1 1 1 13 9  28 o 28.62000 0.2954000 28.86000 0.3968000 28.39000 0.4376000 0.4681000      0.5907000 
1 1 1 13 9  30 o 38.59000 0.3283000 38.40000 0.4515000 38.77000 0.4768000 -0.3749000     0.6566000 
1 1 1 13 9  32 o 25.07000 0.3351000 25.06000 0.5008000 25.08000 0.4453000 -0.2406000E-01 0.6702000 
1 1 1 13 9  34 o 41.78000 0.4027000 41.93000 0.5543000 41.63000 0.5844000 0.3038000      0.8055000 
1 1 1 13 9  36 o 8.893000 0.6937000 8.513000 1.104000  9.273000 0.8406000 -0.7606000     1.387000  
1 1 1 13 9  38 o 12.20000 0.4673000 12.00000 0.6625000 12.40000 0.6593000 -0.4047000     0.9346000 
1 1 1 13 9  40 o 28.40000 0.3501000 27.72000 0.4511000 29.08000 0.5356000 -1.363000      0.7003000 
1 1 1 13 9  42 o 12.21000 0.4983000 12.86000 0.7040000 11.56000 0.7055000 1.304000       0.9967000 
1 1 1 13 9  44 o 29.16000 0.3317000 29.21000 0.4655000 29.11000 0.4728000 0.9743000E-01  0.6635000 
1 1 1 13 9  46 o 15.54000 0.4642000 15.31000 0.6504000 15.78000 0.6626000 -0.4745000     0.9285000 
1 1 1 13 9  48 o 20.63000 0.3506000 20.63000 0.5269000 20.62000 0.4627000 0.1523000E-01  0.7013000 
1 1 1 13 9  50 o 10.83000 0.5455000 10.69000 0.6991000 10.97000 0.8375000 -0.2773000     1.091000  
1 1 1 13 9  52 o 4.807000 0.9984000 4.141000 1.358000  5.473000 1.464000  -1.331000      1.997000  
1 1 1 13 9  54 o 4.151000 0.9478000 3.406000 1.369000  4.896000 1.311000  -1.490000      1.896000  
1 1 1 13 9  56 o 6.082000 0.8568000 6.063000 1.273000  6.102000 1.147000  -0.3910000E-01 1.714000  
1 1 1 13 9  58 o 4.681000 1.237000  5.415000 2.048000  3.946000 1.389000  1.469000       2.475000  
1 1 1 13 9  60 o 9.719000 0.7141000 9.151000 1.134000  10.29000 0.8690000 -1.137000      1.428000  
1 1 1 13 9  62 o 10.80000 0.5575000 10.69000 0.8032000 10.90000 0.7734000 -0.2146000     1.115000  
1 1 1 13 9  64 o 7.240000 0.7800000 6.982000 1.226000  7.498000 0.9648000 -0.5165000     1.560000  
1 1 1 13 10 1  o 44.11000 0.3213000 44.21000 0.4547000 44.02000 0.4542000 0.1886000      0.6427000 
1 1 1 13 10 3  o 145.6000 0.9915000 147.4000 1.420000  143.8000 1.384000  3.668000       1.983000  
1 1 1 13 10 5  o 62.14000 0.4365000 61.91000 0.6158000 62.37000 0.6189000 -0.4608000     0.8730000 
1 1 1 13 10 7  o 36.85000 0.3080000 36.60000 0.4676000 37.10000 0.4011000 -0.5019000     0.6161000 
1 1 1 13 10 9  o 31.27000 0.2940000 31.56000 0.4163000 30.97000 0.4153000 0.5843000      0.5880000 
1 1 1 13 10 11 o 94.59000 0.7050000 94.12000 0.9182000 95.07000 1.070000  -0.9490000     1.410000  
1 1 1 13 10 13 o 79.99000 0.5561000 80.47000 0.7908000 79.51000 0.7822000 0.9546000      1.112000  
1 1 1 13 10 15 o 79.61000 0.5994000 79.71000 0.7830000 79.52000 0.9077000 0.1911000      1.199000  
1 1 1 13 10 17 o 42.96000 0.3900000 43.72000 0.4213000 42.20000 0.6564000 1.522000       0.7799000 
1 1 1 13 10 19 o 49.54000 0.4868000 49.60000 0.6115000 49.49000 0.7577000 0.1095000      0.9737000 
1 1 1 13 10 21 o 82.61000 0.6806000 83.43000 0.7355000 81.79000 1.145000  1.647000       1.361000  
1 1 1 13 10 23 o 34.69000 0.3835000 34.88000 0.5869000 34.51000 0.4937000 0.3738000      0.7670000 
1 1 1 13 10 25 o 35.02000 0.3185000 35.17000 0.3803000 34.86000 0.5110000 0.3085000      0.6369000 
1 1 1 13 10 27 o 22.24000 0.2905000 21.67000 0.3845000 22.81000 0.4356000 -1.138000      0.5810000 
1 1 1 13 10 29 o 56.71000 0.4201000 57.30000 0.5919000 56.12000 0.5964000 1.171000       0.8402000 
1 1 1 13 10 31 o 30.83000 0.3032000 31.25000 0.4180000 30.40000 0.4392000 0.8437000      0.6063000 
1 1 1 13 10 33 o 14.12000 0.4868000 13.36000 0.7521000 14.87000 0.6182000 -1.511000      0.9736000 
1 1 1 13 10 35 o 7.718000 0.8520000 7.997000 0.8679000 7.440000 1.466000  0.5567000      1.704000  
1 1 1 13 10 37 o 30.41000 0.4197000 29.80000 0.6452000 31.02000 0.5371000 -1.221000      0.8395000 
1 1 1 13 10 39 o 36.62000 0.3615000 36.75000 0.4735000 36.49000 0.5464000 0.2549000      0.7230000 
1 1 1 13 10 41 o 20.91000 0.3526000 21.06000 0.4856000 20.76000 0.5115000 0.3035000      0.7052000 
1 1 1 13 10 43 o 33.51000 0.3322000 33.14000 0.4706000 33.88000 0.4689000 -0.7349000     0.6644000 
1 1 1 13 10 45 o 4.403000 1.053000  4.345000 1.495000  4.462000 1.482000  -0.1169000     2.105000  
1 1 1 13 10 47 o 12.05000 0.5702000 11.73000 0.9461000 12.37000 0.6366000 -0.6365000     1.140000  
1 1 1 13 10 49 o 6.136000 0.9183000 5.236000 1.314000  7.037000 1.283000  -1.801000      1.837000  
1 1 1 13 10 51 o 3.856000 0.9815000 4.214000 1.423000  3.498000 1.352000  0.7159000      1.963000  
1 1 1 13 10 53 o 7.551000 0.6692000 7.284000 0.9698000 7.817000 0.9224000 -0.5328000     1.338000  
1 1 1 13 10 55 o 6.085000 0.9179000 6.846000 1.068000  5.325000 1.493000  1.521000       1.836000  
1 1 1 13 10 57 o 6.551000 0.8532000 4.876000 1.441000  8.226000 0.9138000 -3.349000      1.706000  
1 1 1 13 10 59 o 6.192000 0.8883000 6.302000 1.271000  6.081000 1.242000  0.2210000      1.777000  
1 1 1 13 10 61 o 7.356000 0.8934000 7.279000 1.387000  7.433000 1.127000  -0.1544000     1.787000  
1 1 1 13 10 63 o 6.932000 0.8995000 6.409000 1.376000  7.455000 1.159000  -1.046000      1.799000  
1 1 1 13 11 0  o 89.30000 0.8687000 89.30000 0.8687000 89.30000 0.8687000 0.000000       0.000000  
1 1 1 13 11 2  o 79.94000 0.5527000 79.47000 0.7771000 80.40000 0.7861000 -0.9320000     1.105000  
1 1 1 13 11 4  o 117.3000 0.8664000 118.0000 1.140000  116.6000 1.305000  1.488000       1.733000  
1 1 1 13 11 6  o 101.0000 0.6931000 101.8000 0.9874000 100.2000 0.9729000 1.615000       1.386000  
1 1 1 13 11 8  o 107.0000 0.7923000 106.6000 1.194000  107.5000 1.042000  -0.8513000     1.585000  
1 1 1 13 11 10 o 38.27000 0.2928000 38.22000 0.4141000 38.32000 0.4142000 -0.9875000E-01 0.5857000 
1 1 1 13 11 12 o 51.76000 0.4333000 52.21000 0.6168000 51.31000 0.6088000 0.8958000      0.8667000 
1 1 1 13 11 14 o 52.52000 0.4139000 52.42000 0.5333000 52.63000 0.6331000 -0.2115000     0.8278000 
1 1 1 13 11 16 o 30.48000 0.3233000 30.43000 0.3350000 30.52000 0.5530000 -0.9191000E-01 0.6466000 
1 1 1 13 11 18 o 142.7000 1.006000  143.7000 1.240000  141.7000 1.584000  1.955000       2.012000  
1 1 1 13 11 20 o 53.92000 0.6294000 53.26000 0.4941000 54.58000 1.158000  -1.313000      1.259000  
1 1 1 13 11 22 o 45.99000 0.3811000 46.09000 0.4920000 45.89000 0.5822000 0.2011000      0.7623000 
1 1 1 13 11 24 o 43.45000 0.3542000 43.45000 0.4275000 43.44000 0.5649000 0.4974000E-02  0.7084000 
1 1 1 13 11 26 o 56.27000 0.4302000 55.81000 0.5176000 56.73000 0.6872000 -0.9164000     0.8603000 
1 1 1 13 11 28 o 11.20000 0.4109000 10.80000 0.5482000 11.60000 0.6123000 -0.7934000     0.8218000 
1 1 1 13 11 30 f 43.76000 0.3496000 43.47000 0.4821000 44.05000 0.5063000 -0.5762000     0.6992000 
1 1 1 13 11 32 o 34.57000 0.3371000 35.08000 0.4962000 34.05000 0.4564000 1.036000       0.6742000 
1 1 1 13 11 34 o 24.11000 0.3305000 23.45000 0.4823000 24.77000 0.4520000 -1.319000      0.6610000 
1 1 1 13 11 36 o 31.63000 0.3631000 31.74000 0.4940000 31.51000 0.5323000 0.2309000      0.7262000 
1 1 1 13 11 38 o 25.67000 0.3483000 24.91000 0.4490000 26.43000 0.5326000 -1.519000      0.6966000 
1 1 1 13 11 40 o 34.10000 0.3358000 34.11000 0.4643000 34.09000 0.4853000 0.2933000E-01  0.6717000 
1 1 1 13 11 42 o 12.01000 0.5010000 11.39000 0.7253000 12.63000 0.6913000 -1.239000      1.002000  
1 1 1 13 11 44 o 12.72000 0.4642000 12.60000 0.6715000 12.85000 0.6412000 -0.2581000     0.9285000 
1 1 1 13 11 46 o 12.46000 0.4757000 12.94000 0.6973000 11.99000 0.6472000 0.9510000      0.9514000 
1 1 1 13 11 48 o 11.69000 0.4547000 11.83000 0.6919000 11.54000 0.5902000 0.2922000      0.9094000 
1 1 1 13 11 50 o 14.17000 0.4303000 13.61000 0.6699000 14.74000 0.5402000 -1.128000      0.8606000 
1 1 1 13 11 52 o 5.965000 0.8598000 6.381000 1.108000  5.548000 1.315000  0.8326000      1.720000  
1 1 1 13 11 54 o 6.846000 0.7553000 7.186000 1.112000  6.506000 1.022000  0.6802000      1.511000  
1 1 1 13 11 56 o 20.42000 0.3756000 20.49000 0.5056000 20.35000 0.5555000 0.1367000      0.7511000 
1 1 1 13 11 58 o 4.629000 1.010000  3.827000 1.612000  5.431000 1.218000  -1.603000      2.021000  
1 1 1 13 11 60 o 5.201000 1.182000  4.650000 1.782000  5.751000 1.555000  -1.101000      2.365000  
1 1 1 13 11 62 o 4.754000 0.9991000 5.403000 1.465000  4.104000 1.358000  1.299000       1.998000  
1 1 1 13 11 64 o 4.870000 0.9816000 4.267000 1.509000  5.473000 1.256000  -1.206000      1.963000  
1 1 1 13 12 1  o 52.18000 0.3721000 51.71000 0.5216000 52.64000 0.5309000 -0.9380000     0.7443000 
1 1 1 13 12 3  o 68.12000 0.4750000 68.32000 0.6736000 67.91000 0.6698000 0.4088000      0.9499000 
1 1 1 13 12 5  o 83.64000 0.6245000 84.35000 0.8237000 82.94000 0.9389000 1.407000       1.249000  
1 1 1 13 12 7  o 128.0000 0.8746000 128.3000 1.239000  127.8000 1.234000  0.4978000      1.749000  
1 1 1 13 12 9  o 51.53000 0.4016000 51.62000 0.6084000 51.43000 0.5245000 0.1836000      0.8033000 
1 1 1 13 12 11 o 124.5000 0.8521000 124.7000 1.207000  124.2000 1.203000  0.4338000      1.704000  
1 1 1 13 12 13 o 51.97000 0.4095000 51.78000 0.5257000 52.16000 0.6280000 -0.3787000     0.8189000 
1 1 1 13 12 15 o 21.83000 0.4415000 22.10000 0.3190000 21.56000 0.8234000 0.5358000      0.8830000 
1 1 1 13 12 17 o 67.67000 0.4976000 66.56000 0.5939000 68.78000 0.7986000 -2.220000      0.9952000 
1 1 1 13 12 19 o 16.54000 0.4692000 15.97000 0.3332000 17.11000 0.8772000 -1.139000      0.9383000 
1 1 1 13 12 21 o 45.82000 0.3793000 46.39000 0.4920000 45.25000 0.5773000 1.135000       0.7585000 
1 1 1 13 12 23 o 43.66000 0.3981000 43.55000 0.5592000 43.76000 0.5667000 -0.2093000     0.7961000 
1 1 1 13 12 25 o 54.30000 0.4182000 53.80000 0.5010000 54.80000 0.6698000 -0.9979000     0.8364000 
1 1 1 13 12 27 f 25.19000 0.2950000 25.04000 0.3489000 25.33000 0.4758000 -0.2827000     0.5900000 
1 1 1 13 12 29 o 57.32000 0.4235000 56.88000 0.5864000 57.77000 0.6111000 -0.8898000     0.8469000 
1 1 1 13 12 31 o 38.95000 0.3301000 39.03000 0.4524000 38.86000 0.4808000 0.1716000      0.6602000 
1 1 1 13 12 33 o 32.58000 0.3600000 33.52000 0.4913000 31.64000 0.5263000 1.887000       0.7200000 
1 1 1 13 12 35 o 41.59000 0.3746000 41.80000 0.5577000 41.38000 0.5003000 0.4183000      0.7493000 
1 1 1 13 12 37 o 32.23000 0.3186000 32.10000 0.4400000 32.36000 0.4608000 -0.2676000     0.6371000 
1 1 1 13 12 39 o 11.37000 0.6388000 10.62000 0.7546000 12.13000 1.031000  -1.504000      1.278000  
1 1 1 13 12 41 o 25.61000 0.3293000 25.72000 0.4480000 25.51000 0.4827000 0.2137000      0.6586000 
1 1 1 13 12 43 o 21.21000 0.3716000 21.75000 0.5580000 20.66000 0.4910000 1.097000       0.7432000 
1 1 1 13 12 45 o 30.76000 0.3853000 31.15000 0.5281000 30.36000 0.5613000 0.7963000      0.7707000 
1 1 1 13 12 47 o 34.03000 0.4134000 34.28000 0.6851000 33.77000 0.4630000 0.5110000      0.8269000 
1 1 1 13 12 49 o 14.71000 0.4478000 14.51000 0.6973000 14.91000 0.5621000 -0.3998000     0.8956000 
1 1 1 13 12 51 o 18.85000 0.4507000 17.83000 0.6053000 19.86000 0.6679000 -2.027000      0.9014000 
1 1 1 13 12 53 o 10.57000 0.4803000 10.67000 0.7059000 10.47000 0.6515000 0.1933000      0.9606000 
1 1 1 13 12 55 o 4.388000 0.9049000 3.493000 1.325000  5.283000 1.233000  -1.790000      1.810000  
1 1 1 13 12 57 o 7.085000 0.7702000 6.490000 1.173000  7.680000 0.9982000 -1.190000      1.540000  
1 1 1 13 12 59 o 9.012000 0.8722000 10.04000 1.300000  7.988000 1.163000  2.048000       1.744000  
1 1 1 13 12 61 o 5.382000 0.9437000 7.490000 1.277000  3.273000 1.390000  4.218000       1.887000  
1 1 1 13 12 63 o 8.908000 0.6449000 9.003000 0.9386000 8.814000 0.8846000 0.1886000      1.290000  
1 1 1 13 13 0  f 9.803000 0.6847000 9.803000 0.6847000 9.803000 0.6847000 0.000000       0.000000  
1 1 1 13 13 2  o 26.73000 0.2524000 27.16000 0.3924000 26.29000 0.3175000 0.8706000      0.5048000 
1 1 1 13 13 4  o 61.57000 0.4692000 61.77000 0.6145000 61.36000 0.7091000 0.4114000      0.9383000 
1 1 1 13 13 6  o 92.66000 0.6389000 91.62000 0.8925000 93.71000 0.9145000 -2.092000      1.278000  
1 1 1 13 13 8  o 20.30000 0.3095000 20.90000 0.5171000 19.69000 0.3402000 1.206000       0.6190000 
1 1 1 13 13 10 o 42.80000 0.3508000 42.74000 0.4525000 42.85000 0.5361000 -0.1085000     0.7015000 
1 1 1 13 13 12 o 17.30000 0.3194000 17.09000 0.3544000 17.52000 0.5314000 -0.4328000     0.6388000 
1 1 1 13 13 14 o 43.04000 0.3900000 42.80000 0.4055000 43.28000 0.6664000 -0.4829000     0.7801000 
1 1 1 13 13 16 o 56.35000 0.4443000 56.61000 0.5804000 56.10000 0.6729000 0.5029000      0.8886000 
1 1 1 13 13 18 o 38.02000 0.4991000 37.78000 0.4233000 38.26000 0.9039000 -0.4808000     0.9982000 
1 1 1 13 13 20 o 24.91000 0.3091000 25.13000 0.4179000 24.70000 0.4557000 0.4278000      0.6183000 
1 1 1 13 13 22 o 14.97000 0.3166000 14.31000 0.3652000 15.64000 0.5172000 -1.337000      0.6332000 
1 1 1 13 13 24 o 55.57000 0.4461000 55.06000 0.5756000 56.09000 0.6817000 -1.027000      0.8922000 
1 1 1 13 13 26 o 23.85000 0.3100000 23.79000 0.4020000 23.92000 0.4721000 -0.1295000     0.6201000 
1 1 1 13 13 28 o 23.17000 0.3122000 23.28000 0.3934000 23.06000 0.4849000 0.2237000      0.6244000 
1 1 1 13 13 30 o 31.75000 0.3003000 31.53000 0.4096000 31.98000 0.4392000 -0.4556000     0.6006000 
1 1 1 13 13 32 o 26.66000 0.3107000 27.09000 0.4481000 26.23000 0.4305000 0.8534000      0.6214000 
1 1 1 13 13 34 f 28.60000 0.3055000 28.64000 0.4167000 28.56000 0.4470000 0.7571000E-01  0.6111000 
1 1 1 13 13 36 o 17.95000 0.4005000 17.38000 0.5206000 18.53000 0.6086000 -1.157000      0.8009000 
1 1 1 13 13 38 o 19.93000 0.4440000 19.59000 0.7252000 20.27000 0.5126000 -0.6851000     0.8881000 
1 1 1 13 13 40 o 46.63000 0.4112000 46.26000 0.6139000 46.99000 0.5471000 -0.7327000     0.8223000 
1 1 1 13 13 42 o 25.00000 0.3504000 24.51000 0.5494000 25.48000 0.4349000 -0.9686000     0.7007000 
1 1 1 13 13 44 o 15.96000 0.4247000 15.44000 0.6877000 16.49000 0.4985000 -1.044000      0.8494000 
1 1 1 13 13 46 o 21.65000 0.4027000 21.22000 0.6689000 22.08000 0.4487000 -0.8599000     0.8055000 
1 1 1 13 13 48 o 26.04000 0.3525000 25.63000 0.5249000 26.46000 0.4707000 -0.8328000     0.7051000 
1 1 1 13 13 50 o 22.34000 0.4020000 21.92000 0.6330000 22.75000 0.4958000 -0.8319000     0.8040000 
1 1 1 13 13 52 o 10.79000 0.5262000 10.88000 0.8388000 10.70000 0.6355000 0.1825000      1.052000  
1 1 1 13 13 54 o 8.165000 0.6492000 8.933000 0.9678000 7.397000 0.8657000 1.536000       1.298000  
1 1 1 13 13 56 o 11.49000 0.5491000 11.30000 0.8321000 11.68000 0.7168000 -0.3730000     1.098000  
1 1 1 13 13 58 o 3.518000 0.9762000 3.567000 1.445000  3.468000 1.313000  0.9907000E-01  1.952000  
1 1 1 13 13 60 o 3.676000 0.9945000 3.508000 1.413000  3.845000 1.400000  -0.3376000     1.989000  
1 1 1 13 13 62 o 3.255000 0.9575000 3.186000 1.387000  3.325000 1.321000  -0.1384000     1.915000  
1 1 1 13 13 64 o 3.764000 1.028000  3.841000 1.468000  3.687000 1.441000  0.1539000      2.057000  
1 1 1 13 14 1  o 62.67000 0.4405000 62.48000 0.6211000 62.85000 0.6249000 -0.3752000     0.8811000 
1 1 1 13 14 3  o 47.17000 0.3435000 47.15000 0.4851000 47.18000 0.4864000 -0.2956000E-01 0.6870000 
1 1 1 13 14 5  o 63.03000 0.4799000 63.60000 0.6328000 62.45000 0.7217000 1.150000       0.9598000 
1 1 1 13 14 7  o 20.78000 0.2129000 20.58000 0.3010000 20.98000 0.3012000 -0.3955000     0.4258000 
1 1 1 13 14 9  o 30.95000 0.3019000 30.74000 0.4029000 31.15000 0.4498000 -0.4122000     0.6038000 
1 1 1 13 14 11 o 67.62000 0.5828000 67.85000 0.6685000 67.38000 0.9549000 0.4726000      1.166000  
1 1 1 13 14 13 o 73.09000 0.5288000 74.00000 0.6522000 72.18000 0.8326000 1.818000       1.058000  
1 1 1 13 14 15 o 63.22000 0.4673000 62.90000 0.5624000 63.53000 0.7464000 -0.6322000     0.9346000 
1 1 1 13 14 17 o 110.9000 0.9276000 113.0000 1.094000  108.8000 1.498000  4.272000       1.855000  
1 1 1 13 14 19 f 44.20000 0.4213000 44.47000 0.4718000 43.93000 0.6982000 0.5320000      0.8427000 
1 1 1 13 14 21 f 24.31000 0.3541000 24.23000 0.4264000 24.39000 0.5653000 -0.1530000     0.7081000 
1 1 1 13 14 23 o 76.62000 0.5844000 76.46000 0.7589000 76.78000 0.8890000 -0.3170000     1.169000  
1 1 1 13 14 25 o 92.12000 0.6939000 92.68000 0.9117000 91.55000 1.046000  1.127000       1.388000  
1 1 1 13 14 27 o 11.90000 0.4184000 11.73000 0.5556000 12.08000 0.6258000 -0.3449000     0.8369000 
1 1 1 13 14 29 o 11.42000 0.3922000 12.03000 0.5020000 10.81000 0.6027000 1.219000       0.7844000 
1 1 1 13 14 31 o 12.56000 0.3830000 11.98000 0.5395000 13.15000 0.5438000 -1.163000      0.7660000 
1 1 1 13 14 33 o 14.19000 0.4930000 14.16000 0.4883000 14.22000 0.8565000 -0.5785000E-01 0.9860000 
1 1 1 13 14 35 o 16.51000 0.4201000 16.53000 0.5690000 16.49000 0.6182000 0.3989000E-01  0.8402000 
1 1 1 13 14 37 o 23.70000 0.3282000 24.21000 0.5081000 23.20000 0.4154000 1.015000       0.6563000 
1 1 1 13 14 39 o 29.74000 0.3960000 30.03000 0.6719000 29.45000 0.4193000 0.5773000      0.7920000 
1 1 1 13 14 41 o 13.13000 0.5093000 12.60000 0.8177000 13.66000 0.6075000 -1.061000      1.019000  
1 1 1 13 14 43 f 31.58000 0.3852000 31.39000 0.5381000 31.77000 0.5513000 -0.3751000     0.7704000 
1 1 1 13 14 45 o 37.37000 0.3761000 37.52000 0.5600000 37.22000 0.5022000 0.3072000      0.7522000 
1 1 1 13 14 47 o 12.25000 0.6283000 11.59000 1.016000  12.90000 0.7388000 -1.306000      1.257000  
1 1 1 13 14 49 o 6.969000 0.8996000 7.147000 1.255000  6.790000 1.290000  0.3569000      1.799000  
1 1 1 13 14 51 o 15.59000 0.4792000 14.90000 0.8415000 16.29000 0.4587000 -1.384000      0.9584000 
1 1 1 13 14 53 o 4.376000 0.9879000 5.106000 1.505000  3.646000 1.279000  1.460000       1.976000  
1 1 1 13 14 55 o 8.358000 0.7700000 6.912000 1.338000  9.805000 0.7626000 -2.892000      1.540000  
1 1 1 13 14 57 o 3.861000 1.087000  3.947000 1.733000  3.774000 1.313000  0.1731000      2.174000  
1 1 1 13 14 59 o 4.384000 0.9676000 3.065000 1.395000  5.704000 1.341000  -2.639000      1.935000  
1 1 1 13 14 61 o 3.651000 0.9830000 3.956000 1.426000  3.346000 1.353000  0.6100000      1.966000  
1 1 1 13 14 63 o 4.041000 1.031000  4.405000 1.510000  3.677000 1.403000  0.7277000      2.061000  
1 1 1 13 15 0  o 238.5000 2.290000  238.5000 2.290000  238.5000 2.290000  0.000000       0.000000  
1 1 1 13 15 2  o 197.3000 1.341000  195.5000 1.879000  199.0000 1.913000  -3.470000      2.682000  
1 1 1 13 15 4  o 62.84000 0.4790000 63.12000 0.6281000 62.56000 0.7235000 0.5576000      0.9581000 
1 1 1 13 15 6  o 109.9000 0.7552000 109.2000 1.062000  110.5000 1.074000  -1.262000      1.510000  
1 1 1 13 15 8  o 41.42000 0.5590000 40.89000 0.9175000 41.94000 0.6390000 -1.051000      1.118000  
1 1 1 13 15 10 o 88.06000 0.8640000 88.38000 1.226000  87.74000 1.217000  0.6394000      1.728000  
1 1 1 13 15 12 o 54.74000 0.4096000 54.77000 0.4959000 54.71000 0.6521000 0.5549000E-01  0.8193000 
1 1 1 13 15 14 o 59.86000 0.4660000 59.96000 0.6055000 59.75000 0.7086000 0.2049000      0.9321000 
1 1 1 13 15 16 o 60.97000 0.5364000 60.59000 0.6042000 61.35000 0.8864000 -0.7635000     1.073000  
1 1 1 13 15 18 o 58.78000 0.4420000 58.80000 0.5341000 58.76000 0.7045000 0.3434000E-01  0.8841000 
1 1 1 13 15 20 o 47.38000 0.3725000 47.76000 0.4514000 46.99000 0.5926000 0.7725000      0.7450000 
1 1 1 13 15 22 o 14.00000 0.3729000 14.05000 0.4646000 13.95000 0.5834000 0.9570000E-01  0.7458000 
1 1 1 13 15 24 o 21.20000 0.3729000 21.05000 0.4383000 21.36000 0.6035000 -0.3110000     0.7459000 
1 1 1 13 15 26 o 40.87000 0.3570000 40.90000 0.4563000 40.83000 0.5491000 0.6246000E-01  0.7140000 
1 1 1 13 15 28 f 34.93000 0.3209000 35.20000 0.3830000 34.67000 0.5150000 0.5251000      0.6418000 
1 1 1 13 15 30 f 23.50000 0.2942000 22.94000 0.3895000 24.06000 0.4410000 -1.117000      0.5884000 
1 1 1 13 15 32 o 13.37000 0.4179000 14.20000 0.5264000 12.53000 0.6492000 1.670000       0.8358000 
1 1 1 13 15 34 o 10.15000 0.5193000 10.34000 0.8127000 9.949000 0.6468000 0.3933000      1.039000  
1 1 1 13 15 36 o 10.39000 0.5783000 10.56000 0.7670000 10.23000 0.8656000 0.3249000      1.157000  
1 1 1 13 15 38 o 13.19000 0.4791000 13.64000 0.7452000 12.75000 0.6024000 0.8934000      0.9582000 
1 1 1 13 15 40 o 49.76000 0.4103000 50.31000 0.6469000 49.22000 0.5048000 1.092000       0.8205000 
1 1 1 13 15 42 o 11.37000 0.5542000 11.57000 0.8861000 11.18000 0.6658000 0.3942000      1.108000  
1 1 1 13 15 44 o 26.34000 0.3534000 27.31000 0.5164000 25.37000 0.4827000 1.934000       0.7069000 
1 1 1 13 15 46 o 14.72000 0.4744000 14.94000 0.7248000 14.51000 0.6122000 0.4284000      0.9487000 
1 1 1 13 15 48 o 17.60000 0.3841000 18.37000 0.5975000 16.84000 0.4830000 1.534000       0.7683000 
1 1 1 13 15 50 o 15.09000 0.4167000 15.28000 0.6505000 14.90000 0.5211000 0.3772000      0.8334000 
1 1 1 13 15 52 o 5.800000 0.9076000 5.773000 1.441000  5.826000 1.104000  -0.5335000E-01 1.815000  
1 1 1 13 15 54 o 4.261000 1.028000  4.868000 1.568000  3.653000 1.330000  1.216000       2.056000  
1 1 1 13 15 56 o 4.258000 0.9664000 3.755000 1.475000  4.761000 1.249000  -1.006000      1.933000  
1 1 1 13 15 58 o 3.949000 1.048000  4.405000 1.628000  3.493000 1.321000  0.9119000      2.097000  
1 1 1 13 15 60 o 3.882000 1.043000  3.978000 1.557000  3.786000 1.388000  0.1924000      2.085000  
1 1 1 13 15 62 o 3.789000 1.104000  4.142000 1.744000  3.436000 1.355000  0.7060000      2.208000  
1 1 1 13 16 1  o 47.30000 0.3442000 47.68000 0.4907000 46.92000 0.4828000 0.7575000      0.6884000 
1 1 1 13 16 3  o 32.29000 0.2933000 31.75000 0.4108000 32.84000 0.4188000 -1.086000      0.5867000 
1 1 1 13 16 5  f 44.10000 0.4164000 44.54000 0.5302000 43.67000 0.6423000 0.8716000      0.8329000 
1 1 1 13 16 7  o 28.71000 0.5642000 28.07000 0.8063000 29.34000 0.7894000 -1.268000      1.128000  
1 1 1 13 16 9  o 63.61000 0.5249000 62.66000 0.7309000 64.55000 0.7536000 -1.893000      1.050000  
1 1 1 13 16 11 o 67.33000 0.5526000 67.35000 0.7813000 67.32000 0.7817000 0.3374000E-01  1.105000  
1 1 1 13 16 13 o 33.07000 0.3039000 33.12000 0.3847000 33.03000 0.4704000 0.8820000E-01  0.6077000 
1 1 1 13 16 15 o 116.9000 0.9830000 116.7000 1.131000  117.1000 1.608000  -0.3290000     1.966000  
1 1 1 13 16 17 o 64.22000 0.4731000 65.29000 0.5841000 63.16000 0.7445000 2.133000       0.9462000 
1 1 1 13 16 19 o 35.79000 0.3675000 35.47000 0.3668000 36.11000 0.6370000 -0.6404000     0.7350000 
1 1 1 13 16 21 o 10.85000 0.3927000 11.27000 0.4165000 10.44000 0.6658000 0.8271000      0.7853000 
1 1 1 13 16 23 o 38.93000 0.3465000 38.56000 0.4405000 39.31000 0.5349000 -0.7466000     0.6930000 
1 1 1 13 16 25 o 18.56000 0.3636000 17.33000 0.3816000 19.78000 0.6190000 -2.456000      0.7272000 
1 1 1 13 16 27 o 32.74000 0.3676000 32.93000 0.4073000 32.55000 0.6120000 0.3742000      0.7351000 
1 1 1 13 16 29 f 9.311000 0.4989000 9.319000 0.5470000 9.303000 0.8346000 0.1598000E-01  0.9979000 
1 1 1 13 16 31 o 40.88000 0.4339000 40.74000 0.6490000 41.01000 0.5760000 -0.2723000     0.8678000 
1 1 1 13 16 33 o 68.38000 0.5117000 69.40000 0.8095000 67.37000 0.6263000 2.029000       1.023000  
1 1 1 13 16 35 o 38.11000 0.4248000 38.01000 0.6469000 38.20000 0.5509000 -0.1912000     0.8497000 
1 1 1 13 16 37 o 30.41000 0.3356000 30.84000 0.5276000 29.97000 0.4150000 0.8722000      0.6713000 
1 1 1 13 16 39 o 50.36000 0.4767000 51.05000 0.8086000 49.67000 0.5051000 1.380000       0.9534000 
1 1 1 13 16 41 o 12.34000 0.5224000 12.77000 0.8019000 11.91000 0.6697000 0.8622000      1.045000  
1 1 1 13 16 43 o 13.23000 0.5231000 13.53000 0.7951000 12.93000 0.6799000 0.5962000      1.046000  
1 1 1 13 16 45 o 15.58000 0.4174000 14.89000 0.6157000 16.26000 0.5637000 -1.363000      0.8348000 
1 1 1 13 16 47 o 17.03000 0.4570000 17.36000 0.7215000 16.70000 0.5610000 0.6633000      0.9139000 
1 1 1 13 16 49 o 14.63000 0.4339000 14.87000 0.6208000 14.38000 0.6064000 0.4895000      0.8679000 
1 1 1 13 16 51 o 11.06000 0.5085000 10.53000 0.8379000 11.58000 0.5764000 -1.044000      1.017000  
1 1 1 13 16 53 o 10.75000 0.6121000 10.43000 1.058000  11.07000 0.6168000 -0.6397000     1.224000  
1 1 1 13 16 55 o 3.593000 0.9890000 4.332000 1.555000  2.854000 1.223000  1.478000       1.978000  
1 1 1 13 16 57 o 7.197000 1.196000  7.226000 2.078000  7.168000 1.185000  0.5827000E-01  2.393000  
1 1 1 13 16 59 o 4.392000 1.153000  4.655000 1.664000  4.128000 1.597000  0.5268000      2.306000  
1 1 1 13 16 61 o 4.783000 1.047000  4.953000 1.651000  4.612000 1.289000  0.3418000      2.094000  
1 1 1 13 16 63 o 2.965000 0.9386000 3.233000 1.452000  2.698000 1.190000  0.5348000      1.877000  
1 1 1 13 17 0  o 7.719000 0.5138000 7.719000 0.5138000 7.719000 0.5138000 0.000000       0.000000  
1 1 1 13 17 2  o 22.47000 0.3207000 22.49000 0.4681000 22.45000 0.4384000 0.4369000E-01  0.6414000 
1 1 1 13 17 4  o 42.86000 0.4093000 42.48000 0.5106000 43.25000 0.6399000 -0.7712000     0.8186000 
1 1 1 13 17 6  o 78.70000 0.7113000 79.11000 1.105000  78.28000 0.8965000 0.8224000      1.423000  
1 1 1 13 17 8  o 80.60000 0.7315000 81.55000 1.145000  79.66000 0.9105000 1.882000       1.463000  
1 1 1 13 17 10 o 83.72000 0.6746000 82.98000 0.9457000 84.46000 0.9621000 -1.477000      1.349000  
1 1 1 13 17 12 o 46.93000 0.4127000 46.99000 0.5836000 46.86000 0.5838000 0.1308000      0.8255000 
1 1 1 13 17 14 o 31.67000 0.4015000 31.63000 0.5646000 31.71000 0.5711000 -0.8420000E-01 0.8031000 
1 1 1 13 17 16 o 14.43000 0.2993000 13.99000 0.3079000 14.87000 0.5133000 -0.8856000     0.5986000 
1 1 1 13 17 18 o 89.03000 0.7617000 88.26000 0.8607000 89.79000 1.257000  -1.534000      1.523000  
1 1 1 13 17 20 o 56.02000 0.4260000 55.54000 0.5095000 56.50000 0.6829000 -0.9555000     0.8520000 
1 1 1 13 17 22 o 38.26000 0.3400000 37.69000 0.4253000 38.83000 0.5305000 -1.133000      0.6799000 
1 1 1 13 17 24 o 37.06000 0.3249000 36.88000 0.3808000 37.23000 0.5265000 -0.3535000     0.6498000 
1 1 1 13 17 26 o 55.74000 0.4492000 55.51000 0.5812000 55.98000 0.6849000 -0.4757000     0.8983000 
1 1 1 13 17 28 o 51.65000 0.4044000 52.10000 0.4921000 51.21000 0.6419000 0.8859000      0.8089000 
1 1 1 13 17 30 o 22.85000 0.4551000 22.83000 0.7002000 22.87000 0.5816000 -0.3706000E-01 0.9102000 
1 1 1 13 17 32 o 37.81000 0.3850000 37.44000 0.5234000 38.18000 0.5647000 -0.7364000     0.7699000 
1 1 1 13 17 34 o 23.22000 0.3619000 23.18000 0.5171000 23.27000 0.5066000 -0.9754000E-01 0.7239000 
1 1 1 13 17 36 o 24.29000 0.3613000 25.20000 0.5304000 23.37000 0.4908000 1.834000       0.7227000 
1 1 1 13 17 38 o 14.58000 0.4563000 15.00000 0.7111000 14.15000 0.5720000 0.8511000      0.9126000 
1 1 1 13 17 40 o 3.793000 1.091000  3.750000 1.656000  3.835000 1.421000  -0.8515000E-01 2.182000  
1 1 1 13 17 42 o 11.97000 0.5532000 12.99000 0.8893000 10.94000 0.6581000 2.056000       1.106000  
1 1 1 13 17 44 o 24.46000 0.3834000 24.38000 0.5271000 24.54000 0.5568000 -0.1590000     0.7667000 
1 1 1 13 17 46 o 15.80000 0.3895000 15.56000 0.5940000 16.05000 0.5040000 -0.4925000     0.7790000 
1 1 1 13 17 48 o 28.59000 0.4268000 28.34000 0.5235000 28.85000 0.6742000 -0.5075000     0.8536000 
1 1 1 13 17 50 o 10.63000 0.5543000 10.44000 0.8910000 10.83000 0.6595000 -0.3827000     1.109000  
1 1 1 13 17 52 o 6.137000 0.9464000 5.876000 1.542000  6.398000 1.098000  -0.5220000     1.893000  
1 1 1 13 17 54 o 3.344000 0.9812000 3.482000 1.467000  3.206000 1.304000  0.2766000      1.962000  
1 1 1 13 17 56 o 7.655000 0.7558000 7.501000 1.153000  7.808000 0.9773000 -0.3062000     1.512000  
1 1 1 13 17 58 f 8.903000 0.7629000 8.433000 1.258000  9.373000 0.8630000 -0.9404000     1.526000  
1 1 1 13 17 60 o 2.927000 0.9183000 3.272000 1.427000  2.582000 1.156000  0.6900000      1.837000  
1 1 1 13 17 62 o 5.541000 1.005000  5.409000 1.692000  5.672000 1.084000  -0.2637000     2.010000  
1 1 1 13 18 1  o 63.01000 0.4453000 63.19000 0.6313000 62.82000 0.6281000 0.3707000      0.8905000 
1 1 1 13 18 3  o 91.11000 0.6294000 90.91000 0.8888000 91.31000 0.8915000 -0.4051000     1.259000  
1 1 1 13 18 5  o 31.73000 0.3208000 30.94000 0.4491000 32.53000 0.4581000 -1.588000      0.6415000 
1 1 1 13 18 7  o 100.7000 0.8025000 100.9000 1.137000  100.5000 1.133000  0.4367000      1.605000  
1 1 1 13 18 9  o 114.8000 0.9116000 114.0000 1.280000  115.6000 1.298000  -1.539000      1.823000  
1 1 1 13 18 11 o 48.43000 0.5212000 48.42000 0.7242000 48.44000 0.7499000 -0.2031000E-01 1.042000  
1 1 1 13 18 13 o 87.05000 0.8562000 87.85000 1.219000  86.26000 1.202000  1.591000       1.712000  
1 1 1 13 18 15 o 49.22000 0.4859000 48.69000 0.6038000 49.75000 0.7614000 -1.064000      0.9718000 
1 1 1 13 18 17 f 63.61000 0.4714000 63.55000 0.5695000 63.67000 0.7513000 -0.1251000     0.9428000 
1 1 1 13 18 19 o 69.99000 0.5129000 70.88000 0.6310000 69.09000 0.8088000 1.791000       1.026000  
1 1 1 13 18 21 o 3.915000 0.8355000 3.004000 1.053000  4.827000 1.298000  -1.822000      1.671000  
1 1 1 13 18 23 o 16.06000 0.3241000 16.57000 0.3960000 15.55000 0.5132000 1.012000       0.6483000 
1 1 1 13 18 25 o 49.57000 0.3913000 49.41000 0.4679000 49.74000 0.6272000 -0.3325000     0.7825000 
1 1 1 13 18 27 o 32.22000 0.3261000 32.20000 0.4186000 32.24000 0.5001000 -0.4434000E-01 0.6521000 
1 1 1 13 18 29 o 19.67000 0.3166000 19.73000 0.4183000 19.61000 0.4753000 0.1201000      0.6332000 
1 1 1 13 18 31 o 47.54000 0.4367000 48.12000 0.7295000 46.96000 0.4805000 1.157000       0.8735000 
1 1 1 13 18 33 o 32.82000 0.5347000 33.81000 0.9360000 31.82000 0.5173000 1.986000       1.069000  
1 1 1 13 18 35 o 25.21000 0.3654000 25.47000 0.6094000 24.95000 0.4034000 0.5263000      0.7308000 
1 1 1 13 18 37 o 17.43000 0.4122000 17.38000 0.6084000 17.47000 0.5563000 -0.9032000E-01 0.8244000 
1 1 1 13 18 39 o 28.60000 0.3654000 28.26000 0.5517000 28.95000 0.4792000 -0.6934000     0.7308000 
1 1 1 13 18 41 o 16.57000 0.4129000 15.98000 0.6519000 17.15000 0.5070000 -1.169000      0.8258000 
1 1 1 13 18 43 o 4.868000 1.021000  4.369000 1.559000  5.367000 1.319000  -0.9984000     2.042000  
1 1 1 13 18 45 o 14.92000 0.4484000 15.14000 0.7323000 14.69000 0.5176000 0.4415000      0.8967000 
1 1 1 13 18 47 o 15.65000 0.4448000 15.23000 0.6741000 16.07000 0.5804000 -0.8462000     0.8896000 
1 1 1 13 18 49 f 6.468000 0.8434000 8.090000 1.123000  4.846000 1.258000  3.244000       1.687000  
1 1 1 13 18 51 o 20.67000 0.4029000 20.55000 0.6240000 20.80000 0.5098000 -0.2481000     0.8058000 
1 1 1 13 18 53 o 12.09000 0.5029000 11.51000 0.8085000 12.67000 0.5983000 -1.159000      1.006000  
1 1 1 13 18 55 f 16.14000 0.4137000 15.47000 0.6685000 16.81000 0.4874000 -1.336000      0.8273000 
1 1 1 13 18 57 o 9.870000 0.7102000 10.49000 1.156000  9.247000 0.8254000 1.245000       1.420000  
1 1 1 13 18 59 o 3.901000 1.054000  3.312000 1.458000  4.490000 1.522000  -1.178000      2.107000  
1 1 1 13 18 61 o 4.058000 1.074000  4.031000 1.618000  4.085000 1.414000  -0.5473000E-01 2.149000  
1 1 1 13 19 0  o 71.36000 0.7067000 71.36000 0.7067000 71.36000 0.7067000 0.000000       0.000000  
1 1 1 13 19 2  o 26.30000 0.3959000 26.52000 0.5605000 26.08000 0.5592000 0.4337000      0.7917000 
1 1 1 13 19 4  o 43.78000 0.4375000 44.06000 0.6910000 43.50000 0.5369000 0.5588000      0.8750000 
1 1 1 13 19 6  o 121.9000 0.9661000 120.8000 1.352000  123.1000 1.380000  -2.294000      1.932000  
1 1 1 13 19 8  o 95.72000 1.082000  95.08000 1.869000  96.36000 1.091000  -1.279000      2.164000  
1 1 1 13 19 10 o 100.1000 0.9774000 100.0000 1.382000  100.1000 1.383000  -0.9540000E-01 1.955000  
1 1 1 13 19 12 o 54.55000 0.5190000 54.38000 0.6542000 54.72000 0.8058000 -0.3426000     1.038000  
1 1 1 13 19 14 o 47.36000 0.4733000 47.83000 0.7406000 46.90000 0.5894000 0.9285000      0.9465000 
1 1 1 13 19 16 o 13.20000 0.3484000 12.22000 0.2852000 14.18000 0.6359000 -1.961000      0.6969000 
1 1 1 13 19 18 o 70.81000 0.5962000 71.12000 0.6322000 70.49000 1.011000  0.6267000      1.192000  
1 1 1 13 19 20 o 11.13000 0.3574000 10.23000 0.3979000 12.02000 0.5938000 -1.796000      0.7148000 
1 1 1 13 19 22 o 66.59000 0.5168000 65.70000 0.6592000 67.49000 0.7961000 -1.790000      1.034000  
1 1 1 13 19 24 o 76.26000 0.5860000 75.15000 0.7509000 77.36000 0.8999000 -2.213000      1.172000  
1 1 1 13 19 26 o 17.60000 0.3311000 16.71000 0.4196000 18.49000 0.5124000 -1.785000      0.6622000 
1 1 1 13 19 28 f 22.26000 0.3238000 22.32000 0.4522000 22.21000 0.4634000 0.1076000      0.6475000 
1 1 1 13 19 30 o 23.43000 0.3151000 23.39000 0.4643000 23.47000 0.4260000 -0.7813000E-01 0.6301000 
1 1 1 13 19 32 o 29.88000 0.3533000 30.10000 0.4972000 29.65000 0.5020000 0.4516000      0.7066000 
1 1 1 13 19 34 f 47.53000 0.4592000 48.48000 0.7453000 46.59000 0.5365000 1.893000       0.9183000 
1 1 1 13 19 36 o 11.52000 0.6224000 11.56000 1.032000  11.47000 0.6962000 0.9638000E-01  1.245000  
1 1 1 13 19 38 o 19.92000 0.4459000 20.20000 0.7102000 19.64000 0.5394000 0.5641000      0.8918000 
1 1 1 13 19 40 o 25.44000 0.4190000 25.89000 0.7130000 24.98000 0.4405000 0.9031000      0.8381000 
1 1 1 13 19 42 o 31.25000 0.3392000 31.62000 0.5293000 30.89000 0.4242000 0.7318000      0.6783000 
1 1 1 13 19 44 o 14.20000 0.4416000 14.39000 0.7067000 14.00000 0.5297000 0.3932000      0.8832000 
1 1 1 13 19 46 o 16.73000 0.4587000 16.59000 0.7385000 16.88000 0.5443000 -0.2899000     0.9174000 
1 1 1 13 19 48 o 6.410000 0.8918000 7.234000 1.208000  5.587000 1.312000  1.648000       1.784000  
1 1 1 13 19 50 o 15.39000 0.4449000 15.85000 0.6709000 14.92000 0.5845000 0.9323000      0.8898000 
1 1 1 13 19 52 o 12.39000 0.5472000 12.01000 0.7408000 12.78000 0.8057000 -0.7657000     1.094000  
1 1 1 13 19 54 o 14.63000 0.4687000 14.14000 0.7322000 15.12000 0.5853000 -0.9812000     0.9374000 
1 1 1 13 19 56 o 4.271000 1.114000  4.600000 1.733000  3.942000 1.400000  0.6584000      2.228000  
1 1 1 13 19 58 o 3.859000 1.039000  3.808000 1.562000  3.909000 1.370000  -0.1010000     2.078000  
1 1 1 13 19 60 o 5.832000 0.9341000 5.446000 1.568000  6.219000 1.016000  -0.7729000     1.868000  
1 1 1 13 19 62 o 4.114000 0.9768000 3.393000 1.507000  4.835000 1.243000  -1.442000      1.954000  
1 1 1 13 20 1  o 40.78000 0.3679000 40.70000 0.5182000 40.86000 0.5224000 -0.1563000     0.7359000 
1 1 1 13 20 3  o 55.48000 0.4139000 55.23000 0.6573000 55.73000 0.5032000 -0.5050000     0.8278000 
1 1 1 13 20 5  o 53.17000 0.5015000 52.49000 0.7657000 53.86000 0.6478000 -1.377000      1.003000  
1 1 1 13 20 7  o 49.34000 0.6427000 48.54000 1.047000  50.15000 0.7455000 -1.613000      1.285000  
1 1 1 13 20 9  o 108.9000 0.9675000 109.6000 1.232000  108.3000 1.492000  1.304000       1.935000  
1 1 1 13 20 11 o 91.30000 0.8178000 92.20000 1.047000  90.40000 1.257000  1.808000       1.636000  
1 1 1 13 20 13 o 28.71000 0.4103000 28.64000 0.5864000 28.78000 0.5742000 -0.1428000     0.8207000 
1 1 1 13 20 15 o 22.77000 0.3235000 22.57000 0.4649000 22.96000 0.4498000 -0.3861000     0.6469000 
1 1 1 13 20 17 o 42.54000 0.3456000 42.09000 0.4032000 42.99000 0.5615000 -0.8961000     0.6913000 
1 1 1 13 20 19 o 28.81000 0.3004000 27.96000 0.3720000 29.67000 0.4719000 -1.709000      0.6009000 
1 1 1 13 20 21 o 39.88000 0.3481000 40.12000 0.4401000 39.64000 0.5395000 0.4811000      0.6962000 
1 1 1 13 20 23 o 45.65000 0.3675000 46.05000 0.4408000 45.25000 0.5882000 0.7993000      0.7351000 
1 1 1 13 20 25 o 42.13000 0.3921000 41.59000 0.5365000 42.67000 0.5721000 -1.080000      0.7843000 
1 1 1 13 20 27 o 49.90000 0.4405000 50.45000 0.6305000 49.36000 0.6153000 1.089000       0.8810000 
1 1 1 13 20 29 o 41.34000 0.3659000 41.53000 0.5497000 41.15000 0.4832000 0.3825000      0.7319000 
1 1 1 13 20 31 o 59.36000 0.5065000 59.59000 0.7103000 59.14000 0.7224000 0.4457000      1.013000  
1 1 1 13 20 33 o 58.42000 0.5418000 60.11000 0.8952000 56.73000 0.6105000 3.380000       1.084000  
1 1 1 13 20 35 o 6.180000 0.9564000 4.384000 1.686000  7.976000 0.9035000 -3.592000      1.913000  
1 1 1 13 20 37 o 34.52000 0.3453000 34.41000 0.5397000 34.63000 0.4308000 -0.2238000     0.6905000 
1 1 1 13 20 39 o 21.05000 0.4302000 20.63000 0.7042000 21.48000 0.4943000 -0.8490000     0.8604000 
1 1 1 13 20 41 f 21.15000 0.4256000 21.84000 0.7262000 20.47000 0.4441000 1.378000       0.8513000 
1 1 1 13 20 43 o 12.27000 0.5254000 11.86000 0.8227000 12.67000 0.6538000 -0.8077000     1.051000  
1 1 1 13 20 45 o 17.10000 0.4430000 17.59000 0.6991000 16.60000 0.5442000 0.9854000      0.8860000 
1 1 1 13 20 47 o 28.79000 0.4116000 29.20000 0.6733000 28.37000 0.4737000 0.8321000      0.8233000 
1 1 1 13 20 49 o 14.98000 0.4257000 14.87000 0.6701000 15.10000 0.5253000 -0.2244000     0.8514000 
1 1 1 13 20 51 o 16.74000 0.4024000 16.57000 0.6320000 16.90000 0.4982000 -0.3262000     0.8047000 
1 1 1 13 20 53 o 6.448000 0.9912000 7.847000 1.513000  5.050000 1.281000  2.796000       1.982000  
1 1 1 13 20 55 f 3.017000 0.8949000 2.568000 1.215000  3.467000 1.314000  -0.8983000     1.790000  
1 1 1 13 20 57 o 3.558000 1.057000  3.887000 1.655000  3.230000 1.315000  0.6573000      2.114000  
1 1 1 13 20 59 f 4.969000 1.048000  4.560000 1.607000  5.379000 1.346000  -0.8187000     2.096000  
1 1 1 13 20 61 o 4.197000 1.089000  4.644000 1.703000  3.750000 1.358000  0.8940000      2.178000  
1 1 1 13 21 0  o 56.54000 0.8092000 56.54000 0.8092000 56.54000 0.8092000 0.000000       0.000000  
1 1 1 13 21 2  o 33.62000 0.3497000 34.08000 0.5581000 33.15000 0.4216000 0.9326000      0.6994000 
1 1 1 13 21 4  o 82.63000 0.7420000 83.73000 1.164000  81.53000 0.9211000 2.200000       1.484000  
1 1 1 13 21 6  o 61.77000 0.7779000 61.27000 0.8777000 62.27000 1.285000  -1.000000      1.556000  
1 1 1 13 21 8  o 57.11000 0.5939000 56.64000 0.8414000 57.58000 0.8385000 -0.9441000     1.188000  
1 1 1 13 21 10 o 48.03000 0.4234000 48.11000 0.5980000 47.95000 0.5995000 0.1590000      0.8468000 
1 1 1 13 21 12 o 54.42000 0.4671000 54.05000 0.6555000 54.79000 0.6655000 -0.7416000     0.9341000 
1 1 1 13 21 14 o 52.79000 0.4556000 52.81000 0.6437000 52.78000 0.6450000 0.3255000E-01  0.9112000 
1 1 1 13 21 16 o 32.59000 0.3424000 32.80000 0.4856000 32.38000 0.4830000 0.4233000      0.6849000 
1 1 1 13 21 18 o 5.162000 0.8030000 4.800000 0.5901000 5.523000 1.494000  -0.7234000     1.606000  
1 1 1 13 21 20 o 10.64000 0.3585000 10.03000 0.3773000 11.25000 0.6097000 -1.219000      0.7170000 
1 1 1 13 21 22 f 20.39000 0.2838000 20.22000 0.3094000 20.57000 0.4758000 -0.3486000     0.5676000 
1 1 1 13 21 24 o 24.34000 0.2936000 23.58000 0.3427000 25.10000 0.4768000 -1.521000      0.5872000 
1 1 1 13 21 26 o 72.62000 0.5573000 72.73000 0.7294000 72.51000 0.8427000 0.2268000      1.115000  
1 1 1 13 21 28 o 42.27000 0.4267000 43.06000 0.7039000 41.48000 0.4826000 1.570000       0.8535000 
1 1 1 13 21 30 o 47.05000 0.3971000 47.90000 0.5994000 46.21000 0.5211000 1.689000       0.7943000 
1 1 1 13 21 32 o 36.62000 0.3530000 35.60000 0.5182000 37.64000 0.4797000 -2.034000      0.7061000 
1 1 1 13 21 34 o 63.68000 0.7102000 64.25000 1.289000  63.11000 0.5974000 1.139000       1.420000  
1 1 1 13 21 36 o 20.09000 0.3617000 20.00000 0.5761000 20.18000 0.4377000 -0.1791000     0.7235000 
1 1 1 13 21 38 o 37.11000 0.4170000 37.03000 0.6623000 37.19000 0.5069000 -0.1640000     0.8340000 
1 1 1 13 21 40 o 32.41000 0.3585000 33.26000 0.5334000 31.55000 0.4790000 1.709000       0.7169000 
1 1 1 13 21 42 o 11.01000 0.6732000 10.92000 1.051000  11.09000 0.8419000 -0.1643000     1.346000  
1 1 1 13 21 44 o 4.512000 1.044000  5.231000 1.631000  3.792000 1.304000  1.439000       2.088000  
1 1 1 13 21 46 o 16.65000 0.7174000 15.36000 1.330000  17.94000 0.5379000 -2.586000      1.435000  
1 1 1 13 21 48 o 3.598000 1.004000  3.705000 1.511000  3.492000 1.322000  0.2132000      2.008000  
1 1 1 13 21 50 o 5.173000 0.9437000 4.342000 1.563000  6.005000 1.058000  -1.663000      1.887000  
1 1 1 13 21 52 o 4.019000 1.025000  4.670000 1.562000  3.367000 1.327000  1.303000       2.050000  
1 1 1 13 21 54 o 4.990000 1.049000  5.907000 1.568000  4.073000 1.395000  1.834000       2.099000  
1 1 1 13 21 56 o 13.69000 0.5448000 14.13000 0.8450000 13.25000 0.6878000 0.8872000      1.090000  
1 1 1 13 21 58 o 4.397000 1.041000  4.738000 1.628000  4.055000 1.298000  0.6834000      2.082000  
1 1 1 13 21 60 o 5.816000 0.9685000 5.701000 1.652000  5.931000 1.011000  -0.2296000     1.937000  
1 1 1 13 22 1  o 35.05000 0.3168000 35.45000 0.4554000 34.65000 0.4406000 0.8043000      0.6336000 
1 1 1 13 22 3  f 17.36000 0.2744000 17.96000 0.4365000 16.77000 0.3328000 1.196000       0.5489000 
1 1 1 13 22 5  o 60.05000 0.6193000 59.98000 0.8834000 60.12000 0.8682000 -0.1327000     1.239000  
1 1 1 13 22 7  o 10.11000 0.5682000 10.64000 0.8892000 9.577000 0.7075000 1.066000       1.136000  
1 1 1 13 22 9  o 10.34000 0.4689000 9.898000 0.6951000 10.78000 0.6295000 -0.8808000     0.9378000 
1 1 1 13 22 11 o 27.73000 0.3218000 27.78000 0.4562000 27.68000 0.4541000 0.9872000E-01  0.6437000 
1 1 1 13 22 13 o 12.09000 0.4381000 12.01000 0.6259000 12.17000 0.6132000 -0.1608000     0.8762000 
1 1 1 13 22 15 o 64.04000 0.5345000 63.96000 0.7527000 64.11000 0.7592000 -0.1497000     1.069000  
1 1 1 13 22 17 o 24.48000 0.3754000 23.89000 0.4615000 25.06000 0.5922000 -1.169000      0.7508000 
1 1 1 13 22 19 o 3.972000 0.7348000 4.722000 0.6849000 3.223000 1.300000  1.499000       1.470000  
1 1 1 13 22 21 o 38.15000 0.3394000 37.78000 0.4197000 38.52000 0.5334000 -0.7328000     0.6787000 
1 1 1 13 22 23 o 42.84000 0.3539000 42.80000 0.4165000 42.87000 0.5723000 -0.7004000E-01 0.7078000 
1 1 1 13 22 25 o 31.33000 0.3707000 31.32000 0.4055000 31.33000 0.6206000 -0.4408000E-02 0.7413000 
1 1 1 13 22 27 o 19.03000 0.3001000 19.01000 0.4263000 19.06000 0.4226000 -0.4922000E-01 0.6002000 
1 1 1 13 22 29 o 39.27000 0.4094000 39.07000 0.6652000 39.48000 0.4775000 -0.4132000     0.8188000 
1 1 1 13 22 31 o 12.35000 0.4410000 12.78000 0.5940000 11.92000 0.6519000 0.8658000      0.8819000 
1 1 1 13 22 33 o 39.88000 0.4168000 40.45000 0.6706000 39.31000 0.4951000 1.145000       0.8336000 
1 1 1 13 22 35 o 15.79000 0.4509000 15.62000 0.7498000 15.95000 0.5010000 -0.3294000     0.9018000 
1 1 1 13 22 37 o 48.97000 0.4042000 50.12000 0.6364000 47.82000 0.4985000 2.307000       0.8083000 
1 1 1 13 22 39 o 23.11000 0.3713000 22.91000 0.5500000 23.31000 0.4991000 -0.4017000     0.7427000 
1 1 1 13 22 41 f 6.730000 1.025000  5.848000 1.812000  7.612000 0.9570000 -1.765000      2.049000  
1 1 1 13 22 43 o 4.552000 1.062000  4.529000 1.638000  4.574000 1.352000  -0.4438000E-01 2.124000  
1 1 1 13 22 45 o 6.050000 1.093000  6.241000 1.747000  5.860000 1.313000  0.3806000      2.185000  
1 1 1 13 22 47 o 9.111000 0.6151000 8.786000 0.9630000 9.435000 0.7657000 -0.6486000     1.230000  
1 1 1 13 22 49 o 7.816000 0.7737000 7.363000 1.308000  8.269000 0.8267000 -0.9057000     1.547000  
1 1 1 13 22 51 o 7.229000 0.8073000 6.900000 1.285000  7.557000 0.9775000 -0.6571000     1.615000  
1 1 1 13 22 53 o 8.299000 0.7419000 8.764000 1.038000  7.833000 1.061000  0.9307000      1.484000  
1 1 1 13 22 55 o 6.101000 1.084000  6.917000 1.695000  5.284000 1.352000  1.632000       2.168000  
1 1 1 13 22 57 o 4.787000 1.157000  5.218000 1.643000  4.356000 1.631000  0.8619000      2.315000  
1 1 1 13 22 59 f 5.549000 0.9993000 5.312000 1.644000  5.786000 1.137000  -0.4739000     1.999000  
1 1 1 13 22 61 o 4.630000 1.091000  5.364000 1.716000  3.895000 1.349000  1.469000       2.183000  
1 1 1 13 23 0  o 10.27000 0.4320000 10.27000 0.4320000 10.27000 0.4320000 0.000000       0.000000  
1 1 1 13 23 2  o 59.06000 0.4230000 59.07000 0.5997000 59.06000 0.5967000 0.1125000E-01  0.8460000 
1 1 1 13 23 4  o 72.29000 0.5256000 72.23000 0.8330000 72.36000 0.6413000 -0.1313000     1.051000  
1 1 1 13 23 6  o 34.07000 0.3921000 33.82000 0.6138000 34.31000 0.4882000 -0.4954000     0.7843000 
1 1 1 13 23 8  o 63.35000 0.5275000 63.42000 0.7449000 63.29000 0.7471000 0.1354000      1.055000  
1 1 1 13 23 10 o 9.851000 0.4952000 9.630000 0.7304000 10.07000 0.6690000 -0.4413000     0.9905000 
1 1 1 13 23 12 o 55.22000 0.4734000 54.49000 0.6589000 55.95000 0.6799000 -1.456000      0.9468000 
1 1 1 13 23 14 o 36.04000 0.3588000 36.07000 0.5037000 36.02000 0.5110000 0.4375000E-01  0.7175000 
1 1 1 13 23 16 o 36.61000 0.3634000 36.70000 0.5107000 36.52000 0.5170000 0.1892000      0.7267000 
1 1 1 13 23 18 o 27.79000 0.3300000 27.11000 0.4528000 28.47000 0.4802000 -1.357000      0.6600000 
1 1 1 13 23 20 o 41.58000 0.3840000 41.15000 0.5265000 42.02000 0.5592000 -0.8661000     0.7681000 
1 1 1 13 23 22 o 24.17000 0.2850000 23.74000 0.3079000 24.60000 0.4798000 -0.8596000     0.5701000 
1 1 1 13 23 24 o 23.08000 0.3148000 23.73000 0.3801000 22.42000 0.5019000 1.311000       0.6296000 
1 1 1 13 23 26 o 60.36000 0.4814000 60.98000 0.6281000 59.75000 0.7297000 1.229000       0.9627000 
1 1 1 13 23 28 o 9.901000 0.5503000 9.076000 0.8654000 10.73000 0.6800000 -1.651000      1.101000  
1 1 1 13 23 30 o 44.33000 0.3874000 44.05000 0.5006000 44.62000 0.5915000 -0.5630000     0.7749000 
1 1 1 13 23 32 o 18.50000 0.3660000 18.54000 0.5508000 18.46000 0.4821000 0.7799000E-01  0.7320000 
1 1 1 13 23 34 o 29.76000 0.3297000 29.87000 0.5126000 29.65000 0.4147000 0.2195000      0.6593000 
1 1 1 13 23 36 o 24.39000 0.3368000 24.86000 0.5210000 23.92000 0.4270000 0.9331000      0.6736000 
1 1 1 13 23 38 o 37.34000 0.3519000 37.15000 0.5436000 37.54000 0.4470000 -0.3896000     0.7038000 
1 1 1 13 23 40 f 20.74000 0.3683000 21.08000 0.5614000 20.41000 0.4767000 0.6653000      0.7365000 
1 1 1 13 23 42 o 6.099000 1.064000  7.284000 1.633000  4.914000 1.363000  2.369000       2.127000  
1 1 1 13 23 44 o 8.500000 0.7231000 9.152000 1.164000  7.849000 0.8589000 1.303000       1.446000  
1 1 1 13 23 46 o 6.999000 0.7993000 7.160000 1.344000  6.838000 0.8656000 0.3215000      1.599000  
1 1 1 13 23 48 o 11.88000 0.6194000 11.43000 1.052000  12.33000 0.6543000 -0.8985000     1.239000  
1 1 1 13 23 50 o 5.982000 1.026000  5.972000 1.721000  5.992000 1.119000  -0.1988000E-01 2.053000  
1 1 1 13 23 52 o 8.655000 0.7060000 8.345000 1.144000  8.965000 0.8278000 -0.6194000     1.412000  
1 1 1 13 23 54 o 4.319000 0.9879000 3.322000 1.543000  5.316000 1.235000  -1.993000      1.976000  
1 1 1 13 23 56 o 6.283000 0.9636000 6.208000 1.573000  6.359000 1.114000  -0.1511000     1.927000  
1 1 1 13 23 58 o 4.937000 1.018000  6.583000 1.566000  3.290000 1.301000  3.293000       2.036000  
1 1 1 13 23 60 o 4.133000 1.033000  4.201000 1.617000  4.065000 1.285000  0.1364000      2.065000  
1 1 1 13 24 1  o 67.43000 0.5144000 68.20000 0.7829000 66.66000 0.6675000 1.536000       1.029000  
1 1 1 13 24 3  o 55.91000 0.4384000 55.76000 0.6657000 56.05000 0.5708000 -0.2921000     0.8769000 
1 1 1 13 24 5  o 23.62000 0.3654000 24.10000 0.4290000 23.15000 0.5916000 0.9494000      0.7308000 
1 1 1 13 24 7  o 24.43000 0.3957000 24.06000 0.6536000 24.79000 0.4462000 -0.7316000     0.7914000 
1 1 1 13 24 9  o 22.29000 0.3237000 22.59000 0.4542000 22.00000 0.4615000 0.5868000      0.6475000 
1 1 1 13 24 11 o 53.31000 0.4604000 53.57000 0.6514000 53.05000 0.6508000 0.5251000      0.9208000 
1 1 1 13 24 13 o 8.347000 0.5963000 8.387000 0.8426000 8.306000 0.8440000 0.8090000E-01  1.193000  
1 1 1 13 24 15 o 11.61000 0.4327000 11.55000 0.5968000 11.66000 0.6268000 -0.1032000     0.8654000 
1 1 1 13 24 17 o 62.05000 0.5876000 61.40000 0.7311000 62.69000 0.9200000 -1.297000      1.175000  
1 1 1 13 24 19 o 46.12000 0.3692000 45.90000 0.4341000 46.35000 0.5973000 -0.4478000     0.7383000 
1 1 1 13 24 21 o 34.28000 0.3284000 33.58000 0.4060000 34.99000 0.5162000 -1.411000      0.6567000 
1 1 1 13 24 23 o 66.72000 0.4787000 65.90000 0.6681000 67.54000 0.6859000 -1.637000      0.9575000 
1 1 1 13 24 25 o 18.47000 0.3383000 18.50000 0.5349000 18.44000 0.4143000 0.5974000E-01  0.6766000 
1 1 1 13 24 27 o 29.05000 0.3414000 28.75000 0.5343000 29.36000 0.4252000 -0.6109000     0.6828000 
1 1 1 13 24 29 f 16.87000 0.3737000 17.06000 0.5734000 16.68000 0.4794000 0.3814000      0.7474000 
1 1 1 13 24 31 o 3.621000 0.9954000 3.113000 1.309000  4.129000 1.500000  -1.015000      1.991000  
1 1 1 13 24 33 o 41.03000 0.4061000 41.53000 0.6767000 40.54000 0.4491000 0.9955000      0.8121000 
1 1 1 13 24 35 o 19.10000 0.3638000 19.23000 0.5595000 18.97000 0.4651000 0.2613000      0.7275000 
1 1 1 13 24 37 o 21.25000 0.3467000 20.69000 0.5368000 21.81000 0.4389000 -1.118000      0.6934000 
1 1 1 13 24 39 f 23.32000 0.3866000 24.06000 0.5280000 22.57000 0.5648000 1.490000       0.7732000 
1 1 1 13 24 41 o 12.93000 0.5870000 12.00000 1.009000  13.86000 0.5998000 -1.860000      1.174000  
1 1 1 13 24 43 o 4.947000 1.019000  4.556000 1.699000  5.337000 1.127000  -0.7811000     2.039000  
1 1 1 13 24 45 o 9.512000 0.5872000 9.139000 0.9787000 9.885000 0.6492000 -0.7466000     1.174000  
1 1 1 13 24 47 o 12.73000 0.4262000 12.96000 0.6580000 12.51000 0.5419000 0.4461000      0.8524000 
1 1 1 13 24 49 o 10.78000 0.5390000 11.05000 0.8631000 10.51000 0.6458000 0.5384000      1.078000  
1 1 1 13 24 51 o 3.000000 0.9228000 3.744000 1.497000  2.257000 1.080000  1.487000       1.846000  
1 1 1 13 24 53 o 8.288000 0.8194000 8.816000 1.345000  7.761000 0.9363000 1.056000       1.639000  
1 1 1 13 24 55 o 5.423000 0.9952000 6.450000 1.439000  4.397000 1.376000  2.053000       1.990000  
1 1 1 13 24 57 o 7.266000 0.7836000 8.333000 1.206000  6.199000 1.000000  2.134000       1.567000  
1 1 1 13 24 59 o 7.096000 0.9425000 6.929000 1.643000  7.262000 0.9247000 -0.3327000     1.885000  
1 1 1 13 25 0  o 15.65000 0.7046000 15.65000 0.7046000 15.65000 0.7046000 0.000000       0.000000  
1 1 1 13 25 2  o 21.26000 0.3518000 21.12000 0.5849000 21.41000 0.3911000 -0.2886000     0.7037000 
1 1 1 13 25 4  o 46.75000 0.3827000 46.19000 0.5836000 47.30000 0.4951000 -1.110000      0.7653000 
1 1 1 13 25 6  o 33.46000 0.4222000 32.70000 0.5662000 34.22000 0.6265000 -1.516000      0.8445000 
1 1 1 13 25 8  o 6.114000 0.7998000 6.252000 1.098000  5.977000 1.163000  0.2745000      1.600000  
1 1 1 13 25 10 o 38.16000 0.3710000 38.35000 0.5235000 37.97000 0.5258000 0.3844000      0.7420000 
1 1 1 13 25 12 f 20.96000 0.3298000 20.76000 0.4580000 21.16000 0.4748000 -0.3952000     0.6597000 
1 1 1 13 25 14 o 7.322000 0.6749000 7.683000 0.8774000 6.962000 1.026000  0.7207000      1.350000  
1 1 1 13 25 16 o 13.98000 0.4437000 14.67000 0.5339000 13.29000 0.7088000 1.378000       0.8874000 
1 1 1 13 25 18 o 34.76000 0.3585000 34.60000 0.5024000 34.92000 0.5116000 -0.3236000     0.7170000 
1 1 1 13 25 20 o 22.27000 0.4586000 21.02000 0.3290000 23.51000 0.8562000 -2.488000      0.9173000 
1 1 1 13 25 22 o 21.91000 0.3078000 21.80000 0.4854000 22.03000 0.3788000 -0.2293000     0.6157000 
1 1 1 13 25 24 o 40.73000 0.3779000 40.79000 0.5309000 40.68000 0.5380000 0.1087000      0.7558000 
1 1 1 13 25 26 o 27.82000 0.3623000 28.21000 0.5256000 27.44000 0.4987000 0.7738000      0.7245000 
1 1 1 13 25 28 o 11.61000 0.3993000 11.41000 0.5745000 11.81000 0.5546000 -0.4068000     0.7986000 
1 1 1 13 25 30 o 29.40000 0.3962000 30.02000 0.5209000 28.78000 0.5971000 1.235000       0.7924000 
1 1 1 13 25 32 o 18.36000 0.3976000 18.81000 0.6114000 17.91000 0.5086000 0.9030000      0.7953000 
1 1 1 13 25 34 o 19.33000 0.3480000 20.10000 0.5295000 18.57000 0.4517000 1.537000       0.6960000 
1 1 1 13 25 36 o 20.86000 0.3856000 21.14000 0.6325000 20.59000 0.4413000 0.5499000      0.7713000 
1 1 1 13 25 38 o 26.87000 0.3466000 27.26000 0.5207000 26.48000 0.4577000 0.7793000      0.6932000 
1 1 1 13 25 40 o 37.33000 0.3693000 37.19000 0.5466000 37.47000 0.4969000 -0.2775000     0.7387000 
1 1 1 13 25 42 o 31.43000 0.4095000 31.55000 0.6807000 31.30000 0.4555000 0.2501000      0.8191000 
1 1 1 13 25 44 o 12.70000 0.5478000 12.93000 0.9542000 12.47000 0.5385000 0.4658000      1.096000  
1 1 1 13 25 46 o 11.08000 0.5327000 10.95000 0.8462000 11.22000 0.6474000 -0.2676000     1.065000  
1 1 1 13 25 48 o 12.94000 0.4605000 12.64000 0.7504000 13.23000 0.5339000 -0.5809000     0.9210000 
1 1 1 13 25 50 o 4.385000 1.020000  4.026000 1.556000  4.743000 1.321000  -0.7171000     2.041000  
1 1 1 13 25 52 o 10.54000 0.6123000 9.633000 1.000000  11.44000 0.7068000 -1.809000      1.225000  
1 1 1 13 25 54 o 6.346000 1.250000  5.831000 2.264000  6.862000 1.060000  -1.032000      2.500000  
1 1 1 13 25 56 o 6.770000 1.049000  6.689000 1.804000  6.850000 1.072000  -0.1617000     2.098000  
1 1 1 13 25 58 o 4.834000 1.011000  3.985000 1.609000  5.682000 1.223000  -1.697000      2.021000  
1 1 1 13 26 1  f 29.70000 0.2616000 29.36000 0.3711000 30.03000 0.3688000 -0.6751000     0.5232000 
1 1 1 13 26 3  o 14.52000 0.2512000 14.59000 0.3858000 14.45000 0.3218000 0.1387000      0.5024000 
1 1 1 13 26 5  o 8.658000 0.3780000 9.234000 0.6500000 8.082000 0.3862000 1.152000       0.7561000 
1 1 1 13 26 7  o 47.41000 0.4502000 48.07000 0.5140000 46.75000 0.7393000 1.322000       0.9005000 
1 1 1 13 26 9  o 21.06000 0.3299000 20.51000 0.4562000 21.62000 0.4766000 -1.105000      0.6597000 
1 1 1 13 26 11 o 43.97000 0.4019000 43.45000 0.5585000 44.49000 0.5781000 -1.039000      0.8038000 
1 1 1 13 26 13 o 14.05000 0.3948000 13.90000 0.5666000 14.21000 0.5499000 -0.3027000     0.7896000 
1 1 1 13 26 15 o 23.67000 0.3286000 23.36000 0.4532000 23.97000 0.4758000 -0.6158000     0.6571000 
1 1 1 13 26 17 o 35.43000 0.3627000 35.97000 0.5124000 34.89000 0.5136000 1.077000       0.7255000 
1 1 1 13 26 19 o 37.29000 0.4639000 36.88000 0.6618000 37.70000 0.6503000 -0.8137000     0.9279000 
1 1 1 13 26 21 o 24.94000 0.3880000 25.28000 0.4812000 24.61000 0.6088000 0.6758000      0.7761000 
1 1 1 13 26 23 o 32.76000 0.3148000 32.45000 0.4633000 33.07000 0.4265000 -0.6167000     0.6297000 
1 1 1 13 26 25 o 27.61000 0.4492000 26.89000 0.8008000 28.32000 0.4070000 -1.435000      0.8983000 
1 1 1 13 26 27 o 23.58000 0.3262000 23.74000 0.4014000 23.43000 0.5143000 0.3108000      0.6524000 
1 1 1 13 26 29 o 11.46000 0.4538000 11.12000 0.6003000 11.79000 0.6807000 -0.6612000     0.9076000 
1 1 1 13 26 31 o 35.48000 0.3272000 35.21000 0.4523000 35.75000 0.4729000 -0.5391000     0.6544000 
1 1 1 13 26 33 o 16.00000 0.3847000 15.33000 0.6119000 16.66000 0.4664000 -1.329000      0.7694000 
1 1 1 13 26 35 o 9.310000 0.5994000 8.362000 1.014000  10.26000 0.6401000 -1.898000      1.199000  
1 1 1 13 26 37 o 18.87000 0.4717000 18.33000 0.7302000 19.41000 0.5975000 -1.082000      0.9435000 
1 1 1 13 26 39 o 40.28000 0.3590000 40.33000 0.5585000 40.23000 0.4513000 0.9279000E-01  0.7180000 
1 1 1 13 26 41 o 22.62000 0.3706000 22.12000 0.5202000 23.12000 0.5280000 -0.9979000     0.7412000 
1 1 1 13 26 43 o 8.443000 0.8891000 8.797000 1.613000  8.088000 0.7488000 0.7084000      1.778000  
1 1 1 13 26 45 o 7.622000 0.6871000 7.713000 1.094000  7.530000 0.8312000 0.1834000      1.374000  
1 1 1 13 26 47 o 14.12000 0.4098000 14.24000 0.6552000 14.00000 0.4923000 0.2443000      0.8196000 
1 1 1 13 26 49 o 4.174000 1.026000  4.632000 1.580000  3.717000 1.310000  0.9144000      2.052000  
1 1 1 13 26 51 o 6.473000 0.8408000 7.303000 1.243000  5.642000 1.133000  1.661000       1.682000  
1 1 1 13 26 53 o 5.958000 1.010000  6.361000 1.502000  5.555000 1.349000  0.8062000      2.019000  
1 1 1 13 26 55 o 9.078000 0.9720000 10.06000 1.768000  8.100000 0.8082000 1.955000       1.944000  
1 1 1 13 26 57 o 8.335000 0.7267000 9.103000 1.059000  7.566000 0.9952000 1.537000       1.453000  
1 1 1 13 26 59 o 4.950000 1.168000  4.789000 1.887000  5.111000 1.378000  -0.3224000     2.336000  
1 1 1 13 27 0  o 4.156000 1.009000  4.156000 1.009000  4.156000 1.009000  0.000000       0.000000  
1 1 1 13 27 2  o 48.49000 0.3911000 48.27000 0.5939000 48.72000 0.5090000 -0.4468000     0.7822000 
1 1 1 13 27 4  o 47.02000 0.3528000 46.98000 0.5023000 47.06000 0.4954000 -0.8702000E-01 0.7055000 
1 1 1 13 27 6  o 51.20000 0.3771000 51.97000 0.5447000 50.42000 0.5217000 1.551000       0.7542000 
1 1 1 13 27 8  o 96.59000 0.8262000 96.21000 0.9432000 96.96000 1.357000  -0.7561000     1.652000  
1 1 1 13 27 10 o 71.50000 0.6306000 71.11000 0.7154000 71.90000 1.039000  -0.7927000     1.261000  
1 1 1 13 27 12 o 45.11000 0.4120000 44.92000 0.5768000 45.29000 0.5885000 -0.3693000     0.8240000 
1 1 1 13 27 14 o 33.46000 0.3537000 33.20000 0.4914000 33.73000 0.5089000 -0.5338000     0.7074000 
1 1 1 13 27 16 o 25.77000 0.3343000 26.18000 0.4672000 25.35000 0.4783000 0.8262000      0.6686000 
1 1 1 13 27 18 o 17.14000 0.4052000 17.77000 0.4915000 16.51000 0.6442000 1.256000       0.8103000 
1 1 1 13 27 20 o 24.24000 0.3856000 24.09000 0.5999000 24.38000 0.4847000 -0.2829000     0.7713000 
1 1 1 13 27 22 o 19.92000 0.2622000 19.26000 0.3655000 20.58000 0.3762000 -1.315000      0.5245000 
1 1 1 13 27 24 o 19.50000 0.4661000 20.14000 0.8413000 18.86000 0.4017000 1.277000       0.9323000 
1 1 1 13 27 26 o 15.94000 0.3240000 15.74000 0.4694000 16.14000 0.4468000 -0.3983000     0.6481000 
1 1 1 13 27 28 o 43.67000 0.3866000 43.82000 0.5840000 43.51000 0.5068000 0.3111000      0.7733000 
1 1 1 13 27 30 o 22.13000 0.3717000 21.86000 0.5400000 22.40000 0.5110000 -0.5365000     0.7435000 
1 1 1 13 27 32 o 59.89000 0.4826000 59.59000 0.7202000 60.19000 0.6425000 -0.6043000     0.9651000 
1 1 1 13 27 34 o 11.24000 0.5198000 10.44000 0.8566000 12.05000 0.5890000 -1.615000      1.040000  
1 1 1 13 27 36 o 13.81000 0.4803000 12.99000 0.6795000 14.63000 0.6791000 -1.638000      0.9607000 
1 1 1 13 27 38 f 26.23000 0.3280000 27.02000 0.5144000 25.45000 0.4070000 1.565000       0.6559000 
1 1 1 13 27 40 o 15.90000 0.4327000 15.58000 0.6008000 16.21000 0.6228000 -0.6335000     0.8654000 
1 1 1 13 27 42 o 23.31000 0.3728000 24.07000 0.6176000 22.56000 0.4177000 1.506000       0.7456000 
1 1 1 13 27 44 o 7.649000 0.7234000 7.050000 1.247000  8.248000 0.7343000 -1.199000      1.447000  
1 1 1 13 27 46 o 2.682000 0.8541000 2.784000 1.282000  2.581000 1.129000  0.2035000      1.708000  
1 1 1 13 27 48 o 4.756000 0.9602000 4.737000 1.515000  4.775000 1.180000  -0.3829000E-01 1.920000  
1 1 1 13 27 50 o 3.872000 0.9985000 3.618000 1.477000  4.125000 1.345000  -0.5072000     1.997000  
1 1 1 13 27 52 o 3.049000 0.9357000 3.610000 1.452000  2.489000 1.180000  1.121000       1.871000  
1 1 1 13 27 54 o 10.21000 0.6325000 10.05000 1.063000  10.38000 0.6861000 -0.3309000     1.265000  
1 1 1 13 27 56 o 7.869000 0.7377000 7.749000 1.209000  7.990000 0.8459000 -0.2402000     1.475000  
1 1 1 13 27 58 o 4.179000 0.9809000 6.025000 1.637000  2.333000 1.081000  3.692000       1.962000  
1 1 1 13 28 1  o 36.23000 0.3189000 36.28000 0.4869000 36.19000 0.4121000 0.8511000E-01  0.6378000 
1 1 1 13 28 3  o 47.79000 0.3578000 47.16000 0.5042000 48.41000 0.5077000 -1.259000      0.7156000 
1 1 1 13 28 5  o 73.42000 0.5608000 73.49000 0.8528000 73.34000 0.7286000 0.1535000      1.122000  
1 1 1 13 28 7  o 55.18000 0.5085000 54.29000 0.5675000 56.08000 0.8440000 -1.797000      1.017000  
1 1 1 13 28 9  o 45.90000 0.4445000 46.17000 0.5038000 45.64000 0.7325000 0.5294000      0.8890000 
1 1 1 13 28 11 o 22.31000 0.3600000 22.14000 0.3881000 22.48000 0.6064000 -0.3401000     0.7199000 
1 1 1 13 28 13 o 9.382000 0.6136000 9.774000 0.7129000 8.989000 0.9989000 0.7851000      1.227000  
1 1 1 13 28 15 o 25.21000 0.3846000 25.15000 0.4612000 25.26000 0.6156000 -0.1104000     0.7692000 
1 1 1 13 28 17 o 20.63000 0.5051000 20.58000 0.5643000 20.68000 0.8379000 -0.9953000E-01 1.010000  
1 1 1 13 28 19 o 24.65000 0.3981000 24.56000 0.6229000 24.74000 0.4960000 -0.1822000     0.7963000 
1 1 1 13 28 21 o 4.378000 0.7197000 3.623000 1.093000  5.132000 0.9366000 -1.509000      1.439000  
1 1 1 13 28 23 f 38.11000 0.3398000 38.00000 0.5081000 38.22000 0.4512000 -0.2186000     0.6796000 
1 1 1 13 28 25 o 24.86000 0.2830000 24.83000 0.3966000 24.89000 0.4038000 -0.5676000E-01 0.5660000 
1 1 1 13 28 27 o 30.18000 0.3840000 30.21000 0.4252000 30.16000 0.6394000 0.5291000E-01  0.7679000 
1 1 1 13 28 29 o 6.298000 0.7755000 6.130000 1.045000  6.466000 1.146000  -0.3355000     1.551000  
1 1 1 13 28 31 o 9.701000 0.5510000 9.408000 0.7563000 9.993000 0.8015000 -0.5844000     1.102000  
1 1 1 13 28 33 o 14.71000 0.4873000 15.18000 0.8414000 14.23000 0.4919000 0.9476000      0.9747000 
1 1 1 13 28 35 o 24.55000 0.3366000 25.20000 0.4926000 23.91000 0.4589000 1.287000       0.6733000 
1 1 1 13 28 37 o 22.46000 0.3255000 22.40000 0.5026000 22.51000 0.4138000 -0.1097000     0.6510000 
1 1 1 13 28 39 o 18.73000 0.3586000 18.79000 0.5323000 18.68000 0.4806000 0.1150000      0.7172000 
1 1 1 13 28 41 o 11.37000 0.4551000 11.17000 0.7043000 11.57000 0.5766000 -0.4040000     0.9102000 
1 1 1 13 28 43 o 11.01000 0.8983000 9.958000 1.714000  12.06000 0.5380000 -2.104000      1.797000  
1 1 1 13 28 45 o 9.980000 0.5633000 9.978000 0.8584000 9.982000 0.7295000 -0.3633000E-02 1.127000  
1 1 1 13 28 47 o 8.732000 0.6027000 9.304000 0.9406000 8.160000 0.7538000 1.143000       1.205000  
1 1 1 13 28 49 o 3.713000 1.006000  4.403000 1.565000  3.024000 1.263000  1.379000       2.012000  
1 1 1 13 28 51 o 6.343000 0.9626000 6.589000 1.405000  6.096000 1.316000  0.4923000      1.925000  
1 1 1 13 28 53 o 6.945000 0.9882000 6.837000 1.634000  7.054000 1.111000  -0.2168000     1.976000  
1 1 1 13 28 55 o 4.913000 1.077000  4.135000 1.854000  5.692000 1.097000  -1.556000      2.154000  
1 1 1 13 28 57 f 3.127000 0.9460000 3.108000 1.399000  3.147000 1.274000  -0.3903000E-01 1.892000  
1 1 1 13 29 0  o 8.364000 0.6851000 8.364000 0.6851000 8.364000 0.6851000 0.000000       0.000000  
1 1 1 13 29 2  o 31.13000 0.2702000 31.07000 0.3878000 31.20000 0.3763000 -0.1327000     0.5404000 
1 1 1 13 29 4  o 70.37000 0.5415000 71.47000 0.8332000 69.26000 0.6917000 2.210000       1.083000  
1 1 1 13 29 6  o 29.40000 0.2639000 28.92000 0.3843000 29.88000 0.3619000 -0.9620000     0.5279000 
1 1 1 13 29 8  o 13.22000 0.4573000 12.39000 0.5080000 14.05000 0.7606000 -1.662000      0.9146000 
1 1 1 13 29 10 o 11.49000 0.4916000 11.27000 0.5103000 11.71000 0.8404000 -0.4421000     0.9831000 
1 1 1 13 29 12 o 9.838000 0.5927000 9.964000 0.5764000 9.712000 1.036000  0.2515000      1.185000  
1 1 1 13 29 14 o 52.01000 0.6459000 52.01000 0.6459000 ?        ?         ?              ?         
1 1 1 13 29 16 o 44.00000 0.4597000 43.59000 0.7023000 44.41000 0.5935000 -0.8192000     0.9195000 
1 1 1 13 29 18 o 26.64000 0.3960000 26.80000 0.6169000 26.48000 0.4966000 0.3226000      0.7919000 
1 1 1 13 29 20 o 24.57000 0.3786000 24.60000 0.5701000 24.55000 0.4984000 0.4831000E-01  0.7573000 
1 1 1 13 29 22 o 6.316000 0.5912000 5.543000 0.9593000 7.089000 0.6913000 -1.545000      1.182000  
1 1 1 13 29 24 o 9.510000 0.4133000 9.276000 0.5666000 9.743000 0.6019000 -0.4665000     0.8267000 
1 1 1 13 29 26 o 33.45000 0.3091000 33.19000 0.4311000 33.72000 0.4432000 -0.5260000     0.6183000 
1 1 1 13 29 28 o 37.36000 0.3929000 37.65000 0.4634000 37.08000 0.6346000 0.5653000      0.7858000 
1 1 1 13 29 30 o 23.27000 0.3063000 22.76000 0.4263000 23.78000 0.4401000 -1.017000      0.6127000 
1 1 1 13 29 32 o 39.91000 0.3819000 39.52000 0.4836000 40.30000 0.5911000 -0.7769000     0.7638000 
1 1 1 13 29 34 o 4.421000 0.9818000 3.965000 1.428000  4.878000 1.348000  -0.9126000     1.964000  
1 1 1 13 29 36 o 4.303000 0.9740000 4.307000 1.457000  4.298000 1.293000  0.9160000E-02  1.948000  
1 1 1 13 29 38 o 21.80000 0.3922000 21.91000 0.6397000 21.69000 0.4540000 0.2191000      0.7844000 
1 1 1 13 29 40 o 12.67000 0.4725000 12.08000 0.7217000 13.26000 0.6102000 -1.172000      0.9451000 
1 1 1 13 29 42 o 15.30000 0.4628000 14.90000 0.8100000 15.69000 0.4478000 -0.7840000     0.9255000 
1 1 1 13 29 44 o 11.97000 0.5656000 12.17000 0.9244000 11.77000 0.6521000 0.4059000      1.131000  
1 1 1 13 29 46 o 8.043000 0.7595000 6.799000 1.359000  9.286000 0.6783000 -2.488000      1.519000  
1 1 1 13 29 48 o 2.972000 0.9044000 2.767000 1.263000  3.177000 1.295000  -0.4104000     1.809000  
1 1 1 13 29 50 o 6.658000 0.8728000 6.690000 1.391000  6.626000 1.054000  0.6394000E-01  1.746000  
1 1 1 13 29 52 o 2.894000 0.9055000 3.320000 1.421000  2.469000 1.123000  0.8511000      1.811000  
1 1 1 13 29 54 o 3.649000 1.031000  3.956000 1.612000  3.341000 1.284000  0.6158000      2.061000  
1 1 1 13 29 56 o 3.930000 1.020000  4.017000 1.606000  3.843000 1.259000  0.1739000      2.041000  
1 1 1 13 30 1  o 9.305000 0.3334000 10.16000 0.4439000 8.453000 0.4975000 1.704000       0.6668000 
1 1 1 13 30 3  o 13.18000 0.3191000 12.62000 0.5331000 13.73000 0.3509000 -1.110000      0.6383000 
1 1 1 13 30 5  o 18.31000 0.2458000 18.39000 0.3775000 18.23000 0.3149000 0.1625000      0.4916000 
1 1 1 13 30 7  o 30.89000 0.3015000 30.50000 0.4014000 31.29000 0.4499000 -0.7916000     0.6030000 
1 1 1 13 30 9  o 14.96000 0.4389000 15.55000 0.4232000 14.37000 0.7689000 1.182000       0.8777000 
1 1 1 13 30 11 o 32.64000 0.4850000 33.33000 0.4207000 31.94000 0.8740000 1.393000       0.9700000 
1 1 1 13 30 13 o 29.34000 0.4950000 28.69000 0.4654000 30.00000 0.8738000 -1.311000      0.9900000 
1 1 1 13 30 15 o 8.017000 0.7347000 8.227000 0.6932000 7.807000 1.296000  0.4200000      1.469000  
1 1 1 13 30 17 o 9.885000 0.6036000 10.20000 0.7275000 9.572000 0.9634000 0.6242000      1.207000  
1 1 1 13 30 19 o 32.33000 0.4900000 32.38000 0.8377000 32.29000 0.5086000 0.8812000E-01  0.9800000 
1 1 1 13 30 21 o 11.17000 0.5012000 11.74000 0.8798000 10.60000 0.4803000 1.141000       1.002000  
1 1 1 13 30 23 o 47.70000 0.3693000 47.88000 0.5201000 47.51000 0.5245000 0.3758000      0.7386000 
1 1 1 13 30 25 o 14.61000 0.3333000 14.59000 0.4584000 14.63000 0.4840000 -0.3620000E-01 0.6666000 
1 1 1 13 30 27 o 17.59000 0.5541000 17.46000 0.4448000 17.71000 1.015000  -0.2490000     1.108000  
1 1 1 13 30 29 o 9.701000 0.5838000 10.27000 0.9114000 9.133000 0.7298000 1.134000       1.168000  
1 1 1 13 30 31 o 23.83000 0.3379000 23.27000 0.5156000 24.40000 0.4369000 -1.126000      0.6758000 
1 1 1 13 30 33 o 9.948000 0.5303000 9.614000 0.8116000 10.28000 0.6828000 -0.6693000     1.061000  
1 1 1 13 30 35 o 25.13000 0.3115000 25.37000 0.4808000 24.90000 0.3962000 0.4736000      0.6230000 
1 1 1 13 30 37 o 4.198000 0.9476000 5.002000 1.393000  3.394000 1.285000  1.607000       1.895000  
1 1 1 13 30 39 o 12.50000 0.4051000 12.65000 0.6338000 12.35000 0.5048000 0.2944000      0.8102000 
1 1 1 13 30 41 o 17.05000 0.4257000 16.41000 0.6937000 17.69000 0.4938000 -1.276000      0.8515000 
1 1 1 13 30 43 o 4.184000 0.9659000 5.024000 1.467000  3.344000 1.257000  1.680000       1.932000  
1 1 1 13 30 45 o 3.453000 0.9640000 3.860000 1.486000  3.045000 1.228000  0.8152000      1.928000  
1 1 1 13 30 47 o 5.538000 0.9638000 4.586000 1.564000  6.491000 1.127000  -1.905000      1.928000  
1 1 1 13 30 49 o 4.395000 0.9875000 4.071000 1.529000  4.719000 1.250000  -0.6481000     1.975000  
1 1 1 13 30 51 o 10.66000 0.5535000 10.86000 0.8963000 10.45000 0.6495000 0.4152000      1.107000  
1 1 1 13 30 53 o 7.794000 0.7749000 7.852000 1.136000  7.735000 1.054000  0.1168000      1.550000  
1 1 1 13 30 55 o 3.998000 1.017000  3.647000 1.509000  4.349000 1.364000  -0.7012000     2.034000  
1 1 1 13 30 57 o 3.478000 1.001000  3.233000 1.463000  3.722000 1.365000  -0.4893000     2.001000  
1 1 1 13 31 0  o 13.26000 0.4885000 13.26000 0.4885000 13.26000 0.4885000 0.000000       0.000000  
1 1 1 13 31 2  o 16.58000 0.2530000 16.15000 0.3702000 17.00000 0.3449000 -0.8507000     0.5060000 
1 1 1 13 31 4  o 38.89000 0.3418000 38.28000 0.5236000 39.49000 0.4395000 -1.211000      0.6836000 
1 1 1 13 31 6  o 29.38000 0.2665000 28.86000 0.3898000 29.90000 0.3637000 -1.039000      0.5331000 
1 1 1 13 31 8  o 49.01000 0.4022000 49.58000 0.5355000 48.44000 0.6002000 1.133000       0.8044000 
1 1 1 13 31 10 o 45.79000 0.5805000 45.79000 0.5805000 ?        ?         ?              ?         
1 1 1 13 31 12 o 17.33000 0.4054000 17.88000 0.4253000 16.79000 0.6903000 1.092000       0.8108000 
1 1 1 13 31 14 o 46.93000 0.4849000 46.48000 0.5964000 47.38000 0.7648000 -0.8963000     0.9698000 
1 1 1 13 31 16 o 48.07000 0.4718000 47.49000 0.5273000 48.65000 0.7826000 -1.159000      0.9436000 
1 1 1 13 31 18 o 15.78000 0.4782000 16.72000 0.6193000 14.84000 0.7287000 1.876000       0.9563000 
1 1 1 13 31 20 o 19.47000 0.3931000 19.49000 0.4277000 19.44000 0.6597000 0.5623000E-01  0.7863000 
1 1 1 13 31 22 o 14.87000 0.2909000 14.96000 0.4056000 14.78000 0.4170000 0.1803000      0.5817000 
1 1 1 13 31 24 o 19.82000 0.2913000 19.40000 0.4107000 20.24000 0.4133000 -0.8456000     0.5827000 
1 1 1 13 31 26 o 27.67000 0.3389000 26.89000 0.4692000 28.44000 0.4891000 -1.548000      0.6778000 
1 1 1 13 31 28 f 18.25000 0.3709000 17.93000 0.4531000 18.57000 0.5873000 -0.6429000     0.7418000 
1 1 1 13 31 30 o 35.91000 0.3515000 36.88000 0.5333000 34.95000 0.4581000 1.939000       0.7030000 
1 1 1 13 31 32 o 27.35000 0.3355000 27.09000 0.4440000 27.62000 0.5031000 -0.5253000     0.6710000 
1 1 1 13 31 34 o 7.889000 0.6076000 8.897000 0.8589000 6.881000 0.8596000 2.016000       1.215000  
1 1 1 13 31 36 o 7.095000 0.6665000 7.611000 0.9493000 6.578000 0.9358000 1.034000       1.333000  
1 1 1 13 31 38 o 9.675000 0.5128000 9.630000 0.8077000 9.720000 0.6321000 -0.9037000E-01 1.026000  
1 1 1 13 31 40 o 4.322000 0.9754000 4.129000 1.513000  4.516000 1.232000  -0.3872000     1.951000  
1 1 1 13 31 42 o 11.28000 0.5489000 11.92000 0.9046000 10.64000 0.6218000 1.272000       1.098000  
1 1 1 13 31 44 o 4.645000 1.058000  5.536000 1.636000  3.753000 1.343000  1.783000       2.117000  
1 1 1 13 31 46 o 13.42000 0.4707000 13.40000 0.7233000 13.43000 0.6025000 -0.3173000E-01 0.9414000 
1 1 1 13 31 48 o 2.708000 0.8305000 2.134000 1.056000  3.282000 1.282000  -1.147000      1.661000  
1 1 1 13 31 50 o 3.744000 1.009000  3.761000 1.518000  3.727000 1.330000  0.3423000E-01  2.018000  
1 1 1 13 31 52 o 5.160000 1.093000  5.600000 1.747000  4.720000 1.313000  0.8801000      2.185000  
1 1 1 13 31 54 o 7.003000 0.8749000 6.628000 1.484000  7.379000 0.9267000 -0.7512000     1.750000  
1 1 1 13 31 56 o 4.324000 1.100000  4.185000 1.771000  4.462000 1.305000  -0.2766000     2.200000  
1 1 1 13 32 1  o 9.163000 0.4186000 9.901000 0.4808000 8.425000 0.6855000 1.476000       0.8373000 
1 1 1 13 32 3  o 41.67000 0.3589000 41.70000 0.5510000 41.64000 0.4600000 0.5922000E-01  0.7178000 
1 1 1 13 32 5  o 43.92000 0.3719000 43.29000 0.4814000 44.55000 0.5669000 -1.260000      0.7437000 
1 1 1 13 32 7  o 34.67000 0.4327000 34.41000 0.4823000 34.94000 0.7186000 -0.5280000     0.8654000 
1 1 1 13 32 9  o 31.94000 0.3393000 32.09000 0.4179000 31.78000 0.5347000 0.3137000      0.6787000 
1 1 1 13 32 11 o 57.43000 0.5309000 57.07000 0.6010000 57.80000 0.8754000 -0.7310000     1.062000  
1 1 1 13 32 13 o 41.89000 0.4519000 42.38000 0.5664000 41.41000 0.7042000 0.9688000      0.9037000 
1 1 1 13 32 15 f 16.82000 0.4620000 16.74000 0.5863000 16.91000 0.7143000 -0.1766000     0.9241000 
1 1 1 13 32 17 o 26.13000 0.4362000 26.03000 0.6211000 26.22000 0.6125000 -0.1909000     0.8723000 
1 1 1 13 32 19 o 12.14000 0.5072000 12.02000 0.6014000 12.27000 0.8170000 -0.2420000     1.014000  
1 1 1 13 32 21 o 22.98000 0.3019000 23.37000 0.4351000 22.59000 0.4188000 0.7801000      0.6039000 
1 1 1 13 32 23 o 19.71000 0.2879000 19.99000 0.3551000 19.43000 0.4532000 0.5607000      0.5757000 
1 1 1 13 32 25 o 38.16000 0.5608000 37.33000 0.5467000 38.99000 0.9793000 -1.655000      1.122000  
1 1 1 13 32 27 o 11.03000 0.4631000 11.94000 0.5584000 10.13000 0.7388000 1.804000       0.9261000 
1 1 1 13 32 29 o 11.81000 0.4359000 12.19000 0.6279000 11.43000 0.6049000 0.7600000      0.8719000 
1 1 1 13 32 31 o 21.76000 0.3650000 21.98000 0.5330000 21.54000 0.4988000 0.4375000      0.7300000 
1 1 1 13 32 33 o 9.814000 0.4863000 9.377000 0.7322000 10.25000 0.6401000 -0.8739000     0.9726000 
1 1 1 13 32 35 o 9.054000 0.5457000 8.670000 0.8561000 9.437000 0.6771000 -0.7673000     1.091000  
1 1 1 13 32 37 o 14.00000 0.3703000 14.38000 0.5595000 13.62000 0.4852000 0.7624000      0.7406000 
1 1 1 13 32 39 o 20.78000 0.3699000 21.09000 0.5820000 20.47000 0.4566000 0.6173000      0.7397000 
1 1 1 13 32 41 o 24.43000 0.3909000 24.36000 0.6182000 24.49000 0.4786000 -0.1289000     0.7818000 
1 1 1 13 32 43 o 8.606000 0.6372000 8.298000 1.035000  8.915000 0.7442000 -0.6177000     1.274000  
1 1 1 13 32 45 o 8.981000 0.5500000 9.140000 0.8977000 8.821000 0.6356000 0.3191000      1.100000  
1 1 1 13 32 47 o 5.389000 0.9163000 4.750000 1.522000  6.027000 1.021000  -1.277000      1.833000  
1 1 1 13 32 49 o 10.20000 0.5807000 10.33000 0.9046000 10.08000 0.7285000 0.2446000      1.161000  
1 1 1 13 32 51 o 8.149000 0.8620000 7.664000 1.545000  8.633000 0.7649000 -0.9686000     1.724000  
1 1 1 13 32 53 o 4.148000 1.088000  5.021000 1.774000  3.274000 1.261000  1.748000       2.176000  
1 1 1 13 32 55 o 2.859000 0.8920000 3.313000 1.426000  2.406000 1.072000  0.9066000      1.784000  
1 1 1 13 33 0  o 17.78000 0.3650000 17.78000 0.3650000 17.78000 0.3650000 0.000000       0.000000  
1 1 1 13 33 2  f 5.125000 0.7889000 4.849000 1.211000  5.401000 1.011000  -0.5513000     1.578000  
1 1 1 13 33 4  o 20.72000 0.2754000 20.89000 0.3834000 20.54000 0.3954000 0.3534000      0.5507000 
1 1 1 13 33 6  o 28.62000 0.2823000 28.93000 0.4000000 28.32000 0.3985000 0.6019000      0.5647000 
1 1 1 13 33 8  o 25.25000 0.2622000 25.40000 0.3989000 25.09000 0.3406000 0.3148000      0.5245000 
1 1 1 13 33 10 o 33.73000 0.3867000 33.52000 0.4279000 33.93000 0.6442000 -0.4047000     0.7734000 
1 1 1 13 33 12 o 23.62000 0.4339000 23.88000 0.5836000 23.35000 0.6423000 0.5330000      0.8678000 
1 1 1 13 33 14 o 19.27000 0.4318000 18.59000 0.5631000 19.95000 0.6548000 -1.356000      0.8636000 
1 1 1 13 33 16 f 41.53000 0.5066000 41.80000 0.7077000 41.26000 0.7250000 0.5465000      1.013000  
1 1 1 13 33 18 o 33.71000 0.3978000 33.71000 0.4491000 33.71000 0.6567000 0.1823000E-02  0.7955000 
1 1 1 13 33 20 o 7.065000 0.8522000 6.604000 1.038000  7.526000 1.352000  -0.9224000     1.704000  
1 1 1 13 33 22 o 12.55000 0.3768000 12.89000 0.5638000 12.21000 0.5000000 0.6811000      0.7535000 
1 1 1 13 33 24 o 14.16000 0.6302000 15.07000 0.4364000 13.25000 1.182000  1.816000       1.260000  
1 1 1 13 33 26 o 30.70000 0.3266000 31.05000 0.4369000 30.36000 0.4856000 0.6883000      0.6532000 
1 1 1 13 33 28 o 21.41000 0.3924000 21.47000 0.4163000 21.35000 0.6654000 0.1165000      0.7849000 
1 1 1 13 33 30 o 14.17000 0.3762000 14.18000 0.5044000 14.16000 0.5583000 0.2415000E-01  0.7524000 
1 1 1 13 33 32 o 13.01000 0.4262000 12.93000 0.6676000 13.09000 0.5300000 -0.1566000     0.8524000 
1 1 1 13 33 34 o 4.261000 0.9355000 4.553000 1.372000  3.969000 1.273000  0.5841000      1.871000  
1 1 1 13 33 36 o 4.421000 0.8980000 4.224000 1.386000  4.618000 1.142000  -0.3946000     1.796000  
1 1 1 13 33 38 o 15.47000 0.3875000 15.45000 0.5811000 15.48000 0.5128000 -0.2494000E-01 0.7750000 
1 1 1 13 33 40 o 15.33000 0.3765000 15.83000 0.5768000 14.82000 0.4840000 1.008000       0.7530000 
1 1 1 13 33 42 o 17.96000 0.4079000 17.56000 0.5774000 18.37000 0.5764000 -0.8188000     0.8159000 
1 1 1 13 33 44 o 14.65000 0.4043000 15.13000 0.6267000 14.17000 0.5109000 0.9597000      0.8086000 
1 1 1 13 33 46 o 6.457000 0.8373000 5.761000 1.456000  7.152000 0.8275000 -1.391000      1.675000  
1 1 1 13 33 48 o 10.93000 0.5548000 10.60000 0.9217000 11.26000 0.6176000 -0.6599000     1.110000  
1 1 1 13 33 50 o 10.44000 0.5520000 10.45000 0.8797000 10.44000 0.6672000 0.1129000E-01  1.104000  
1 1 1 13 33 52 o 3.859000 1.028000  4.378000 1.611000  3.341000 1.278000  1.037000       2.057000  
1 1 1 13 33 54 o 3.324000 0.9823000 3.711000 1.549000  2.937000 1.208000  0.7736000      1.965000  
1 1 1 13 34 1  o 32.53000 0.3869000 33.23000 0.5866000 31.84000 0.5047000 1.389000       0.7738000 
1 1 1 13 34 3  o 50.17000 0.4843000 51.23000 0.6241000 49.11000 0.7407000 2.126000       0.9686000 
1 1 1 13 34 5  o 13.56000 0.3121000 13.21000 0.5161000 13.90000 0.3512000 -0.6913000     0.6242000 
1 1 1 13 34 7  o 8.194000 0.4561000 8.464000 0.7694000 7.924000 0.4899000 0.5400000      0.9121000 
1 1 1 13 34 9  o 3.062000 0.8210000 3.708000 1.346000  2.415000 0.9401000 1.293000       1.642000  
1 1 1 13 34 11 o 13.13000 0.5687000 14.25000 0.6446000 12.02000 0.9371000 2.230000       1.137000  
1 1 1 13 34 13 o 19.17000 0.4304000 18.38000 0.5666000 19.96000 0.6480000 -1.585000      0.8608000 
1 1 1 13 34 15 o 11.97000 0.5658000 11.57000 0.7146000 12.37000 0.8774000 -0.7985000     1.132000  
1 1 1 13 34 17 o 15.89000 0.4542000 16.49000 0.4862000 15.29000 0.7673000 1.200000       0.9083000 
1 1 1 13 34 19 o 9.735000 0.6417000 10.00000 0.7130000 9.467000 1.067000  0.5364000      1.283000  
1 1 1 13 34 21 o 24.35000 0.4896000 23.93000 0.4289000 24.77000 0.8804000 -0.8330000     0.9793000 
1 1 1 13 34 23 o 53.08000 0.4741000 52.54000 0.5080000 53.62000 0.8006000 -1.075000      0.9481000 
1 1 1 13 34 25 o 27.07000 0.3152000 26.86000 0.4091000 27.28000 0.4797000 -0.4130000     0.6305000 
1 1 1 13 34 27 f 26.07000 0.3068000 26.19000 0.3857000 25.95000 0.4771000 0.2411000      0.6136000 
1 1 1 13 34 29 o 19.44000 0.3570000 19.93000 0.4252000 18.96000 0.5734000 0.9621000      0.7139000 
1 1 1 13 34 31 o 17.44000 0.3108000 17.97000 0.3790000 16.91000 0.4926000 1.056000       0.6215000 
1 1 1 13 34 33 o 5.738000 0.8009000 5.010000 1.255000  6.467000 0.9954000 -1.457000      1.602000  
1 1 1 13 34 35 o 13.80000 0.3569000 13.90000 0.5527000 13.69000 0.4516000 0.2107000      0.7137000 
1 1 1 13 34 37 o 7.136000 0.6351000 7.302000 0.9908000 6.970000 0.7948000 0.3329000      1.270000  
1 1 1 13 34 39 o 13.59000 0.4231000 13.21000 0.6940000 13.97000 0.4841000 -0.7547000     0.8461000 
1 1 1 13 34 41 o 10.47000 0.4975000 11.02000 0.7777000 9.915000 0.6206000 1.102000       0.9950000 
1 1 1 13 34 43 o 12.82000 0.4427000 12.88000 0.6982000 12.76000 0.5444000 0.1229000      0.8854000 
1 1 1 13 34 45 o 6.797000 0.8541000 6.752000 1.445000  6.843000 0.9114000 -0.9103000E-01 1.708000  
1 1 1 13 34 47 o 4.209000 0.9907000 4.697000 1.529000  3.721000 1.260000  0.9759000      1.981000  
1 1 1 13 34 49 o 7.021000 0.8491000 6.356000 1.472000  7.685000 0.8463000 -1.329000      1.698000  
1 1 1 13 34 51 o 5.907000 0.8919000 5.490000 1.476000  6.323000 1.002000  -0.8328000     1.784000  
1 1 1 13 34 53 o 3.550000 0.9993000 3.972000 1.577000  3.129000 1.228000  0.8429000      1.999000  
1 1 1 13 35 0  o 6.760000 0.7118000 6.760000 0.7118000 6.760000 0.7118000 0.000000       0.000000  
1 1 1 13 35 2  o 14.01000 0.2916000 14.11000 0.4232000 13.91000 0.4012000 0.2042000      0.5831000 
1 1 1 13 35 4  o 25.44000 0.2832000 25.31000 0.4329000 25.57000 0.3654000 -0.2627000     0.5665000 
1 1 1 13 35 6  o 18.60000 0.3363000 18.73000 0.5842000 18.47000 0.3333000 0.2621000      0.6725000 
1 1 1 13 35 8  o 33.20000 0.3510000 33.67000 0.5796000 32.73000 0.3960000 0.9422000      0.7019000 
1 1 1 13 35 10 o 6.915000 0.6337000 6.475000 1.170000  7.355000 0.4880000 -0.8803000     1.267000  
1 1 1 13 35 12 o 18.30000 0.4219000 18.73000 0.4551000 17.86000 0.7106000 0.8693000      0.8438000 
1 1 1 13 35 14 o 11.73000 0.5688000 12.02000 0.5846000 11.44000 0.9760000 0.5723000      1.138000  
1 1 1 13 35 16 o 51.62000 0.4999000 51.54000 0.5663000 51.70000 0.8239000 -0.1584000     0.9998000 
1 1 1 13 35 18 o 39.20000 0.4344000 39.86000 0.4842000 38.54000 0.7214000 1.323000       0.8688000 
1 1 1 13 35 20 o 32.49000 0.5217000 32.73000 0.4444000 32.25000 0.9439000 0.4794000      1.043000  
1 1 1 13 35 22 o 33.93000 0.3174000 33.70000 0.3854000 34.17000 0.5044000 -0.4743000     0.6348000 
1 1 1 13 35 24 o 5.629000 0.8645000 5.093000 1.338000  6.164000 1.096000  -1.072000      1.729000  
1 1 1 13 35 26 o 22.69000 0.2999000 22.45000 0.3664000 22.94000 0.4750000 -0.4917000     0.5999000 
1 1 1 13 35 28 o 22.07000 0.4990000 21.42000 0.4292000 22.72000 0.9010000 -1.304000      0.9980000 
1 1 1 13 35 30 o 10.16000 0.4308000 10.82000 0.5138000 9.491000 0.6916000 1.328000       0.8616000 
1 1 1 13 35 32 o 4.323000 0.8792000 5.388000 1.227000  3.258000 1.259000  2.130000       1.758000  
1 1 1 13 35 34 o 8.863000 0.4637000 9.067000 0.6592000 8.658000 0.6523000 0.4095000      0.9274000 
1 1 1 13 35 36 o 21.93000 0.3021000 22.00000 0.4361000 21.87000 0.4181000 0.1374000      0.6041000 
1 1 1 13 35 38 o 8.954000 0.5136000 9.042000 0.7288000 8.865000 0.7240000 0.1771000      1.027000  
1 1 1 13 35 40 o 3.559000 0.9096000 3.132000 1.283000  3.986000 1.290000  -0.8541000     1.819000  
1 1 1 13 35 42 o 5.182000 1.021000  5.133000 1.470000  5.231000 1.417000  -0.9729000E-01 2.042000  
1 1 1 13 35 44 o 9.204000 0.5874000 8.928000 0.9329000 9.480000 0.7142000 -0.5515000     1.175000  
1 1 1 13 35 46 o 4.705000 0.8999000 3.447000 1.378000  5.964000 1.158000  -2.518000      1.800000  
1 1 1 13 35 48 o 3.829000 1.005000  3.742000 1.486000  3.917000 1.353000  -0.1743000     2.010000  
1 1 1 13 35 50 o 3.439000 1.004000  3.661000 1.584000  3.216000 1.234000  0.4444000      2.008000  
1 1 1 13 35 52 o 4.930000 1.052000  5.103000 1.610000  4.757000 1.355000  0.3466000      2.104000  
1 1 1 13 36 1  o 47.73000 0.3679000 48.27000 0.5266000 47.18000 0.5140000 1.098000       0.7359000 
1 1 1 13 36 3  o 21.97000 0.2948000 21.37000 0.4269000 22.57000 0.4066000 -1.196000      0.5896000 
1 1 1 13 36 5  o 10.98000 0.3411000 10.83000 0.5225000 11.13000 0.4386000 -0.2956000     0.6822000 
1 1 1 13 36 7  o 23.54000 0.2849000 23.84000 0.4497000 23.25000 0.3501000 0.5834000      0.5699000 
1 1 1 13 36 9  o 5.507000 0.6818000 5.205000 1.195000  5.808000 0.6563000 -0.6023000     1.364000  
1 1 1 13 36 11 f 15.19000 0.4467000 15.99000 0.7633000 14.40000 0.4642000 1.594000       0.8934000 
1 1 1 13 36 13 o 47.60000 0.4732000 47.33000 0.5315000 47.87000 0.7832000 -0.5389000     0.9465000 
1 1 1 13 36 15 o 16.84000 0.4463000 16.34000 0.4704000 17.33000 0.7586000 -0.9880000     0.8926000 
1 1 1 13 36 17 o 39.54000 0.5579000 39.30000 0.4810000 39.77000 1.007000  -0.4765000     1.116000  
1 1 1 13 36 19 o 21.43000 0.5098000 21.48000 0.4411000 21.37000 0.9193000 0.1137000      1.020000  
1 1 1 13 36 21 o 10.81000 0.4420000 11.32000 0.6435000 10.29000 0.6061000 1.027000       0.8840000 
1 1 1 13 36 23 o 26.65000 0.2965000 26.99000 0.3659000 26.31000 0.4667000 0.6800000      0.5930000 
1 1 1 13 36 25 o 31.57000 0.3343000 31.72000 0.4522000 31.42000 0.4924000 0.3046000      0.6685000 
1 1 1 13 36 27 o 18.19000 0.3446000 18.18000 0.4139000 18.19000 0.5511000 -0.1085000E-01 0.6892000 
1 1 1 13 36 29 o 9.979000 0.5548000 10.42000 0.5841000 9.542000 0.9435000 0.8729000      1.110000  
1 1 1 13 36 31 o 11.20000 0.3985000 11.72000 0.5105000 10.67000 0.6120000 1.048000       0.7970000 
1 1 1 13 36 33 o 8.697000 0.4740000 8.981000 0.5514000 8.413000 0.7711000 0.5686000      0.9480000 
1 1 1 13 36 35 o 2.834000 0.8278000 2.908000 1.194000  2.761000 1.146000  0.1471000      1.656000  
1 1 1 13 36 37 o 14.64000 0.4050000 13.88000 0.6543000 15.40000 0.4774000 -1.521000      0.8099000 
1 1 1 13 36 39 o 9.287000 0.5295000 9.504000 0.7971000 9.070000 0.6972000 0.4346000      1.059000  
1 1 1 13 36 41 o 9.154000 0.5810000 8.904000 0.7692000 9.404000 0.8710000 -0.4991000     1.162000  
1 1 1 13 36 43 o 19.84000 0.3489000 19.12000 0.4972000 20.56000 0.4897000 -1.437000      0.6979000 
1 1 1 13 36 45 o 20.04000 0.3801000 19.93000 0.5910000 20.16000 0.4783000 -0.2376000     0.7603000 
1 1 1 13 36 47 o 12.74000 0.4743000 12.50000 0.7185000 12.99000 0.6193000 -0.4909000     0.9485000 
1 1 1 13 36 49 o 8.056000 0.7412000 7.665000 1.249000  8.447000 0.7984000 -0.7816000     1.482000  
1 1 1 13 36 51 o 3.465000 0.9709000 3.372000 1.423000  3.558000 1.321000  -0.1855000     1.942000  
1 1 1 13 37 0  o 9.895000 0.5665000 9.895000 0.5665000 9.895000 0.5665000 0.000000       0.000000  
1 1 1 13 37 2  o 39.08000 0.4135000 40.12000 0.6572000 38.03000 0.5022000 2.084000       0.8271000 
1 1 1 13 37 4  o 60.31000 0.5118000 60.88000 0.7224000 59.74000 0.7251000 1.138000       1.024000  
1 1 1 13 37 6  o 21.66000 0.3400000 20.97000 0.4445000 22.34000 0.5145000 -1.377000      0.6799000 
1 1 1 13 37 8  o 29.61000 0.2862000 30.17000 0.4261000 29.04000 0.3821000 1.126000       0.5723000 
1 1 1 13 37 10 o 42.13000 0.3705000 42.25000 0.5749000 42.02000 0.4676000 0.2210000      0.7410000 
1 1 1 13 37 12 o 40.23000 0.4806000 40.58000 0.7216000 39.87000 0.6350000 0.7071000      0.9612000 
1 1 1 13 37 14 o 11.38000 0.7142000 10.60000 0.8024000 12.17000 1.182000  -1.565000      1.428000  
1 1 1 13 37 16 o 13.61000 0.6450000 13.47000 0.5816000 13.76000 1.151000  -0.2874000     1.290000  
1 1 1 13 37 18 o 38.45000 0.4318000 39.16000 0.4827000 37.75000 0.7162000 1.410000       0.8637000 
1 1 1 13 37 20 o 26.67000 0.3191000 27.20000 0.4365000 26.14000 0.4657000 1.056000       0.6382000 
1 1 1 13 37 22 o 7.142000 0.5478000 7.643000 0.6744000 6.642000 0.8635000 1.001000       1.096000  
1 1 1 13 37 24 o 9.635000 0.4821000 10.48000 0.6070000 8.788000 0.7490000 1.694000       0.9641000 
1 1 1 13 37 26 o 13.64000 0.3878000 14.70000 0.4487000 12.58000 0.6327000 2.125000       0.7756000 
1 1 1 13 37 28 o 12.40000 0.4436000 11.83000 0.4569000 12.97000 0.7605000 -1.141000      0.8872000 
1 1 1 13 37 30 o 12.46000 0.3487000 12.73000 0.4230000 12.19000 0.5544000 0.5413000      0.6973000 
1 1 1 13 37 32 o 18.87000 0.3179000 19.20000 0.4394000 18.55000 0.4596000 0.6508000      0.6359000 
1 1 1 13 37 34 o 11.44000 0.3741000 11.86000 0.5240000 11.02000 0.5342000 0.8365000      0.7483000 
1 1 1 13 37 36 o 4.206000 0.8916000 3.371000 1.373000  5.040000 1.138000  -1.670000      1.783000  
1 1 1 13 37 38 o 13.26000 0.3712000 12.79000 0.5308000 13.73000 0.5191000 -0.9422000     0.7424000 
1 1 1 13 37 40 o 25.30000 0.3366000 25.26000 0.4426000 25.34000 0.5074000 -0.8140000E-01 0.6733000 
1 1 1 13 37 42 o 15.01000 0.4244000 14.75000 0.5473000 15.27000 0.6488000 -0.5255000     0.8488000 
1 1 1 13 37 44 o 9.711000 0.5679000 9.112000 0.8423000 10.31000 0.7618000 -1.198000      1.136000  
1 1 1 13 37 46 o 8.836000 0.6920000 8.652000 1.138000  9.019000 0.7871000 -0.3671000     1.384000  
1 1 1 13 37 48 o 13.79000 0.4340000 13.43000 0.6153000 14.15000 0.6123000 -0.7193000     0.8681000 
1 1 1 13 37 50 o 5.980000 0.8740000 6.791000 1.145000  5.170000 1.321000  1.621000       1.748000  
1 1 1 13 37 52 o 5.767000 1.948000  5.767000 1.948000  ?        ?         ?              ?         
1 1 1 13 38 1  o 12.67000 0.3975000 12.00000 0.5284000 13.34000 0.5940000 -1.342000      0.7950000 
1 1 1 13 38 3  o 21.40000 0.3085000 21.21000 0.4544000 21.59000 0.4173000 -0.3820000     0.6169000 
1 1 1 13 38 5  o 17.25000 0.3547000 17.01000 0.4385000 17.49000 0.5577000 -0.4758000     0.7094000 
1 1 1 13 38 7  o 9.657000 0.4304000 10.16000 0.6182000 9.151000 0.5989000 1.011000       0.8607000 
1 1 1 13 38 9  o 28.91000 0.3748000 28.27000 0.5762000 29.55000 0.4794000 -1.284000      0.7496000 
1 1 1 13 38 11 o 6.204000 1.086000  6.972000 0.9588000 5.436000 1.950000  1.536000       2.173000  
1 1 1 13 38 13 o 25.46000 0.4136000 25.31000 0.6419000 25.60000 0.5217000 -0.2905000     0.8272000 
1 1 1 13 38 15 o 30.77000 0.3330000 30.47000 0.4456000 31.06000 0.4949000 -0.5943000     0.6659000 
1 1 1 13 38 17 o 8.024000 0.5605000 8.388000 0.8509000 7.660000 0.7298000 0.7281000      1.121000  
1 1 1 13 38 19 o 32.92000 0.3327000 32.74000 0.4514000 33.09000 0.4890000 -0.3467000     0.6654000 
1 1 1 13 38 21 o 15.39000 0.3363000 16.18000 0.4147000 14.61000 0.5296000 1.571000       0.6727000 
1 1 1 13 38 23 o 21.55000 0.3297000 22.03000 0.3991000 21.07000 0.5248000 0.9652000      0.6593000 
1 1 1 13 38 25 o 15.76000 0.3289000 15.80000 0.3978000 15.73000 0.5238000 0.7082000E-01  0.6577000 
1 1 1 13 38 27 o 29.06000 0.3125000 28.67000 0.4122000 29.45000 0.4699000 -0.7790000     0.6251000 
1 1 1 13 38 29 o 10.47000 0.5265000 10.52000 0.4997000 10.43000 0.9268000 0.8722000E-01  1.053000  
1 1 1 13 38 31 o 2.800000 0.7694000 3.398000 1.144000  2.202000 1.029000  1.195000       1.539000  
1 1 1 13 38 33 o 8.045000 0.4981000 8.052000 0.6370000 8.037000 0.7660000 0.1453000E-01  0.9963000 
1 1 1 13 38 35 f 12.42000 0.3844000 11.75000 0.5800000 13.09000 0.5045000 -1.332000      0.7687000 
1 1 1 13 38 37 o 14.44000 0.3524000 14.21000 0.5028000 14.66000 0.4940000 -0.4526000     0.7049000 
1 1 1 13 38 39 o 17.18000 0.3556000 17.63000 0.4715000 16.72000 0.5325000 0.9091000      0.7112000 
1 1 1 13 38 41 o 7.344000 0.6393000 7.013000 0.9536000 7.675000 0.8516000 -0.6618000     1.279000  
1 1 1 13 38 43 o 16.66000 0.4396000 16.14000 0.5177000 17.18000 0.7106000 -1.048000      0.8792000 
1 1 1 13 38 45 o 13.04000 0.4417000 12.23000 0.6675000 13.85000 0.5787000 -1.615000      0.8835000 
1 1 1 13 38 47 o 9.392000 0.5683000 9.075000 0.8712000 9.708000 0.7300000 -0.6335000     1.137000  
1 1 1 13 38 49 o 3.147000 0.8944000 2.801000 1.228000  3.494000 1.300000  -0.6933000     1.789000  
1 1 1 13 38 51 o 4.909000 1.061000  4.800000 1.401000  5.019000 1.594000  -0.2187000     2.123000  
1 1 1 13 39 0  o 14.33000 0.4643000 14.33000 0.4643000 14.33000 0.4643000 0.000000       0.000000  
1 1 1 13 39 2  o 14.27000 0.3585000 14.68000 0.4773000 13.86000 0.5351000 0.8194000      0.7170000 
1 1 1 13 39 4  f 19.78000 0.2860000 20.03000 0.4172000 19.52000 0.3914000 0.5101000      0.5720000 
1 1 1 13 39 6  o 11.70000 0.4191000 12.45000 0.5328000 10.95000 0.6472000 1.503000       0.8382000 
1 1 1 13 39 8  o 13.07000 0.5373000 12.55000 0.5514000 13.59000 0.9222000 -1.039000      1.075000  
1 1 1 13 39 10 o 32.02000 0.3173000 31.99000 0.4422000 32.06000 0.4553000 -0.6436000E-01 0.6347000 
1 1 1 13 39 12 o 25.78000 0.3780000 26.46000 0.6016000 25.10000 0.4580000 1.358000       0.7561000 
1 1 1 13 39 14 o 32.39000 0.3075000 32.23000 0.4567000 32.55000 0.4119000 -0.3173000     0.6150000 
1 1 1 13 39 16 f 19.32000 0.2985000 19.59000 0.4773000 19.05000 0.3585000 0.5399000      0.5969000 
1 1 1 13 39 18 o 14.50000 0.3656000 14.45000 0.5447000 14.56000 0.4878000 -0.1105000     0.7312000 
1 1 1 13 39 20 o 23.84000 0.2908000 23.50000 0.3595000 24.17000 0.4571000 -0.6700000     0.5816000 
1 1 1 13 39 22 o 25.97000 0.3456000 25.97000 0.4292000 25.98000 0.5418000 -0.1347000E-01 0.6913000 
1 1 1 13 39 24 o 40.24000 0.3530000 39.95000 0.4239000 40.52000 0.5646000 -0.5615000     0.7060000 
1 1 1 13 39 26 o 31.37000 0.3969000 31.36000 0.6191000 31.38000 0.4968000 -0.1798000E-01 0.7937000 
1 1 1 13 39 28 o 12.99000 0.4488000 12.72000 0.4323000 13.26000 0.7867000 -0.5450000     0.8976000 
1 1 1 13 39 30 o 3.444000 0.8547000 3.576000 1.133000  3.311000 1.279000  0.2652000      1.709000  
1 1 1 13 39 32 o 4.184000 0.8679000 3.703000 1.277000  4.665000 1.176000  -0.9625000     1.736000  
1 1 1 13 39 34 o 3.714000 0.8974000 3.799000 1.338000  3.630000 1.197000  0.1686000      1.795000  
1 1 1 13 39 36 o 18.17000 0.3148000 18.35000 0.4368000 17.99000 0.4534000 0.3550000      0.6296000 
1 1 1 13 39 38 o 12.31000 0.4382000 12.88000 0.5903000 11.75000 0.6477000 1.126000       0.8764000 
1 1 1 13 39 40 o 5.521000 0.7951000 6.189000 1.048000  4.853000 1.196000  1.335000       1.590000  
1 1 1 13 39 42 o 8.210000 0.5923000 8.246000 0.8019000 8.174000 0.8718000 0.7224000E-01  1.185000  
1 1 1 13 39 44 o 7.376000 0.6453000 7.849000 0.8825000 6.902000 0.9418000 0.9476000      1.291000  
1 1 1 13 39 46 o 4.344000 1.106000  4.707000 1.749000  3.981000 1.353000  0.7264000      2.211000  
1 1 1 13 39 48 o 3.507000 0.8963000 2.661000 1.225000  4.352000 1.309000  -1.691000      1.793000  
1 1 1 13 39 50 o 2.791000 0.8637000 3.051000 1.268000  2.530000 1.173000  0.5215000      1.727000  
1 1 1 13 40 1  o 14.46000 0.3351000 14.58000 0.4759000 14.34000 0.4720000 0.2334000      0.6703000 
1 1 1 13 40 3  o 4.094000 0.9099000 4.554000 1.244000  3.635000 1.328000  0.9191000      1.820000  
1 1 1 13 40 5  o 5.917000 0.7231000 4.928000 1.210000  6.906000 0.7924000 -1.978000      1.446000  
1 1 1 13 40 7  o 28.15000 0.3265000 28.71000 0.4290000 27.58000 0.4923000 1.126000       0.6530000 
1 1 1 13 40 9  o 15.61000 0.3129000 15.34000 0.4864000 15.88000 0.3936000 -0.5432000     0.6257000 
1 1 1 13 40 11 o 14.60000 0.3247000 14.74000 0.5114000 14.47000 0.4002000 0.2677000      0.6494000 
1 1 1 13 40 13 o 40.92000 0.3832000 40.16000 0.5510000 41.68000 0.5328000 -1.521000      0.7665000 
1 1 1 13 40 15 o 16.29000 0.3678000 16.49000 0.5381000 16.10000 0.5015000 0.3899000      0.7356000 
1 1 1 13 40 17 o 18.60000 0.3275000 18.69000 0.4878000 18.52000 0.4370000 0.1712000      0.6549000 
1 1 1 13 40 19 o 21.70000 0.2812000 21.60000 0.3615000 21.79000 0.4308000 -0.1895000     0.5624000 
1 1 1 13 40 21 o 16.83000 0.3112000 17.02000 0.3741000 16.65000 0.4974000 0.3706000      0.6223000 
1 1 1 13 40 23 o 22.20000 0.2945000 22.70000 0.3672000 21.69000 0.4606000 1.008000       0.5891000 
1 1 1 13 40 25 o 8.372000 0.4927000 7.822000 0.6789000 8.922000 0.7144000 -1.100000      0.9855000 
1 1 1 13 40 27 o 4.607000 0.8426000 4.700000 1.075000  4.514000 1.298000  0.1861000      1.685000  
1 1 1 13 40 29 o 2.999000 0.8952000 2.281000 0.9940000 3.717000 1.489000  -1.436000      1.790000  
1 1 1 13 40 31 o 6.763000 0.6028000 6.860000 0.7329000 6.666000 0.9572000 0.1934000      1.206000  
1 1 1 13 40 33 o 5.341000 0.8311000 5.082000 1.257000  5.599000 1.088000  -0.5174000     1.662000  
1 1 1 13 40 35 o 11.42000 0.4123000 11.75000 0.5871000 11.08000 0.5789000 0.6745000      0.8246000 
1 1 1 13 40 37 o 4.233000 0.9243000 4.605000 1.267000  3.861000 1.347000  0.7441000      1.849000  
1 1 1 13 40 39 o 9.570000 0.4606000 9.606000 0.6400000 9.533000 0.6625000 0.7262000E-01  0.9211000 
1 1 1 13 40 41 o 6.818000 0.6745000 6.958000 0.8859000 6.677000 1.017000  0.2812000      1.349000  
1 1 1 13 40 43 o 7.224000 0.7223000 7.035000 0.9638000 7.413000 1.076000  -0.3775000     1.445000  
1 1 1 13 40 45 o 6.609000 0.7729000 6.136000 1.212000  7.081000 0.9599000 -0.9451000     1.546000  
1 1 1 13 40 47 o 7.129000 0.7111000 7.236000 1.032000  7.023000 0.9789000 0.2135000      1.422000  
1 1 1 13 40 49 o 3.961000 1.014000  4.501000 1.384000  3.422000 1.482000  1.079000       2.028000  
1 1 1 13 41 0  o 37.84000 0.4562000 37.84000 0.4562000 37.84000 0.4562000 0.000000       0.000000  
1 1 1 13 41 2  o 30.32000 0.4005000 30.56000 0.4279000 30.07000 0.6771000 0.4978000      0.8010000 
1 1 1 13 41 4  o 16.87000 0.3391000 17.12000 0.4438000 16.63000 0.5129000 0.4952000      0.6782000 
1 1 1 13 41 6  f 13.64000 0.3427000 13.98000 0.5001000 13.30000 0.4688000 0.6749000      0.6854000 
1 1 1 13 41 8  o 26.12000 0.3500000 25.88000 0.4997000 26.36000 0.4903000 -0.4764000     0.7001000 
1 1 1 13 41 10 o 29.20000 0.2917000 28.77000 0.4275000 29.63000 0.3971000 -0.8550000     0.5835000 
1 1 1 13 41 12 o 25.36000 0.3308000 24.68000 0.4732000 26.04000 0.4623000 -1.367000      0.6615000 
1 1 1 13 41 14 o 39.93000 0.3356000 39.10000 0.4816000 40.76000 0.4676000 -1.661000      0.6713000 
1 1 1 13 41 16 o 20.11000 0.3216000 19.55000 0.5035000 20.66000 0.4002000 -1.104000      0.6431000 
1 1 1 13 41 18 o 3.478000 0.8471000 2.965000 1.161000  3.992000 1.234000  -1.028000      1.694000  
1 1 1 13 41 20 o 6.582000 0.5805000 5.439000 0.8860000 7.725000 0.7503000 -2.285000      1.161000  
1 1 1 13 41 22 o 21.87000 0.3003000 21.95000 0.4012000 21.80000 0.4470000 0.1517000      0.6006000 
1 1 1 13 41 24 o 27.53000 0.3137000 27.68000 0.4024000 27.38000 0.4814000 0.2995000      0.6274000 
1 1 1 13 41 26 o 21.04000 0.3001000 21.42000 0.3662000 20.66000 0.4755000 0.7647000      0.6001000 
1 1 1 13 41 28 o 15.68000 0.4662000 15.57000 0.4826000 15.78000 0.7979000 -0.2086000     0.9324000 
1 1 1 13 41 30 o 10.78000 0.4070000 11.05000 0.4962000 10.52000 0.6453000 0.5316000      0.8140000 
1 1 1 13 41 32 o 7.698000 0.5234000 7.603000 0.6946000 7.792000 0.7832000 -0.1884000     1.047000  
1 1 1 13 41 34 o 5.671000 0.7489000 4.078000 1.294000  7.265000 0.7541000 -3.187000      1.498000  
1 1 1 13 41 36 o 10.31000 0.5236000 10.28000 0.7837000 10.35000 0.6945000 -0.6753000E-01 1.047000  
1 1 1 13 41 38 o 7.510000 0.5879000 7.457000 0.8596000 7.563000 0.8021000 -0.1062000     1.176000  
1 1 1 13 41 40 o 13.09000 0.4042000 12.84000 0.5326000 13.34000 0.6082000 -0.5013000     0.8084000 
1 1 1 13 41 42 o 11.79000 0.4804000 11.30000 0.6128000 12.29000 0.7400000 -0.9906000     0.9608000 
1 1 1 13 41 44 o 4.462000 0.8902000 4.095000 1.326000  4.829000 1.188000  -0.7337000     1.780000  
1 1 1 13 41 46 o 5.561000 1.026000  5.523000 1.429000  5.599000 1.474000  -0.7596000E-01 2.053000  
1 1 1 13 41 48 f 2.604000 0.8505000 2.277000 1.058000  2.932000 1.332000  -0.6551000     1.701000  
1 1 1 13 42 1  o 12.38000 0.5357000 12.95000 0.9284000 11.81000 0.5346000 1.139000       1.071000  
1 1 1 13 42 3  o 25.12000 0.2854000 25.05000 0.4051000 25.20000 0.4021000 -0.1518000     0.5708000 
1 1 1 13 42 5  o 17.70000 0.3279000 18.38000 0.4390000 17.02000 0.4871000 1.364000       0.6557000 
1 1 1 13 42 7  o 8.892000 0.5300000 8.592000 0.8951000 9.192000 0.5678000 -0.6006000     1.060000  
1 1 1 13 42 9  o 3.538000 0.8926000 4.247000 1.299000  2.830000 1.225000  1.417000       1.785000  
1 1 1 13 42 11 o 5.238000 0.8017000 5.098000 1.354000  5.378000 0.8583000 -0.2802000     1.603000  
1 1 1 13 42 13 o 15.20000 0.3137000 14.84000 0.4949000 15.56000 0.3857000 -0.7216000     0.6274000 
1 1 1 13 42 15 o 15.09000 0.3196000 14.59000 0.4964000 15.60000 0.4025000 -1.011000      0.6391000 
1 1 1 13 42 17 o 8.626000 0.5459000 8.665000 0.7296000 8.588000 0.8122000 0.7776000E-01  1.092000  
1 1 1 13 42 19 o 18.94000 0.3008000 19.51000 0.3605000 18.37000 0.4815000 1.142000       0.6015000 
1 1 1 13 42 21 o 4.629000 0.8391000 4.214000 1.275000  5.045000 1.091000  -0.8316000     1.678000  
1 1 1 13 42 23 o 5.099000 0.8044000 4.941000 1.098000  5.256000 1.176000  -0.3150000     1.609000  
1 1 1 13 42 25 f 3.221000 0.8286000 3.446000 1.110000  2.996000 1.230000  0.4499000      1.657000  
1 1 1 13 42 27 o 9.654000 0.4326000 9.695000 0.5344000 9.614000 0.6804000 0.8022000E-01  0.8652000 
1 1 1 13 42 29 o 8.081000 0.7176000 7.671000 0.6955000 8.492000 1.255000  -0.8209000     1.435000  
1 1 1 13 42 31 f 7.850000 0.5334000 7.627000 0.7436000 8.073000 0.7650000 -0.4459000     1.067000  
1 1 1 13 42 33 o 8.085000 0.5676000 7.610000 0.8338000 8.560000 0.7704000 -0.9501000     1.135000  
1 1 1 13 42 35 o 6.948000 0.5566000 8.319000 0.6835000 5.576000 0.8786000 2.743000       1.113000  
1 1 1 13 42 37 o 5.811000 0.7929000 4.675000 1.315000  6.946000 0.8865000 -2.271000      1.586000  
1 1 1 13 42 39 f 8.552000 0.5491000 8.400000 0.7430000 8.703000 0.8088000 -0.3029000     1.098000  
1 1 1 13 42 41 o 6.905000 0.7603000 7.102000 0.9058000 6.708000 1.221000  0.3940000      1.521000  
1 1 1 13 42 43 f 3.535000 0.9515000 3.103000 1.255000  3.968000 1.430000  -0.8652000     1.903000  
1 1 1 13 42 45 o 2.653000 0.8531000 2.581000 1.153000  2.724000 1.258000  -0.1430000     1.706000  
1 1 1 13 42 47 o 3.397000 0.9793000 3.666000 1.424000  3.128000 1.345000  0.5382000      1.959000  
1 1 1 13 43 0  o 31.70000 0.4255000 31.70000 0.4255000 31.70000 0.4255000 0.000000       0.000000  
1 1 1 13 43 2  o 16.28000 0.3162000 15.69000 0.4620000 16.88000 0.4319000 -1.190000      0.6325000 
1 1 1 13 43 4  o 9.415000 0.6710000 8.581000 1.224000  10.25000 0.5500000 -1.666000      1.342000  
1 1 1 13 43 6  o 13.90000 0.3943000 14.90000 0.5783000 12.90000 0.5363000 2.003000       0.7886000 
1 1 1 13 43 8  o 21.60000 0.2815000 21.87000 0.4155000 21.33000 0.3800000 0.5308000      0.5631000 
1 1 1 13 43 10 o 14.84000 0.3919000 14.83000 0.5754000 14.84000 0.5323000 -0.1236000E-01 0.7839000 
1 1 1 13 43 12 o 16.22000 0.2995000 15.84000 0.4610000 16.60000 0.3823000 -0.7667000     0.5989000 
1 1 1 13 43 14 o 13.49000 0.3260000 13.74000 0.5068000 13.23000 0.4101000 0.5068000      0.6519000 
1 1 1 13 43 16 o 18.80000 0.3495000 19.62000 0.4399000 17.97000 0.5432000 1.647000       0.6990000 
1 1 1 13 43 18 o 10.19000 0.3935000 9.011000 0.5634000 11.36000 0.5495000 -2.348000      0.7870000 
1 1 1 13 43 20 o 13.67000 0.3560000 13.51000 0.5085000 13.82000 0.4984000 -0.3077000     0.7120000 
1 1 1 13 43 22 o 12.52000 0.3536000 13.23000 0.4276000 11.81000 0.5633000 1.416000       0.7072000 
1 1 1 13 43 24 o 16.32000 0.4042000 16.41000 0.6455000 16.24000 0.4868000 0.1741000      0.8085000 
1 1 1 13 43 26 o 7.703000 0.5554000 8.987000 0.5412000 6.419000 0.9700000 2.568000       1.111000  
1 1 1 13 43 28 o 5.168000 0.9281000 4.263000 1.077000  6.072000 1.511000  -1.810000      1.856000  
1 1 1 13 43 30 o 4.802000 0.8349000 5.302000 1.064000  4.302000 1.287000  1.001000       1.670000  
1 1 1 13 43 32 o 6.377000 0.6209000 6.317000 0.8008000 6.437000 0.9491000 -0.1196000     1.242000  
1 1 1 13 43 34 o 10.21000 0.4762000 10.48000 0.5495000 9.938000 0.7777000 0.5392000      0.9523000 
1 1 1 13 43 36 o 2.847000 0.8295000 2.904000 1.156000  2.791000 1.189000  0.1130000      1.659000  
1 1 1 13 43 38 o 2.574000 0.7984000 3.130000 1.274000  2.017000 0.9631000 1.113000       1.597000  
1 1 1 13 43 40 o 4.894000 0.9362000 5.485000 1.143000  4.304000 1.483000  1.181000       1.872000  
1 1 1 13 43 42 o 5.328000 0.9313000 5.288000 1.177000  5.368000 1.443000  -0.7960000E-01 1.863000  
1 1 1 13 43 44 o 3.853000 0.9822000 4.047000 1.316000  3.660000 1.458000  0.3875000      1.964000  
1 1 1 13 43 46 o 4.396000 1.058000  5.465000 1.598000  3.326000 1.386000  2.138000       2.116000  
1 1 1 13 44 1  o 10.68000 0.3970000 10.61000 0.5818000 10.75000 0.5403000 -0.1378000     0.7940000 
1 1 1 13 44 3  o 20.82000 0.2874000 20.44000 0.4116000 21.20000 0.4011000 -0.7603000     0.5747000 
1 1 1 13 44 5  o 13.25000 0.3718000 13.51000 0.5968000 12.99000 0.4435000 0.5212000      0.7435000 
1 1 1 13 44 7  o 12.07000 0.4837000 12.15000 0.8539000 11.98000 0.4545000 0.1723000      0.9673000 
1 1 1 13 44 9  o 9.084000 0.4776000 9.768000 0.7713000 8.400000 0.5634000 1.369000       0.9552000 
1 1 1 13 44 11 o 9.374000 0.4828000 8.940000 0.7076000 9.808000 0.6569000 -0.8681000     0.9655000 
1 1 1 13 44 13 o 14.20000 0.3321000 14.18000 0.4986000 14.21000 0.4389000 -0.2577000E-01 0.6642000 
1 1 1 13 44 15 o 17.72000 0.2972000 17.79000 0.4524000 17.65000 0.3856000 0.1398000      0.5945000 
1 1 1 13 44 17 o 22.57000 0.2866000 22.36000 0.4372000 22.78000 0.3707000 -0.4200000     0.5732000 
1 1 1 13 44 19 o 13.83000 0.3246000 13.26000 0.4441000 14.40000 0.4737000 -1.135000      0.6493000 
1 1 1 13 44 21 f 6.253000 0.5728000 6.354000 0.7584000 6.153000 0.8587000 0.2014000      1.146000  
1 1 1 13 44 23 o 6.062000 0.6593000 6.226000 0.9003000 5.898000 0.9634000 0.3286000      1.319000  
1 1 1 13 44 25 o 8.245000 0.5654000 8.064000 0.7684000 8.426000 0.8295000 -0.3617000     1.131000  
1 1 1 13 44 27 o 5.630000 0.7641000 6.531000 0.8784000 4.729000 1.251000  1.802000       1.528000  
1 1 1 13 44 29 o 5.208000 1.011000  5.131000 1.130000  5.285000 1.676000  -0.1538000     2.021000  
1 1 1 13 44 31 o 7.379000 0.6153000 8.028000 0.7167000 6.731000 1.000000  1.296000       1.231000  
1 1 1 13 44 33 o 4.568000 1.181000  4.568000 1.181000  ?        ?         ?              ?         
1 1 1 13 44 35 o 5.239000 0.8753000 5.869000 0.9939000 4.609000 1.441000  1.261000       1.751000  
1 1 1 13 44 37 o 9.743000 0.4728000 8.946000 0.6859000 10.54000 0.6510000 -1.593000      0.9457000 
1 1 1 13 44 39 o 7.913000 0.6432000 7.620000 0.7811000 8.206000 1.022000  -0.5858000     1.286000  
1 1 1 13 44 41 o 4.826000 0.9592000 5.060000 1.250000  4.592000 1.455000  0.4679000      1.918000  
1 1 1 13 44 43 f 4.898000 1.131000  5.159000 1.806000  4.637000 1.361000  0.5226000      2.262000  
1 1 1 13 44 45 o 5.004000 1.025000  3.248000 1.400000  6.759000 1.497000  -3.510000      2.050000  
1 1 1 13 45 0  o 14.65000 0.4498000 14.65000 0.4498000 14.65000 0.4498000 0.000000       0.000000  
1 1 1 13 45 2  o 7.391000 0.5135000 7.382000 0.7407000 7.401000 0.7114000 -0.1866000E-01 1.027000  
1 1 1 13 45 4  o 11.29000 0.3685000 11.00000 0.5442000 11.59000 0.4971000 -0.5936000     0.7371000 
1 1 1 13 45 6  o 10.07000 0.3886000 10.56000 0.5681000 9.581000 0.5303000 0.9805000      0.7772000 
1 1 1 13 45 8  o 2.997000 0.8014000 3.546000 1.227000  2.449000 1.031000  1.097000       1.603000  
1 1 1 13 45 10 o 19.97000 0.3158000 20.36000 0.5105000 19.58000 0.3718000 0.7801000      0.6316000 
1 1 1 13 45 12 o 11.02000 0.5042000 11.06000 0.7170000 10.97000 0.7089000 0.9382000E-01  1.008000  
1 1 1 13 45 14 o 12.44000 0.3475000 12.59000 0.5327000 12.28000 0.4462000 0.3125000      0.6949000 
1 1 1 13 45 16 o 17.53000 0.3021000 17.48000 0.4643000 17.57000 0.3867000 -0.9661000E-01 0.6042000 
1 1 1 13 45 18 o 13.36000 0.3885000 13.54000 0.5846000 13.18000 0.5117000 0.3602000      0.7770000 
1 1 1 13 45 20 o 6.917000 0.5395000 7.045000 0.6820000 6.788000 0.8362000 0.2574000      1.079000  
1 1 1 13 45 22 o 5.872000 0.6516000 6.301000 0.8583000 5.444000 0.9807000 0.8570000      1.303000  
1 1 1 13 45 24 o 4.157000 0.8335000 4.710000 1.115000  3.604000 1.239000  1.106000       1.667000  
1 1 1 13 45 26 o 8.441000 0.5022000 9.250000 0.6342000 7.631000 0.7788000 1.619000       1.004000  
1 1 1 13 45 28 o 5.439000 1.179000  5.503000 0.8518000 5.375000 2.198000  0.1281000      2.358000  
1 1 1 13 45 30 f 6.928000 0.6129000 7.212000 0.7945000 6.644000 0.9334000 0.5678000      1.226000  
1 1 1 13 45 32 o 3.162000 1.188000  3.162000 1.188000  ?        ?         ?              ?         
1 1 1 13 45 34 o 2.957000 0.9302000 3.347000 1.423000  2.567000 1.199000  0.7802000      1.860000  
1 1 1 13 45 36 o 8.707000 0.5049000 8.597000 0.6634000 8.818000 0.7613000 -0.2209000     1.010000  
1 1 1 13 45 38 o 4.207000 0.9765000 3.023000 1.343000  5.392000 1.418000  -2.369000      1.953000  
1 1 1 13 45 40 o 5.455000 0.9474000 6.490000 1.239000  4.420000 1.434000  2.070000       1.895000  
1 1 1 13 45 42 o 7.575000 0.9685000 6.668000 1.635000  8.482000 1.038000  -1.814000      1.937000  
1 1 1 13 45 44 o 4.704000 1.751000  4.704000 1.751000  ?        ?         ?              ?         
1 1 1 13 46 1  o 12.71000 0.3383000 12.79000 0.4727000 12.62000 0.4841000 0.1726000      0.6766000 
1 1 1 13 46 3  o 9.834000 0.4185000 9.089000 0.6207000 10.58000 0.5614000 -1.491000      0.8369000 
1 1 1 13 46 5  o 10.23000 0.3795000 9.975000 0.5712000 10.49000 0.4999000 -0.5174000     0.7591000 
1 1 1 13 46 7  o 22.55000 0.2805000 23.27000 0.4127000 21.82000 0.3801000 1.450000       0.5611000 
1 1 1 13 46 9  o 5.942000 0.6341000 6.678000 0.8529000 5.206000 0.9386000 1.472000       1.268000  
1 1 1 13 46 11 o 13.11000 0.3255000 12.97000 0.4990000 13.25000 0.4181000 -0.2771000     0.6510000 
1 1 1 13 46 13 o 12.42000 0.3938000 13.06000 0.5219000 11.79000 0.5898000 1.272000       0.7875000 
1 1 1 13 46 15 f 13.35000 0.5342000 14.39000 0.9761000 12.30000 0.4343000 2.092000       1.068000  
1 1 1 13 46 17 o 18.43000 0.3214000 19.47000 0.5211000 17.40000 0.3763000 2.072000       0.6428000 
1 1 1 13 46 19 o 10.93000 0.3721000 10.63000 0.4752000 11.22000 0.5728000 -0.5906000     0.7442000 
1 1 1 13 46 21 o 7.193000 0.4972000 7.226000 0.6299000 7.160000 0.7694000 0.6555000E-01  0.9944000 
1 1 1 13 46 23 o 3.163000 0.7991000 3.060000 1.075000  3.266000 1.183000  -0.2064000     1.598000  
1 1 1 13 46 25 o 4.984000 0.7843000 6.033000 1.048000  3.936000 1.167000  2.097000       1.569000  
1 1 1 13 46 27 o 13.90000 0.4758000 14.80000 0.4329000 13.01000 0.8474000 1.792000       0.9516000 
1 1 1 13 46 29 o 6.374000 0.8619000 7.065000 0.7003000 5.682000 1.575000  1.383000       1.724000  
1 1 1 13 46 31 o 2.960000 1.186000  2.960000 1.186000  ?        ?         ?              ?         
1 1 1 13 46 33 o 3.565000 0.9306000 4.210000 1.281000  2.920000 1.350000  1.290000       1.861000  
1 1 1 13 46 35 o 9.543000 0.5531000 9.061000 0.6632000 10.02000 0.8855000 -0.9637000     1.106000  
1 1 1 13 46 37 o 18.40000 0.4417000 18.94000 0.5772000 17.86000 0.6686000 1.081000       0.8833000 
1 1 1 13 46 39 o 9.428000 0.6133000 8.927000 0.9171000 9.928000 0.8145000 -1.001000      1.227000  
1 1 1 13 46 41 o 5.383000 1.072000  5.502000 1.535000  5.264000 1.497000  0.2384000      2.144000  
1 1 1 13 46 43 o 4.885000 2.170000  4.885000 2.170000  ?        ?         ?              ?         
1 1 1 13 47 0  o 2.155000 0.9969000 2.155000 0.9969000 2.155000 0.9969000 0.000000       0.000000  
1 1 1 13 47 2  o 4.921000 0.7846000 5.059000 1.076000  4.783000 1.142000  0.2761000      1.569000  
1 1 1 13 47 4  o 12.59000 0.3790000 12.13000 0.6075000 13.06000 0.4534000 -0.9329000     0.7580000 
1 1 1 13 47 6  o 3.238000 0.8158000 2.769000 1.144000  3.706000 1.163000  -0.9371000     1.632000  
1 1 1 13 47 8  o 5.931000 0.5903000 6.732000 0.8384000 5.129000 0.8313000 1.603000       1.181000  
1 1 1 13 47 10 o 9.403000 0.3914000 9.504000 0.5907000 9.302000 0.5137000 0.2022000      0.7829000 
1 1 1 13 47 12 o 19.07000 0.3224000 18.97000 0.4843000 19.18000 0.4258000 -0.2138000     0.6449000 
1 1 1 13 47 14 o 8.128000 0.5481000 8.136000 0.8018000 8.120000 0.7474000 0.1660000E-01  1.096000  
1 1 1 13 47 16 o 12.65000 0.3990000 13.42000 0.5336000 11.88000 0.5933000 1.542000       0.7979000 
1 1 1 13 47 18 o 13.60000 0.4040000 13.64000 0.6099000 13.56000 0.5299000 0.8479000E-01  0.8080000 
1 1 1 13 47 20 o 2.884000 0.7933000 3.526000 1.204000  2.241000 1.033000  1.286000       1.587000  
1 1 1 13 47 22 o 11.42000 0.3601000 10.91000 0.5063000 11.94000 0.5123000 -1.027000      0.7202000 
1 1 1 13 47 24 o 4.089000 0.9632000 4.123000 1.075000  4.056000 1.599000  0.6697000E-01  1.926000  
1 1 1 13 47 26 o 6.259000 0.8695000 7.276000 0.7631000 5.243000 1.563000  2.033000       1.739000  
1 1 1 13 47 28 o 4.348000 0.9836000 4.256000 1.134000  4.441000 1.608000  -0.1853000     1.967000  
1 1 1 13 47 30 o 10.50000 0.5789000 10.50000 0.5789000 ?        ?         ?              ?         
1 1 1 13 47 32 f 6.235000 1.015000  6.503000 1.105000  5.966000 1.703000  0.5366000      2.030000  
1 1 1 13 47 34 o 3.653000 1.016000  3.477000 1.376000  3.828000 1.495000  -0.3511000     2.032000  
1 1 1 13 47 36 o 7.276000 1.178000  8.596000 0.8663000 5.957000 2.192000  2.640000       2.357000  
1 1 1 13 47 38 o 5.381000 0.9768000 5.255000 1.395000  5.507000 1.367000  -0.2519000     1.954000  
1 1 1 13 47 40 o 8.664000 0.6780000 8.189000 1.044000  9.139000 0.8649000 -0.9491000     1.356000  
1 1 1 13 48 1  o 10.17000 0.4257000 10.26000 0.5732000 10.09000 0.6294000 0.1687000      0.8513000 
1 1 1 13 48 3  o 3.586000 0.9069000 3.962000 1.333000  3.210000 1.230000  0.7523000      1.814000  
1 1 1 13 48 5  o 4.144000 0.7933000 4.007000 1.159000  4.281000 1.083000  -0.2746000     1.587000  
1 1 1 13 48 7  o 3.458000 0.8441000 3.515000 1.266000  3.401000 1.117000  0.1136000      1.688000  
1 1 1 13 48 9  o 3.608000 0.8187000 3.169000 1.154000  4.047000 1.162000  -0.8771000     1.637000  
1 1 1 13 48 11 o 6.573000 0.6244000 6.356000 1.037000  6.789000 0.6961000 -0.4330000     1.249000  
1 1 1 13 48 13 o 4.613000 0.8064000 5.080000 1.171000  4.147000 1.109000  0.9335000      1.613000  
1 1 1 13 48 15 f 10.44000 0.4719000 10.56000 0.6423000 10.32000 0.6915000 0.2331000      0.9438000 
1 1 1 13 48 17 o 18.16000 0.4110000 17.92000 0.6705000 18.40000 0.4756000 -0.4889000     0.8220000 
1 1 1 13 48 19 o 13.96000 0.3310000 14.20000 0.4618000 13.73000 0.4744000 0.4719000      0.6621000 
1 1 1 13 48 21 o 4.248000 0.8048000 4.772000 1.014000  3.723000 1.250000  1.049000       1.610000  
1 1 1 13 48 23 o 9.193000 0.6408000 9.623000 0.4941000 8.764000 1.183000  0.8587000      1.282000  
1 1 1 13 48 25 o 8.092000 0.6840000 7.168000 0.7522000 9.016000 1.143000  -1.848000      1.368000  
1 1 1 13 48 27 o 8.621000 0.9718000 8.450000 0.9731000 8.792000 1.683000  -0.3423000     1.944000  
1 1 1 13 48 29 o 7.894000 0.7023000 7.288000 0.6235000 8.500000 1.259000  -1.212000      1.405000  
1 1 1 13 48 31 o 5.512000 0.9599000 6.216000 1.173000  4.807000 1.519000  1.409000       1.920000  
1 1 1 13 48 33 o 4.086000 1.094000  3.696000 1.403000  4.477000 1.679000  -0.7803000     2.188000  
1 1 1 13 48 35 o 5.538000 0.9491000 5.834000 1.288000  5.241000 1.395000  0.5928000      1.898000  
1 1 1 13 48 37 o 3.951000 1.042000  4.294000 1.498000  3.609000 1.450000  0.6855000      2.084000  
1 1 1 13 48 39 o 4.371000 1.158000  4.449000 1.439000  4.292000 1.816000  0.1571000      2.317000  
1 1 1 13 49 0  o 14.87000 0.5025000 14.87000 0.5025000 14.87000 0.5025000 0.000000       0.000000  
1 1 1 13 49 2  o 7.767000 0.6380000 7.481000 1.068000  8.053000 0.6977000 -0.5725000     1.276000  
1 1 1 13 49 4  o 5.843000 0.6416000 6.694000 0.8331000 4.993000 0.9759000 1.701000       1.283000  
1 1 1 13 49 6  f 10.45000 0.5147000 11.08000 0.8750000 9.818000 0.5422000 1.260000       1.029000  
1 1 1 13 49 8  o 12.20000 0.3973000 12.06000 0.6529000 12.34000 0.4529000 -0.2825000     0.7946000 
1 1 1 13 49 10 o 9.820000 0.4937000 9.957000 0.7868000 9.682000 0.5965000 0.2754000      0.9873000 
1 1 1 13 49 12 o 26.69000 0.3464000 26.85000 0.5021000 26.52000 0.4775000 0.3245000      0.6929000 
1 1 1 13 49 14 f 17.60000 0.3297000 17.29000 0.5320000 17.92000 0.3897000 -0.6343000     0.6595000 
1 1 1 13 49 16 o 7.000000 0.7482000 7.381000 1.135000  6.619000 0.9758000 0.7614000      1.496000  
1 1 1 13 49 18 o 5.341000 0.7776000 5.125000 1.118000  5.556000 1.081000  -0.4312000     1.555000  
1 1 1 13 49 20 o 5.691000 0.8310000 5.252000 0.9916000 6.129000 1.334000  -0.8772000     1.662000  
1 1 1 13 49 22 o 5.231000 0.9129000 3.753000 1.104000  6.708000 1.454000  -2.955000      1.826000  
1 1 1 13 49 24 o 5.512000 0.8760000 6.572000 0.7219000 4.451000 1.596000  2.121000       1.752000  
1 1 1 13 49 26 o 2.521000 1.075000  2.521000 1.075000  ?        ?         ?              ?         
1 1 1 13 49 28 o 7.925000 0.8358000 8.553000 0.8457000 7.296000 1.442000  1.257000       1.672000  
1 1 1 13 49 30 o 4.404000 1.112000  4.346000 1.524000  4.463000 1.619000  -0.1168000     2.224000  
1 1 1 13 49 32 o 5.082000 1.026000  6.233000 1.332000  3.930000 1.562000  2.303000       2.053000  
1 1 1 13 49 34 o 10.67000 0.6537000 11.42000 0.9208000 9.915000 0.9280000 1.510000       1.307000  
1 1 1 13 49 36 o 3.432000 0.9664000 3.246000 1.319000  3.618000 1.413000  -0.3720000     1.933000  
1 1 1 13 49 38 o 4.578000 1.081000  4.318000 1.497000  4.839000 1.559000  -0.5210000     2.161000  
1 1 1 13 50 1  o 5.253000 0.7977000 5.283000 1.220000  5.222000 1.028000  0.6058000E-01  1.595000  
1 1 1 13 50 3  o 15.91000 0.3049000 16.02000 0.4316000 15.79000 0.4307000 0.2242000      0.6098000 
1 1 1 13 50 5  o 10.17000 0.4759000 10.41000 0.7789000 9.929000 0.5469000 0.4831000      0.9517000 
1 1 1 13 50 7  o 3.753000 0.7270000 2.387000 1.120000  5.120000 0.9273000 -2.733000      1.454000  
1 1 1 13 50 9  o 8.027000 0.4999000 7.679000 0.8096000 8.375000 0.5865000 -0.6965000     0.9998000 
1 1 1 13 50 11 o 10.87000 0.3985000 10.95000 0.5656000 10.79000 0.5614000 0.1543000      0.7969000 
1 1 1 13 50 13 o 3.539000 0.8514000 4.084000 1.288000  2.993000 1.114000  1.091000       1.703000  
1 1 1 13 50 15 o 3.458000 0.7972000 3.748000 1.123000  3.168000 1.132000  0.5796000      1.594000  
1 1 1 13 50 17 o 12.84000 0.3483000 13.35000 0.5251000 12.33000 0.4576000 1.017000       0.6965000 
1 1 1 13 50 19 o 5.699000 0.9617000 5.100000 1.196000  6.298000 1.506000  -1.198000      1.923000  
1 1 1 13 50 21 o 10.99000 0.5073000 10.70000 0.5008000 11.28000 0.8824000 -0.5754000     1.015000  
1 1 1 13 50 23 o 4.217000 1.098000  3.517000 1.150000  4.917000 1.870000  -1.400000      2.195000  
1 1 1 13 50 25 o 3.344000 1.068000  3.344000 1.068000  ?        ?         ?              ?         
1 1 1 13 50 27 o 4.531000 1.002000  4.335000 1.261000  4.728000 1.557000  -0.3933000     2.003000  
1 1 1 13 50 29 o 2.873000 0.9266000 2.364000 1.114000  3.381000 1.481000  -1.017000      1.853000  
1 1 1 13 50 31 o 5.764000 1.028000  6.479000 1.219000  5.048000 1.656000  1.431000       2.056000  
1 1 1 13 50 33 o 6.985000 0.7960000 6.643000 1.124000  7.327000 1.127000  -0.6841000     1.592000  
1 1 1 13 50 35 o 5.453000 0.8857000 6.119000 1.227000  4.787000 1.278000  1.332000       1.771000  
1 1 1 13 50 37 o 7.462000 0.9762000 8.700000 1.468000  6.224000 1.287000  2.475000       1.952000  
1 1 1 13 51 0  o 12.85000 0.6103000 12.85000 0.6103000 12.85000 0.6103000 0.000000       0.000000  
1 1 1 13 51 2  o 14.44000 0.3383000 14.27000 0.4916000 14.61000 0.4649000 -0.3413000     0.6766000 
1 1 1 13 51 4  o 13.37000 0.3938000 13.82000 0.6370000 12.92000 0.4632000 0.9016000      0.7876000 
1 1 1 13 51 6  o 4.765000 0.7637000 5.208000 1.025000  4.323000 1.132000  0.8849000      1.527000  
1 1 1 13 51 8  o 3.432000 0.8148000 3.246000 1.153000  3.618000 1.151000  -0.3717000     1.630000  
1 1 1 13 51 10 o 2.831000 0.7861000 2.970000 1.163000  2.692000 1.058000  0.2778000      1.572000  
1 1 1 13 51 12 o 2.901000 0.7904000 2.389000 1.061000  3.414000 1.172000  -1.025000      1.581000  
1 1 1 13 51 14 o 5.107000 0.7336000 4.226000 1.249000  5.987000 0.7694000 -1.761000      1.467000  
1 1 1 13 51 16 f 10.17000 0.4544000 10.88000 0.5882000 9.461000 0.6928000 1.420000       0.9088000 
1 1 1 13 51 18 f 4.316000 0.9352000 4.952000 1.368000  3.680000 1.276000  1.272000       1.870000  
1 1 1 13 51 20 o 4.553000 1.070000  3.445000 1.260000  5.661000 1.730000  -2.216000      2.141000  
1 1 1 13 51 22 o 3.401000 1.017000  2.750000 1.085000  4.052000 1.721000  -1.303000      2.034000  
1 1 1 13 51 24 o 9.900000 1.026000  11.84000 0.6036000 7.961000 1.962000  3.879000       2.053000  
1 1 1 13 51 26 o 8.373000 0.8261000 9.034000 0.7581000 7.712000 1.468000  1.323000       1.652000  
1 1 1 13 51 28 o 6.051000 0.9524000 4.883000 1.251000  7.220000 1.436000  -2.336000      1.905000  
1 1 1 13 51 30 o 5.969000 1.091000  5.637000 1.419000  6.301000 1.657000  -0.6636000     2.181000  
1 1 1 13 51 32 o 2.714000 0.8815000 2.334000 1.069000  3.095000 1.402000  -0.7609000     1.763000  
1 1 1 13 51 34 o 3.188000 0.9566000 3.428000 1.390000  2.948000 1.314000  0.4798000      1.913000  
1 1 1 13 52 1  o 3.711000 0.9515000 3.559000 1.232000  3.864000 1.451000  -0.3051000     1.903000  
1 1 1 13 52 3  o 2.355000 0.7471000 2.284000 1.059000  2.426000 1.054000  -0.1426000     1.494000  
1 1 1 13 52 5  o 16.54000 0.3546000 16.92000 0.5241000 16.15000 0.4777000 0.7710000      0.7091000 
1 1 1 13 52 7  o 10.41000 0.3982000 10.46000 0.5558000 10.36000 0.5704000 0.9913000E-01  0.7964000 
1 1 1 13 52 9  o 5.387000 0.6743000 5.326000 1.041000  5.447000 0.8574000 -0.1203000     1.349000  
1 1 1 13 52 11 o 2.547000 0.7655000 2.427000 1.083000  2.667000 1.082000  -0.2408000     1.531000  
1 1 1 13 52 13 o 6.462000 0.9973000 6.571000 0.8731000 6.353000 1.793000  0.2173000      1.995000  
1 1 1 13 52 15 o 2.987000 0.8533000 2.314000 1.044000  3.660000 1.350000  -1.345000      1.707000  
1 1 1 13 52 17 o 6.035000 1.080000  5.843000 1.191000  6.226000 1.801000  -0.3831000     2.159000  
1 1 1 13 52 19 o 12.00000 0.6262000 11.82000 0.6159000 12.18000 1.090000  -0.3536000     1.252000  
1 1 1 13 52 21 o 6.691000 0.8450000 8.937000 0.7480000 4.446000 1.515000  4.492000       1.690000  
1 1 1 13 52 23 o 8.744000 0.6713000 8.196000 0.7175000 9.293000 1.135000  -1.098000      1.343000  
1 1 1 13 52 25 o 6.485000 0.8914000 5.750000 1.133000  7.220000 1.376000  -1.471000      1.783000  
1 1 1 13 52 27 o 3.703000 1.056000  3.840000 1.447000  3.565000 1.538000  0.2742000      2.112000  
1 1 1 13 52 29 o 3.293000 0.9964000 3.205000 1.282000  3.381000 1.526000  -0.1757000     1.993000  
1 1 1 13 52 31 o 8.179000 1.081000  9.677000 0.6977000 6.680000 2.045000  2.997000       2.161000  
1 1 1 13 52 33 o 5.371000 0.9340000 5.052000 1.368000  5.691000 1.271000  -0.6390000     1.868000  
1 1 1 13 53 0  o 6.902000 0.8950000 6.902000 0.8950000 6.902000 0.8950000 0.000000       0.000000  
1 1 1 13 53 2  o 8.126000 0.4885000 7.133000 0.7575000 9.120000 0.6172000 -1.987000      0.9771000 
1 1 1 13 53 4  o 3.105000 0.8268000 3.041000 1.173000  3.169000 1.165000  -0.1287000     1.654000  
1 1 1 13 53 6  o 2.718000 0.7815000 2.769000 1.117000  2.667000 1.094000  0.1019000      1.563000  
1 1 1 13 53 8  o 3.170000 0.8021000 3.965000 1.205000  2.375000 1.059000  1.590000       1.604000  
1 1 1 13 53 10 o 2.883000 0.7951000 2.542000 1.113000  3.224000 1.136000  -0.6823000     1.590000  
1 1 1 13 53 12 o 5.331000 0.8309000 5.647000 1.060000  5.014000 1.280000  0.6330000      1.662000  
1 1 1 13 53 14 o 5.125000 1.062000  4.547000 1.245000  5.703000 1.721000  -1.157000      2.124000  
1 1 1 13 53 16 o 10.29000 0.4721000 10.89000 0.6353000 9.688000 0.6984000 1.199000       0.9441000 
1 1 1 13 53 18 o 7.778000 0.8641000 8.461000 0.7340000 7.095000 1.565000  1.366000       1.728000  
1 1 1 13 53 20 o 3.999000 1.198000  3.109000 1.246000  4.889000 2.047000  -1.780000      2.396000  
1 1 1 13 53 22 o 7.610000 0.8330000 6.749000 0.9455000 8.472000 1.372000  -1.723000      1.666000  
1 1 1 13 53 24 o 4.981000 1.046000  4.501000 1.369000  5.460000 1.581000  -0.9592000     2.092000  
1 1 1 13 53 26 o 4.946000 1.073000  3.437000 1.377000  6.455000 1.646000  -3.019000      2.146000  
1 1 1 13 53 28 o 7.303000 1.139000  8.049000 0.8278000 6.557000 2.122000  1.492000       2.278000  
1 1 1 13 53 30 o 4.723000 1.130000  3.772000 1.345000  5.674000 1.816000  -1.901000      2.260000  
1 1 1 13 53 32 o 3.794000 1.528000  3.794000 1.528000  ?        ?         ?              ?         
1 1 1 13 54 1  o 10.78000 0.4241000 10.80000 0.5861000 10.76000 0.6130000 0.3703000E-01  0.8481000 
1 1 1 13 54 3  o 9.990000 0.4178000 10.05000 0.6026000 9.928000 0.5788000 0.1234000      0.8356000 
1 1 1 13 54 5  o 3.639000 0.7739000 4.550000 1.054000  2.728000 1.133000  1.822000       1.548000  
1 1 1 13 54 7  o 5.699000 0.6380000 5.576000 0.9629000 5.822000 0.8374000 -0.2464000     1.276000  
1 1 1 13 54 9  o 8.841000 0.4637000 8.534000 0.7258000 9.147000 0.5772000 -0.6129000     0.9273000 
1 1 1 13 54 11 o 8.932000 0.4387000 9.218000 0.6654000 8.646000 0.5720000 0.5716000      0.8774000 
1 1 1 13 54 13 o 6.438000 0.6593000 7.263000 0.9819000 5.613000 0.8801000 1.650000       1.319000  
1 1 1 13 54 15 f 8.625000 0.8053000 9.500000 0.6981000 7.749000 1.451000  1.752000       1.611000  
1 1 1 13 54 17 o 9.636000 0.7293000 10.50000 0.6557000 8.772000 1.303000  1.728000       1.459000  
1 1 1 13 54 19 o 5.609000 1.271000  4.789000 1.196000  6.428000 2.244000  -1.639000      2.543000  
1 1 1 13 54 21 o 8.864000 0.7312000 9.123000 0.7087000 8.606000 1.279000  0.5178000      1.462000  
1 1 1 13 54 23 o 9.414000 0.6836000 9.730000 0.7214000 9.098000 1.161000  0.6325000      1.367000  
1 1 1 13 54 25 o 6.317000 0.9435000 5.857000 1.203000  6.778000 1.454000  -0.9213000     1.887000  
1 1 1 13 54 27 o 3.809000 1.088000  3.585000 1.387000  4.034000 1.677000  -0.4492000     2.176000  
1 1 1 13 54 29 o 5.028000 1.116000  4.112000 1.308000  5.945000 1.808000  -1.833000      2.232000  
1 1 1 13 55 0  o 2.557000 1.126000  2.557000 1.126000  2.557000 1.126000  0.000000       0.000000  
1 1 1 13 55 2  o 6.942000 0.5849000 6.447000 0.9077000 7.436000 0.7380000 -0.9887000     1.170000  
1 1 1 13 55 4  o 14.74000 0.3274000 14.76000 0.4800000 14.73000 0.4454000 0.2942000E-01  0.6548000 
1 1 1 13 55 6  o 3.923000 0.8185000 4.407000 1.182000  3.439000 1.133000  0.9681000      1.637000  
1 1 1 13 55 8  f 3.887000 0.8227000 3.565000 1.228000  4.209000 1.096000  -0.6442000     1.645000  
1 1 1 13 55 10 o 4.397000 0.7644000 3.713000 1.245000  5.081000 0.8875000 -1.368000      1.529000  
1 1 1 13 55 12 o 3.709000 0.9625000 3.970000 1.442000  3.448000 1.275000  0.5220000      1.925000  
1 1 1 13 55 14 o 6.218000 0.9812000 6.401000 1.057000  6.034000 1.654000  0.3677000      1.962000  
1 1 1 13 55 16 o 7.435000 1.087000  6.478000 0.9020000 8.392000 1.979000  -1.913000      2.175000  
1 1 1 13 55 18 o 5.809000 0.9950000 5.602000 1.124000  6.015000 1.642000  -0.4129000     1.990000  
1 1 1 13 55 20 o 3.792000 1.039000  3.050000 1.279000  4.534000 1.636000  -1.484000      2.077000  
1 1 1 13 55 22 o 4.864000 1.054000  4.902000 1.188000  4.826000 1.741000  0.7626000E-01  2.107000  
1 1 1 13 55 24 o 7.844000 0.9434000 6.748000 1.047000  8.940000 1.570000  -2.193000      1.887000  
1 1 1 13 55 26 o 3.625000 1.032000  2.771000 1.173000  4.478000 1.698000  -1.707000      2.064000  
1 1 1 13 56 1  o 3.080000 0.7758000 1.985000 0.9496000 4.176000 1.227000  -2.190000      1.552000  
1 1 1 13 56 3  o 9.557000 0.5019000 9.450000 0.6297000 9.663000 0.7818000 -0.2133000     1.004000  
1 1 1 13 56 5  o 9.518000 0.4266000 8.924000 0.6416000 10.11000 0.5625000 -1.188000      0.8532000 
1 1 1 13 56 7  o 4.556000 0.8790000 4.951000 1.134000  4.161000 1.343000  0.7898000      1.758000  
1 1 1 13 56 9  o 3.798000 0.9016000 3.604000 1.211000  3.992000 1.336000  -0.3874000     1.803000  
1 1 1 13 56 11 o 5.173000 0.8482000 6.655000 1.072000  3.691000 1.315000  2.965000       1.696000  
1 1 1 13 56 13 o 5.359000 0.8988000 4.600000 1.232000  6.118000 1.309000  -1.518000      1.798000  
1 1 1 13 56 15 o 4.016000 1.136000  3.835000 1.410000  4.196000 1.783000  -0.3610000     2.273000  
1 1 1 13 56 17 o 6.265000 0.9525000 4.880000 1.154000  7.650000 1.516000  -2.770000      1.905000  
1 1 1 13 56 19 o 5.944000 1.004000  5.878000 1.164000  6.009000 1.637000  -0.1306000     2.008000  
1 1 1 13 56 21 o 3.808000 1.117000  3.587000 1.306000  4.028000 1.812000  -0.4407000     2.234000  
1 1 1 13 56 23 o 3.213000 0.9918000 2.813000 1.213000  3.614000 1.569000  -0.8013000     1.984000  
1 1 1 13 56 25 o 4.602000 1.136000  3.895000 1.592000  5.309000 1.620000  -1.414000      2.271000  
1 1 1 13 57 0  o 2.816000 1.214000  2.816000 1.214000  2.816000 1.214000  0.000000       0.000000  
1 1 1 13 57 2  o 3.228000 0.8253000 3.991000 1.250000  2.464000 1.078000  1.527000       1.651000  
1 1 1 13 57 4  o 4.208000 0.9314000 4.091000 1.240000  4.325000 1.390000  -0.2336000     1.863000  
1 1 1 13 57 6  o 2.580000 0.8052000 2.405000 1.047000  2.756000 1.223000  -0.3512000     1.610000  
1 1 1 13 57 8  o 2.857000 0.8333000 2.645000 1.121000  3.068000 1.234000  -0.4227000     1.667000  
1 1 1 13 57 10 o 3.308000 0.9489000 3.645000 1.356000  2.971000 1.328000  0.6742000      1.898000  
1 1 1 13 57 12 o 4.598000 1.240000  3.694000 1.308000  5.503000 2.108000  -1.809000      2.481000  
1 1 1 13 57 14 o 8.565000 0.8512000 9.332000 0.8009000 7.797000 1.502000  1.535000       1.702000  
1 1 1 13 57 16 o 4.005000 0.9418000 4.895000 1.292000  3.115000 1.371000  1.780000       1.884000  
1 1 1 13 57 18 o 6.065000 1.235000  5.113000 1.195000  7.017000 2.161000  -1.903000      2.470000  
1 1 1 13 57 20 o 4.709000 1.048000  3.674000 1.325000  5.744000 1.623000  -2.071000      2.095000  
1 1 1 13 57 22 o 5.356000 1.165000  5.234000 1.419000  5.478000 1.848000  -0.2437000     2.330000  
1 1 1 13 58 1  o 5.659000 0.7763000 4.924000 1.148000  6.394000 1.045000  -1.470000      1.553000  
1 1 1 13 58 3  o 4.931000 0.7523000 6.226000 0.9174000 3.635000 1.193000  2.591000       1.505000  
1 1 1 13 58 5  o 6.131000 0.7185000 5.463000 1.032000  6.798000 1.000000  -1.334000      1.437000  
1 1 1 13 58 7  o 11.94000 0.5800000 12.91000 0.5396000 10.97000 1.027000  1.942000       1.160000  
1 1 1 13 58 9  f 6.408000 1.119000  5.086000 0.9974000 7.730000 2.003000  -2.644000      2.237000  
1 1 1 13 58 11 o 6.249000 0.9412000 6.113000 0.9859000 6.384000 1.604000  -0.2708000     1.882000  
1 1 1 13 58 13 o 3.609000 1.055000  2.760000 1.243000  4.459000 1.704000  -1.699000      2.110000  
1 1 1 13 58 15 o 12.22000 0.7704000 11.19000 0.6837000 13.25000 1.381000  -2.061000      1.541000  
1 1 1 13 58 17 o 8.686000 0.7534000 8.054000 0.9200000 9.318000 1.193000  -1.264000      1.507000  
1 1 1 13 58 19 o 4.093000 1.122000  4.271000 1.552000  3.914000 1.621000  0.3572000      2.245000  
1 1 1 13 59 0  f 2.611000 1.127000  2.611000 1.127000  2.611000 1.127000  0.000000       0.000000  
1 1 1 13 59 2  o 3.083000 0.8580000 2.540000 1.094000  3.627000 1.322000  -1.087000      1.716000  
1 1 1 13 59 4  o 2.561000 0.7901000 2.878000 1.160000  2.244000 1.073000  0.6339000      1.580000  
1 1 1 13 59 6  o 4.834000 1.077000  4.642000 1.089000  5.026000 1.860000  -0.3843000     2.155000  
1 1 1 13 59 8  o 2.986000 0.9237000 2.569000 1.101000  3.403000 1.483000  -0.8335000     1.847000  
1 1 1 13 59 10 o 8.442000 0.7170000 7.600000 0.8102000 9.283000 1.183000  -1.683000      1.434000  
1 1 1 13 59 12 o 3.222000 0.9637000 3.721000 1.481000  2.723000 1.233000  0.9981000      1.927000  
1 1 1 13 59 14 o 5.933000 1.102000  5.412000 1.289000  6.454000 1.788000  -1.043000      2.204000  
1 1 1 13 60 1  o 7.141000 0.7104000 6.756000 0.8697000 7.526000 1.123000  -0.7705000     1.421000  
1 1 1 13 60 3  o 3.347000 1.017000  2.612000 1.090000  4.082000 1.718000  -1.470000      2.035000  
1 1 1 13 60 5  o 5.036000 1.005000  5.677000 1.044000  4.396000 1.718000  1.281000       2.010000  
1 1 1 13 60 7  o 3.675000 0.8917000 1.838000 0.8950000 5.512000 1.543000  -3.675000      1.783000  
1 1 1 13 60 9  o 3.241000 1.012000  2.921000 1.243000  3.560000 1.598000  -0.6397000     2.025000  
1 1 1 14 0  0  o 5.335000 1.174000  5.335000 1.174000  5.335000 1.174000  0.000000       0.000000  
1 1 1 14 0  2  o 70.11000 0.9762000 70.11000 0.9762000 70.11000 0.9762000 0.000000       0.000000  
1 1 1 14 0  4  o 23.59000 0.2991000 23.59000 0.2991000 23.59000 0.2991000 0.000000       0.000000  
1 1 1 14 0  6  o 124.2000 1.385000  124.2000 1.385000  124.2000 1.385000  0.000000       0.000000  
1 1 1 14 0  8  o 185.6000 2.061000  185.6000 2.061000  185.6000 2.061000  0.000000       0.000000  
1 1 1 14 0  10 o 16.10000 0.4646000 16.10000 0.4646000 16.10000 0.4646000 0.000000       0.000000  
1 1 1 14 0  12 o 160.2000 2.181000  160.2000 2.181000  160.2000 2.181000  0.000000       0.000000  
1 1 1 14 0  14 o 73.35000 0.7260000 73.35000 0.7260000 73.35000 0.7260000 0.000000       0.000000  
1 1 1 14 0  16 o 44.70000 0.4784000 44.70000 0.4784000 44.70000 0.4784000 0.000000       0.000000  
1 1 1 14 0  18 o 12.05000 0.5431000 12.05000 0.5431000 12.05000 0.5431000 0.000000       0.000000  
1 1 1 14 0  20 o 63.65000 0.6445000 63.65000 0.6445000 63.65000 0.6445000 0.000000       0.000000  
1 1 1 14 0  22 o 4.329000 1.374000  4.329000 1.374000  4.329000 1.374000  0.000000       0.000000  
1 1 1 14 0  24 o 93.58000 0.9201000 93.58000 0.9201000 93.58000 0.9201000 0.000000       0.000000  
1 1 1 14 0  26 o 48.60000 0.5306000 48.60000 0.5306000 48.60000 0.5306000 0.000000       0.000000  
1 1 1 14 0  28 o 17.94000 0.4593000 17.94000 0.4593000 17.94000 0.4593000 0.000000       0.000000  
1 1 1 14 0  30 o 62.60000 0.6454000 62.60000 0.6454000 62.60000 0.6454000 0.000000       0.000000  
1 1 1 14 0  32 o 39.57000 0.4736000 39.57000 0.4736000 39.57000 0.4736000 0.000000       0.000000  
1 1 1 14 0  34 o 12.68000 0.5877000 12.68000 0.5877000 12.68000 0.5877000 0.000000       0.000000  
1 1 1 14 0  36 o 6.893000 1.004000  6.893000 1.004000  6.893000 1.004000  0.000000       0.000000  
1 1 1 14 0  38 o 19.26000 0.4977000 19.26000 0.4977000 19.26000 0.4977000 0.000000       0.000000  
1 1 1 14 0  40 o 18.67000 0.5103000 18.67000 0.5103000 18.67000 0.5103000 0.000000       0.000000  
1 1 1 14 0  42 o 32.94000 0.6665000 32.94000 0.6665000 32.94000 0.6665000 0.000000       0.000000  
1 1 1 14 0  44 o 18.06000 0.5525000 18.06000 0.5525000 18.06000 0.5525000 0.000000       0.000000  
1 1 1 14 0  46 o 3.769000 1.521000  3.769000 1.521000  3.769000 1.521000  0.000000       0.000000  
1 1 1 14 0  48 o 13.64000 0.6405000 13.64000 0.6405000 13.64000 0.6405000 0.000000       0.000000  
1 1 1 14 0  50 o 20.52000 0.5024000 20.52000 0.5024000 20.52000 0.5024000 0.000000       0.000000  
1 1 1 14 0  52 o 11.09000 0.6758000 11.09000 0.6758000 11.09000 0.6758000 0.000000       0.000000  
1 1 1 14 0  54 o 3.570000 1.443000  3.570000 1.443000  3.570000 1.443000  0.000000       0.000000  
1 1 1 14 0  56 o 14.84000 0.5998000 14.84000 0.5998000 14.84000 0.5998000 0.000000       0.000000  
1 1 1 14 0  58 o 20.38000 0.5139000 20.38000 0.5139000 20.38000 0.5139000 0.000000       0.000000  
1 1 1 14 0  60 o 3.879000 1.437000  3.879000 1.437000  3.879000 1.437000  0.000000       0.000000  
1 1 1 14 0  62 o 5.731000 1.495000  5.731000 1.495000  5.731000 1.495000  0.000000       0.000000  
1 1 1 14 0  64 o 3.563000 1.411000  3.563000 1.411000  3.563000 1.411000  0.000000       0.000000  
1 1 1 14 1  1  o 46.02000 0.4063000 45.46000 0.6585000 46.58000 0.4762000 -1.126000      0.8127000 
1 1 1 14 1  3  o 37.39000 0.3446000 37.04000 0.5593000 37.73000 0.4026000 -0.6868000     0.6891000 
1 1 1 14 1  5  o 73.25000 0.5502000 73.63000 0.8354000 72.88000 0.7163000 0.7448000      1.100000  
1 1 1 14 1  7  o 97.92000 0.7277000 98.70000 1.108000  97.13000 0.9438000 1.567000       1.455000  
1 1 1 14 1  9  f 75.45000 0.6059000 75.38000 0.8561000 75.52000 0.8578000 -0.1472000     1.212000  
1 1 1 14 1  11 o 83.32000 0.6239000 82.87000 0.8119000 83.76000 0.9474000 -0.8885000     1.248000  
1 1 1 14 1  13 o 93.88000 0.7934000 93.87000 0.9163000 93.89000 1.295000  -0.1825000E-01 1.587000  
1 1 1 14 1  15 o 42.24000 0.3228000 41.85000 0.4540000 42.63000 0.4591000 -0.7732000     0.6457000 
1 1 1 14 1  17 o 17.44000 0.2982000 17.69000 0.4431000 17.20000 0.3992000 0.4937000      0.5964000 
1 1 1 14 1  19 o 75.09000 0.5709000 74.74000 0.7434000 75.44000 0.8667000 -0.7013000     1.142000  
1 1 1 14 1  21 o 21.63000 0.2766000 21.46000 0.3875000 21.81000 0.3948000 -0.3558000     0.5532000 
1 1 1 14 1  23 o 8.360000 0.5924000 8.368000 0.7618000 8.352000 0.9075000 0.1528000E-01  1.185000  
1 1 1 14 1  25 o 57.18000 0.4221000 56.96000 0.5947000 57.39000 0.5992000 -0.4239000     0.8442000 
1 1 1 14 1  27 o 8.616000 0.6400000 8.056000 1.041000  9.176000 0.7453000 -1.120000      1.280000  
1 1 1 14 1  29 o 23.89000 0.2919000 23.66000 0.4132000 24.12000 0.4124000 -0.4581000     0.5838000 
1 1 1 14 1  31 o 21.48000 0.3363000 21.59000 0.4976000 21.37000 0.4527000 0.2232000      0.6727000 
1 1 1 14 1  33 o 48.31000 0.4377000 47.96000 0.6121000 48.66000 0.6258000 -0.6957000     0.8754000 
1 1 1 14 1  35 o 54.32000 0.4113000 54.67000 0.5856000 53.97000 0.5778000 0.7017000      0.8227000 
1 1 1 14 1  37 o 20.30000 0.3699000 20.43000 0.5176000 20.17000 0.5286000 0.2635000      0.7398000 
1 1 1 14 1  39 o 18.76000 0.3563000 18.93000 0.5117000 18.59000 0.4959000 0.3444000      0.7126000 
1 1 1 14 1  41 o 12.63000 0.5211000 13.14000 0.6627000 12.12000 0.8042000 1.025000       1.042000  
1 1 1 14 1  43 o 21.37000 0.3572000 21.02000 0.4900000 21.71000 0.5198000 -0.6882000     0.7144000 
1 1 1 14 1  45 o 13.40000 0.5388000 12.98000 0.8552000 13.81000 0.6556000 -0.8261000     1.078000  
1 1 1 14 1  47 o 15.75000 0.4208000 16.06000 0.5801000 15.43000 0.6098000 0.6323000      0.8416000 
1 1 1 14 1  49 o 12.42000 0.4919000 11.97000 0.7133000 12.86000 0.6777000 -0.8909000     0.9839000 
1 1 1 14 1  51 o 3.498000 0.9300000 3.117000 1.286000  3.880000 1.344000  -0.7633000     1.860000  
1 1 1 14 1  53 o 6.842000 0.7667000 7.617000 0.9364000 6.067000 1.214000  1.550000       1.533000  
1 1 1 14 1  55 o 5.049000 1.025000  5.250000 1.503000  4.847000 1.395000  0.4032000      2.050000  
1 1 1 14 1  57 f 3.798000 1.110000  3.517000 1.576000  4.079000 1.562000  -0.5623000     2.219000  
1 1 1 14 1  59 o 7.289000 0.8986000 5.999000 1.438000  8.580000 1.078000  -2.581000      1.797000  
1 1 1 14 1  61 o 8.945000 0.6843000 8.782000 0.9601000 9.107000 0.9755000 -0.3248000     1.369000  
1 1 1 14 1  63 o 3.909000 1.027000  3.561000 1.392000  4.256000 1.512000  -0.6947000     2.055000  
1 1 1 14 1  65 o 3.379000 1.010000  3.605000 1.531000  3.152000 1.319000  0.4528000      2.020000  
1 1 1 14 2  0  o 42.43000 0.4419000 42.43000 0.4419000 42.43000 0.4419000 0.000000       0.000000  
1 1 1 14 2  2  o 89.59000 0.6667000 89.81000 1.010000  89.36000 0.8706000 0.4506000      1.333000  
1 1 1 14 2  4  o 128.0000 0.9436000 127.9000 1.425000  128.2000 1.237000  -0.2795000     1.887000  
1 1 1 14 2  6  o 108.8000 0.8046000 108.3000 1.212000  109.3000 1.059000  -1.052000      1.609000  
1 1 1 14 2  8  o 142.5000 0.9719000 143.9000 1.388000  141.2000 1.361000  2.713000       1.944000  
1 1 1 14 2  10 o 93.56000 0.6444000 93.66000 0.9121000 93.47000 0.9106000 0.1921000      1.289000  
1 1 1 14 2  12 o 134.2000 0.9165000 133.6000 1.290000  134.8000 1.302000  -1.213000      1.833000  
1 1 1 14 2  14 f 94.11000 0.7013000 94.57000 0.9225000 93.65000 1.057000  0.9201000      1.403000  
1 1 1 14 2  16 o 67.67000 0.5519000 67.79000 0.7810000 67.54000 0.7799000 0.2546000      1.104000  
1 1 1 14 2  18 o 69.59000 0.5684000 69.07000 0.7980000 70.10000 0.8096000 -1.035000      1.137000  
1 1 1 14 2  20 o 59.78000 0.4315000 59.55000 0.6078000 60.01000 0.6127000 -0.4609000     0.8630000 
1 1 1 14 2  22 o 62.78000 0.5527000 63.35000 0.6458000 62.22000 0.8971000 1.125000       1.105000  
1 1 1 14 2  24 o 7.024000 0.6550000 6.742000 0.9367000 7.306000 0.9157000 -0.5642000     1.310000  
1 1 1 14 2  26 o 53.30000 0.4001000 53.52000 0.5671000 53.08000 0.5645000 0.4368000      0.8001000 
1 1 1 14 2  28 o 12.27000 0.4529000 12.25000 0.6904000 12.29000 0.5865000 -0.3774000E-01 0.9059000 
1 1 1 14 2  30 o 17.34000 0.3941000 17.16000 0.5814000 17.52000 0.5323000 -0.3621000     0.7883000 
1 1 1 14 2  32 o 23.92000 0.3280000 23.91000 0.4922000 23.93000 0.4338000 -0.1430000E-01 0.6560000 
1 1 1 14 2  34 o 11.78000 0.4474000 11.73000 0.6427000 11.82000 0.6226000 -0.8923000E-01 0.8948000 
1 1 1 14 2  36 o 33.32000 0.3619000 33.50000 0.5119000 33.13000 0.5118000 0.3744000      0.7239000 
1 1 1 14 2  38 o 13.55000 0.4372000 13.81000 0.6057000 13.28000 0.6307000 0.5295000      0.8745000 
1 1 1 14 2  40 o 19.69000 0.3508000 20.28000 0.4987000 19.10000 0.4935000 1.188000       0.7017000 
1 1 1 14 2  42 o 4.385000 1.063000  3.838000 1.473000  4.931000 1.534000  -1.094000      2.126000  
1 1 1 14 2  44 o 15.32000 0.4733000 15.39000 0.6079000 15.25000 0.7256000 0.1382000      0.9466000 
1 1 1 14 2  46 f 17.60000 0.5048000 17.61000 0.7730000 17.60000 0.6495000 0.8818000E-02  1.010000  
1 1 1 14 2  48 o 32.25000 0.3304000 32.31000 0.4712000 32.19000 0.4632000 0.1182000      0.6607000 
1 1 1 14 2  50 o 17.70000 0.3662000 17.80000 0.5100000 17.60000 0.5256000 0.2028000      0.7323000 
1 1 1 14 2  52 o 3.855000 0.9639000 4.388000 1.372000  3.322000 1.354000  1.066000       1.928000  
1 1 1 14 2  54 o 7.490000 0.7303000 8.354000 0.9033000 6.626000 1.148000  1.728000       1.461000  
1 1 1 14 2  56 o 10.56000 0.5771000 10.75000 0.7604000 10.36000 0.8683000 0.3836000      1.154000  
1 1 1 14 2  58 o 10.32000 0.5427000 10.60000 0.7614000 10.04000 0.7736000 0.5638000      1.085000  
1 1 1 14 2  60 o 6.472000 0.8763000 5.047000 1.457000  7.897000 0.9734000 -2.850000      1.753000  
1 1 1 14 2  62 o 4.830000 1.049000  4.617000 1.488000  5.044000 1.479000  -0.4273000     2.099000  
1 1 1 14 2  64 o 11.68000 0.6005000 11.31000 0.7743000 12.06000 0.9179000 -0.7469000     1.201000  
1 1 1 14 3  1  o 164.6000 1.120000  165.2000 1.590000  164.0000 1.577000  1.224000       2.239000  
1 1 1 14 3  3  o 148.7000 1.093000  147.9000 1.645000  149.6000 1.440000  -1.685000      2.187000  
1 1 1 14 3  5  o 47.83000 0.4477000 47.73000 0.6937000 47.93000 0.5662000 -0.1995000     0.8954000 
1 1 1 14 3  7  o 84.79000 0.5858000 84.95000 0.8298000 84.62000 0.8272000 0.3263000      1.172000  
1 1 1 14 3  9  o 90.50000 0.6235000 90.26000 0.8797000 90.74000 0.8839000 -0.4779000     1.247000  
1 1 1 14 3  11 o 61.67000 0.4364000 61.66000 0.6176000 61.69000 0.6167000 -0.2848000E-01 0.8728000 
1 1 1 14 3  13 o 29.20000 0.2550000 28.71000 0.3586000 29.69000 0.3626000 -0.9810000     0.5100000 
1 1 1 14 3  15 o 27.53000 0.2800000 27.77000 0.3660000 27.28000 0.4239000 0.4918000      0.5600000 
1 1 1 14 3  17 o 35.42000 0.3174000 35.30000 0.4785000 35.55000 0.4172000 -0.2495000     0.6349000 
1 1 1 14 3  19 o 89.94000 0.7204000 90.28000 1.021000  89.61000 1.017000  0.6714000      1.441000  
1 1 1 14 3  21 o 58.83000 0.5060000 58.72000 0.5404000 58.94000 0.8556000 -0.2257000     1.012000  
1 1 1 14 3  23 o 36.85000 0.3391000 35.95000 0.4339000 37.75000 0.5212000 -1.802000      0.6782000 
1 1 1 14 3  25 o 51.46000 0.4189000 51.53000 0.5464000 51.38000 0.6352000 0.1510000      0.8378000 
1 1 1 14 3  27 o 53.14000 0.4009000 52.85000 0.5625000 53.43000 0.5713000 -0.5829000     0.8018000 
1 1 1 14 3  29 o 23.80000 0.3908000 24.00000 0.4833000 23.59000 0.6143000 0.4152000      0.7817000 
1 1 1 14 3  31 o 16.19000 0.3325000 16.12000 0.4673000 16.25000 0.4732000 -0.1348000     0.6651000 
1 1 1 14 3  33 o 12.23000 0.5715000 13.11000 0.8469000 11.35000 0.7676000 1.758000       1.143000  
1 1 1 14 3  35 o 10.68000 0.5453000 10.25000 0.7788000 11.10000 0.7635000 -0.8482000     1.091000  
1 1 1 14 3  37 o 5.230000 0.9677000 4.783000 1.497000  5.677000 1.227000  -0.8941000     1.935000  
1 1 1 14 3  39 o 19.29000 0.3534000 19.34000 0.5020000 19.25000 0.4976000 0.9072000E-01  0.7069000 
1 1 1 14 3  41 o 33.86000 0.3343000 33.64000 0.4721000 34.08000 0.4736000 -0.4365000     0.6687000 
1 1 1 14 3  43 o 38.57000 0.4058000 38.55000 0.5644000 38.60000 0.5832000 -0.4818000E-01 0.8116000 
1 1 1 14 3  45 o 31.72000 0.3355000 31.42000 0.4735000 32.02000 0.4755000 -0.5987000     0.6710000 
1 1 1 14 3  47 o 20.58000 0.3848000 20.67000 0.5934000 20.49000 0.4902000 0.1767000      0.7697000 
1 1 1 14 3  49 o 9.278000 0.7378000 7.438000 1.243000  11.12000 0.7945000 -3.681000      1.476000  
1 1 1 14 3  51 o 4.065000 0.8359000 5.509000 1.187000  2.621000 1.177000  2.888000       1.672000  
1 1 1 14 3  53 o 7.440000 0.7357000 6.469000 1.083000  8.411000 0.9964000 -1.942000      1.471000  
1 1 1 14 3  55 o 7.806000 0.7485000 6.607000 1.098000  9.005000 1.018000  -2.397000      1.497000  
1 1 1 14 3  57 o 3.479000 1.024000  3.376000 1.423000  3.582000 1.472000  -0.2056000     2.047000  
1 1 1 14 3  59 o 3.942000 1.059000  4.099000 1.538000  3.784000 1.457000  0.3150000      2.119000  
1 1 1 14 3  61 o 3.360000 0.9670000 3.038000 1.303000  3.681000 1.429000  -0.6427000     1.934000  
1 1 1 14 3  63 o 3.858000 1.035000  2.886000 1.252000  4.831000 1.649000  -1.945000      2.070000  
1 1 1 14 3  65 o 4.363000 1.149000  4.222000 1.456000  4.504000 1.778000  -0.2820000     2.298000  
1 1 1 14 4  0  o 132.5000 1.475000  132.5000 1.475000  132.5000 1.475000  0.000000       0.000000  
1 1 1 14 4  2  o 70.54000 0.5682000 70.32000 0.8014000 70.76000 0.8059000 -0.4387000     1.136000  
1 1 1 14 4  4  f 88.29000 0.7431000 87.20000 1.205000  89.38000 0.8701000 -2.181000      1.486000  
1 1 1 14 4  6  o 113.8000 0.8416000 113.7000 1.272000  113.9000 1.102000  -0.2057000     1.683000  
1 1 1 14 4  8  o 128.2000 0.9470000 128.3000 1.433000  128.2000 1.238000  0.1433000      1.894000  
1 1 1 14 4  10 o 142.7000 1.051000  142.8000 1.590000  142.6000 1.376000  0.2799000      2.103000  
1 1 1 14 4  12 o 84.75000 0.5867000 84.82000 0.8305000 84.69000 0.8290000 0.1310000      1.173000  
1 1 1 14 4  14 o 84.99000 0.5890000 84.59000 0.8291000 85.40000 0.8368000 -0.8105000     1.178000  
1 1 1 14 4  16 o 58.31000 0.4836000 57.75000 0.6771000 58.87000 0.6906000 -1.123000      0.9672000 
1 1 1 14 4  18 o 92.54000 0.6925000 92.79000 0.9091000 92.29000 1.045000  0.4983000      1.385000  
1 1 1 14 4  20 o 84.67000 0.7214000 85.14000 0.8383000 84.20000 1.174000  0.9406000      1.443000  
1 1 1 14 4  22 o 57.93000 0.4580000 58.28000 0.6010000 57.59000 0.6912000 0.6946000      0.9160000 
1 1 1 14 4  24 o 58.95000 0.5079000 59.46000 0.5474000 58.45000 0.8556000 1.008000       1.016000  
1 1 1 14 4  26 o 38.65000 0.3780000 38.60000 0.5295000 38.70000 0.5395000 -0.1041000     0.7559000 
1 1 1 14 4  28 o 43.17000 0.3753000 42.81000 0.4851000 43.52000 0.5728000 -0.7067000     0.7506000 
1 1 1 14 4  30 o 63.69000 0.4993000 63.35000 0.7487000 64.03000 0.6607000 -0.6767000     0.9985000 
1 1 1 14 4  32 o 21.01000 0.3388000 20.53000 0.5160000 21.48000 0.4393000 -0.9567000     0.6776000 
1 1 1 14 4  34 o 38.76000 0.3615000 38.97000 0.5509000 38.54000 0.4683000 0.4342000      0.7231000 
1 1 1 14 4  36 o 38.93000 0.3871000 39.39000 0.5492000 38.46000 0.5458000 0.9295000      0.7743000 
1 1 1 14 4  38 o 25.43000 0.3180000 25.00000 0.4441000 25.87000 0.4552000 -0.8745000     0.6359000 
1 1 1 14 4  40 o 33.18000 0.3556000 32.79000 0.4627000 33.56000 0.5401000 -0.7773000     0.7112000 
1 1 1 14 4  42 o 32.22000 0.3646000 32.44000 0.4690000 32.00000 0.5584000 0.4438000      0.7292000 
1 1 1 14 4  44 o 7.750000 0.8698000 8.866000 1.135000  6.634000 1.318000  2.232000       1.740000  
1 1 1 14 4  46 o 29.08000 0.3782000 28.90000 0.5303000 29.27000 0.5395000 -0.3634000     0.7565000 
1 1 1 14 4  48 o 5.387000 0.9597000 4.837000 1.498000  5.937000 1.200000  -1.100000      1.919000  
1 1 1 14 4  50 o 6.875000 0.7502000 6.843000 1.082000  6.906000 1.039000  -0.6285000E-01 1.500000  
1 1 1 14 4  52 o 19.04000 0.3722000 18.78000 0.4726000 19.29000 0.5752000 -0.5053000     0.7444000 
1 1 1 14 4  54 o 2.522000 0.8229000 2.385000 1.123000  2.659000 1.203000  -0.2735000     1.646000  
1 1 1 14 4  56 o 11.41000 0.5420000 11.90000 0.7894000 10.91000 0.7428000 0.9849000      1.084000  
1 1 1 14 4  58 o 7.477000 0.8453000 6.716000 1.436000  8.238000 0.8923000 -1.523000      1.691000  
1 1 1 14 4  60 o 4.241000 0.9971000 5.312000 1.495000  3.171000 1.320000  2.141000       1.994000  
1 1 1 14 4  62 o 7.321000 0.7513000 8.089000 0.9372000 6.553000 1.175000  1.535000       1.503000  
1 1 1 14 4  64 o 5.926000 0.9013000 6.396000 1.267000  5.456000 1.282000  0.9408000      1.803000  
1 1 1 14 5  1  o 104.7000 0.8295000 104.0000 1.164000  105.5000 1.182000  -1.559000      1.659000  
1 1 1 14 5  3  o 47.33000 0.3712000 46.88000 0.5585000 47.79000 0.4891000 -0.9140000     0.7424000 
1 1 1 14 5  5  o 59.31000 0.4524000 59.30000 0.6845000 59.32000 0.5916000 -0.1630000E-01 0.9048000 
1 1 1 14 5  7  o 66.58000 0.4663000 66.09000 0.6549000 67.08000 0.6638000 -0.9920000     0.9325000 
1 1 1 14 5  9  f 47.42000 0.3748000 47.15000 0.5653000 47.68000 0.4922000 -0.5324000     0.7495000 
1 1 1 14 5  11 o 149.6000 1.101000  149.7000 1.666000  149.5000 1.441000  0.2230000      2.202000  
1 1 1 14 5  13 o 94.28000 0.6502000 94.22000 0.9187000 94.34000 0.9204000 -0.1179000     1.300000  
1 1 1 14 5  15 o 40.02000 0.3352000 39.51000 0.5019000 40.53000 0.4445000 -1.029000      0.6704000 
1 1 1 14 5  17 o 51.10000 0.4356000 50.78000 0.6111000 51.42000 0.6208000 -0.6402000     0.8711000 
1 1 1 14 5  19 o 90.79000 0.7466000 90.85000 0.7978000 90.74000 1.262000  0.1087000      1.493000  
1 1 1 14 5  21 o 16.79000 0.3722000 16.63000 0.3935000 16.95000 0.6319000 -0.3200000     0.7444000 
1 1 1 14 5  23 o 17.70000 0.5472000 16.98000 0.5631000 18.41000 0.9383000 -1.424000      1.094000  
1 1 1 14 5  25 o 49.67000 0.3915000 49.63000 0.4755000 49.71000 0.6222000 -0.7330000E-01 0.7831000 
1 1 1 14 5  27 o 51.57000 0.4219000 51.95000 0.5514000 51.20000 0.6387000 0.7579000      0.8438000 
1 1 1 14 5  29 o 49.68000 0.3826000 50.12000 0.5407000 49.24000 0.5415000 0.8756000      0.7653000 
1 1 1 14 5  31 o 8.900000 0.5781000 8.994000 0.8474000 8.806000 0.7867000 0.1883000      1.156000  
1 1 1 14 5  33 o 46.02000 0.4207000 46.17000 0.5908000 45.86000 0.5993000 0.3146000      0.8415000 
1 1 1 14 5  35 o 32.29000 0.3382000 32.60000 0.5103000 31.98000 0.4439000 0.6242000      0.6764000 
1 1 1 14 5  37 o 50.28000 0.4533000 50.59000 0.6405000 49.97000 0.6416000 0.6220000      0.9066000 
1 1 1 14 5  39 o 35.24000 0.3548000 35.27000 0.4654000 35.21000 0.5356000 0.6261000E-01  0.7096000 
1 1 1 14 5  41 f 29.59000 0.3324000 29.79000 0.4693000 29.39000 0.4710000 0.3937000      0.6649000 
1 1 1 14 5  43 o 3.869000 1.028000  4.271000 1.482000  3.467000 1.425000  0.8043000      2.056000  
1 1 1 14 5  45 o 19.04000 0.4012000 18.94000 0.6107000 19.15000 0.5204000 -0.2031000     0.8024000 
1 1 1 14 5  47 o 7.683000 0.8062000 7.489000 1.293000  7.878000 0.9636000 -0.3885000     1.612000  
1 1 1 14 5  49 o 4.888000 1.028000  4.622000 1.447000  5.155000 1.460000  -0.5330000     2.055000  
1 1 1 14 5  51 o 11.70000 0.4564000 11.69000 0.6704000 11.70000 0.6196000 -0.1227000E-01 0.9129000 
1 1 1 14 5  53 f 4.029000 0.9613000 3.229000 1.318000  4.829000 1.399000  -1.600000      1.923000  
1 1 1 14 5  55 o 8.813000 0.6329000 9.084000 0.8253000 8.543000 0.9598000 0.5406000      1.266000  
1 1 1 14 5  57 o 3.461000 1.001000  2.948000 1.317000  3.975000 1.509000  -1.027000      2.003000  
1 1 1 14 5  59 o 6.635000 0.9582000 6.204000 1.386000  7.066000 1.324000  -0.8618000     1.916000  
1 1 1 14 5  61 o 9.002000 0.6893000 9.067000 0.9024000 8.936000 1.042000  0.1308000      1.379000  
1 1 1 14 5  63 o 3.057000 0.9384000 2.755000 1.254000  3.358000 1.396000  -0.6026000     1.877000  
1 1 1 14 5  65 o 4.307000 1.277000  3.895000 1.732000  4.720000 1.877000  -0.8248000     2.554000  
1 1 1 14 6  0  o 36.76000 0.4626000 36.76000 0.4626000 36.76000 0.4626000 0.000000       0.000000  
1 1 1 14 6  2  o 81.13000 0.6060000 80.94000 0.9144000 81.33000 0.7956000 -0.3930000     1.212000  
1 1 1 14 6  4  o 119.5000 0.8171000 119.9000 1.159000  119.1000 1.152000  0.8412000      1.634000  
1 1 1 14 6  6  o 149.3000 1.101000  151.0000 1.681000  147.5000 1.422000  3.462000       2.201000  
1 1 1 14 6  8  o 115.7000 0.7918000 116.4000 1.126000  115.0000 1.113000  1.378000       1.584000  
1 1 1 14 6  10 o 102.4000 0.7031000 102.1000 0.9918000 102.6000 0.9967000 -0.4994000     1.406000  
1 1 1 14 6  12 f 55.82000 0.4336000 55.91000 0.6574000 55.73000 0.5655000 0.1810000      0.8672000 
1 1 1 14 6  14 o 56.17000 0.4038000 55.74000 0.5671000 56.60000 0.5752000 -0.8640000     0.8077000 
1 1 1 14 6  16 o 31.08000 0.2940000 31.02000 0.4447000 31.13000 0.3848000 -0.1106000     0.5881000 
1 1 1 14 6  18 o 99.63000 0.7437000 99.37000 0.9706000 99.89000 1.127000  -0.5197000     1.487000  
1 1 1 14 6  20 o 41.39000 0.3917000 41.25000 0.4158000 41.52000 0.6641000 -0.2739000     0.7835000 
1 1 1 14 6  22 o 68.40000 0.5972000 68.59000 0.6903000 68.22000 0.9749000 0.3722000      1.194000  
1 1 1 14 6  24 o 59.49000 0.7049000 59.91000 0.7093000 59.08000 1.218000  0.8264000      1.410000  
1 1 1 14 6  26 o 36.73000 0.3410000 36.41000 0.4357000 37.06000 0.5246000 -0.6496000     0.6820000 
1 1 1 14 6  28 o 34.37000 0.3106000 34.14000 0.4336000 34.59000 0.4448000 -0.4486000     0.6211000 
1 1 1 14 6  30 f 5.402000 0.8457000 6.112000 1.034000  4.691000 1.338000  1.421000       1.691000  
1 1 1 14 6  32 o 3.493000 0.9302000 2.854000 1.235000  4.131000 1.392000  -1.277000      1.860000  
1 1 1 14 6  34 o 7.666000 0.6379000 7.977000 0.8881000 7.355000 0.9160000 0.6217000      1.276000  
1 1 1 14 6  36 o 38.93000 0.3887000 38.17000 0.5393000 39.69000 0.5598000 -1.520000      0.7774000 
1 1 1 14 6  38 o 34.10000 0.3507000 34.37000 0.4594000 33.84000 0.5300000 0.5319000      0.7013000 
1 1 1 14 6  40 o 40.29000 0.3523000 40.43000 0.4991000 40.15000 0.4973000 0.2766000      0.7046000 
1 1 1 14 6  42 o 8.993000 0.6346000 8.810000 0.9361000 9.177000 0.8572000 -0.3677000     1.269000  
1 1 1 14 6  44 o 23.30000 0.3402000 22.43000 0.4839000 24.18000 0.4783000 -1.752000      0.6804000 
1 1 1 14 6  46 o 15.08000 0.4853000 15.30000 0.6709000 14.86000 0.7015000 0.4344000      0.9707000 
1 1 1 14 6  48 o 17.07000 0.4462000 16.64000 0.7517000 17.49000 0.4811000 -0.8514000     0.8925000 
1 1 1 14 6  50 o 17.01000 0.3642000 17.28000 0.5118000 16.73000 0.5182000 0.5467000      0.7284000 
1 1 1 14 6  52 f 17.07000 0.3659000 17.12000 0.5238000 17.02000 0.5110000 0.9992000E-01  0.7318000 
1 1 1 14 6  54 o 11.59000 0.5156000 11.71000 0.6733000 11.48000 0.7811000 0.2316000      1.031000  
1 1 1 14 6  56 o 3.875000 0.9722000 4.006000 1.426000  3.743000 1.322000  0.2630000      1.944000  
1 1 1 14 6  58 o 8.837000 0.6503000 8.541000 1.045000  9.133000 0.7738000 -0.5920000     1.301000  
1 1 1 14 6  60 o 7.583000 0.7767000 7.928000 1.083000  7.238000 1.114000  0.6902000      1.553000  
1 1 1 14 6  62 o 7.023000 0.9151000 6.650000 1.277000  7.396000 1.311000  -0.7465000     1.830000  
1 1 1 14 6  64 o 8.018000 0.7951000 6.783000 1.129000  9.253000 1.120000  -2.470000      1.590000  
1 1 1 14 7  1  o 75.47000 0.5662000 75.78000 0.7435000 75.16000 0.8540000 0.6242000      1.132000  
1 1 1 14 7  3  o 94.68000 0.6508000 94.88000 0.9223000 94.48000 0.9185000 0.3931000      1.302000  
1 1 1 14 7  5  o 132.2000 1.043000  131.7000 1.468000  132.6000 1.482000  -0.8602000     2.086000  
1 1 1 14 7  7  o 29.59000 0.2659000 29.82000 0.4035000 29.37000 0.3463000 0.4518000      0.5317000 
1 1 1 14 7  9  o 87.82000 0.6063000 87.58000 0.8546000 88.07000 0.8604000 -0.4904000     1.213000  
1 1 1 14 7  11 o 50.46000 0.3665000 50.07000 0.5137000 50.85000 0.5228000 -0.7857000     0.7329000 
1 1 1 14 7  13 o 62.68000 0.4809000 62.39000 0.7254000 62.97000 0.6315000 -0.5773000     0.9618000 
1 1 1 14 7  15 o 168.5000 1.405000  168.0000 2.290000  169.1000 1.628000  -1.098000      2.810000  
1 1 1 14 7  17 o 54.64000 0.3986000 54.30000 0.5609000 54.98000 0.5664000 -0.6778000     0.7971000 
1 1 1 14 7  19 o 12.32000 0.4356000 12.70000 0.4862000 11.94000 0.7229000 0.7616000      0.8712000 
1 1 1 14 7  21 o 107.4000 0.7630000 108.9000 0.9488000 105.8000 1.195000  3.070000       1.526000  
1 1 1 14 7  23 o 135.9000 1.006000  136.1000 1.317000  135.7000 1.520000  0.4106000      2.011000  
1 1 1 14 7  25 o 81.81000 0.6206000 81.94000 0.8105000 81.68000 0.9400000 0.2577000      1.241000  
1 1 1 14 7  27 o 31.98000 0.3663000 31.93000 0.4160000 32.02000 0.6031000 -0.9037000E-01 0.7327000 
1 1 1 14 7  29 o 17.82000 0.3139000 17.60000 0.4269000 18.04000 0.4603000 -0.4388000     0.6278000 
1 1 1 14 7  31 o 24.28000 0.2978000 24.21000 0.4125000 24.35000 0.4297000 -0.1354000     0.5956000 
1 1 1 14 7  33 o 45.18000 0.4175000 45.20000 0.5808000 45.16000 0.6000000 0.3235000E-01  0.8351000 
1 1 1 14 7  35 o 37.41000 0.3601000 37.43000 0.5444000 37.39000 0.4715000 0.4170000E-01  0.7202000 
1 1 1 14 7  37 o 22.15000 0.3802000 22.32000 0.5252000 21.99000 0.5498000 0.3270000      0.7603000 
1 1 1 14 7  39 o 18.63000 0.3762000 18.92000 0.5568000 18.33000 0.5060000 0.5877000      0.7524000 
1 1 1 14 7  41 o 27.28000 0.3580000 27.02000 0.4630000 27.54000 0.5461000 -0.5203000     0.7159000 
1 1 1 14 7  43 o 4.067000 0.9898000 3.256000 1.389000  4.879000 1.411000  -1.623000      1.980000  
1 1 1 14 7  45 o 6.037000 0.9329000 6.241000 1.295000  5.834000 1.343000  0.4066000      1.866000  
1 1 1 14 7  47 o 4.549000 1.010000  4.449000 1.442000  4.649000 1.416000  -0.2001000     2.021000  
1 1 1 14 7  49 o 10.31000 0.5393000 9.479000 0.8068000 11.14000 0.7158000 -1.661000      1.079000  
1 1 1 14 7  51 o 8.924000 0.6125000 9.365000 0.7542000 8.482000 0.9653000 0.8829000      1.225000  
1 1 1 14 7  53 o 5.564000 0.9037000 6.542000 1.054000  4.587000 1.468000  1.955000       1.807000  
1 1 1 14 7  55 o 3.435000 0.9506000 3.120000 1.298000  3.750000 1.389000  -0.6300000     1.901000  
1 1 1 14 7  57 o 10.89000 0.6857000 9.890000 1.173000  11.89000 0.7113000 -1.996000      1.371000  
1 1 1 14 7  59 o 4.968000 0.9754000 4.065000 1.390000  5.870000 1.368000  -1.804000      1.951000  
1 1 1 14 7  61 o 5.438000 0.9823000 6.424000 1.288000  4.452000 1.484000  1.972000       1.965000  
1 1 1 14 7  63 o 3.911000 1.118000  2.549000 1.226000  5.274000 1.869000  -2.725000      2.235000  
1 1 1 14 8  0  o 28.80000 0.3366000 28.80000 0.3366000 28.80000 0.3366000 0.000000       0.000000  
1 1 1 14 8  2  o 28.47000 0.2572000 28.56000 0.3326000 28.39000 0.3923000 0.1729000      0.5143000 
1 1 1 14 8  4  o 79.16000 0.5485000 78.61000 0.7709000 79.71000 0.7805000 -1.099000      1.097000  
1 1 1 14 8  6  o 58.53000 0.4480000 58.18000 0.6748000 58.89000 0.5896000 -0.7065000     0.8961000 
1 1 1 14 8  8  o 91.01000 0.7257000 91.43000 1.030000  90.60000 1.023000  0.8295000      1.451000  
1 1 1 14 8  10 o 111.8000 0.7663000 112.4000 1.089000  111.2000 1.078000  1.206000       1.533000  
1 1 1 14 8  12 o 38.48000 0.3000000 38.81000 0.4272000 38.15000 0.4212000 0.6689000      0.5999000 
1 1 1 14 8  14 o 27.00000 0.2715000 27.07000 0.4108000 26.94000 0.3550000 0.1266000      0.5429000 
1 1 1 14 8  16 o 105.3000 0.7831000 105.1000 1.183000  105.5000 1.026000  -0.4558000     1.566000  
1 1 1 14 8  18 o 42.06000 0.3937000 41.19000 0.4076000 42.93000 0.6737000 -1.742000      0.7874000 
1 1 1 14 8  20 o 55.23000 0.4984000 55.15000 0.5721000 55.32000 0.8163000 -0.1678000     0.9968000 
1 1 1 14 8  22 o 27.74000 0.3484000 26.66000 0.3878000 28.83000 0.5788000 -2.171000      0.6967000 
1 1 1 14 8  24 o 52.34000 0.4542000 52.47000 0.6400000 52.22000 0.6447000 0.2484000      0.9084000 
1 1 1 14 8  26 o 34.82000 0.3364000 34.43000 0.4332000 35.21000 0.5148000 -0.7870000     0.6728000 
1 1 1 14 8  28 o 37.28000 0.3885000 37.33000 0.4417000 37.24000 0.6392000 0.9334000E-01  0.7769000 
1 1 1 14 8  30 o 30.04000 0.2988000 30.27000 0.4135000 29.81000 0.4314000 0.4592000      0.5975000 
1 1 1 14 8  32 o 48.18000 0.4576000 48.26000 0.7410000 48.10000 0.5371000 0.1523000      0.9152000 
1 1 1 14 8  34 o 34.86000 0.3200000 34.65000 0.4423000 35.06000 0.4624000 -0.4118000     0.6399000 
1 1 1 14 8  36 o 30.84000 0.5399000 31.34000 0.8805000 30.35000 0.6252000 0.9864000      1.080000  
1 1 1 14 8  38 o 26.34000 0.3223000 25.68000 0.4412000 27.00000 0.4701000 -1.325000      0.6447000 
1 1 1 14 8  40 f 7.440000 0.8588000 6.982000 1.155000  7.899000 1.272000  -0.9170000     1.718000  
1 1 1 14 8  42 o 13.85000 0.4618000 13.83000 0.6458000 13.87000 0.6604000 -0.3596000E-01 0.9237000 
1 1 1 14 8  44 o 33.43000 0.3319000 33.00000 0.4669000 33.86000 0.4719000 -0.8564000     0.6639000 
1 1 1 14 8  46 o 17.73000 0.4383000 17.92000 0.7079000 17.53000 0.5169000 0.3908000      0.8765000 
1 1 1 14 8  48 o 12.63000 0.4691000 12.07000 0.7434000 13.18000 0.5724000 -1.108000      0.9383000 
1 1 1 14 8  50 o 8.910000 0.6099000 8.521000 0.8688000 9.300000 0.8562000 -0.7794000     1.220000  
1 1 1 14 8  52 o 3.783000 0.9813000 3.734000 1.357000  3.833000 1.418000  -0.9877000E-01 1.963000  
1 1 1 14 8  54 o 4.604000 0.9759000 4.965000 1.390000  4.243000 1.370000  0.7215000      1.952000  
1 1 1 14 8  56 o 8.083000 0.7079000 8.033000 0.9898000 8.134000 1.012000  -0.1010000     1.416000  
1 1 1 14 8  58 o 3.986000 1.085000  4.385000 1.690000  3.587000 1.361000  0.7974000      2.170000  
1 1 1 14 8  60 o 4.059000 1.018000  5.388000 1.622000  2.730000 1.231000  2.658000       2.036000  
1 1 1 14 8  62 o 6.801000 0.9252000 6.186000 1.499000  7.416000 1.085000  -1.231000      1.850000  
1 1 1 14 8  64 o 4.523000 1.037000  5.183000 1.485000  3.863000 1.447000  1.320000       2.073000  
1 1 1 14 9  1  o 78.28000 0.5427000 77.78000 0.7628000 78.79000 0.7720000 -1.006000      1.085000  
1 1 1 14 9  3  o 12.63000 0.2401000 13.15000 0.2975000 12.10000 0.3769000 1.050000       0.4802000 
1 1 1 14 9  5  o 115.6000 0.7908000 115.6000 1.118000  115.6000 1.119000  -0.8033000E-01 1.582000  
1 1 1 14 9  7  o 65.93000 0.4990000 65.17000 0.7477000 66.69000 0.6612000 -1.511000      0.9981000 
1 1 1 14 9  9  o 25.85000 0.2338000 25.83000 0.3301000 25.88000 0.3312000 -0.5206000E-01 0.4676000 
1 1 1 14 9  11 o 107.9000 0.8558000 107.6000 1.207000  108.2000 1.214000  -0.6076000     1.712000  
1 1 1 14 9  13 o 40.95000 0.3375000 41.01000 0.5089000 40.89000 0.4434000 0.1148000      0.6750000 
1 1 1 14 9  15 o 47.75000 0.4274000 48.73000 0.5118000 46.77000 0.6846000 1.970000       0.8548000 
1 1 1 14 9  17 o 79.28000 0.6811000 78.81000 0.7799000 79.76000 1.117000  -0.9511000     1.362000  
1 1 1 14 9  19 o 28.46000 0.4457000 27.74000 0.3387000 29.18000 0.8245000 -1.441000      0.8913000 
1 1 1 14 9  21 o 36.82000 0.4054000 36.86000 0.5078000 36.79000 0.6321000 0.7458000E-01  0.8108000 
1 1 1 14 9  23 o 114.1000 0.9070000 114.6000 1.285000  113.7000 1.281000  0.8511000      1.814000  
1 1 1 14 9  25 o 70.72000 0.5198000 71.43000 0.6403000 70.01000 0.8189000 1.416000       1.040000  
1 1 1 14 9  27 o 18.75000 0.3206000 18.41000 0.3738000 19.08000 0.5210000 -0.6709000     0.6412000 
1 1 1 14 9  29 o 27.87000 0.2961000 27.51000 0.3968000 28.23000 0.4396000 -0.7225000     0.5922000 
1 1 1 14 9  31 o 34.95000 0.3820000 34.87000 0.4375000 35.03000 0.6262000 -0.1629000     0.7639000 
1 1 1 14 9  33 o 27.09000 0.3940000 27.96000 0.5864000 26.22000 0.5265000 1.746000       0.7881000 
1 1 1 14 9  35 o 10.59000 0.4974000 11.06000 0.6550000 10.12000 0.7487000 0.9366000      0.9947000 
1 1 1 14 9  37 o 48.49000 0.4177000 49.11000 0.6358000 47.87000 0.5420000 1.247000       0.8355000 
1 1 1 14 9  39 o 23.53000 0.3563000 23.54000 0.4553000 23.51000 0.5483000 0.2670000E-01  0.7126000 
1 1 1 14 9  41 o 19.45000 0.3675000 19.42000 0.5111000 19.48000 0.5284000 -0.5590000E-01 0.7351000 
1 1 1 14 9  43 o 21.67000 0.3443000 21.71000 0.4914000 21.63000 0.4823000 0.8387000E-01  0.6886000 
1 1 1 14 9  45 o 15.37000 0.4571000 15.03000 0.5882000 15.72000 0.6998000 -0.6920000     0.9141000 
1 1 1 14 9  47 o 16.73000 0.3921000 16.16000 0.6210000 17.30000 0.4789000 -1.137000      0.7843000 
1 1 1 14 9  49 f 4.763000 1.044000  4.736000 1.532000  4.789000 1.417000  -0.5324000E-01 2.087000  
1 1 1 14 9  51 o 18.94000 0.3423000 18.66000 0.4902000 19.22000 0.4779000 -0.5612000     0.6846000 
1 1 1 14 9  53 o 5.853000 0.8846000 5.410000 1.291000  6.297000 1.210000  -0.8862000     1.769000  
1 1 1 14 9  55 o 13.00000 0.4459000 13.72000 0.6070000 12.29000 0.6532000 1.430000       0.8917000 
1 1 1 14 9  57 o 7.538000 0.7963000 7.991000 1.105000  7.084000 1.147000  0.9077000      1.593000  
1 1 1 14 9  59 o 6.705000 0.9739000 5.445000 1.549000  7.965000 1.181000  -2.521000      1.948000  
1 1 1 14 9  61 o 4.066000 1.129000  4.334000 1.779000  3.799000 1.392000  0.5349000      2.258000  
1 1 1 14 9  63 o 3.862000 1.038000  3.666000 1.460000  4.059000 1.477000  -0.3932000     2.076000  
1 1 1 14 10 0  o 6.936000 0.4670000 6.936000 0.4670000 6.936000 0.4670000 0.000000       0.000000  
1 1 1 14 10 2  o 7.905000 0.3189000 7.467000 0.4290000 8.344000 0.4721000 -0.8766000     0.6379000 
1 1 1 14 10 4  o 50.40000 0.3910000 50.13000 0.5107000 50.68000 0.5922000 -0.5545000     0.7820000 
1 1 1 14 10 6  o 30.43000 0.2502000 30.33000 0.3517000 30.53000 0.3560000 -0.1992000     0.5004000 
1 1 1 14 10 8  o 84.35000 0.6317000 85.16000 0.9632000 83.55000 0.8176000 1.611000       1.263000  
1 1 1 14 10 10 o 53.85000 0.3877000 54.09000 0.5503000 53.61000 0.5464000 0.4845000      0.7755000 
1 1 1 14 10 12 o 101.8000 0.8578000 102.0000 1.402000  101.6000 0.9891000 0.3206000      1.716000  
1 1 1 14 10 14 o 12.23000 0.3252000 12.45000 0.4664000 12.00000 0.4533000 0.4560000      0.6504000 
1 1 1 14 10 16 o 113.4000 0.9235000 113.1000 0.9812000 113.7000 1.565000  -0.6140000     1.847000  
1 1 1 14 10 18 o 27.30000 0.3584000 27.22000 0.4668000 27.38000 0.5438000 -0.1674000     0.7167000 
1 1 1 14 10 20 o 48.79000 0.3812000 48.80000 0.4624000 48.78000 0.6062000 0.1765000E-01  0.7624000 
1 1 1 14 10 22 o 62.40000 0.5803000 62.54000 0.8954000 62.26000 0.7383000 0.2803000      1.161000  
1 1 1 14 10 24 o 39.73000 0.3361000 39.81000 0.4065000 39.64000 0.5353000 0.1665000      0.6722000 
1 1 1 14 10 26 o 56.29000 0.4319000 55.76000 0.5190000 56.81000 0.6904000 -1.052000      0.8637000 
1 1 1 14 10 28 o 49.26000 0.4066000 49.21000 0.5234000 49.32000 0.6225000 -0.1125000     0.8133000 
1 1 1 14 10 30 o 10.07000 0.4725000 8.815000 0.6932000 11.33000 0.6422000 -2.511000      0.9450000 
1 1 1 14 10 32 o 25.85000 0.3830000 25.39000 0.4640000 26.32000 0.6096000 -0.9249000     0.7661000 
1 1 1 14 10 34 o 37.98000 0.3861000 37.69000 0.5339000 38.27000 0.5578000 -0.5755000     0.7721000 
1 1 1 14 10 36 o 20.90000 0.3759000 20.93000 0.5124000 20.86000 0.5500000 0.7537000E-01  0.7517000 
1 1 1 14 10 38 o 36.72000 0.3650000 36.64000 0.4663000 36.80000 0.5617000 -0.1533000     0.7300000 
1 1 1 14 10 40 o 12.58000 0.4819000 12.67000 0.6764000 12.50000 0.6866000 0.1664000      0.9638000 
1 1 1 14 10 42 o 8.772000 0.6709000 7.813000 1.042000  9.731000 0.8458000 -1.918000      1.342000  
1 1 1 14 10 44 o 12.30000 0.4815000 12.38000 0.6724000 12.23000 0.6894000 0.1523000      0.9630000 
1 1 1 14 10 46 o 13.78000 0.4688000 13.95000 0.6637000 13.60000 0.6622000 0.3536000      0.9375000 
1 1 1 14 10 48 o 10.25000 0.5631000 9.991000 0.8386000 10.51000 0.7517000 -0.5207000     1.126000  
1 1 1 14 10 50 o 8.975000 0.6368000 9.065000 0.9619000 8.885000 0.8347000 0.1804000      1.274000  
1 1 1 14 10 52 o 5.659000 0.8805000 5.971000 1.178000  5.348000 1.309000  0.6234000      1.761000  
1 1 1 14 10 54 o 7.287000 0.6975000 6.879000 1.011000  7.695000 0.9606000 -0.8162000     1.395000  
1 1 1 14 10 56 o 8.706000 0.6046000 8.778000 0.8746000 8.634000 0.8350000 0.1434000      1.209000  
1 1 1 14 10 58 o 3.639000 1.118000  4.295000 1.838000  2.983000 1.274000  1.312000       2.237000  
1 1 1 14 10 60 o 10.53000 0.7430000 11.44000 1.099000  9.614000 1.000000  1.826000       1.486000  
1 1 1 14 10 62 o 4.746000 0.9826000 3.079000 1.356000  6.413000 1.422000  -3.334000      1.965000  
1 1 1 14 10 64 o 4.278000 1.085000  4.730000 1.570000  3.825000 1.498000  0.9053000      2.170000  
1 1 1 14 11 1  o 79.56000 0.5509000 79.38000 0.7776000 79.74000 0.7807000 -0.3657000     1.102000  
1 1 1 14 11 3  o 78.93000 0.5917000 79.04000 0.7744000 78.81000 0.8948000 0.2260000      1.183000  
1 1 1 14 11 5  o 97.67000 0.6715000 98.12000 0.9536000 97.23000 0.9456000 0.8857000      1.343000  
1 1 1 14 11 7  o 38.97000 0.3218000 38.85000 0.4848000 39.08000 0.4234000 -0.2335000     0.6436000 
1 1 1 14 11 9  o 94.78000 0.6530000 95.55000 0.9304000 94.00000 0.9164000 1.556000       1.306000  
1 1 1 14 11 11 o 45.10000 0.3615000 44.59000 0.5407000 45.61000 0.4799000 -1.021000      0.7229000 
1 1 1 14 11 13 o 62.39000 0.4437000 62.53000 0.6289000 62.25000 0.6262000 0.2811000      0.8875000 
1 1 1 14 11 15 f 40.84000 0.3875000 40.70000 0.4420000 40.98000 0.6367000 -0.2805000     0.7750000 
1 1 1 14 11 17 o 72.30000 0.5999000 73.25000 0.6497000 71.36000 1.009000  1.885000       1.200000  
1 1 1 14 11 19 o 57.48000 0.5170000 57.96000 0.5947000 56.99000 0.8460000 0.9752000      1.034000  
1 1 1 14 11 21 o 55.84000 0.4402000 56.36000 0.5756000 55.31000 0.6661000 1.042000       0.8804000 
1 1 1 14 11 23 o 6.442000 0.8143000 7.057000 0.9762000 5.827000 1.304000  1.230000       1.629000  
1 1 1 14 11 25 o 13.52000 0.3642000 13.03000 0.4308000 14.02000 0.5873000 -0.9907000     0.7283000 
1 1 1 14 11 27 o 24.01000 0.2983000 23.86000 0.3507000 24.16000 0.4826000 -0.2962000     0.5966000 
1 1 1 14 11 29 o 29.98000 0.2987000 30.18000 0.4060000 29.78000 0.4382000 0.4023000      0.5974000 
1 1 1 14 11 31 o 63.98000 0.5016000 64.01000 0.7501000 63.95000 0.6660000 0.5367000E-01  1.003000  
1 1 1 14 11 33 o 3.858000 0.9782000 3.946000 1.328000  3.771000 1.437000  0.1758000      1.956000  
1 1 1 14 11 35 o 37.35000 0.5183000 37.78000 0.4615000 36.92000 0.9281000 0.8583000      1.037000  
1 1 1 14 11 37 o 34.80000 0.3604000 34.61000 0.5335000 35.00000 0.4848000 -0.3933000     0.7209000 
1 1 1 14 11 39 o 7.690000 0.8032000 9.394000 0.8731000 5.985000 1.349000  3.409000       1.606000  
1 1 1 14 11 41 o 28.51000 0.3331000 28.42000 0.4567000 28.60000 0.4851000 -0.1822000     0.6663000 
1 1 1 14 11 43 o 21.63000 0.3420000 21.65000 0.4822000 21.60000 0.4851000 0.4824000E-01  0.6840000 
1 1 1 14 11 45 o 14.02000 0.4719000 13.93000 0.6268000 14.12000 0.7055000 -0.1928000     0.9437000 
1 1 1 14 11 47 o 9.958000 0.6294000 10.31000 1.021000  9.601000 0.7358000 0.7135000      1.259000  
1 1 1 14 11 49 o 7.540000 0.7061000 7.575000 0.9700000 7.505000 1.026000  0.6942000E-01  1.412000  
1 1 1 14 11 51 o 8.056000 0.6620000 8.213000 0.8583000 7.899000 1.008000  0.3138000      1.324000  
1 1 1 14 11 53 o 10.83000 0.4897000 10.57000 0.6940000 11.09000 0.6912000 -0.5210000     0.9795000 
1 1 1 14 11 55 o 7.686000 0.7590000 8.148000 0.9038000 7.223000 1.219000  0.9245000      1.518000  
1 1 1 14 11 57 o 4.335000 1.013000  4.015000 1.472000  4.656000 1.393000  -0.6413000     2.027000  
1 1 1 14 11 59 o 3.935000 1.133000  4.312000 1.639000  3.557000 1.565000  0.7550000      2.266000  
1 1 1 14 11 61 o 3.333000 1.015000  3.866000 1.565000  2.800000 1.293000  1.066000       2.030000  
1 1 1 14 11 63 o 3.516000 0.9705000 3.634000 1.415000  3.399000 1.328000  0.2356000      1.941000  
1 1 1 14 12 0  o 83.45000 0.8153000 83.45000 0.8153000 83.45000 0.8153000 0.000000       0.000000  
1 1 1 14 12 2  o 56.45000 0.4008000 56.66000 0.5684000 56.24000 0.5653000 0.4235000      0.8016000 
1 1 1 14 12 4  o 55.45000 0.4302000 54.93000 0.5542000 55.98000 0.6582000 -1.055000      0.8605000 
1 1 1 14 12 6  o 80.80000 0.5602000 81.04000 0.7946000 80.55000 0.7900000 0.4876000      1.120000  
1 1 1 14 12 8  o 48.47000 0.3828000 48.67000 0.5807000 48.26000 0.4989000 0.4129000      0.7656000 
1 1 1 14 12 10 o 26.14000 0.2769000 26.51000 0.3848000 25.77000 0.3982000 0.7430000      0.5537000 
1 1 1 14 12 12 o 53.77000 0.4177000 54.20000 0.5543000 53.34000 0.6251000 0.8592000      0.8355000 
1 1 1 14 12 14 o 16.38000 0.3494000 16.43000 0.3652000 16.33000 0.5959000 0.9850000E-01  0.6989000 
1 1 1 14 12 16 o 115.9000 0.8242000 114.7000 0.9953000 117.0000 1.314000  -2.235000      1.648000  
1 1 1 14 12 18 o 101.6000 1.105000  102.7000 1.001000  100.4000 1.970000  2.285000       2.210000  
1 1 1 14 12 20 o 92.89000 0.8299000 92.06000 1.272000  93.72000 1.066000  -1.659000      1.660000  
1 1 1 14 12 22 o 68.39000 0.5269000 69.19000 0.6941000 67.59000 0.7928000 1.592000       1.054000  
1 1 1 14 12 24 o 14.64000 0.3697000 14.86000 0.4766000 14.42000 0.5653000 0.4468000      0.7394000 
1 1 1 14 12 26 o 70.26000 0.5173000 70.48000 0.6325000 70.03000 0.8186000 0.4432000      1.035000  
1 1 1 14 12 28 o 22.65000 0.2959000 22.30000 0.3495000 23.00000 0.4777000 -0.7003000     0.5919000 
1 1 1 14 12 30 o 36.37000 0.3176000 36.05000 0.4342000 36.69000 0.4636000 -0.6315000     0.6352000 
1 1 1 14 12 32 o 32.12000 0.3558000 32.41000 0.4777000 31.83000 0.5275000 0.5829000      0.7116000 
1 1 1 14 12 34 o 45.37000 0.4226000 45.13000 0.5826000 45.61000 0.6123000 -0.4838000     0.8452000 
1 1 1 14 12 36 o 41.38000 0.4462000 41.47000 0.5524000 41.30000 0.7008000 0.1766000      0.8923000 
1 1 1 14 12 38 o 22.46000 0.3629000 22.95000 0.5431000 21.96000 0.4815000 0.9948000      0.7258000 
1 1 1 14 12 40 o 33.74000 0.3343000 33.94000 0.4683000 33.53000 0.4772000 0.4063000      0.6686000 
1 1 1 14 12 42 o 13.45000 0.4729000 12.57000 0.6915000 14.32000 0.6453000 -1.743000      0.9458000 
1 1 1 14 12 44 o 7.296000 0.7949000 6.720000 1.191000  7.871000 1.054000  -1.151000      1.590000  
1 1 1 14 12 46 o 18.45000 0.3825000 18.38000 0.5593000 18.53000 0.5220000 -0.1484000     0.7651000 
1 1 1 14 12 48 o 22.71000 0.4179000 22.70000 0.5484000 22.72000 0.6308000 -0.1877000E-01 0.8359000 
1 1 1 14 12 50 o 8.507000 0.7133000 7.863000 1.096000  9.151000 0.9130000 -1.288000      1.427000  
1 1 1 14 12 52 o 9.006000 0.5642000 9.401000 0.7889000 8.611000 0.8069000 0.7905000      1.128000  
1 1 1 14 12 54 o 13.13000 0.4781000 13.10000 0.7272000 13.16000 0.6209000 -0.5655000E-01 0.9562000 
1 1 1 14 12 56 o 5.688000 0.8676000 6.487000 1.147000  4.890000 1.302000  1.597000       1.735000  
1 1 1 14 12 58 o 3.754000 0.9743000 3.184000 1.368000  4.324000 1.388000  -1.140000      1.949000  
1 1 1 14 12 60 o 3.441000 0.9960000 3.730000 1.455000  3.153000 1.361000  0.5768000      1.992000  
1 1 1 14 12 62 o 3.037000 0.9408000 3.088000 1.352000  2.986000 1.309000  0.1017000      1.882000  
1 1 1 14 13 1  o 88.46000 0.6106000 87.84000 0.8576000 89.09000 0.8692000 -1.252000      1.221000  
1 1 1 14 13 3  o 77.62000 0.5842000 76.80000 0.7543000 78.44000 0.8923000 -1.634000      1.168000  
1 1 1 14 13 5  o 36.60000 0.2843000 36.20000 0.3973000 37.00000 0.4068000 -0.8045000     0.5686000 
1 1 1 14 13 7  o 26.64000 0.2839000 26.49000 0.4560000 26.79000 0.3385000 -0.2956000     0.5679000 
1 1 1 14 13 9  o 16.99000 0.2463000 16.48000 0.3456000 17.50000 0.3512000 -1.019000      0.4927000 
1 1 1 14 13 11 o 44.76000 0.3587000 44.88000 0.4733000 44.65000 0.5390000 0.2286000      0.7173000 
1 1 1 14 13 13 o 99.13000 0.7063000 99.48000 0.8660000 98.79000 1.116000  0.6878000      1.413000  
1 1 1 14 13 15 o 50.46000 0.4034000 49.95000 0.5116000 50.98000 0.6240000 -1.031000      0.8069000 
1 1 1 14 13 17 o 38.40000 0.4024000 37.44000 0.4912000 39.35000 0.6376000 -1.910000      0.8048000 
1 1 1 14 13 19 o 113.6000 0.9584000 113.8000 1.102000  113.5000 1.568000  0.2669000      1.917000  
1 1 1 14 13 21 o 62.99000 0.5883000 63.14000 0.7389000 62.84000 0.9157000 0.2976000      1.177000  
1 1 1 14 13 23 o 30.86000 0.2991000 31.05000 0.3526000 30.67000 0.4834000 0.3722000      0.5983000 
1 1 1 14 13 25 o 35.36000 0.3162000 35.24000 0.3758000 35.47000 0.5087000 -0.2353000     0.6324000 
1 1 1 14 13 27 o 24.81000 0.3108000 25.08000 0.4052000 24.54000 0.4713000 0.5402000      0.6215000 
1 1 1 14 13 29 f 21.92000 0.3038000 21.74000 0.3502000 22.11000 0.4964000 -0.3694000     0.6075000 
1 1 1 14 13 31 o 37.41000 0.3483000 38.04000 0.5126000 36.78000 0.4715000 1.264000       0.6965000 
1 1 1 14 13 33 o 32.51000 0.3343000 33.18000 0.4279000 31.84000 0.5138000 1.333000       0.6686000 
1 1 1 14 13 35 o 54.74000 0.5354000 55.30000 0.8215000 54.18000 0.6868000 1.117000       1.071000  
1 1 1 14 13 37 o 25.97000 0.3456000 25.95000 0.4367000 25.99000 0.5357000 -0.3482000E-01 0.6911000 
1 1 1 14 13 39 o 52.50000 0.5311000 52.77000 0.6700000 52.23000 0.8243000 0.5453000      1.062000  
1 1 1 14 13 41 o 31.91000 0.3317000 32.18000 0.4540000 31.65000 0.4838000 0.5339000      0.6634000 
1 1 1 14 13 43 o 7.295000 0.7926000 6.829000 1.185000  7.762000 1.053000  -0.9327000     1.585000  
1 1 1 14 13 45 o 3.581000 1.031000  3.512000 1.433000  3.651000 1.482000  -0.1384000     2.062000  
1 1 1 14 13 47 o 8.515000 0.7399000 7.258000 1.171000  9.772000 0.9048000 -2.515000      1.480000  
1 1 1 14 13 49 o 10.81000 0.5023000 10.87000 0.7219000 10.74000 0.6985000 0.1225000      1.005000  
1 1 1 14 13 51 o 6.932000 0.8565000 5.679000 1.434000  8.184000 0.9372000 -2.505000      1.713000  
1 1 1 14 13 53 o 7.137000 0.7122000 6.862000 1.111000  7.413000 0.8917000 -0.5506000     1.424000  
1 1 1 14 13 55 o 3.308000 0.9851000 3.343000 1.387000  3.272000 1.399000  0.7120000E-01  1.970000  
1 1 1 14 13 57 o 3.024000 0.9626000 3.513000 1.527000  2.535000 1.172000  0.9772000      1.925000  
1 1 1 14 13 59 o 7.943000 0.7822000 6.712000 1.215000  9.175000 0.9858000 -2.462000      1.564000  
1 1 1 14 13 61 o 3.049000 0.9198000 2.902000 1.303000  3.196000 1.299000  -0.2936000     1.840000  
1 1 1 14 13 63 o 4.114000 0.9992000 4.724000 1.477000  3.505000 1.347000  1.219000       1.998000  
1 1 1 14 14 0  o 93.53000 0.9110000 93.53000 0.9110000 93.53000 0.9110000 0.000000       0.000000  
1 1 1 14 14 2  o 57.87000 0.4128000 57.83000 0.5834000 57.91000 0.5841000 -0.7419000E-01 0.8255000 
1 1 1 14 14 4  o 85.43000 0.6829000 84.63000 0.9542000 86.22000 0.9773000 -1.592000      1.366000  
1 1 1 14 14 6  o 49.79000 0.4130000 49.00000 0.5757000 50.57000 0.5923000 -1.575000      0.8259000 
1 1 1 14 14 8  o 52.48000 0.4851000 52.44000 0.7514000 52.52000 0.6138000 -0.7655000E-01 0.9702000 
1 1 1 14 14 10 o 39.60000 0.3254000 39.57000 0.4293000 39.63000 0.4890000 -0.6532000E-01 0.6507000 
1 1 1 14 14 12 o 26.18000 0.2659000 25.82000 0.2960000 26.55000 0.4418000 -0.7258000     0.5318000 
1 1 1 14 14 14 o 39.79000 0.3257000 39.85000 0.3866000 39.73000 0.5244000 0.1193000      0.6515000 
1 1 1 14 14 16 o 31.01000 0.3362000 31.35000 0.3642000 30.68000 0.5652000 0.6663000      0.6724000 
1 1 1 14 14 18 o 29.37000 0.3468000 28.84000 0.3834000 29.90000 0.5780000 -1.055000      0.6936000 
1 1 1 14 14 20 o 30.15000 0.2899000 30.29000 0.3439000 30.01000 0.4669000 0.2740000      0.5798000 
1 1 1 14 14 22 o 49.61000 0.4040000 49.73000 0.5222000 49.50000 0.6165000 0.2290000      0.8079000 
1 1 1 14 14 24 o 37.54000 0.4124000 37.38000 0.5088000 37.70000 0.6490000 -0.3222000     0.8247000 
1 1 1 14 14 26 o 49.98000 0.3944000 49.66000 0.4711000 50.30000 0.6326000 -0.6366000     0.7888000 
1 1 1 14 14 28 o 52.95000 0.4111000 52.88000 0.4969000 53.02000 0.6552000 -0.1425000     0.8223000 
1 1 1 14 14 30 o 61.53000 0.4849000 61.47000 0.7226000 61.59000 0.6466000 -0.1225000     0.9697000 
1 1 1 14 14 32 f 9.580000 0.6511000 9.206000 0.6569000 9.955000 1.124000  -0.7497000     1.302000  
1 1 1 14 14 34 o 23.00000 0.3428000 22.77000 0.4293000 23.22000 0.5345000 -0.4565000     0.6856000 
1 1 1 14 14 36 o 11.94000 0.5569000 11.06000 0.8318000 12.82000 0.7408000 -1.757000      1.114000  
1 1 1 14 14 38 o 35.33000 0.3369000 34.51000 0.4611000 36.15000 0.4913000 -1.638000      0.6737000 
1 1 1 14 14 40 o 3.438000 1.063000  2.994000 1.320000  3.883000 1.668000  -0.8891000     2.127000  
1 1 1 14 14 42 o 13.57000 0.4688000 13.96000 0.6144000 13.18000 0.7083000 0.7818000      0.9377000 
1 1 1 14 14 44 o 7.593000 0.8303000 6.461000 1.250000  8.724000 1.093000  -2.263000      1.661000  
1 1 1 14 14 46 o 6.777000 0.8375000 6.909000 1.059000  6.645000 1.298000  0.2644000      1.675000  
1 1 1 14 14 48 o 14.22000 0.4272000 13.56000 0.5752000 14.89000 0.6317000 -1.332000      0.8544000 
1 1 1 14 14 50 o 5.332000 0.9765000 5.876000 1.424000  4.788000 1.337000  1.089000       1.953000  
1 1 1 14 14 52 o 13.35000 0.4230000 13.68000 0.5964000 13.02000 0.6001000 0.6692000      0.8460000 
1 1 1 14 14 54 o 7.651000 0.8072000 7.523000 1.301000  7.779000 0.9554000 -0.2557000     1.614000  
1 1 1 14 14 56 o 14.62000 0.4161000 14.46000 0.6046000 14.78000 0.5720000 -0.3125000     0.8323000 
1 1 1 14 14 58 o 5.177000 1.080000  5.596000 1.476000  4.758000 1.578000  0.8381000      2.160000  
1 1 1 14 14 60 o 8.671000 0.8366000 9.276000 1.073000  8.065000 1.284000  1.211000       1.673000  
1 1 1 14 14 62 o 8.387000 0.7125000 8.197000 1.136000  8.576000 0.8605000 -0.3789000     1.425000  
1 1 1 14 15 1  o 82.16000 0.6549000 81.97000 0.9232000 82.34000 0.9292000 -0.3759000     1.310000  
1 1 1 14 15 3  o 113.8000 0.8992000 115.3000 1.288000  112.2000 1.255000  3.075000       1.798000  
1 1 1 14 15 5  o 38.43000 0.3743000 39.33000 0.4816000 37.54000 0.5731000 1.789000       0.7486000 
1 1 1 14 15 7  o 67.43000 0.5478000 67.64000 0.7808000 67.22000 0.7687000 0.4186000      1.096000  
1 1 1 14 15 9  o 48.76000 0.3577000 48.57000 0.5035000 48.95000 0.5082000 -0.3849000     0.7154000 
1 1 1 14 15 11 o 67.77000 0.5193000 67.21000 0.6704000 68.32000 0.7934000 -1.109000      1.039000  
1 1 1 14 15 13 o 6.944000 0.4751000 6.481000 0.4260000 7.407000 0.8494000 -0.9262000     0.9503000 
1 1 1 14 15 15 o 50.82000 0.4558000 51.29000 0.5216000 50.35000 0.7477000 0.9416000      0.9116000 
1 1 1 14 15 17 o 32.91000 0.3138000 32.42000 0.3972000 33.40000 0.4859000 -0.9816000     0.6276000 
1 1 1 14 15 19 o 28.87000 0.4433000 28.01000 0.3547000 29.73000 0.8126000 -1.718000      0.8866000 
1 1 1 14 15 21 o 95.86000 0.6884000 95.54000 0.8358000 96.18000 1.094000  -0.6408000     1.377000  
1 1 1 14 15 23 o 34.26000 0.3112000 34.29000 0.3699000 34.24000 0.5006000 0.4243000E-01  0.6224000 
1 1 1 14 15 25 o 41.82000 0.3662000 40.95000 0.4673000 42.69000 0.5640000 -1.736000      0.7324000 
1 1 1 14 15 27 o 12.63000 0.4538000 12.64000 0.4684000 12.63000 0.7775000 0.1478000E-01  0.9077000 
1 1 1 14 15 29 o 5.422000 0.7907000 3.843000 1.179000  7.002000 1.054000  -3.159000      1.581000  
1 1 1 14 15 31 o 14.87000 0.3881000 14.94000 0.4639000 14.80000 0.6223000 0.1448000      0.7762000 
1 1 1 14 15 33 o 18.18000 0.3328000 18.80000 0.4380000 17.56000 0.5013000 1.239000       0.6657000 
1 1 1 14 15 35 o 29.43000 0.3616000 29.50000 0.4945000 29.36000 0.5277000 0.1397000      0.7232000 
1 1 1 14 15 37 o 38.46000 0.3440000 38.26000 0.4739000 38.65000 0.4987000 -0.3877000     0.6879000 
1 1 1 14 15 39 o 36.59000 0.3719000 36.02000 0.5516000 37.16000 0.4988000 -1.132000      0.7437000 
1 1 1 14 15 41 o 17.21000 0.3874000 16.94000 0.5346000 17.48000 0.5609000 -0.5432000     0.7749000 
1 1 1 14 15 43 o 11.97000 0.4957000 11.85000 0.6946000 12.08000 0.7074000 -0.2295000     0.9914000 
1 1 1 14 15 45 o 19.26000 0.4060000 19.53000 0.5390000 18.99000 0.6074000 0.5423000      0.8121000 
1 1 1 14 15 47 f 7.863000 0.7744000 8.020000 1.025000  7.706000 1.161000  0.3145000      1.549000  
1 1 1 14 15 49 o 6.548000 0.8731000 6.254000 1.333000  6.843000 1.128000  -0.5892000     1.746000  
1 1 1 14 15 51 o 4.489000 0.9810000 4.875000 1.397000  4.104000 1.378000  0.7707000      1.962000  
1 1 1 14 15 53 o 10.82000 0.6399000 10.70000 1.100000  10.94000 0.6534000 -0.2333000     1.280000  
1 1 1 14 15 55 o 8.578000 0.6982000 8.698000 0.8933000 8.459000 1.073000  0.2387000      1.396000  
1 1 1 14 15 57 o 6.869000 0.8264000 5.942000 1.319000  7.797000 0.9955000 -1.854000      1.653000  
1 1 1 14 15 59 o 8.463000 0.7607000 8.938000 0.9909000 7.988000 1.155000  0.9505000      1.521000  
1 1 1 14 15 61 o 6.727000 0.8977000 6.598000 1.395000  6.857000 1.130000  -0.2596000     1.795000  
1 1 1 14 15 63 f 2.890000 0.8942000 3.597000 1.447000  2.183000 1.051000  1.414000       1.788000  
1 1 1 14 16 0  o 97.20000 1.090000  97.20000 1.090000  97.20000 1.090000  0.000000       0.000000  
1 1 1 14 16 2  o 86.38000 0.6880000 86.69000 0.9762000 86.06000 0.9696000 0.6290000      1.376000  
1 1 1 14 16 4  o 82.49000 0.6193000 82.30000 0.8072000 82.67000 0.9394000 -0.3693000     1.239000  
1 1 1 14 16 6  o 93.03000 0.6428000 92.15000 0.8999000 93.91000 0.9182000 -1.760000      1.286000  
1 1 1 14 16 8  f 85.86000 0.7773000 87.92000 1.227000  83.80000 0.9544000 4.122000       1.555000  
1 1 1 14 16 10 o 45.69000 0.4018000 45.05000 0.5621000 46.33000 0.5742000 -1.281000      0.8035000 
1 1 1 14 16 12 o 48.74000 0.5156000 48.84000 0.7299000 48.65000 0.7284000 0.1866000      1.031000  
1 1 1 14 16 14 o 33.70000 0.3658000 33.23000 0.4380000 34.16000 0.5860000 -0.9289000     0.7316000 
1 1 1 14 16 16 o 10.88000 0.4764000 10.35000 0.7272000 11.41000 0.6155000 -1.065000      0.9527000 
1 1 1 14 16 18 o 54.13000 0.4788000 53.87000 0.4952000 54.38000 0.8196000 -0.5121000     0.9576000 
1 1 1 14 16 20 o 34.66000 0.3074000 34.59000 0.3603000 34.73000 0.4982000 -0.1423000     0.6149000 
1 1 1 14 16 22 o 61.93000 0.5172000 61.75000 0.7242000 62.11000 0.7387000 -0.3630000     1.034000  
1 1 1 14 16 24 o 23.72000 0.3016000 23.67000 0.3833000 23.77000 0.4659000 -0.9265000E-01 0.6033000 
1 1 1 14 16 26 o 24.18000 0.3043000 24.00000 0.3914000 24.36000 0.4659000 -0.3539000     0.6085000 
1 1 1 14 16 28 o 41.84000 0.3529000 41.65000 0.4219000 42.02000 0.5659000 -0.3714000     0.7058000 
1 1 1 14 16 30 o 10.23000 0.8459000 10.52000 0.6251000 9.938000 1.572000  0.5788000      1.692000  
1 1 1 14 16 32 o 39.16000 0.3689000 39.36000 0.4608000 38.96000 0.5762000 0.3996000      0.7378000 
1 1 1 14 16 34 o 12.59000 0.5214000 12.41000 0.5991000 12.77000 0.8536000 -0.3665000     1.043000  
1 1 1 14 16 36 o 7.610000 0.6941000 7.124000 0.9685000 8.096000 0.9946000 -0.9721000     1.388000  
1 1 1 14 16 38 o 11.60000 0.5199000 11.37000 0.7260000 11.83000 0.7445000 -0.4537000     1.040000  
1 1 1 14 16 40 o 15.78000 0.4552000 15.39000 0.6878000 16.17000 0.5965000 -0.7808000     0.9104000 
1 1 1 14 16 42 o 12.21000 0.5035000 11.79000 0.7066000 12.63000 0.7176000 -0.8398000     1.007000  
1 1 1 14 16 44 o 7.056000 1.240000  6.113000 1.224000  7.999000 2.157000  -1.886000      2.480000  
1 1 1 14 16 46 o 22.89000 0.3845000 23.63000 0.6016000 22.14000 0.4791000 1.492000       0.7691000 
1 1 1 14 16 48 o 10.07000 0.6428000 10.09000 0.7572000 10.05000 1.039000  0.3490000E-01  1.286000  
1 1 1 14 16 50 o 15.64000 0.3973000 15.00000 0.5674000 16.29000 0.5564000 -1.293000      0.7946000 
1 1 1 14 16 52 f 5.243000 0.9888000 6.022000 1.432000  4.465000 1.363000  1.558000       1.978000  
1 1 1 14 16 54 o 6.148000 0.8298000 5.697000 1.283000  6.598000 1.052000  -0.9007000     1.660000  
1 1 1 14 16 56 o 9.703000 0.6985000 10.27000 1.151000  9.134000 0.7916000 1.139000       1.397000  
1 1 1 14 16 58 o 7.971000 0.7385000 7.114000 1.231000  8.829000 0.8155000 -1.715000      1.477000  
1 1 1 14 16 60 o 10.10000 0.6096000 10.83000 0.8478000 9.383000 0.8761000 1.443000       1.219000  
1 1 1 14 16 62 o 2.936000 0.9157000 2.836000 1.279000  3.036000 1.311000  -0.2002000     1.831000  
1 1 1 14 17 1  o 141.0000 0.9618000 140.8000 1.359000  141.2000 1.362000  -0.3542000     1.924000  
1 1 1 14 17 3  o 71.96000 0.6066000 70.94000 0.9753000 72.99000 0.7214000 -2.049000      1.213000  
1 1 1 14 17 5  o 38.37000 0.3278000 38.76000 0.5061000 37.97000 0.4168000 0.7920000      0.6556000 
1 1 1 14 17 7  o 34.54000 0.3850000 34.70000 0.6054000 34.38000 0.4758000 0.3196000      0.7700000 
1 1 1 14 17 9  o 27.73000 0.3161000 28.01000 0.4531000 27.44000 0.4408000 0.5681000      0.6322000 
1 1 1 14 17 11 o 51.40000 0.5373000 51.21000 0.7572000 51.59000 0.7626000 -0.3713000     1.075000  
1 1 1 14 17 13 o 38.92000 0.4074000 39.39000 0.5232000 38.44000 0.6245000 0.9491000      0.8147000 
1 1 1 14 17 15 o 12.03000 0.3326000 12.78000 0.2881000 11.28000 0.5996000 1.503000       0.6652000 
1 1 1 14 17 17 o 41.94000 0.3408000 41.31000 0.3968000 42.57000 0.5542000 -1.251000      0.6816000 
1 1 1 14 17 19 o 4.816000 0.7616000 5.030000 0.7474000 4.601000 1.327000  0.4291000      1.523000  
1 1 1 14 17 21 o 49.77000 0.4047000 49.61000 0.5182000 49.94000 0.6217000 -0.3303000     0.8094000 
1 1 1 14 17 23 o 36.87000 0.3367000 37.07000 0.4321000 36.67000 0.5164000 0.3988000      0.6733000 
1 1 1 14 17 25 o 27.50000 0.2943000 27.11000 0.3382000 27.89000 0.4818000 -0.7884000     0.5886000 
1 1 1 14 17 27 o 22.29000 0.3165000 22.08000 0.4041000 22.50000 0.4871000 -0.4164000     0.6329000 
1 1 1 14 17 29 o 28.51000 0.3576000 28.21000 0.3955000 28.81000 0.5959000 -0.6023000     0.7152000 
1 1 1 14 17 31 o 40.51000 0.3737000 39.53000 0.4589000 41.50000 0.5898000 -1.967000      0.7473000 
1 1 1 14 17 33 o 60.14000 0.7329000 60.83000 0.7217000 59.44000 1.276000  1.388000       1.466000  
1 1 1 14 17 35 o 16.49000 0.3857000 15.94000 0.5639000 17.05000 0.5263000 -1.103000      0.7714000 
1 1 1 14 17 37 o 13.43000 0.4887000 13.20000 0.7475000 13.65000 0.6298000 -0.4432000     0.9774000 
1 1 1 14 17 39 o 13.62000 0.4394000 13.46000 0.6026000 13.78000 0.6396000 -0.3224000     0.8788000 
1 1 1 14 17 41 o 23.83000 0.3660000 23.67000 0.5399000 23.98000 0.4944000 -0.3100000     0.7321000 
1 1 1 14 17 43 o 4.243000 0.9824000 3.183000 1.396000  5.304000 1.382000  -2.120000      1.965000  
1 1 1 14 17 45 o 21.99000 0.3848000 20.94000 0.6341000 23.04000 0.4360000 -2.105000      0.7695000 
1 1 1 14 17 47 o 3.716000 1.046000  3.750000 1.495000  3.682000 1.463000  0.6795000E-01  2.092000  
1 1 1 14 17 49 o 20.21000 0.3501000 20.24000 0.5535000 20.18000 0.4287000 0.6295000E-01  0.7001000 
1 1 1 14 17 51 o 12.76000 0.5103000 12.22000 0.8387000 13.31000 0.5817000 -1.092000      1.021000  
1 1 1 14 17 53 o 3.067000 0.9201000 3.352000 1.405000  2.782000 1.188000  0.5693000      1.840000  
1 1 1 14 17 55 o 7.466000 0.7470000 8.143000 0.9856000 6.790000 1.123000  1.353000       1.494000  
1 1 1 14 17 57 f 2.832000 0.8729000 2.322000 1.120000  3.342000 1.339000  -1.020000      1.746000  
1 1 1 14 17 59 o 4.662000 1.010000  3.493000 1.451000  5.832000 1.406000  -2.340000      2.021000  
1 1 1 14 17 61 f 4.187000 1.038000  3.822000 1.622000  4.551000 1.296000  -0.7288000     2.076000  
1 1 1 14 18 0  o 110.5000 1.072000  110.5000 1.072000  110.5000 1.072000  0.000000       0.000000  
1 1 1 14 18 2  o 56.27000 0.4038000 56.59000 0.5734000 55.95000 0.5686000 0.6407000      0.8076000 
1 1 1 14 18 4  o 94.92000 0.7087000 95.47000 0.9319000 94.37000 1.068000  1.099000       1.417000  
1 1 1 14 18 6  o 77.11000 0.6247000 77.53000 0.8882000 76.69000 0.8787000 0.8449000      1.249000  
1 1 1 14 18 8  o 24.29000 0.4734000 24.07000 0.7956000 24.51000 0.5133000 -0.4406000     0.9468000 
1 1 1 14 18 10 o 30.87000 0.3959000 29.93000 0.5531000 31.81000 0.5667000 -1.888000      0.7918000 
1 1 1 14 18 12 o 119.1000 0.9460000 118.6000 1.331000  119.6000 1.344000  -0.9810000     1.892000  
1 1 1 14 18 14 o 60.81000 0.5109000 59.70000 0.7114000 61.91000 0.7334000 -2.206000      1.022000  
1 1 1 14 18 16 o 54.49000 0.4128000 54.34000 0.4953000 54.65000 0.6604000 -0.3156000     0.8255000 
1 1 1 14 18 18 o 48.29000 0.4366000 48.27000 0.4499000 48.31000 0.7485000 -0.4662000E-01 0.8733000 
1 1 1 14 18 20 o 30.87000 0.2925000 30.75000 0.3387000 30.99000 0.4770000 -0.2407000     0.5850000 
1 1 1 14 18 22 o 39.43000 0.3459000 38.71000 0.4319000 40.15000 0.5403000 -1.440000      0.6917000 
1 1 1 14 18 24 o 65.23000 0.5083000 65.58000 0.6648000 64.88000 0.7692000 0.6972000      1.017000  
1 1 1 14 18 26 o 30.60000 0.3046000 30.89000 0.3579000 30.32000 0.4929000 0.5737000      0.6091000 
1 1 1 14 18 28 o 55.79000 0.5097000 55.91000 0.5795000 55.67000 0.8387000 0.2379000      1.019000  
1 1 1 14 18 30 o 21.39000 0.3163000 22.08000 0.3676000 20.71000 0.5148000 1.368000       0.6325000 
1 1 1 14 18 32 o 28.42000 0.3326000 28.71000 0.4085000 28.14000 0.5251000 0.5657000      0.6653000 
1 1 1 14 18 34 o 28.34000 0.3296000 28.37000 0.4710000 28.31000 0.4612000 0.5408000E-01  0.6592000 
1 1 1 14 18 36 o 23.19000 0.3744000 22.79000 0.4975000 23.59000 0.5597000 -0.8021000     0.7489000 
1 1 1 14 18 38 o 4.945000 1.051000  4.200000 1.578000  5.690000 1.388000  -1.490000      2.102000  
1 1 1 14 18 40 o 12.96000 0.6100000 12.96000 1.054000  12.95000 0.6149000 0.1548000E-01  1.220000  
1 1 1 14 18 42 o 13.67000 0.5055000 13.63000 0.8405000 13.71000 0.5620000 -0.8406000E-01 1.011000  
1 1 1 14 18 44 o 18.93000 0.4110000 18.84000 0.6812000 19.01000 0.4599000 -0.1718000     0.8219000 
1 1 1 14 18 46 o 15.30000 0.5058000 14.59000 0.8341000 16.01000 0.5725000 -1.424000      1.012000  
1 1 1 14 18 48 o 17.85000 0.4982000 17.56000 0.7557000 18.13000 0.6495000 -0.5782000     0.9964000 
1 1 1 14 18 50 o 10.10000 0.6065000 10.07000 0.9260000 10.14000 0.7834000 -0.7524000E-01 1.213000  
1 1 1 14 18 52 o 9.322000 0.6208000 9.201000 1.038000  9.444000 0.6809000 -0.2427000     1.242000  
1 1 1 14 18 54 o 10.41000 0.5748000 10.99000 0.8252000 9.835000 0.8005000 1.154000       1.150000  
1 1 1 14 18 56 o 6.434000 1.198000  7.438000 2.110000  5.430000 1.137000  2.008000       2.397000  
1 1 1 14 18 58 o 10.98000 0.5904000 10.73000 0.7917000 11.23000 0.8759000 -0.5006000     1.181000  
1 1 1 14 18 60 o 2.997000 0.9342000 3.313000 1.405000  2.681000 1.232000  0.6320000      1.868000  
1 1 1 14 18 62 o 5.911000 0.9059000 4.787000 1.527000  7.035000 0.9752000 -2.248000      1.812000  
1 1 1 14 19 1  o 41.08000 0.3435000 41.58000 0.5292000 40.58000 0.4380000 1.001000       0.6869000 
1 1 1 14 19 3  o 30.20000 0.3210000 30.11000 0.4035000 30.28000 0.4994000 -0.1645000     0.6420000 
1 1 1 14 19 5  o 60.03000 0.6086000 60.13000 0.8622000 59.92000 0.8590000 0.2118000      1.217000  
1 1 1 14 19 7  o 51.50000 0.7810000 51.35000 1.102000  51.65000 1.107000  -0.3009000     1.562000  
1 1 1 14 19 9  o 60.98000 0.5688000 60.36000 0.7138000 61.60000 0.8858000 -1.239000      1.138000  
1 1 1 14 19 11 f 58.22000 0.4909000 57.91000 0.6908000 58.53000 0.6976000 -0.6205000     0.9817000 
1 1 1 14 19 13 o 16.68000 0.3499000 16.62000 0.4989000 16.75000 0.4909000 -0.1281000     0.6999000 
1 1 1 14 19 15 o 44.95000 0.4057000 45.26000 0.5763000 44.63000 0.5712000 0.6264000      0.8113000 
1 1 1 14 19 17 f 54.54000 0.4147000 54.79000 0.5011000 54.29000 0.6608000 0.5007000      0.8293000 
1 1 1 14 19 19 o 54.16000 0.4128000 54.31000 0.4983000 54.01000 0.6582000 0.2980000      0.8256000 
1 1 1 14 19 21 o 52.60000 0.4240000 52.23000 0.5405000 52.96000 0.6533000 -0.7289000     0.8479000 
1 1 1 14 19 23 o 24.57000 0.3045000 23.99000 0.3807000 25.16000 0.4753000 -1.165000      0.6090000 
1 1 1 14 19 25 o 58.43000 0.4652000 58.72000 0.6061000 58.14000 0.7060000 0.5828000      0.9305000 
1 1 1 14 19 27 o 39.69000 0.4049000 40.07000 0.4627000 39.31000 0.6647000 0.7522000      0.8099000 
1 1 1 14 19 29 o 33.24000 0.3324000 33.53000 0.4183000 32.96000 0.5166000 0.5722000      0.6647000 
1 1 1 14 19 31 o 15.16000 0.4358000 15.64000 0.4536000 14.68000 0.7443000 0.9655000      0.8716000 
1 1 1 14 19 33 o 19.61000 0.3615000 19.58000 0.4461000 19.64000 0.5691000 -0.5884000E-01 0.7230000 
1 1 1 14 19 35 o 18.72000 0.3555000 19.20000 0.4763000 18.25000 0.5278000 0.9520000      0.7109000 
1 1 1 14 19 37 o 27.46000 0.3388000 26.82000 0.5291000 28.11000 0.4234000 -1.290000      0.6776000 
1 1 1 14 19 39 o 21.49000 0.4497000 21.22000 0.6982000 21.75000 0.5670000 -0.5315000     0.8994000 
1 1 1 14 19 41 o 7.455000 0.9833000 6.974000 1.734000  7.936000 0.9283000 -0.9623000     1.967000  
1 1 1 14 19 43 o 10.85000 0.6055000 11.10000 0.8661000 10.59000 0.8463000 0.5126000      1.211000  
1 1 1 14 19 45 o 10.43000 0.5382000 10.35000 0.8787000 10.51000 0.6217000 -0.1592000     1.076000  
1 1 1 14 19 47 o 5.525000 1.125000  4.636000 1.750000  6.413000 1.413000  -1.777000      2.249000  
1 1 1 14 19 49 o 19.47000 0.4245000 20.14000 0.7300000 18.80000 0.4335000 1.338000       0.8490000 
1 1 1 14 19 51 o 4.198000 1.005000  4.786000 1.474000  3.609000 1.367000  1.177000       2.011000  
1 1 1 14 19 53 o 8.952000 0.8494000 7.730000 1.561000  10.17000 0.6710000 -2.445000      1.699000  
1 1 1 14 19 55 o 8.118000 0.8092000 7.918000 1.252000  8.318000 1.026000  -0.4002000     1.618000  
1 1 1 14 19 57 o 3.571000 1.027000  3.667000 1.516000  3.476000 1.385000  0.1909000      2.053000  
1 1 1 14 19 59 o 9.191000 0.7312000 9.354000 1.100000  9.027000 0.9631000 0.3272000      1.462000  
1 1 1 14 19 61 o 5.351000 0.9111000 5.218000 1.344000  5.484000 1.231000  -0.2666000     1.822000  
1 1 1 14 20 0  o 107.1000 1.199000  107.1000 1.199000  107.1000 1.199000  0.000000       0.000000  
1 1 1 14 20 2  o 39.90000 0.3940000 41.20000 0.6253000 38.59000 0.4797000 2.617000       0.7881000 
1 1 1 14 20 4  o 24.84000 0.4703000 25.48000 0.8322000 24.19000 0.4385000 1.286000       0.9406000 
1 1 1 14 20 6  f 80.17000 0.7223000 81.34000 0.9300000 79.00000 1.105000  2.336000       1.445000  
1 1 1 14 20 8  o 78.79000 0.6403000 78.55000 0.9021000 79.04000 0.9089000 -0.4898000     1.281000  
1 1 1 14 20 10 o 59.28000 0.4999000 58.99000 0.7035000 59.56000 0.7105000 -0.5716000     0.9999000 
1 1 1 14 20 12 o 54.42000 0.4663000 54.41000 0.6583000 54.43000 0.6606000 -0.2728000E-01 0.9326000 
1 1 1 14 20 14 o 16.95000 0.3528000 17.17000 0.5052000 16.72000 0.4925000 0.4479000      0.7055000 
1 1 1 14 20 16 o 54.11000 0.5173000 54.93000 0.6647000 53.29000 0.7929000 1.639000       1.035000  
1 1 1 14 20 18 o 47.15000 0.4512000 45.89000 0.4906000 48.40000 0.7575000 -2.515000      0.9025000 
1 1 1 14 20 20 o 28.45000 0.3008000 27.63000 0.3754000 29.27000 0.4701000 -1.635000      0.6015000 
1 1 1 14 20 22 o 41.05000 0.3431000 40.55000 0.4017000 41.55000 0.5562000 -0.9924000     0.6861000 
1 1 1 14 20 24 o 44.12000 0.3599000 44.10000 0.4281000 44.14000 0.5787000 -0.4355000E-01 0.7198000 
1 1 1 14 20 26 o 13.06000 0.4241000 12.71000 0.4011000 13.42000 0.7473000 -0.7162000     0.8481000 
1 1 1 14 20 28 o 49.54000 0.4433000 49.53000 0.6158000 49.56000 0.6378000 -0.3198000E-01 0.8866000 
1 1 1 14 20 30 o 14.69000 0.3917000 14.18000 0.4671000 15.20000 0.6288000 -1.021000      0.7833000 
1 1 1 14 20 32 o 3.877000 0.9465000 2.990000 1.237000  4.764000 1.433000  -1.774000      1.893000  
1 1 1 14 20 34 o 27.38000 0.3779000 26.82000 0.5994000 27.93000 0.4604000 -1.114000      0.7558000 
1 1 1 14 20 36 o 21.26000 0.3432000 20.99000 0.5434000 21.52000 0.4194000 -0.5342000     0.6864000 
1 1 1 14 20 38 o 19.51000 0.5145000 18.89000 0.8966000 20.12000 0.5050000 -1.238000      1.029000  
1 1 1 14 20 40 o 37.63000 0.3545000 37.12000 0.5480000 38.13000 0.4500000 -1.010000      0.7091000 
1 1 1 14 20 42 o 23.96000 0.4312000 23.38000 0.6590000 24.55000 0.5563000 -1.170000      0.8624000 
1 1 1 14 20 44 o 6.443000 0.9170000 6.012000 1.569000  6.873000 0.9503000 -0.8610000     1.834000  
1 1 1 14 20 46 o 9.295000 0.7067000 8.479000 1.194000  10.11000 0.7564000 -1.632000      1.413000  
1 1 1 14 20 48 o 11.57000 0.5066000 12.04000 0.7935000 11.11000 0.6300000 0.9226000      1.013000  
1 1 1 14 20 50 o 13.39000 0.4535000 13.76000 0.6932000 13.03000 0.5848000 0.7292000      0.9069000 
1 1 1 14 20 52 o 8.618000 0.7305000 7.970000 1.272000  9.265000 0.7179000 -1.296000      1.461000  
1 1 1 14 20 54 o 3.060000 0.9376000 2.665000 1.245000  3.455000 1.402000  -0.7902000     1.875000  
1 1 1 14 20 56 f 19.45000 0.4774000 19.00000 0.7733000 19.90000 0.5600000 -0.8999000     0.9548000 
1 1 1 14 20 58 o 6.794000 0.9040000 6.474000 1.453000  7.113000 1.076000  -0.6388000     1.808000  
1 1 1 14 20 60 o 3.347000 1.008000  4.012000 1.649000  2.682000 1.160000  1.330000       2.017000  
1 1 1 14 21 1  o 65.28000 0.4624000 65.11000 0.6521000 65.45000 0.6559000 -0.3399000     0.9249000 
1 1 1 14 21 3  f 82.02000 0.6183000 82.46000 0.9410000 81.58000 0.8023000 0.8804000      1.237000  
1 1 1 14 21 5  o 16.35000 0.3391000 16.76000 0.4733000 15.94000 0.4858000 0.8128000      0.6782000 
1 1 1 14 21 7  o 20.27000 0.3735000 20.45000 0.5955000 20.08000 0.4511000 0.3744000      0.7470000 
1 1 1 14 21 9  o 58.77000 0.4956000 59.29000 0.7066000 58.25000 0.6951000 1.034000       0.9911000 
1 1 1 14 21 11 o 35.75000 0.3519000 35.20000 0.4965000 36.30000 0.4989000 -1.098000      0.7039000 
1 1 1 14 21 13 o 56.48000 0.4810000 55.96000 0.6742000 57.00000 0.6861000 -1.034000      0.9619000 
1 1 1 14 21 15 o 101.8000 0.8154000 102.1000 1.156000  101.4000 1.151000  0.6586000      1.631000  
1 1 1 14 21 17 o 31.74000 0.3885000 31.78000 0.4806000 31.70000 0.6104000 0.8400000E-01  0.7769000 
1 1 1 14 21 19 o 30.87000 0.3085000 30.50000 0.3860000 31.23000 0.4814000 -0.7286000     0.6170000 
1 1 1 14 21 21 o 14.26000 0.3752000 13.34000 0.5251000 15.17000 0.5361000 -1.829000      0.7504000 
1 1 1 14 21 23 o 34.53000 0.3132000 34.64000 0.3656000 34.43000 0.5086000 0.2123000      0.6264000 
1 1 1 14 21 25 o 23.18000 0.3588000 22.90000 0.3855000 23.45000 0.6053000 -0.5552000     0.7176000 
1 1 1 14 21 27 o 13.26000 0.3947000 12.80000 0.4562000 13.73000 0.6443000 -0.9329000     0.7894000 
1 1 1 14 21 29 o 13.53000 0.4256000 13.33000 0.5656000 13.73000 0.6361000 -0.3922000     0.8511000 
1 1 1 14 21 31 o 32.44000 0.4956000 32.74000 0.3820000 32.14000 0.9147000 0.5975000      0.9912000 
1 1 1 14 21 33 o 13.65000 0.4964000 13.94000 0.8300000 13.36000 0.5448000 0.5808000      0.9928000 
1 1 1 14 21 35 o 30.45000 0.3765000 30.80000 0.5979000 30.11000 0.4578000 0.6869000      0.7530000 
1 1 1 14 21 37 o 30.92000 0.3345000 30.10000 0.5192000 31.74000 0.4219000 -1.640000      0.6690000 
1 1 1 14 21 39 o 12.34000 0.5458000 11.93000 0.8285000 12.74000 0.7108000 -0.8013000     1.092000  
1 1 1 14 21 41 o 9.633000 0.6112000 9.677000 0.9432000 9.590000 0.7777000 0.8727000E-01  1.222000  
1 1 1 14 21 43 o 10.56000 0.6619000 11.48000 1.078000  9.643000 0.7683000 1.842000       1.324000  
1 1 1 14 21 45 o 19.54000 0.4321000 18.82000 0.7152000 20.27000 0.4852000 -1.453000      0.8643000 
1 1 1 14 21 47 o 22.22000 0.4003000 22.36000 0.6673000 22.07000 0.4426000 0.2941000      0.8007000 
1 1 1 14 21 49 o 8.599000 0.6763000 8.816000 1.081000  8.382000 0.8128000 0.4344000      1.353000  
1 1 1 14 21 51 o 17.54000 0.4127000 17.14000 0.6135000 17.94000 0.5524000 -0.8035000     0.8255000 
1 1 1 14 21 53 o 4.413000 1.124000  3.150000 1.416000  5.676000 1.745000  -2.526000      2.248000  
1 1 1 14 21 55 o 11.29000 0.8044000 11.53000 1.464000  11.04000 0.6661000 0.4897000      1.609000  
1 1 1 14 21 57 o 3.470000 0.9797000 4.630000 1.631000  2.309000 1.086000  2.321000       1.959000  
1 1 1 14 21 59 o 8.228000 0.8142000 7.312000 1.410000  9.145000 0.8153000 -1.833000      1.628000  
1 1 1 14 21 61 o 9.149000 0.6892000 9.571000 1.209000  8.727000 0.6616000 0.8440000      1.378000  
1 1 1 14 22 0  o 37.29000 0.4969000 37.29000 0.4969000 37.29000 0.4969000 0.000000       0.000000  
1 1 1 14 22 2  o 45.94000 0.3577000 45.78000 0.5715000 46.11000 0.4304000 -0.3320000     0.7155000 
1 1 1 14 22 4  o 25.95000 0.2610000 25.94000 0.4324000 25.95000 0.2923000 -0.1224000E-01 0.5220000 
1 1 1 14 22 6  f 65.21000 0.6086000 65.09000 0.9449000 65.33000 0.7672000 -0.2399000     1.217000  
1 1 1 14 22 8  o 65.21000 0.5415000 64.34000 0.7555000 66.09000 0.7760000 -1.751000      1.083000  
1 1 1 14 22 10 o 56.39000 0.4798000 56.53000 0.6791000 56.25000 0.6780000 0.2771000      0.9596000 
1 1 1 14 22 12 o 65.15000 0.5420000 64.63000 0.7594000 65.66000 0.7735000 -1.034000      1.084000  
1 1 1 14 22 14 o 43.89000 0.4531000 43.32000 0.5610000 44.45000 0.7116000 -1.137000      0.9061000 
1 1 1 14 22 16 o 30.00000 0.3359000 30.88000 0.4753000 29.12000 0.4748000 1.756000       0.6719000 
1 1 1 14 22 18 o 24.66000 0.3241000 24.64000 0.4569000 24.67000 0.4599000 -0.3555000E-01 0.6483000 
1 1 1 14 22 20 o 47.77000 0.3930000 47.28000 0.4962000 48.26000 0.6095000 -0.9839000     0.7859000 
1 1 1 14 22 22 o 8.978000 0.4409000 7.831000 0.5102000 10.13000 0.7192000 -2.295000      0.8818000 
1 1 1 14 22 24 o 10.16000 0.4955000 10.18000 0.4536000 10.13000 0.8810000 0.5250000E-01  0.9909000 
1 1 1 14 22 26 o 51.82000 0.4570000 51.93000 0.6374000 51.71000 0.6552000 0.2236000      0.9140000 
1 1 1 14 22 28 o 27.56000 0.3180000 27.27000 0.3838000 27.85000 0.5072000 -0.5854000     0.6361000 
1 1 1 14 22 30 o 25.32000 0.3728000 25.47000 0.3577000 25.17000 0.6543000 0.2994000      0.7457000 
1 1 1 14 22 32 o 49.43000 0.4175000 49.06000 0.5374000 49.81000 0.6392000 -0.7426000     0.8351000 
1 1 1 14 22 34 o 24.43000 0.3858000 24.07000 0.6208000 24.78000 0.4583000 -0.7108000     0.7716000 
1 1 1 14 22 36 o 31.98000 0.3363000 31.52000 0.5227000 32.44000 0.4232000 -0.9233000     0.6725000 
1 1 1 14 22 38 o 20.83000 0.3588000 20.52000 0.5576000 21.14000 0.4517000 -0.6183000     0.7176000 
1 1 1 14 22 40 o 13.91000 0.4615000 14.38000 0.6963000 13.45000 0.6058000 0.9244000      0.9230000 
1 1 1 14 22 42 f 18.09000 0.4924000 18.16000 0.8060000 18.03000 0.5661000 0.1287000      0.9849000 
1 1 1 14 22 44 o 14.84000 0.4306000 14.75000 0.6894000 14.94000 0.5160000 -0.1837000     0.8611000 
1 1 1 14 22 46 o 15.07000 0.4419000 14.84000 0.6957000 15.30000 0.5450000 -0.4581000     0.8837000 
1 1 1 14 22 48 o 15.45000 0.4095000 15.45000 0.6555000 15.44000 0.4909000 0.1116000E-01  0.8190000 
1 1 1 14 22 50 o 10.21000 0.7504000 9.130000 1.321000  11.29000 0.7130000 -2.164000      1.501000  
1 1 1 14 22 52 f 3.663000 0.9519000 3.038000 1.382000  4.288000 1.309000  -1.250000      1.904000  
1 1 1 14 22 54 o 3.688000 1.046000  3.784000 1.580000  3.591000 1.370000  0.1928000      2.092000  
1 1 1 14 22 56 o 4.672000 1.070000  4.738000 1.694000  4.607000 1.306000  0.1308000      2.139000  
1 1 1 14 22 58 o 3.332000 0.9602000 2.976000 1.358000  3.687000 1.358000  -0.7103000     1.920000  
1 1 1 14 22 60 o 3.345000 0.9384000 2.932000 1.384000  3.758000 1.268000  -0.8257000     1.877000  
1 1 1 14 23 1  o 35.04000 0.3716000 34.72000 0.6244000 35.37000 0.4030000 -0.6436000     0.7432000 
1 1 1 14 23 3  o 47.71000 0.3841000 47.17000 0.5821000 48.25000 0.5014000 -1.080000      0.7683000 
1 1 1 14 23 5  o 100.6000 0.8050000 100.5000 1.137000  100.7000 1.140000  -0.2117000     1.610000  
1 1 1 14 23 7  o 48.03000 0.4806000 48.30000 0.7525000 47.76000 0.5981000 0.5414000      0.9612000 
1 1 1 14 23 9  o 60.37000 0.5074000 60.76000 0.7200000 59.97000 0.7151000 0.7889000      1.015000  
1 1 1 14 23 11 o 64.64000 0.5389000 64.23000 0.7570000 65.05000 0.7673000 -0.8232000     1.078000  
1 1 1 14 23 13 o 46.62000 0.4172000 46.72000 0.5880000 46.52000 0.5921000 0.2024000      0.8344000 
1 1 1 14 23 15 o 19.26000 0.3349000 18.99000 0.4727000 19.54000 0.4746000 -0.5544000     0.6699000 
1 1 1 14 23 17 o 24.78000 0.3746000 24.81000 0.4619000 24.76000 0.5899000 0.4846000E-01  0.7492000 
1 1 1 14 23 19 o 57.77000 0.4954000 57.42000 0.6943000 58.12000 0.7068000 -0.6962000     0.9908000 
1 1 1 14 23 21 o 4.991000 0.7331000 4.142000 0.8325000 5.840000 1.207000  -1.698000      1.466000  
1 1 1 14 23 23 o 26.74000 0.3409000 25.98000 0.3222000 27.50000 0.6009000 -1.521000      0.6819000 
1 1 1 14 23 25 f 56.35000 0.4536000 56.95000 0.5863000 55.75000 0.6922000 1.192000       0.9071000 
1 1 1 14 23 27 o 33.97000 0.3352000 33.88000 0.4126000 34.06000 0.5284000 -0.1790000     0.6704000 
1 1 1 14 23 29 o 12.82000 0.4606000 13.02000 0.5283000 12.63000 0.7546000 0.3971000      0.9211000 
1 1 1 14 23 31 o 21.27000 0.3482000 21.30000 0.4830000 21.24000 0.5015000 0.6721000E-01  0.6963000 
1 1 1 14 23 33 o 20.43000 0.3791000 20.32000 0.6247000 20.55000 0.4297000 -0.2322000     0.7582000 
1 1 1 14 23 35 o 25.72000 0.3302000 25.67000 0.5116000 25.78000 0.4176000 -0.1076000     0.6604000 
1 1 1 14 23 37 o 24.75000 0.3274000 24.93000 0.4984000 24.57000 0.4248000 0.3604000      0.6549000 
1 1 1 14 23 39 o 32.27000 0.3828000 32.29000 0.5314000 32.25000 0.5512000 0.3681000E-01  0.7656000 
1 1 1 14 23 41 o 10.40000 0.6129000 9.080000 1.028000  11.73000 0.6670000 -2.646000      1.226000  
1 1 1 14 23 43 o 10.16000 0.5921000 10.42000 0.9754000 9.892000 0.6715000 0.5310000      1.184000  
1 1 1 14 23 45 f 13.07000 0.4448000 12.78000 0.7201000 13.37000 0.5223000 -0.5932000     0.8896000 
1 1 1 14 23 47 o 19.26000 0.3602000 19.69000 0.5632000 18.83000 0.4492000 0.8606000      0.7204000 
1 1 1 14 23 49 o 10.71000 0.5532000 11.69000 0.8475000 9.733000 0.7113000 1.956000       1.106000  
1 1 1 14 23 51 o 10.48000 0.5609000 9.925000 0.9410000 11.03000 0.6107000 -1.109000      1.122000  
1 1 1 14 23 53 o 3.633000 1.084000  4.325000 1.748000  2.942000 1.283000  1.383000       2.169000  
1 1 1 14 23 55 o 7.048000 0.8744000 6.851000 1.487000  7.245000 0.9202000 -0.3939000     1.749000  
1 1 1 14 23 57 o 7.519000 1.037000  8.000000 1.257000  7.039000 1.650000  0.9609000      2.074000  
1 1 1 14 23 59 o 3.208000 0.9615000 3.510000 1.516000  2.906000 1.183000  0.6035000      1.923000  
1 1 1 14 24 0  o 13.27000 0.3836000 13.27000 0.3836000 13.27000 0.3836000 0.000000       0.000000  
1 1 1 14 24 2  o 14.78000 0.2925000 14.59000 0.4843000 14.96000 0.3282000 -0.3617000     0.5850000 
1 1 1 14 24 4  o 51.36000 0.3926000 51.78000 0.6292000 50.94000 0.4696000 0.8472000      0.7851000 
1 1 1 14 24 6  o 39.18000 0.4244000 39.28000 0.6632000 39.07000 0.5296000 0.2157000      0.8487000 
1 1 1 14 24 8  o 77.60000 0.6335000 77.87000 0.8967000 77.33000 0.8951000 0.5385000      1.267000  
1 1 1 14 24 10 o 14.35000 0.3876000 15.13000 0.5352000 13.58000 0.5608000 1.551000       0.7752000 
1 1 1 14 24 12 o 24.45000 0.3270000 24.90000 0.4539000 24.00000 0.4709000 0.9032000      0.6540000 
1 1 1 14 24 14 o 19.43000 0.3364000 19.63000 0.4662000 19.23000 0.4850000 0.4057000      0.6727000 
1 1 1 14 24 16 o 20.46000 0.3799000 20.76000 0.4698000 20.16000 0.5970000 0.5957000      0.7597000 
1 1 1 14 24 18 o 41.72000 0.3923000 41.41000 0.5486000 42.02000 0.5610000 -0.6032000     0.7847000 
1 1 1 14 24 20 o 8.116000 0.7835000 8.164000 1.114000  8.068000 1.102000  0.9621000E-01  1.567000  
1 1 1 14 24 22 o 28.60000 0.3125000 28.18000 0.3857000 29.03000 0.4918000 -0.8484000     0.6250000 
1 1 1 14 24 24 o 62.48000 0.4935000 62.15000 0.6310000 62.80000 0.7588000 -0.6442000     0.9869000 
1 1 1 14 24 26 o 32.68000 0.3275000 33.09000 0.4054000 32.27000 0.5144000 0.8249000      0.6549000 
1 1 1 14 24 28 o 25.91000 0.3674000 24.95000 0.4083000 26.86000 0.6111000 -1.914000      0.7349000 
1 1 1 14 24 30 o 22.91000 0.4462000 23.28000 0.6743000 22.54000 0.5845000 0.7471000      0.8924000 
1 1 1 14 24 32 o 9.345000 0.5591000 8.648000 0.8370000 10.04000 0.7414000 -1.394000      1.118000  
1 1 1 14 24 34 o 9.891000 0.5632000 9.941000 0.8678000 9.842000 0.7181000 0.9878000E-01  1.126000  
1 1 1 14 24 36 o 14.28000 0.4390000 14.85000 0.6714000 13.72000 0.5657000 1.127000       0.8780000 
1 1 1 14 24 38 o 6.480000 0.9752000 6.139000 1.560000  6.821000 1.171000  -0.6813000     1.950000  
1 1 1 14 24 40 o 29.17000 0.3490000 29.13000 0.5127000 29.20000 0.4735000 -0.7818000E-01 0.6979000 
1 1 1 14 24 42 o 31.95000 0.4120000 31.75000 0.6223000 32.16000 0.5400000 -0.4103000     0.8240000 
1 1 1 14 24 44 o 15.32000 0.4615000 15.92000 0.7848000 14.72000 0.4858000 1.195000       0.9230000 
1 1 1 14 24 46 o 4.400000 0.9745000 4.020000 1.513000  4.781000 1.229000  -0.7610000     1.949000  
1 1 1 14 24 48 f 18.40000 0.3790000 17.83000 0.6011000 18.97000 0.4618000 -1.137000      0.7580000 
1 1 1 14 24 50 o 13.42000 0.4672000 12.83000 0.7676000 14.00000 0.5329000 -1.166000      0.9344000 
1 1 1 14 24 52 o 6.325000 0.9913000 7.020000 1.381000  5.630000 1.422000  1.390000       1.983000  
1 1 1 14 24 54 o 6.324000 1.082000  5.912000 1.754000  6.736000 1.268000  -0.8242000     2.164000  
1 1 1 14 24 56 o 7.535000 1.038000  7.076000 1.831000  7.994000 0.9800000 -0.9178000     2.077000  
1 1 1 14 24 58 o 3.183000 1.023000  2.857000 1.375000  3.509000 1.515000  -0.6522000     2.046000  
1 1 1 14 25 1  f 28.92000 0.2604000 29.05000 0.3741000 28.79000 0.3623000 0.2516000      0.5208000 
1 1 1 14 25 3  o 33.35000 0.3329000 33.28000 0.4491000 33.43000 0.4916000 -0.1580000     0.6659000 
1 1 1 14 25 5  o 50.74000 0.4991000 50.71000 0.6204000 50.77000 0.7819000 -0.5542000E-01 0.9982000 
1 1 1 14 25 7  o 53.07000 0.5185000 53.00000 0.8061000 53.13000 0.6524000 -0.1390000     1.037000  
1 1 1 14 25 9  o 38.91000 0.3717000 38.42000 0.5177000 39.40000 0.5336000 -0.9849000     0.7434000 
1 1 1 14 25 11 o 7.681000 0.6190000 7.427000 0.8954000 7.936000 0.8549000 -0.5090000     1.238000  
1 1 1 14 25 13 f 38.08000 0.3693000 38.33000 0.5201000 37.84000 0.5243000 0.4959000      0.7385000 
1 1 1 14 25 15 o 35.41000 0.3611000 34.86000 0.4994000 35.95000 0.5216000 -1.089000      0.7221000 
1 1 1 14 25 17 o 73.79000 0.6094000 74.58000 0.8680000 73.00000 0.8556000 1.582000       1.219000  
1 1 1 14 25 19 f 43.71000 0.5029000 43.60000 0.7147000 43.82000 0.7078000 -0.2199000     1.006000  
1 1 1 14 25 21 o 53.82000 0.4729000 54.04000 0.6667000 53.60000 0.6710000 0.4351000      0.9459000 
1 1 1 14 25 23 o 18.22000 0.3777000 17.58000 0.4435000 18.85000 0.6114000 -1.279000      0.7554000 
1 1 1 14 25 25 o 67.14000 0.6279000 67.75000 0.7919000 66.54000 0.9745000 1.211000       1.256000  
1 1 1 14 25 27 o 23.69000 0.3400000 24.07000 0.4435000 23.31000 0.5154000 0.7543000      0.6799000 
1 1 1 14 25 29 o 31.41000 0.3673000 31.00000 0.4305000 31.82000 0.5953000 -0.8292000     0.7347000 
1 1 1 14 25 31 o 49.52000 0.4194000 48.77000 0.6199000 50.27000 0.5651000 -1.503000      0.8389000 
1 1 1 14 25 33 o 17.08000 0.3886000 17.54000 0.5577000 16.61000 0.5413000 0.9373000      0.7773000 
1 1 1 14 25 35 o 29.58000 0.3279000 29.27000 0.5051000 29.90000 0.4184000 -0.6366000     0.6559000 
1 1 1 14 25 37 o 27.74000 0.4243000 28.18000 0.6450000 27.29000 0.5515000 0.8889000      0.8487000 
1 1 1 14 25 39 o 27.15000 0.3330000 26.97000 0.5212000 27.33000 0.4145000 -0.3676000     0.6660000 
1 1 1 14 25 41 o 16.95000 0.4147000 16.62000 0.5832000 17.29000 0.5898000 -0.6752000     0.8294000 
1 1 1 14 25 43 o 8.200000 0.7381000 8.450000 1.261000  7.950000 0.7676000 0.5000000      1.476000  
1 1 1 14 25 45 o 6.714000 0.8374000 6.272000 1.420000  7.155000 0.8878000 -0.8830000     1.675000  
1 1 1 14 25 47 o 6.584000 0.8102000 6.636000 1.317000  6.533000 0.9441000 0.1028000      1.620000  
1 1 1 14 25 49 o 4.588000 1.051000  5.208000 1.645000  3.969000 1.309000  1.239000       2.102000  
1 1 1 14 25 51 o 3.063000 0.9395000 3.043000 1.350000  3.083000 1.307000  -0.3989000E-01 1.879000  
1 1 1 14 25 53 o 10.35000 0.6199000 10.64000 0.9593000 10.06000 0.7853000 0.5851000      1.240000  
1 1 1 14 25 55 o 9.984000 0.6827000 9.818000 1.151000  10.15000 0.7351000 -0.3324000     1.365000  
1 1 1 14 25 57 o 8.899000 0.7286000 8.700000 1.217000  9.099000 0.8010000 -0.3997000     1.457000  
1 1 1 14 25 59 f 6.022000 0.9931000 6.727000 1.572000  5.316000 1.214000  1.411000       1.986000  
1 1 1 14 26 0  o 49.53000 0.5198000 49.53000 0.5198000 49.53000 0.5198000 0.000000       0.000000  
1 1 1 14 26 2  o 42.06000 0.3522000 41.90000 0.5380000 42.22000 0.4546000 -0.3213000     0.7043000 
1 1 1 14 26 4  o 22.56000 0.2410000 22.71000 0.3606000 22.42000 0.3200000 0.2937000      0.4821000 
1 1 1 14 26 6  o 43.27000 0.4531000 43.48000 0.5598000 43.06000 0.7127000 0.4212000      0.9063000 
1 1 1 14 26 8  o 77.82000 0.6368000 78.11000 0.9021000 77.52000 0.8991000 0.5837000      1.274000  
1 1 1 14 26 10 o 45.60000 0.4128000 45.70000 0.5819000 45.50000 0.5858000 0.1986000      0.8257000 
1 1 1 14 26 12 o 39.85000 0.3789000 39.67000 0.5277000 40.02000 0.5438000 -0.3525000     0.7577000 
1 1 1 14 26 14 o 28.75000 0.3341000 28.55000 0.4686000 28.96000 0.4763000 -0.4078000     0.6682000 
1 1 1 14 26 16 o 18.98000 0.3891000 18.61000 0.4918000 19.34000 0.6031000 -0.7334000     0.7782000 
1 1 1 14 26 18 o 30.78000 0.3899000 30.38000 0.4834000 31.19000 0.6118000 -0.8070000     0.7797000 
1 1 1 14 26 20 o 46.22000 0.4251000 45.70000 0.5923000 46.74000 0.6099000 -1.034000      0.8501000 
1 1 1 14 26 22 o 12.07000 0.3752000 11.32000 0.3836000 12.81000 0.6450000 -1.494000      0.7505000 
1 1 1 14 26 24 o 6.669000 0.7515000 5.068000 1.032000  8.271000 1.092000  -3.204000      1.503000  
1 1 1 14 26 26 o 14.49000 0.3619000 14.19000 0.3893000 14.79000 0.6102000 -0.6082000     0.7238000 
1 1 1 14 26 28 o 10.82000 0.5737000 11.47000 0.5666000 10.16000 0.9977000 1.310000       1.147000  
1 1 1 14 26 30 o 31.31000 0.3451000 31.59000 0.5272000 31.03000 0.4453000 0.5604000      0.6901000 
1 1 1 14 26 32 o 9.738000 0.5865000 9.932000 0.8690000 9.543000 0.7880000 0.3890000      1.173000  
1 1 1 14 26 34 o 26.63000 0.3227000 26.41000 0.4974000 26.84000 0.4112000 -0.4278000     0.6454000 
1 1 1 14 26 36 o 24.63000 0.3414000 25.54000 0.4996000 23.71000 0.4654000 1.827000       0.6828000 
1 1 1 14 26 38 o 24.30000 0.3267000 24.52000 0.5129000 24.08000 0.4048000 0.4418000      0.6534000 
1 1 1 14 26 40 o 10.22000 0.6205000 9.228000 0.9503000 11.21000 0.7980000 -1.980000      1.241000  
1 1 1 14 26 42 o 16.66000 0.3848000 16.21000 0.6146000 17.11000 0.4630000 -0.9021000     0.7695000 
1 1 1 14 26 44 o 25.78000 0.3456000 25.39000 0.5141000 26.18000 0.4621000 -0.7887000     0.6912000 
1 1 1 14 26 46 o 15.35000 0.4060000 14.85000 0.6653000 15.86000 0.4654000 -1.004000      0.8119000 
1 1 1 14 26 48 o 19.27000 0.3671000 19.21000 0.5815000 19.34000 0.4483000 -0.1307000     0.7342000 
1 1 1 14 26 50 o 10.23000 0.6070000 10.88000 0.8864000 9.577000 0.8295000 1.300000       1.214000  
1 1 1 14 26 52 o 9.975000 0.6282000 10.22000 0.9909000 9.727000 0.7725000 0.4963000      1.256000  
1 1 1 14 26 54 o 6.623000 1.022000  5.904000 1.804000  7.343000 0.9589000 -1.439000      2.043000  
1 1 1 14 26 56 o 5.017000 1.032000  6.143000 1.554000  3.891000 1.358000  2.252000       2.063000  
1 1 1 14 26 58 o 4.171000 0.9541000 3.428000 1.533000  4.915000 1.136000  -1.487000      1.908000  
1 1 1 14 27 1  o 41.15000 0.3489000 41.19000 0.5334000 41.11000 0.4500000 0.7833000E-01  0.6979000 
1 1 1 14 27 3  o 40.17000 0.3133000 40.02000 0.4471000 40.33000 0.4389000 -0.3042000     0.6266000 
1 1 1 14 27 5  o 36.31000 0.3235000 36.32000 0.5029000 36.31000 0.4070000 0.8652000E-02  0.6470000 
1 1 1 14 27 7  o 12.70000 0.4869000 12.88000 0.4588000 12.53000 0.8590000 0.3510000      0.9738000 
1 1 1 14 27 9  o 47.84000 0.4263000 47.42000 0.5931000 48.26000 0.6126000 -0.8387000     0.8527000 
1 1 1 14 27 11 o 36.03000 0.3618000 35.43000 0.5005000 36.64000 0.5225000 -1.216000      0.7236000 
1 1 1 14 27 13 o 16.88000 0.3561000 17.34000 0.4938000 16.43000 0.5132000 0.9062000      0.7122000 
1 1 1 14 27 15 o 24.24000 0.4874000 24.48000 0.4788000 24.01000 0.8490000 0.4653000      0.9747000 
1 1 1 14 27 17 o 45.11000 0.4660000 45.36000 0.5862000 44.86000 0.7246000 0.4964000      0.9320000 
1 1 1 14 27 19 o 28.46000 0.4010000 28.75000 0.6341000 28.18000 0.4911000 0.5765000      0.8020000 
1 1 1 14 27 21 o 31.86000 0.6321000 ?        ?         31.86000 0.6321000 ?              ?         
1 1 1 14 27 23 o 23.69000 0.3283000 23.36000 0.4290000 24.01000 0.4970000 -0.6459000     0.6565000 
1 1 1 14 27 25 o 51.50000 0.4109000 50.95000 0.4856000 52.06000 0.6630000 -1.110000      0.8218000 
1 1 1 14 27 27 o 13.10000 0.3894000 13.00000 0.5072000 13.19000 0.5912000 -0.1872000     0.7789000 
1 1 1 14 27 29 o 27.92000 0.2988000 28.11000 0.4163000 27.74000 0.4287000 0.3695000      0.5976000 
1 1 1 14 27 31 o 21.83000 0.3970000 21.80000 0.6536000 21.86000 0.4507000 -0.6287000E-01 0.7940000 
1 1 1 14 27 33 o 18.27000 0.4084000 18.28000 0.5646000 18.25000 0.5904000 0.3158000E-01  0.8169000 
1 1 1 14 27 35 o 28.36000 0.3244000 28.59000 0.5040000 28.12000 0.4085000 0.4648000      0.6488000 
1 1 1 14 27 37 o 33.57000 0.3325000 34.12000 0.5164000 33.02000 0.4191000 1.104000       0.6650000 
1 1 1 14 27 39 o 21.91000 0.3428000 22.03000 0.5137000 21.78000 0.4542000 0.2520000      0.6857000 
1 1 1 14 27 41 o 19.88000 0.3973000 20.02000 0.6240000 19.74000 0.4918000 0.2841000      0.7945000 
1 1 1 14 27 43 o 5.280000 0.9690000 4.584000 1.650000  5.977000 1.017000  -1.393000      1.938000  
1 1 1 14 27 45 o 7.255000 0.7287000 6.759000 1.248000  7.752000 0.7526000 -0.9930000     1.457000  
1 1 1 14 27 47 o 9.852000 0.5307000 10.27000 0.8278000 9.438000 0.6642000 0.8279000      1.061000  
1 1 1 14 27 49 o 9.147000 0.6535000 9.124000 1.017000  9.169000 0.8207000 -0.4497000E-01 1.307000  
1 1 1 14 27 51 o 3.486000 1.007000  3.555000 1.450000  3.416000 1.399000  0.1387000      2.015000  
1 1 1 14 27 53 o 10.77000 0.6981000 11.02000 1.188000  10.52000 0.7341000 0.4987000      1.396000  
1 1 1 14 27 55 f 7.110000 0.9256000 7.420000 1.537000  6.801000 1.032000  0.6197000      1.851000  
1 1 1 14 27 57 o 3.395000 1.003000  4.022000 1.630000  2.767000 1.170000  1.256000       2.006000  
1 1 1 14 28 0  o 10.31000 0.5645000 10.31000 0.5645000 10.31000 0.5645000 0.000000       0.000000  
1 1 1 14 28 2  o 10.52000 0.3076000 10.58000 0.4704000 10.47000 0.3965000 0.1066000      0.6152000 
1 1 1 14 28 4  o 21.49000 0.2365000 21.08000 0.3529000 21.90000 0.3151000 -0.8202000     0.4731000 
1 1 1 14 28 6  o 34.62000 0.3812000 34.39000 0.4142000 34.85000 0.6402000 -0.4522000     0.7625000 
1 1 1 14 28 8  o 90.44000 0.7734000 91.80000 0.9035000 89.08000 1.255000  2.723000       1.547000  
1 1 1 14 28 10 o 28.71000 0.3625000 28.65000 0.3938000 28.76000 0.6087000 -0.1063000     0.7250000 
1 1 1 14 28 12 o 16.86000 0.3623000 17.41000 0.4871000 16.32000 0.5365000 1.086000       0.7246000 
1 1 1 14 28 14 o 46.01000 0.4718000 46.27000 0.5937000 45.75000 0.7335000 0.5184000      0.9437000 
1 1 1 14 28 16 o 26.21000 0.3438000 26.21000 0.4658000 26.20000 0.5059000 0.1511000E-01  0.6877000 
1 1 1 14 28 18 o 31.12000 0.4420000 31.21000 0.6291000 31.03000 0.6212000 0.1851000      0.8841000 
1 1 1 14 28 20 o 31.47000 0.4812000 31.53000 0.8160000 31.40000 0.5101000 0.1356000      0.9624000 
1 1 1 14 28 22 o 25.52000 0.3563000 25.41000 0.5089000 25.63000 0.4988000 -0.2197000     0.7126000 
1 1 1 14 28 24 o 19.22000 0.3196000 18.74000 0.3270000 19.71000 0.5492000 -0.9737000     0.6392000 
1 1 1 14 28 26 o 30.84000 0.3227000 30.63000 0.4193000 31.06000 0.4906000 -0.4341000     0.6454000 
1 1 1 14 28 28 o 15.64000 0.4527000 16.15000 0.4836000 15.14000 0.7654000 1.012000       0.9054000 
1 1 1 14 28 30 o 23.40000 0.3077000 23.51000 0.4253000 23.28000 0.4448000 0.2292000      0.6154000 
1 1 1 14 28 32 o 7.509000 0.6729000 7.009000 0.9950000 8.009000 0.9062000 -1.000000      1.346000  
1 1 1 14 28 34 o 19.52000 0.3920000 20.11000 0.6585000 18.93000 0.4256000 1.187000       0.7841000 
1 1 1 14 28 36 o 5.949000 0.8230000 5.710000 1.315000  6.188000 0.9897000 -0.4779000     1.646000  
1 1 1 14 28 38 o 10.04000 0.5299000 10.12000 0.7970000 9.953000 0.6985000 0.1708000      1.060000  
1 1 1 14 28 40 o 11.95000 0.5074000 12.38000 0.7947000 11.53000 0.6310000 0.8526000      1.015000  
1 1 1 14 28 42 o 11.96000 0.4584000 12.14000 0.7422000 11.77000 0.5382000 0.3748000      0.9168000 
1 1 1 14 28 44 o 15.90000 0.4682000 15.73000 0.7950000 16.08000 0.4946000 -0.3541000     0.9363000 
1 1 1 14 28 46 o 17.89000 0.3755000 18.34000 0.5907000 17.44000 0.4638000 0.8984000      0.7510000 
1 1 1 14 28 48 o 5.021000 0.9856000 5.100000 1.479000  4.941000 1.303000  0.1589000      1.971000  
1 1 1 14 28 50 o 7.527000 0.7764000 8.374000 1.135000  6.680000 1.060000  1.694000       1.553000  
1 1 1 14 28 52 o 6.752000 0.9210000 5.896000 1.606000  7.609000 0.9020000 -1.713000      1.842000  
1 1 1 14 28 54 o 4.521000 1.084000  5.545000 1.731000  3.497000 1.305000  2.048000       2.168000  
1 1 1 14 28 56 o 4.518000 1.070000  5.405000 1.674000  3.632000 1.333000  1.773000       2.139000  
1 1 1 14 29 1  o 12.02000 0.3318000 11.86000 0.5304000 12.18000 0.3989000 -0.3247000     0.6637000 
1 1 1 14 29 3  o 38.30000 0.3049000 37.94000 0.4332000 38.66000 0.4292000 -0.7223000     0.6099000 
1 1 1 14 29 5  o 31.20000 0.2983000 31.37000 0.3941000 31.04000 0.4479000 0.3382000      0.5966000 
1 1 1 14 29 7  o 22.11000 0.3614000 22.04000 0.3756000 22.17000 0.6176000 -0.1333000     0.7228000 
1 1 1 14 29 9  o 18.15000 0.4034000 18.51000 0.3993000 17.79000 0.7011000 0.7230000      0.8068000 
1 1 1 14 29 11 o 26.61000 0.4859000 27.86000 0.3956000 25.37000 0.8877000 2.493000       0.9719000 
1 1 1 14 29 13 o 49.50000 0.6340000 49.73000 0.6257000 49.26000 1.103000  0.4700000      1.268000  
1 1 1 14 29 15 o 18.97000 0.4107000 18.80000 0.4840000 19.13000 0.6636000 -0.3263000     0.8214000 
1 1 1 14 29 17 o 24.47000 0.4204000 24.61000 0.5914000 24.34000 0.5976000 0.2704000      0.8408000 
1 1 1 14 29 19 o 55.34000 0.6727000 55.97000 1.158000  54.72000 0.6844000 1.253000       1.345000  
1 1 1 14 29 21 o 10.46000 0.5559000 10.69000 0.8061000 10.23000 0.7656000 0.4559000      1.112000  
1 1 1 14 29 23 o 28.73000 0.3049000 28.88000 0.3400000 28.59000 0.5063000 0.2890000      0.6099000 
1 1 1 14 29 25 o 36.09000 0.4000000 36.39000 0.4461000 35.80000 0.6641000 0.5851000      0.8000000 
1 1 1 14 29 27 f 9.628000 0.4806000 9.479000 0.6678000 9.777000 0.6914000 -0.2981000     0.9612000 
1 1 1 14 29 29 o 38.42000 0.3964000 37.81000 0.5479000 39.03000 0.5729000 -1.216000      0.7927000 
1 1 1 14 29 31 o 14.34000 0.3949000 13.69000 0.5801000 14.99000 0.5359000 -1.297000      0.7898000 
1 1 1 14 29 33 o 8.015000 0.5893000 8.543000 0.8033000 7.486000 0.8625000 1.057000       1.179000  
1 1 1 14 29 35 o 4.874000 0.9127000 4.550000 1.427000  5.198000 1.139000  -0.6483000     1.825000  
1 1 1 14 29 37 o 15.00000 0.3887000 15.84000 0.5582000 14.15000 0.5411000 1.695000       0.7774000 
1 1 1 14 29 39 o 13.02000 0.4122000 12.94000 0.6367000 13.11000 0.5238000 -0.1683000     0.8245000 
1 1 1 14 29 41 f 4.745000 0.9858000 4.615000 1.476000  4.874000 1.307000  -0.2589000     1.972000  
1 1 1 14 29 43 o 11.35000 0.4813000 11.64000 0.7516000 11.06000 0.6015000 0.5834000      0.9627000 
1 1 1 14 29 45 o 13.34000 0.4398000 13.30000 0.6929000 13.38000 0.5418000 -0.7977000E-01 0.8796000 
1 1 1 14 29 47 o 7.748000 0.7310000 8.005000 1.135000  7.491000 0.9216000 0.5140000      1.462000  
1 1 1 14 29 49 o 6.849000 0.8490000 5.707000 1.505000  7.991000 0.7853000 -2.284000      1.698000  
1 1 1 14 29 51 o 10.39000 0.5764000 10.18000 0.9280000 10.60000 0.6840000 -0.4255000     1.153000  
1 1 1 14 29 53 f 6.846000 0.9999000 6.754000 1.536000  6.938000 1.280000  -0.1843000     2.000000  
1 1 1 14 29 55 o 3.186000 0.9610000 3.815000 1.555000  2.557000 1.130000  1.258000       1.922000  
1 1 1 14 29 57 o 2.999000 0.9316000 2.596000 1.241000  3.402000 1.389000  -0.8064000     1.863000  
1 1 1 14 30 0  o 20.37000 0.4171000 20.37000 0.4171000 20.37000 0.4171000 0.000000       0.000000  
1 1 1 14 30 2  o 16.86000 0.2487000 16.77000 0.3689000 16.95000 0.3336000 -0.1774000     0.4973000 
1 1 1 14 30 4  o 18.59000 0.2806000 18.08000 0.4633000 19.09000 0.3168000 -1.008000      0.5612000 
1 1 1 14 30 6  o 15.25000 0.2474000 15.60000 0.4020000 14.91000 0.2884000 0.6906000      0.4947000 
1 1 1 14 30 8  o 28.50000 0.3618000 29.34000 0.3959000 27.65000 0.6056000 1.694000       0.7235000 
1 1 1 14 30 10 o 5.120000 1.078000  5.395000 0.9874000 4.844000 1.918000  0.5512000      2.157000  
1 1 1 14 30 12 o 18.68000 0.3992000 18.60000 0.4043000 18.75000 0.6884000 -0.1412000     0.7983000 
1 1 1 14 30 14 o 22.76000 0.4905000 21.71000 0.4720000 23.81000 0.8601000 -2.097000      0.9810000 
1 1 1 14 30 16 o 21.68000 0.5301000 21.54000 0.9229000 21.82000 0.5217000 -0.2791000     1.060000  
1 1 1 14 30 18 o 38.46000 0.5509000 ?        ?         38.46000 0.5509000 ?              ?         
1 1 1 14 30 20 o 15.40000 0.4192000 15.59000 0.5880000 15.21000 0.5977000 0.3875000      0.8384000 
1 1 1 14 30 22 o 18.11000 0.3858000 18.05000 0.5401000 18.17000 0.5509000 -0.1190000     0.7715000 
1 1 1 14 30 24 o 34.47000 0.3960000 34.67000 0.4372000 34.27000 0.6603000 0.3955000      0.7919000 
1 1 1 14 30 26 o 32.49000 0.3071000 32.06000 0.4255000 32.93000 0.4430000 -0.8664000     0.6142000 
1 1 1 14 30 28 o 37.43000 0.3881000 37.34000 0.5279000 37.53000 0.5691000 -0.1968000     0.7763000 
1 1 1 14 30 30 o 20.77000 0.3369000 20.98000 0.5049000 20.57000 0.4461000 0.4142000      0.6737000 
1 1 1 14 30 32 o 32.41000 0.3682000 33.45000 0.5315000 31.36000 0.5098000 2.095000       0.7365000 
1 1 1 14 30 34 o 17.16000 0.3334000 17.42000 0.5124000 16.91000 0.4266000 0.5019000      0.6667000 
1 1 1 14 30 36 o 5.048000 0.8770000 5.651000 1.220000  4.444000 1.260000  1.207000       1.754000  
1 1 1 14 30 38 o 18.89000 0.3411000 19.64000 0.5280000 18.13000 0.4320000 1.510000       0.6821000 
1 1 1 14 30 40 o 10.40000 0.4887000 10.94000 0.7489000 9.866000 0.6282000 1.070000       0.9775000 
1 1 1 14 30 42 o 14.24000 0.4909000 13.77000 0.8159000 14.71000 0.5460000 -0.9425000     0.9817000 
1 1 1 14 30 44 o 10.91000 0.4976000 10.59000 0.8141000 11.23000 0.5724000 -0.6444000     0.9952000 
1 1 1 14 30 46 o 13.81000 0.4308000 14.13000 0.6897000 13.49000 0.5165000 0.6374000      0.8617000 
1 1 1 14 30 48 o 3.857000 0.9613000 3.848000 1.472000  3.867000 1.236000  -0.1896000E-01 1.923000  
1 1 1 14 30 50 o 6.163000 0.9722000 6.831000 1.385000  5.494000 1.364000  1.337000       1.944000  
1 1 1 14 30 52 o 7.766000 0.8927000 8.295000 1.537000  7.238000 0.9077000 1.057000       1.785000  
1 1 1 14 30 54 o 5.374000 1.064000  6.053000 1.590000  4.696000 1.415000  1.357000       2.129000  
1 1 1 14 30 56 o 3.434000 1.044000  4.398000 1.777000  2.469000 1.095000  1.929000       2.088000  
1 1 1 14 31 1  o 21.16000 0.2435000 21.28000 0.3486000 21.04000 0.3401000 0.2433000      0.4870000 
1 1 1 14 31 3  o 47.91000 0.3947000 47.86000 0.6033000 47.95000 0.5092000 -0.8475000E-01 0.7895000 
1 1 1 14 31 5  o 36.39000 0.3142000 36.47000 0.4310000 36.32000 0.4573000 0.1424000      0.6285000 
1 1 1 14 31 7  o 38.78000 0.5354000 39.48000 0.4542000 38.08000 0.9697000 1.397000       1.071000  
1 1 1 14 31 9  o 28.20000 0.4969000 28.11000 0.3962000 28.29000 0.9113000 -0.1824000     0.9937000 
1 1 1 14 31 11 f 27.51000 0.4849000 27.31000 0.3976000 27.70000 0.8846000 -0.3896000     0.9699000 
1 1 1 14 31 13 o 11.12000 0.6227000 11.68000 0.8249000 10.55000 0.9331000 1.129000       1.245000  
1 1 1 14 31 15 o 4.371000 1.061000  4.319000 1.422000  4.422000 1.576000  -0.1034000     2.122000  
1 1 1 14 31 17 o 23.51000 0.4027000 23.21000 0.5048000 23.82000 0.6277000 -0.6063000     0.8055000 
1 1 1 14 31 19 o 39.39000 0.3942000 39.89000 0.5579000 38.88000 0.5572000 1.012000       0.7885000 
1 1 1 14 31 21 o 8.903000 0.6465000 9.207000 0.8989000 8.599000 0.9293000 0.6080000      1.293000  
1 1 1 14 31 23 o 54.65000 0.5438000 55.37000 0.6874000 53.94000 0.8428000 1.428000       1.088000  
1 1 1 14 31 25 o 21.53000 0.3852000 21.59000 0.5322000 21.47000 0.5569000 0.1252000      0.7704000 
1 1 1 14 31 27 o 31.04000 0.3262000 31.23000 0.4305000 30.85000 0.4903000 0.3773000      0.6524000 
1 1 1 14 31 29 o 33.23000 0.3515000 33.08000 0.4407000 33.38000 0.5478000 -0.3016000     0.7031000 
1 1 1 14 31 31 o 16.19000 0.3713000 16.64000 0.4842000 15.74000 0.5631000 0.8974000      0.7426000 
1 1 1 14 31 33 o 5.111000 0.8819000 5.726000 1.205000  4.496000 1.288000  1.231000       1.764000  
1 1 1 14 31 35 o 12.35000 0.4044000 12.46000 0.6044000 12.24000 0.5375000 0.2181000      0.8089000 
1 1 1 14 31 37 o 5.550000 0.8153000 5.945000 1.209000  5.155000 1.094000  0.7905000      1.631000  
1 1 1 14 31 39 o 7.821000 0.6998000 7.840000 1.133000  7.802000 0.8213000 0.3865000E-01  1.400000  
1 1 1 14 31 41 o 15.26000 0.4364000 14.85000 0.7317000 15.66000 0.4756000 -0.8104000     0.8727000 
1 1 1 14 31 43 o 14.24000 0.4195000 14.57000 0.6601000 13.92000 0.5179000 0.6465000      0.8390000 
1 1 1 14 31 45 o 4.620000 1.038000  6.032000 1.665000  3.209000 1.240000  2.824000       2.076000  
1 1 1 14 31 47 o 5.847000 0.8875000 5.873000 1.427000  5.822000 1.055000  0.5104000E-01  1.775000  
1 1 1 14 31 49 o 4.011000 1.010000  4.146000 1.576000  3.876000 1.263000  0.2696000      2.020000  
1 1 1 14 31 51 o 3.430000 1.031000  4.189000 1.684000  2.671000 1.190000  1.518000       2.062000  
1 1 1 14 31 53 o 13.89000 0.4732000 13.02000 0.7745000 14.76000 0.5439000 -1.739000      0.9464000 
1 1 1 14 31 55 o 6.771000 0.9164000 6.923000 1.548000  6.620000 0.9807000 0.3029000      1.833000  
1 1 1 14 32 0  o 14.33000 0.4018000 14.33000 0.4018000 14.33000 0.4018000 0.000000       0.000000  
1 1 1 14 32 2  o 11.09000 0.3311000 10.51000 0.5077000 11.66000 0.4250000 -1.150000      0.6622000 
1 1 1 14 32 4  o 25.59000 0.2674000 26.06000 0.3829000 25.13000 0.3734000 0.9207000      0.5348000 
1 1 1 14 32 6  o 21.21000 0.2597000 21.67000 0.3877000 20.75000 0.3455000 0.9177000      0.5193000 
1 1 1 14 32 8  o 33.86000 0.4113000 34.03000 0.4887000 33.70000 0.6617000 0.3278000      0.8226000 
1 1 1 14 32 10 o 56.11000 0.6878000 57.22000 0.6902000 55.00000 1.190000  2.219000       1.376000  
1 1 1 14 32 12 o 38.78000 0.4371000 38.91000 0.5368000 38.66000 0.6900000 0.2564000      0.8742000 
1 1 1 14 32 14 o 42.22000 0.4867000 42.10000 0.6606000 42.34000 0.7151000 -0.2383000     0.9735000 
1 1 1 14 32 16 f 48.45000 0.5009000 48.84000 0.6333000 48.06000 0.7761000 0.7783000      1.002000  
1 1 1 14 32 18 o 30.81000 0.3903000 30.27000 0.4318000 31.36000 0.6504000 -1.094000      0.7806000 
1 1 1 14 32 20 o 34.32000 0.4019000 34.33000 0.4476000 34.31000 0.6677000 0.2558000E-01  0.8039000 
1 1 1 14 32 22 o 11.76000 0.5808000 12.04000 0.6995000 11.48000 0.9273000 0.5658000      1.162000  
1 1 1 14 32 24 o 24.27000 0.3301000 24.74000 0.5134000 23.80000 0.4149000 0.9453000      0.6601000 
1 1 1 14 32 26 o 16.09000 0.3553000 16.04000 0.4865000 16.14000 0.5179000 -0.1026000     0.7106000 
1 1 1 14 32 28 o 7.015000 0.6022000 6.595000 0.8714000 7.436000 0.8316000 -0.8414000     1.204000  
1 1 1 14 32 30 o 18.82000 0.4164000 18.54000 0.4315000 19.10000 0.7122000 -0.5583000     0.8328000 
1 1 1 14 32 32 o 35.85000 0.3547000 35.98000 0.5408000 35.73000 0.4591000 0.2457000      0.7094000 
1 1 1 14 32 34 o 12.20000 0.4116000 12.36000 0.6245000 12.04000 0.5364000 0.3135000      0.8232000 
1 1 1 14 32 36 o 10.85000 0.4297000 11.04000 0.6755000 10.66000 0.5313000 0.3785000      0.8594000 
1 1 1 14 32 38 o 16.71000 0.3833000 16.12000 0.6172000 17.30000 0.4547000 -1.184000      0.7666000 
1 1 1 14 32 40 f 13.74000 0.4712000 13.56000 0.8027000 13.91000 0.4938000 -0.3561000     0.9424000 
1 1 1 14 32 42 o 7.974000 0.7697000 7.238000 1.194000  8.710000 0.9712000 -1.471000      1.539000  
1 1 1 14 32 44 o 10.94000 0.5179000 10.61000 0.8496000 11.26000 0.5923000 -0.6413000     1.036000  
1 1 1 14 32 46 o 4.881000 0.9842000 4.522000 1.564000  5.241000 1.195000  -0.7185000     1.968000  
1 1 1 14 32 48 o 10.21000 0.5645000 10.10000 0.9366000 10.32000 0.6305000 -0.2208000     1.129000  
1 1 1 14 32 50 o 9.602000 0.6083000 9.428000 0.9938000 9.776000 0.7019000 -0.3483000     1.217000  
1 1 1 14 32 52 o 8.395000 0.8878000 6.897000 1.639000  9.893000 0.6837000 -2.996000      1.776000  
1 1 1 14 32 54 o 4.266000 1.099000  4.583000 1.636000  3.949000 1.467000  0.6337000      2.198000  
1 1 1 14 33 1  o 25.74000 0.3331000 25.59000 0.4079000 25.89000 0.5267000 -0.3062000     0.6662000 
1 1 1 14 33 3  o 19.12000 0.2714000 19.35000 0.4189000 18.88000 0.3453000 0.4714000      0.5428000 
1 1 1 14 33 5  o 26.85000 0.2821000 26.68000 0.4396000 27.01000 0.3538000 -0.3264000     0.5643000 
1 1 1 14 33 7  o 55.61000 0.5233000 56.99000 0.6847000 54.23000 0.7916000 2.762000       1.047000  
1 1 1 14 33 9  o 20.15000 0.4088000 19.79000 0.4527000 20.51000 0.6808000 -0.7207000     0.8176000 
1 1 1 14 33 11 o 14.01000 0.4763000 13.74000 0.5419000 14.28000 0.7835000 -0.5389000     0.9526000 
1 1 1 14 33 13 o 8.504000 0.7617000 8.931000 0.8624000 8.077000 1.256000  0.8542000      1.523000  
1 1 1 14 33 15 o 20.21000 0.4013000 20.35000 0.4346000 20.07000 0.6747000 0.2828000      0.8025000 
1 1 1 14 33 17 o 47.34000 0.4718000 47.37000 0.5341000 47.32000 0.7779000 0.4470000E-01  0.9436000 
1 1 1 14 33 19 o 10.10000 0.8120000 10.27000 0.7087000 9.919000 1.461000  0.3547000      1.624000  
1 1 1 14 33 21 o 34.51000 0.5150000 34.54000 0.4543000 34.48000 0.9245000 0.5442000E-01  1.030000  
1 1 1 14 33 23 o 30.35000 0.3959000 30.60000 0.4450000 30.11000 0.6549000 0.4930000      0.7918000 
1 1 1 14 33 25 o 23.56000 0.2927000 22.97000 0.4004000 24.15000 0.4270000 -1.185000      0.5854000 
1 1 1 14 33 27 o 11.73000 0.4002000 11.20000 0.5932000 12.27000 0.5372000 -1.061000      0.8003000 
1 1 1 14 33 29 f 18.00000 0.3445000 18.45000 0.4662000 17.55000 0.5075000 0.9004000      0.6891000 
1 1 1 14 33 31 o 8.136000 0.5364000 8.352000 0.7239000 7.919000 0.7918000 0.4323000      1.073000  
1 1 1 14 33 33 o 10.30000 0.5602000 10.39000 0.9446000 10.21000 0.6026000 0.1769000      1.120000  
1 1 1 14 33 35 o 13.70000 0.3722000 13.40000 0.6008000 14.00000 0.4395000 -0.5930000     0.7444000 
1 1 1 14 33 37 o 10.48000 0.5369000 9.658000 0.9448000 11.30000 0.5102000 -1.645000      1.074000  
1 1 1 14 33 39 o 15.88000 0.3606000 15.59000 0.5665000 16.17000 0.4462000 -0.5833000     0.7211000 
1 1 1 14 33 41 o 11.74000 0.4606000 11.11000 0.7032000 12.38000 0.5951000 -1.272000      0.9212000 
1 1 1 14 33 43 o 8.522000 0.6739000 7.560000 1.093000  9.484000 0.7888000 -1.925000      1.348000  
1 1 1 14 33 45 o 13.63000 0.4152000 13.18000 0.6426000 14.07000 0.5258000 -0.8874000     0.8303000 
1 1 1 14 33 47 o 16.21000 0.3995000 16.21000 0.6468000 16.21000 0.4689000 0.7105000E-02  0.7989000 
1 1 1 14 33 49 o 11.91000 0.4915000 12.64000 0.7367000 11.18000 0.6506000 1.455000       0.9829000 
1 1 1 14 33 51 o 3.224000 0.9283000 3.100000 1.355000  3.348000 1.269000  -0.2477000     1.857000  
1 1 1 14 33 53 o 5.054000 1.009000  6.101000 1.611000  4.006000 1.217000  2.095000       2.019000  
1 1 1 14 34 0  o 31.68000 0.4035000 31.68000 0.4035000 31.68000 0.4035000 0.000000       0.000000  
1 1 1 14 34 2  o 39.48000 0.3800000 40.49000 0.5490000 38.48000 0.5256000 2.013000       0.7600000 
1 1 1 14 34 4  f 7.993000 0.4545000 7.795000 0.7163000 8.192000 0.5594000 -0.3968000     0.9089000 
1 1 1 14 34 6  o 54.28000 0.5274000 54.50000 0.8232000 54.06000 0.6594000 0.4384000      1.055000  
1 1 1 14 34 8  o 12.89000 0.3147000 13.12000 0.5489000 12.66000 0.3079000 0.4647000      0.6293000 
1 1 1 14 34 10 o 24.52000 0.3899000 23.72000 0.4531000 25.31000 0.6347000 -1.586000      0.7799000 
1 1 1 14 34 12 o 23.24000 0.4017000 23.03000 0.4922000 23.44000 0.6351000 -0.4174000     0.8035000 
1 1 1 14 34 14 o 13.62000 0.4801000 13.49000 0.5285000 13.75000 0.8018000 -0.2671000     0.9603000 
1 1 1 14 34 16 o 6.578000 0.9996000 6.448000 1.230000  6.707000 1.576000  -0.2589000     1.999000  
1 1 1 14 34 18 o 11.14000 0.7155000 10.86000 0.6623000 11.42000 1.268000  -0.5548000     1.431000  
1 1 1 14 34 20 o 48.46000 0.6171000 48.43000 0.5395000 48.50000 1.110000  -0.6421000E-01 1.234000  
1 1 1 14 34 22 o 25.94000 0.4027000 26.00000 0.4430000 25.88000 0.6726000 0.1280000      0.8054000 
1 1 1 14 34 24 o 19.43000 0.4241000 19.74000 0.4831000 19.12000 0.6973000 0.6232000      0.8483000 
1 1 1 14 34 26 f 8.661000 0.4885000 8.075000 0.6733000 9.248000 0.7080000 -1.172000      0.9771000 
1 1 1 14 34 28 o 31.10000 0.4329000 30.79000 0.6473000 31.42000 0.5750000 -0.6241000     0.8658000 
1 1 1 14 34 30 f 13.95000 0.3829000 13.68000 0.4789000 14.23000 0.5977000 -0.5458000     0.7659000 
1 1 1 14 34 32 o 13.21000 0.3618000 13.00000 0.5147000 13.41000 0.5087000 -0.4164000     0.7237000 
1 1 1 14 34 34 o 10.84000 0.3968000 10.55000 0.5615000 11.13000 0.5608000 -0.5798000     0.7936000 
1 1 1 14 34 36 o 11.32000 0.4656000 11.19000 0.7866000 11.46000 0.4986000 -0.2692000     0.9313000 
1 1 1 14 34 38 o 9.940000 0.5052000 9.609000 0.7961000 10.27000 0.6222000 -0.6624000     1.010000  
1 1 1 14 34 40 o 11.27000 0.5819000 11.66000 0.9747000 10.87000 0.6360000 0.7931000      1.164000  
1 1 1 14 34 42 o 3.812000 0.9552000 3.735000 1.410000  3.889000 1.289000  -0.1541000     1.910000  
1 1 1 14 34 44 o 9.060000 0.5969000 8.488000 0.9900000 9.633000 0.6673000 -1.145000      1.194000  
1 1 1 14 34 46 f 7.473000 0.8792000 7.753000 1.458000  7.194000 0.9825000 0.5597000      1.758000  
1 1 1 14 34 48 o 3.447000 0.9817000 3.648000 1.486000  3.247000 1.283000  0.4009000      1.963000  
1 1 1 14 34 50 o 3.258000 0.9643000 2.909000 1.377000  3.607000 1.351000  -0.6984000     1.929000  
1 1 1 14 34 52 o 5.806000 0.9496000 5.009000 1.653000  6.604000 0.9351000 -1.595000      1.899000  
1 1 1 14 35 1  o 31.41000 0.3301000 30.94000 0.4876000 31.89000 0.4450000 -0.9492000     0.6602000 
1 1 1 14 35 3  o 14.77000 0.3057000 15.35000 0.4787000 14.19000 0.3803000 1.155000       0.6114000 
1 1 1 14 35 5  o 22.22000 0.2744000 22.33000 0.4301000 22.10000 0.3409000 0.2299000      0.5488000 
1 1 1 14 35 7  o 27.54000 0.2913000 28.23000 0.4601000 26.85000 0.3576000 1.380000       0.5827000 
1 1 1 14 35 9  o 13.59000 0.4951000 13.70000 0.5177000 13.49000 0.8441000 0.2078000      0.9902000 
1 1 1 14 35 11 o 11.24000 0.6007000 11.08000 0.7188000 11.41000 0.9627000 -0.3306000     1.201000  
1 1 1 14 35 13 o 22.38000 0.3990000 22.93000 0.4258000 21.84000 0.6749000 1.094000       0.7980000 
1 1 1 14 35 15 o 16.68000 0.5782000 15.73000 0.5707000 17.62000 1.006000  -1.885000      1.156000  
1 1 1 14 35 17 o 16.82000 0.5829000 16.55000 0.4955000 17.10000 1.055000  -0.5489000     1.166000  
1 1 1 14 35 19 o 27.09000 0.4324000 26.89000 0.5167000 27.28000 0.6935000 -0.3931000     0.8648000 
1 1 1 14 35 21 o 15.49000 0.4833000 16.59000 0.5044000 14.39000 0.8246000 2.206000       0.9667000 
1 1 1 14 35 23 o 21.48000 0.4059000 21.86000 0.4461000 21.10000 0.6783000 0.7591000      0.8118000 
1 1 1 14 35 25 o 24.31000 0.3502000 23.87000 0.5208000 24.76000 0.4683000 -0.8914000     0.7004000 
1 1 1 14 35 27 o 19.66000 0.3538000 19.85000 0.4749000 19.47000 0.5245000 0.3771000      0.7075000 
1 1 1 14 35 29 o 15.38000 0.3338000 14.97000 0.4504000 15.78000 0.4929000 -0.8061000     0.6676000 
1 1 1 14 35 31 o 6.114000 0.6550000 5.831000 0.8930000 6.397000 0.9584000 -0.5659000     1.310000  
1 1 1 14 35 33 f 7.347000 0.5811000 7.457000 0.7936000 7.236000 0.8492000 0.2215000      1.162000  
1 1 1 14 35 35 o 3.056000 0.8230000 3.398000 1.219000  2.713000 1.106000  0.6845000      1.646000  
1 1 1 14 35 37 o 23.02000 0.3260000 22.64000 0.4924000 23.41000 0.4272000 -0.7666000     0.6519000 
1 1 1 14 35 39 o 27.72000 0.3837000 27.16000 0.6245000 28.28000 0.4462000 -1.119000      0.7675000 
1 1 1 14 35 41 o 13.97000 0.4067000 14.01000 0.6324000 13.92000 0.5117000 0.9371000E-01  0.8135000 
1 1 1 14 35 43 o 3.638000 0.9685000 3.133000 1.357000  4.142000 1.382000  -1.008000      1.937000  
1 1 1 14 35 45 o 12.45000 0.4795000 12.45000 0.7154000 12.45000 0.6387000 0.1118000E-02  0.9590000 
1 1 1 14 35 47 o 10.89000 0.5243000 10.43000 0.8697000 11.36000 0.5857000 -0.9327000     1.049000  
1 1 1 14 35 49 o 2.901000 0.9119000 2.834000 1.321000  2.968000 1.257000  -0.1338000     1.824000  
1 1 1 14 35 51 o 5.987000 0.9137000 6.646000 1.416000  5.328000 1.155000  1.318000       1.827000  
1 1 1 14 35 53 o 3.493000 1.086000  3.942000 1.731000  3.043000 1.311000  0.8994000      2.171000  
1 1 1 14 36 0  o 19.88000 0.4493000 19.88000 0.4493000 19.88000 0.4493000 0.000000       0.000000  
1 1 1 14 36 2  o 41.65000 0.3774000 42.69000 0.5487000 40.60000 0.5181000 2.088000       0.7547000 
1 1 1 14 36 4  o 28.18000 0.3562000 28.48000 0.4506000 27.88000 0.5517000 0.5930000      0.7123000 
1 1 1 14 36 6  o 4.655000 0.7678000 4.931000 1.194000  4.379000 0.9656000 0.5513000      1.536000  
1 1 1 14 36 8  o 13.45000 0.3127000 12.86000 0.5156000 14.04000 0.3540000 -1.179000      0.6255000 
1 1 1 14 36 10 o 9.297000 0.8193000 8.882000 0.7488000 9.713000 1.458000  -0.8310000     1.639000  
1 1 1 14 36 12 o 17.80000 0.5365000 18.23000 0.4600000 17.37000 0.9694000 0.8602000      1.073000  
1 1 1 14 36 14 o 6.192000 1.156000  4.131000 1.433000  8.252000 1.813000  -4.121000      2.311000  
1 1 1 14 36 16 o 15.52000 0.4846000 15.87000 0.5064000 15.16000 0.8264000 0.7096000      0.9692000 
1 1 1 14 36 18 o 21.26000 0.4112000 21.78000 0.4550000 20.75000 0.6851000 1.030000       0.8225000 
1 1 1 14 36 20 o 11.53000 0.6151000 12.54000 0.5886000 10.53000 1.080000  2.014000       1.230000  
1 1 1 14 36 22 o 5.857000 1.069000  5.064000 1.321000  6.650000 1.680000  -1.586000      2.138000  
1 1 1 14 36 24 o 4.480000 1.044000  5.348000 1.440000  3.613000 1.513000  1.735000       2.088000  
1 1 1 14 36 26 o 13.45000 0.4163000 12.90000 0.5898000 14.00000 0.5876000 -1.102000      0.8325000 
1 1 1 14 36 28 o 7.081000 0.5320000 6.742000 0.7524000 7.419000 0.7524000 -0.6775000     1.064000  
1 1 1 14 36 30 o 9.315000 0.6204000 10.17000 0.5882000 8.464000 1.092000  1.703000       1.241000  
1 1 1 14 36 32 o 17.20000 0.3074000 17.48000 0.3787000 16.92000 0.4844000 0.5573000      0.6148000 
1 1 1 14 36 34 o 5.200000 0.7811000 4.177000 1.197000  6.222000 1.004000  -2.045000      1.562000  
1 1 1 14 36 36 o 25.71000 0.3213000 25.77000 0.4844000 25.64000 0.4224000 0.1370000      0.6427000 
1 1 1 14 36 38 o 17.01000 0.3275000 16.95000 0.4569000 17.07000 0.4693000 -0.1186000     0.6549000 
1 1 1 14 36 40 o 13.16000 0.3970000 13.14000 0.5508000 13.17000 0.5719000 -0.2233000E-01 0.7941000 
1 1 1 14 36 42 o 7.092000 0.6559000 6.757000 0.9733000 7.426000 0.8794000 -0.6687000     1.312000  
1 1 1 14 36 44 o 7.534000 0.9296000 8.866000 1.067000  6.203000 1.523000  2.663000       1.859000  
1 1 1 14 36 46 o 4.068000 1.073000  4.445000 1.677000  3.691000 1.339000  0.7539000      2.146000  
1 1 1 14 36 48 o 14.04000 0.4724000 13.66000 0.7364000 14.42000 0.5921000 -0.7620000     0.9449000 
1 1 1 14 36 50 o 3.927000 1.060000  4.126000 1.621000  3.728000 1.367000  0.3980000      2.120000  
1 1 1 14 36 52 f 3.707000 0.9855000 4.159000 1.419000  3.255000 1.368000  0.9034000      1.971000  
1 1 1 14 37 1  o 12.50000 0.3513000 12.48000 0.5022000 12.51000 0.4912000 -0.2045000E-01 0.7025000 
1 1 1 14 37 3  o 32.85000 0.4768000 32.85000 0.4768000 ?        ?         ?              ?         
1 1 1 14 37 5  o 18.91000 0.2956000 19.03000 0.4311000 18.78000 0.4044000 0.2458000      0.5911000 
1 1 1 14 37 7  o 3.847000 0.8466000 3.993000 1.286000  3.701000 1.102000  0.2919000      1.693000  
1 1 1 14 37 9  o 32.98000 0.3078000 33.45000 0.4390000 32.50000 0.4316000 0.9505000      0.6157000 
1 1 1 14 37 11 o 15.08000 0.6359000 15.89000 0.5686000 14.27000 1.138000  1.629000       1.272000  
1 1 1 14 37 13 o 26.05000 0.3874000 25.75000 0.4334000 26.34000 0.6423000 -0.5880000     0.7749000 
1 1 1 14 37 15 o 22.82000 0.3979000 23.01000 0.4388000 22.63000 0.6639000 0.3868000      0.7958000 
1 1 1 14 37 17 o 24.44000 0.4057000 24.62000 0.4406000 24.25000 0.6813000 0.3783000      0.8114000 
1 1 1 14 37 19 o 15.60000 0.4936000 15.57000 0.5187000 15.62000 0.8398000 -0.5421000E-01 0.9871000 
1 1 1 14 37 21 o 9.671000 0.7003000 10.13000 0.6952000 9.216000 1.216000  0.9099000      1.401000  
1 1 1 14 37 23 o 15.41000 0.4679000 15.54000 0.5142000 15.29000 0.7819000 0.2533000      0.9358000 
1 1 1 14 37 25 o 10.81000 0.4283000 11.04000 0.6361000 10.58000 0.5738000 0.4522000      0.8567000 
1 1 1 14 37 27 o 10.71000 0.4653000 10.65000 0.7301000 10.77000 0.5771000 -0.1205000     0.9306000 
1 1 1 14 37 29 o 4.975000 0.7290000 4.862000 0.9240000 5.089000 1.128000  -0.2265000     1.458000  
1 1 1 14 37 31 o 6.499000 0.7810000 6.682000 0.7232000 6.317000 1.385000  0.3646000      1.562000  
1 1 1 14 37 33 o 4.995000 0.7663000 4.923000 0.9693000 5.067000 1.187000  -0.1438000     1.533000  
1 1 1 14 37 35 o 3.131000 0.8386000 3.482000 1.231000  2.780000 1.140000  0.7017000      1.677000  
1 1 1 14 37 37 o 11.98000 0.3945000 12.14000 0.5468000 11.82000 0.5687000 0.3222000      0.7889000 
1 1 1 14 37 39 o 17.52000 0.3638000 17.66000 0.5366000 17.38000 0.4913000 0.2812000      0.7275000 
1 1 1 14 37 41 o 6.229000 0.7176000 5.914000 1.126000  6.543000 0.8902000 -0.6290000     1.435000  
1 1 1 14 37 43 o 7.210000 0.7099000 6.994000 0.9805000 7.425000 1.027000  -0.4307000     1.420000  
1 1 1 14 37 45 o 6.271000 0.8438000 6.030000 1.297000  6.511000 1.079000  -0.4813000     1.688000  
1 1 1 14 37 47 o 4.250000 1.054000  4.034000 1.634000  4.466000 1.331000  -0.4321000     2.107000  
1 1 1 14 37 49 o 3.484000 0.9796000 3.257000 1.395000  3.710000 1.376000  -0.4526000     1.959000  
1 1 1 14 37 51 o 5.576000 0.9301000 6.749000 1.168000  4.403000 1.448000  2.347000       1.860000  
1 1 1 14 38 0  o 4.561000 1.348000  4.561000 1.348000  4.561000 1.348000  0.000000       0.000000  
1 1 1 14 38 2  o 39.46000 0.3276000 40.20000 0.4693000 38.73000 0.4573000 1.471000       0.6553000 
1 1 1 14 38 4  o 52.63000 0.4335000 53.40000 0.5701000 51.86000 0.6532000 1.532000       0.8670000 
1 1 1 14 38 6  o 21.54000 0.3010000 21.21000 0.4536000 21.87000 0.3956000 -0.6539000     0.6019000 
1 1 1 14 38 8  o 21.01000 0.4135000 21.50000 0.4276000 20.51000 0.7079000 0.9909000      0.8270000 
1 1 1 14 38 10 o 23.63000 0.3315000 24.16000 0.4924000 23.09000 0.4440000 1.069000       0.6630000 
1 1 1 14 38 12 o 16.45000 0.4530000 15.76000 0.5011000 17.13000 0.7548000 -1.371000      0.9060000 
1 1 1 14 38 14 o 23.72000 0.4258000 23.78000 0.5184000 23.65000 0.6756000 0.1225000      0.8516000 
1 1 1 14 38 16 o 17.65000 0.4382000 17.25000 0.4716000 18.06000 0.7388000 -0.8099000     0.8765000 
1 1 1 14 38 18 o 12.99000 0.5391000 13.42000 0.5558000 12.55000 0.9240000 0.8741000      1.078000  
1 1 1 14 38 20 o 30.53000 0.3996000 30.79000 0.4472000 30.27000 0.6624000 0.5162000      0.7993000 
1 1 1 14 38 22 o 20.29000 0.6269000 19.62000 0.4572000 20.97000 1.167000  -1.349000      1.254000  
1 1 1 14 38 24 o 10.67000 0.6068000 10.61000 0.6369000 10.73000 1.033000  -0.1267000     1.214000  
1 1 1 14 38 26 o 15.63000 0.3035000 15.51000 0.4133000 15.75000 0.4445000 -0.2335000     0.6069000 
1 1 1 14 38 28 f 5.510000 0.7751000 5.306000 1.170000  5.714000 1.017000  -0.4077000     1.550000  
1 1 1 14 38 30 o 10.67000 0.3877000 10.40000 0.4789000 10.94000 0.6097000 -0.5398000     0.7753000 
1 1 1 14 38 32 o 15.38000 0.3179000 15.06000 0.4041000 15.70000 0.4907000 -0.6399000     0.6357000 
1 1 1 14 38 34 o 16.32000 0.3435000 16.41000 0.4518000 16.22000 0.5174000 0.1827000      0.6869000 
1 1 1 14 38 36 o 16.99000 0.3241000 17.31000 0.4460000 16.67000 0.4703000 0.6394000      0.6481000 
1 1 1 14 38 38 o 3.130000 0.8570000 2.194000 1.039000  4.065000 1.363000  -1.871000      1.714000  
1 1 1 14 38 40 o 16.77000 0.3418000 16.04000 0.4928000 17.50000 0.4738000 -1.453000      0.6836000 
1 1 1 14 38 42 o 10.18000 0.4944000 10.24000 0.6776000 10.11000 0.7200000 0.1318000      0.9887000 
1 1 1 14 38 44 o 4.992000 0.9728000 5.056000 1.285000  4.927000 1.461000  0.1289000      1.946000  
1 1 1 14 38 46 o 11.73000 0.5347000 10.47000 0.8949000 13.00000 0.5854000 -2.532000      1.069000  
1 1 1 14 38 48 o 8.708000 0.6877000 7.928000 1.131000  9.489000 0.7823000 -1.561000      1.375000  
1 1 1 14 38 50 o 5.414000 0.9837000 4.669000 1.462000  6.159000 1.316000  -1.491000      1.967000  
1 1 1 14 39 1  o 11.94000 0.3976000 11.60000 0.5344000 12.28000 0.5889000 -0.6735000     0.7952000 
1 1 1 14 39 3  o 10.25000 0.4005000 10.63000 0.5800000 9.878000 0.5524000 0.7479000      0.8009000 
1 1 1 14 39 5  o 16.85000 0.4653000 17.53000 0.4380000 16.17000 0.8211000 1.352000       0.9306000 
1 1 1 14 39 7  o 10.36000 0.3988000 11.20000 0.5902000 9.510000 0.5366000 1.695000       0.7976000 
1 1 1 14 39 9  o 9.140000 0.5356000 9.650000 0.9376000 8.630000 0.5180000 1.020000       1.071000  
1 1 1 14 39 11 o 19.25000 0.2844000 19.70000 0.4484000 18.81000 0.3497000 0.8876000      0.5687000 
1 1 1 14 39 13 o 5.352000 1.111000  5.715000 1.382000  4.989000 1.741000  0.7263000      2.223000  
1 1 1 14 39 15 o 19.24000 0.4343000 18.54000 0.4632000 19.94000 0.7348000 -1.398000      0.8686000 
1 1 1 14 39 17 o 10.06000 0.6432000 10.04000 0.6968000 10.08000 1.081000  -0.4388000E-01 1.286000  
1 1 1 14 39 19 o 16.16000 0.4758000 16.57000 0.4796000 15.75000 0.8219000 0.8204000      0.9516000 
1 1 1 14 39 21 o 11.79000 0.7399000 12.03000 0.5736000 11.56000 1.364000  0.4658000      1.480000  
1 1 1 14 39 23 o 3.342000 0.9967000 2.983000 1.288000  3.701000 1.521000  -0.7174000     1.993000  
1 1 1 14 39 25 o 7.434000 0.8711000 7.583000 0.9366000 7.285000 1.469000  0.2983000      1.742000  
1 1 1 14 39 27 o 8.737000 0.4465000 9.166000 0.5978000 8.308000 0.6635000 0.8588000      0.8931000 
1 1 1 14 39 29 o 13.44000 0.3485000 13.44000 0.4550000 13.44000 0.5280000 -0.9470000E-03 0.6970000 
1 1 1 14 39 31 o 9.066000 0.5708000 9.386000 0.5082000 8.746000 1.022000  0.6403000      1.142000  
1 1 1 14 39 33 o 11.01000 0.4015000 11.29000 0.5014000 10.73000 0.6272000 0.5546000      0.8030000 
1 1 1 14 39 35 o 12.62000 0.4800000 12.29000 0.8300000 12.96000 0.4823000 -0.6632000     0.9600000 
1 1 1 14 39 37 o 6.281000 0.7280000 6.638000 0.8635000 5.924000 1.172000  0.7142000      1.456000  
1 1 1 14 39 39 o 8.462000 0.5073000 8.592000 0.6814000 8.333000 0.7516000 0.2593000      1.015000  
1 1 1 14 39 41 f 7.435000 0.6209000 7.502000 0.8259000 7.368000 0.9274000 0.1348000      1.242000  
1 1 1 14 39 43 o 9.522000 0.5085000 9.596000 0.7086000 9.448000 0.7295000 0.1479000      1.017000  
1 1 1 14 39 45 o 6.255000 0.7588000 5.340000 1.254000  7.171000 0.8546000 -1.831000      1.518000  
1 1 1 14 39 47 o 5.343000 1.017000  5.878000 1.521000  4.808000 1.350000  1.071000       2.034000  
1 1 1 14 39 49 o 5.008000 0.9857000 4.897000 1.403000  5.118000 1.385000  -0.2215000     1.971000  
1 1 1 14 40 0  f 30.92000 0.4180000 30.92000 0.4180000 30.92000 0.4180000 0.000000       0.000000  
1 1 1 14 40 2  o 23.07000 0.3995000 23.59000 0.4061000 22.56000 0.6882000 1.031000       0.7991000 
1 1 1 14 40 4  o 13.00000 0.3547000 13.65000 0.5102000 12.35000 0.4930000 1.306000       0.7094000 
1 1 1 14 40 6  o 17.82000 0.3310000 17.68000 0.4363000 17.95000 0.4978000 -0.2659000     0.6619000 
1 1 1 14 40 8  o 18.54000 0.2875000 18.51000 0.4381000 18.56000 0.3725000 -0.4955000E-01 0.5750000 
1 1 1 14 40 10 o 24.09000 0.2794000 24.50000 0.4294000 23.67000 0.3577000 0.8341000      0.5589000 
1 1 1 14 40 12 o 4.570000 0.9429000 5.596000 1.497000  3.545000 1.146000  2.052000       1.886000  
1 1 1 14 40 14 o 15.11000 0.4941000 15.83000 0.5119000 14.39000 0.8453000 1.439000       0.9882000 
1 1 1 14 40 16 o 10.72000 0.6446000 11.04000 0.6220000 10.41000 1.129000  0.6248000      1.289000  
1 1 1 14 40 18 o 12.92000 0.5334000 12.89000 0.5573000 12.95000 0.9096000 -0.6190000E-01 1.067000  
1 1 1 14 40 20 o 18.64000 0.5894000 19.39000 0.4403000 17.89000 1.094000  1.498000       1.179000  
1 1 1 14 40 22 o 13.10000 0.5242000 13.80000 0.5797000 12.39000 0.8736000 1.414000       1.048000  
1 1 1 14 40 24 o 12.51000 0.5507000 12.28000 0.6454000 12.73000 0.8924000 -0.4483000     1.101000  
1 1 1 14 40 26 o 12.77000 0.3331000 12.57000 0.4286000 12.97000 0.5101000 -0.3987000     0.6662000 
1 1 1 14 40 28 o 9.636000 0.3983000 10.06000 0.5217000 9.210000 0.6020000 0.8521000      0.7966000 
1 1 1 14 40 30 o 9.927000 0.4534000 10.53000 0.6069000 9.322000 0.6737000 1.209000       0.9067000 
1 1 1 14 40 32 o 10.61000 0.5205000 10.59000 0.5070000 10.64000 0.9092000 -0.4993000E-01 1.041000  
1 1 1 14 40 34 o 15.05000 0.3474000 15.06000 0.4654000 15.04000 0.5160000 0.2448000E-01  0.6949000 
1 1 1 14 40 36 o 4.245000 0.9206000 3.671000 1.302000  4.818000 1.302000  -1.148000      1.841000  
1 1 1 14 40 38 o 5.325000 0.7886000 5.969000 0.9912000 4.682000 1.227000  1.287000       1.577000  
1 1 1 14 40 40 o 3.814000 0.9009000 3.337000 1.199000  4.292000 1.345000  -0.9549000     1.802000  
1 1 1 14 40 42 o 2.768000 0.8732000 2.335000 1.088000  3.202000 1.366000  -0.8675000     1.746000  
1 1 1 14 40 44 o 3.630000 0.9741000 3.686000 1.343000  3.573000 1.412000  0.1132000      1.948000  
1 1 1 14 40 46 o 4.524000 0.9778000 3.957000 1.333000  5.091000 1.431000  -1.134000      1.956000  
1 1 1 14 40 48 o 9.835000 0.7006000 9.253000 1.123000  10.42000 0.8377000 -1.164000      1.401000  
1 1 1 14 41 1  o 12.62000 0.5267000 12.66000 0.9269000 12.59000 0.5003000 0.7549000E-01  1.053000  
1 1 1 14 41 3  o 8.058000 0.4965000 8.608000 0.7133000 7.508000 0.6910000 1.100000       0.9931000 
1 1 1 14 41 5  o 21.20000 0.2843000 21.13000 0.4219000 21.27000 0.3810000 -0.1352000     0.5685000 
1 1 1 14 41 7  o 24.04000 0.2792000 24.38000 0.4143000 23.69000 0.3745000 0.6841000      0.5584000 
1 1 1 14 41 9  o 11.91000 0.3502000 12.48000 0.5605000 11.34000 0.4200000 1.138000       0.7004000 
1 1 1 14 41 11 o 10.86000 0.3816000 11.04000 0.6302000 10.68000 0.4304000 0.3611000      0.7631000 
1 1 1 14 41 13 o 3.913000 0.8106000 4.474000 1.266000  3.352000 1.013000  1.122000       1.621000  
1 1 1 14 41 15 o 5.225000 1.058000  5.349000 1.257000  5.100000 1.703000  0.2489000      2.116000  
1 1 1 14 41 17 o 15.79000 0.6536000 16.30000 0.4857000 15.28000 1.214000  1.019000       1.307000  
1 1 1 14 41 19 o 16.54000 0.4433000 16.79000 0.4497000 16.29000 0.7641000 0.5092000      0.8866000 
1 1 1 14 41 21 o 2.461000 0.8206000 2.166000 0.9985000 2.756000 1.302000  -0.5901000     1.641000  
1 1 1 14 41 23 o 15.47000 0.4597000 15.59000 0.5495000 15.35000 0.7371000 0.2335000      0.9194000 
1 1 1 14 41 25 o 35.52000 0.4552000 35.15000 0.5399000 35.88000 0.7330000 -0.7303000     0.9104000 
1 1 1 14 41 27 o 4.436000 0.7253000 5.097000 0.8991000 3.774000 1.138000  1.323000       1.451000  
1 1 1 14 41 29 o 13.20000 0.3464000 13.16000 0.4696000 13.24000 0.5094000 -0.8269000E-01 0.6929000 
1 1 1 14 41 31 o 14.88000 0.4174000 15.06000 0.4196000 14.70000 0.7217000 0.3636000      0.8348000 
1 1 1 14 41 33 o 8.819000 0.4947000 10.16000 0.5300000 7.477000 0.8354000 2.684000       0.9893000 
1 1 1 14 41 35 o 6.480000 0.7151000 6.623000 1.060000  6.337000 0.9598000 0.2862000      1.430000  
1 1 1 14 41 37 o 4.456000 0.9587000 3.457000 1.291000  5.455000 1.417000  -1.998000      1.917000  
1 1 1 14 41 39 f 4.156000 0.9003000 3.723000 1.246000  4.590000 1.300000  -0.8675000     1.801000  
1 1 1 14 41 41 o 6.382000 0.8066000 5.428000 1.130000  7.337000 1.152000  -1.909000      1.613000  
1 1 1 14 41 43 o 2.987000 0.9033000 2.390000 1.100000  3.584000 1.433000  -1.194000      1.807000  
1 1 1 14 41 45 o 3.382000 0.9438000 2.841000 1.214000  3.923000 1.445000  -1.083000      1.888000  
1 1 1 14 41 47 o 4.918000 1.031000  4.438000 1.447000  5.398000 1.469000  -0.9602000     2.062000  
1 1 1 14 42 0  o 5.369000 1.007000  5.369000 1.007000  5.369000 1.007000  0.000000       0.000000  
1 1 1 14 42 2  o 11.42000 0.3839000 11.29000 0.5664000 11.55000 0.5182000 -0.2597000     0.7677000 
1 1 1 14 42 4  o 21.13000 0.3799000 21.38000 0.6563000 20.87000 0.3829000 0.5117000      0.7599000 
1 1 1 14 42 6  o 20.89000 0.2791000 21.47000 0.4142000 20.31000 0.3742000 1.163000       0.5582000 
1 1 1 14 42 8  o 27.28000 0.3121000 26.99000 0.4886000 27.57000 0.3886000 -0.5817000     0.6243000 
1 1 1 14 42 10 o 17.35000 0.2885000 17.06000 0.4524000 17.63000 0.3581000 -0.5678000     0.5770000 
1 1 1 14 42 12 o 3.363000 0.8111000 3.095000 1.235000  3.631000 1.052000  -0.5360000     1.622000  
1 1 1 14 42 14 o 4.669000 0.7396000 5.191000 1.167000  4.148000 0.9090000 1.043000       1.479000  
1 1 1 14 42 16 o 8.384000 1.026000  8.664000 0.7507000 8.104000 1.909000  0.5597000      2.051000  
1 1 1 14 42 18 o 11.48000 0.5709000 11.85000 0.6313000 11.10000 0.9513000 0.7552000      1.142000  
1 1 1 14 42 20 o 19.52000 0.4065000 19.37000 0.4404000 19.66000 0.6833000 -0.2913000     0.8129000 
1 1 1 14 42 22 o 5.665000 0.8657000 7.673000 0.7874000 3.658000 1.542000  4.015000       1.731000  
1 1 1 14 42 24 o 25.26000 0.4150000 24.98000 0.4985000 25.54000 0.6635000 -0.5523000     0.8299000 
1 1 1 14 42 26 o 9.970000 0.3842000 11.30000 0.5810000 8.637000 0.5027000 2.666000       0.7683000 
1 1 1 14 42 28 o 3.793000 0.8029000 3.536000 1.103000  4.050000 1.167000  -0.5145000     1.606000  
1 1 1 14 42 30 o 3.019000 0.8067000 2.554000 1.066000  3.483000 1.211000  -0.9291000     1.613000  
1 1 1 14 42 32 o 4.334000 0.9461000 4.187000 1.057000  4.480000 1.569000  -0.2933000     1.892000  
1 1 1 14 42 34 o 7.695000 0.8788000 8.523000 0.5833000 6.867000 1.658000  1.656000       1.758000  
1 1 1 14 42 36 o 7.290000 0.6546000 6.683000 0.7264000 7.896000 1.089000  -1.213000      1.309000  
1 1 1 14 42 38 o 12.26000 0.4328000 11.34000 0.6301000 13.17000 0.5934000 -1.823000      0.8655000 
1 1 1 14 42 40 o 15.79000 0.4304000 15.00000 0.6164000 16.59000 0.6008000 -1.594000      0.8607000 
1 1 1 14 42 42 f 12.57000 0.4671000 11.94000 0.5850000 13.19000 0.7283000 -1.250000      0.9342000 
1 1 1 14 42 44 o 5.498000 1.094000  7.059000 1.631000  3.937000 1.459000  3.122000       2.188000  
1 1 1 14 42 46 f 5.770000 1.074000  5.294000 1.714000  6.247000 1.293000  -0.9533000     2.147000  
1 1 1 14 43 1  o 4.074000 0.7187000 5.754000 0.9702000 2.393000 1.061000  3.361000       1.437000  
1 1 1 14 43 3  o 12.85000 0.3440000 13.14000 0.4942000 12.56000 0.4785000 0.5804000      0.6879000 
1 1 1 14 43 5  o 12.81000 0.3336000 13.18000 0.5022000 12.44000 0.4393000 0.7377000      0.6672000 
1 1 1 14 43 7  o 8.669000 0.6512000 10.12000 0.9530000 7.221000 0.8877000 2.895000       1.302000  
1 1 1 14 43 9  o 18.98000 0.2833000 18.67000 0.4328000 19.29000 0.3658000 -0.6209000     0.5666000 
1 1 1 14 43 11 o 10.40000 0.4260000 10.71000 0.7118000 10.09000 0.4684000 0.6213000      0.8521000 
1 1 1 14 43 13 o 24.97000 0.3087000 25.20000 0.4742000 24.73000 0.3953000 0.4650000      0.6173000 
1 1 1 14 43 15 o 3.020000 0.8904000 3.393000 1.247000  2.647000 1.271000  0.7454000      1.781000  
1 1 1 14 43 17 o 4.941000 0.9781000 5.669000 1.103000  4.214000 1.616000  1.454000       1.956000  
1 1 1 14 43 19 o 19.26000 0.5887000 19.27000 0.5041000 19.26000 1.064000  0.1216000E-01  1.177000  
1 1 1 14 43 21 o 10.74000 0.5553000 9.617000 0.6715000 11.86000 0.8845000 -2.238000      1.111000  
1 1 1 14 43 23 o 11.06000 0.5639000 11.11000 0.5759000 11.01000 0.9696000 0.1088000      1.128000  
1 1 1 14 43 25 o 15.27000 0.4507000 15.58000 0.5023000 14.96000 0.7484000 0.6188000      0.9014000 
1 1 1 14 43 27 o 4.222000 1.053000  3.820000 1.317000  4.625000 1.644000  -0.8058000     2.106000  
1 1 1 14 43 29 o 12.46000 0.5043000 12.68000 0.4044000 12.25000 0.9241000 0.4223000      1.009000  
1 1 1 14 43 31 o 5.185000 0.9631000 3.674000 1.145000  6.696000 1.549000  -3.022000      1.926000  
1 1 1 14 43 33 o 7.182000 0.7475000 7.182000 0.7475000 ?        ?         ?              ?         
1 1 1 14 43 35 o 4.317000 0.9390000 4.076000 1.257000  4.558000 1.396000  -0.4820000     1.878000  
1 1 1 14 43 37 o 10.87000 0.4439000 10.17000 0.6001000 11.56000 0.6543000 -1.385000      0.8878000 
1 1 1 14 43 39 o 12.89000 0.5144000 13.04000 0.6804000 12.75000 0.7717000 0.2975000      1.029000  
1 1 1 14 43 41 o 3.831000 0.9984000 4.635000 1.486000  3.027000 1.334000  1.608000       1.997000  
1 1 1 14 43 43 o 5.454000 1.076000  4.467000 1.679000  6.441000 1.347000  -1.974000      2.152000  
1 1 1 14 43 45 o 4.573000 0.9651000 3.409000 1.390000  5.736000 1.339000  -2.327000      1.930000  
1 1 1 14 44 0  o 10.98000 0.5060000 10.98000 0.5060000 10.98000 0.5060000 0.000000       0.000000  
1 1 1 14 44 2  o 27.70000 0.2854000 28.03000 0.4049000 27.37000 0.4022000 0.6643000      0.5707000 
1 1 1 14 44 4  o 18.26000 0.3229000 17.68000 0.4223000 18.83000 0.4886000 -1.144000      0.6458000 
1 1 1 14 44 6  o 3.516000 0.8824000 3.719000 1.363000  3.313000 1.121000  0.4066000      1.765000  
1 1 1 14 44 8  o 13.43000 0.3835000 13.78000 0.4921000 13.08000 0.5883000 0.7016000      0.7670000 
1 1 1 14 44 10 o 36.31000 0.4198000 36.58000 0.6849000 36.03000 0.4857000 0.5575000      0.8397000 
1 1 1 14 44 12 o 18.67000 0.3239000 18.16000 0.5226000 19.18000 0.3829000 -1.019000      0.6479000 
1 1 1 14 44 14 o 11.36000 0.3911000 12.19000 0.5395000 10.52000 0.5665000 1.664000       0.7823000 
1 1 1 14 44 16 o 16.75000 0.4302000 16.21000 0.4937000 17.29000 0.7047000 -1.077000      0.8604000 
1 1 1 14 44 18 o 9.946000 0.6063000 10.44000 0.7151000 9.451000 0.9794000 0.9889000      1.213000  
1 1 1 14 44 20 o 5.189000 1.053000  4.555000 1.376000  5.823000 1.595000  -1.268000      2.107000  
1 1 1 14 44 22 o 4.036000 1.144000  2.835000 1.209000  5.238000 1.942000  -2.403000      2.288000  
1 1 1 14 44 24 o 15.23000 0.5096000 16.37000 0.6464000 14.10000 0.7881000 2.263000       1.019000  
1 1 1 14 44 26 o 8.207000 0.7450000 6.814000 1.066000  9.600000 1.041000  -2.786000      1.490000  
1 1 1 14 44 28 o 8.267000 0.6783000 7.431000 0.5788000 9.104000 1.227000  -1.672000      1.357000  
1 1 1 14 44 30 o 6.242000 0.8303000 6.050000 0.7060000 6.434000 1.503000  -0.3836000     1.661000  
1 1 1 14 44 32 o 2.872000 1.166000  2.872000 1.166000  ?        ?         ?              ?         
1 1 1 14 44 34 o 3.355000 0.9339000 2.841000 1.090000  3.870000 1.517000  -1.029000      1.868000  
1 1 1 14 44 36 o 7.997000 0.7215000 7.655000 0.9640000 8.339000 1.074000  -0.6840000     1.443000  
1 1 1 14 44 38 o 9.106000 0.6131000 8.324000 0.7842000 9.888000 0.9428000 -1.564000      1.226000  
1 1 1 14 44 40 o 3.690000 0.9690000 3.836000 1.410000  3.544000 1.329000  0.2927000      1.938000  
1 1 1 14 44 42 o 11.50000 0.6029000 11.17000 0.9003000 11.83000 0.8021000 -0.6557000     1.206000  
1 1 1 14 44 44 o 7.443000 0.8087000 6.953000 1.312000  7.932000 0.9459000 -0.9789000     1.617000  
1 1 1 14 45 1  o 4.285000 0.7793000 3.638000 1.184000  4.933000 1.014000  -1.295000      1.559000  
1 1 1 14 45 3  o 19.84000 0.2861000 19.65000 0.4151000 20.03000 0.3939000 -0.3820000     0.5722000 
1 1 1 14 45 5  o 13.94000 0.3352000 13.54000 0.4621000 14.34000 0.4857000 -0.8005000     0.6704000 
1 1 1 14 45 7  o 8.832000 0.4089000 9.625000 0.6009000 8.040000 0.5548000 1.585000       0.8179000 
1 1 1 14 45 9  f 7.658000 0.6498000 8.899000 0.7565000 6.418000 1.057000  2.481000       1.300000  
1 1 1 14 45 11 o 11.20000 0.3505000 11.17000 0.5469000 11.24000 0.4385000 -0.6737000E-01 0.7010000 
1 1 1 14 45 13 f 5.129000 0.6852000 5.073000 1.124000  5.186000 0.7843000 -0.1126000     1.370000  
1 1 1 14 45 15 o 13.30000 0.5434000 13.37000 1.021000  13.24000 0.3721000 0.1267000      1.087000  
1 1 1 14 45 17 f 7.022000 0.8430000 7.602000 0.8090000 6.441000 1.479000  1.161000       1.686000  
1 1 1 14 45 19 o 16.12000 0.4533000 16.25000 0.5392000 16.00000 0.7289000 0.2428000      0.9067000 
1 1 1 14 45 21 o 9.807000 0.6117000 9.630000 0.6455000 9.984000 1.039000  -0.3541000     1.223000  
1 1 1 14 45 23 o 7.732000 0.9100000 8.842000 1.112000  6.622000 1.440000  2.220000       1.820000  
1 1 1 14 45 25 o 3.721000 1.087000  3.554000 1.302000  3.888000 1.740000  -0.3340000     2.174000  
1 1 1 14 45 27 o 12.84000 0.5088000 13.27000 0.4388000 12.41000 0.9180000 0.8638000      1.018000  
1 1 1 14 45 29 o 4.336000 1.007000  4.139000 1.015000  4.533000 1.738000  -0.3939000     2.013000  
1 1 1 14 45 31 o 5.243000 1.251000  3.147000 1.086000  7.339000 2.254000  -4.192000      2.502000  
1 1 1 14 45 33 o 7.594000 0.8992000 8.836000 0.7032000 6.351000 1.655000  2.485000       1.798000  
1 1 1 14 45 35 o 5.831000 0.9134000 5.666000 1.318000  5.996000 1.265000  -0.3299000     1.827000  
1 1 1 14 45 37 o 3.888000 1.032000  3.577000 1.420000  4.199000 1.496000  -0.6213000     2.063000  
1 1 1 14 45 39 o 4.902000 1.045000  5.620000 1.479000  4.184000 1.477000  1.436000       2.090000  
1 1 1 14 45 41 o 3.968000 1.004000  4.233000 1.399000  3.702000 1.441000  0.5306000      2.009000  
1 1 1 14 45 43 o 8.160000 0.8024000 8.041000 1.197000  8.279000 1.069000  -0.2377000     1.605000  
1 1 1 14 46 0  o 12.81000 0.4749000 12.81000 0.4749000 12.81000 0.4749000 0.000000       0.000000  
1 1 1 14 46 2  o 16.55000 0.2929000 16.26000 0.4275000 16.84000 0.4006000 -0.5743000     0.5859000 
1 1 1 14 46 4  o 2.757000 0.8009000 2.889000 1.171000  2.624000 1.093000  0.2652000      1.602000  
1 1 1 14 46 6  o 7.493000 0.5604000 8.022000 0.6873000 6.963000 0.8853000 1.059000       1.121000  
1 1 1 14 46 8  o 9.570000 0.4598000 9.323000 0.7583000 9.817000 0.5205000 -0.4946000     0.9197000 
1 1 1 14 46 10 o 6.393000 0.6357000 6.582000 0.8507000 6.204000 0.9448000 0.3780000      1.271000  
1 1 1 14 46 12 o 25.56000 0.3037000 25.43000 0.4742000 25.68000 0.3796000 -0.2545000     0.6074000 
1 1 1 14 46 14 o 12.52000 0.3432000 13.36000 0.5526000 11.67000 0.4073000 1.685000       0.6864000 
1 1 1 14 46 16 o 4.065000 0.7868000 4.398000 1.235000  3.731000 0.9750000 0.6676000      1.574000  
1 1 1 14 46 18 o 11.56000 0.4979000 11.39000 0.5655000 11.73000 0.8196000 -0.3414000     0.9958000 
1 1 1 14 46 20 o 20.64000 0.5623000 21.37000 0.9047000 19.91000 0.6679000 1.456000       1.125000  
1 1 1 14 46 22 o 5.470000 1.028000  4.669000 1.475000  6.271000 1.433000  -1.602000      2.057000  
1 1 1 14 46 24 o 4.785000 1.067000  4.480000 1.298000  5.090000 1.695000  -0.6100000     2.135000  
1 1 1 14 46 26 o 8.068000 0.7781000 8.408000 0.7596000 7.728000 1.358000  0.6802000      1.556000  
1 1 1 14 46 28 o 4.266000 1.085000  3.832000 1.326000  4.700000 1.717000  -0.8685000     2.169000  
1 1 1 14 46 30 o 9.079000 1.196000  9.745000 0.5541000 8.414000 2.326000  1.331000       2.391000  
1 1 1 14 46 32 o 7.127000 0.8333000 7.109000 0.6407000 7.146000 1.538000  -0.3727000E-01 1.667000  
1 1 1 14 46 34 f 3.267000 0.9908000 2.768000 1.208000  3.766000 1.571000  -0.9980000     1.982000  
1 1 1 14 46 36 o 4.035000 1.010000  4.280000 1.376000  3.790000 1.479000  0.4900000      2.020000  
1 1 1 14 46 38 o 4.460000 1.046000  4.999000 1.489000  3.921000 1.470000  1.078000       2.092000  
1 1 1 14 46 40 f 3.261000 0.9202000 3.895000 1.420000  2.627000 1.171000  1.268000       1.840000  
1 1 1 14 46 42 o 3.974000 1.121000  3.659000 1.584000  4.289000 1.588000  -0.6307000     2.243000  
1 1 1 14 47 1  o 3.852000 0.8367000 3.758000 1.125000  3.946000 1.239000  -0.1879000     1.673000  
1 1 1 14 47 3  o 15.59000 0.3208000 16.47000 0.4341000 14.70000 0.4725000 1.765000       0.6417000 
1 1 1 14 47 5  o 25.40000 0.3225000 26.03000 0.4846000 24.77000 0.4258000 1.264000       0.6451000 
1 1 1 14 47 7  o 22.12000 0.3342000 22.85000 0.4234000 21.38000 0.5173000 1.471000       0.6685000 
1 1 1 14 47 9  o 13.46000 0.3263000 13.38000 0.5014000 13.54000 0.4178000 -0.1598000     0.6526000 
1 1 1 14 47 11 o 9.174000 0.4945000 9.686000 0.7016000 8.662000 0.6972000 1.024000       0.9891000 
1 1 1 14 47 13 o 3.369000 0.8126000 3.313000 1.224000  3.424000 1.069000  -0.1105000     1.625000  
1 1 1 14 47 15 o 3.087000 0.8021000 3.133000 1.237000  3.041000 1.021000  0.9197000E-01  1.604000  
1 1 1 14 47 17 o 9.531000 0.4948000 10.44000 0.7719000 8.624000 0.6194000 1.815000       0.9897000 
1 1 1 14 47 19 o 7.906000 0.7698000 7.059000 1.073000  8.753000 1.104000  -1.694000      1.540000  
1 1 1 14 47 21 o 4.476000 0.9816000 3.165000 1.304000  5.788000 1.468000  -2.623000      1.963000  
1 1 1 14 47 23 o 6.583000 0.8839000 6.429000 1.032000  6.737000 1.436000  -0.3088000     1.768000  
1 1 1 14 47 25 o 7.050000 0.9492000 8.713000 0.9552000 5.386000 1.641000  3.326000       1.898000  
1 1 1 14 47 27 o 4.398000 1.143000  4.229000 1.419000  4.568000 1.793000  -0.3391000     2.286000  
1 1 1 14 47 29 o 8.192000 1.044000  7.244000 0.9239000 9.140000 1.873000  -1.896000      2.089000  
1 1 1 14 47 31 o 9.243000 0.7397000 8.853000 0.8537000 9.634000 1.208000  -0.7807000     1.479000  
1 1 1 14 47 33 o 3.734000 1.060000  3.635000 1.486000  3.833000 1.512000  -0.1986000     2.120000  
1 1 1 14 47 35 o 4.533000 1.002000  5.461000 1.369000  3.604000 1.464000  1.857000       2.004000  
1 1 1 14 47 37 o 13.86000 0.5688000 13.80000 0.6785000 13.92000 0.9132000 -0.1288000     1.138000  
1 1 1 14 47 39 o 6.523000 0.9210000 7.454000 1.158000  5.592000 1.433000  1.861000       1.842000  
1 1 1 14 48 0  o 16.22000 0.4277000 16.22000 0.4277000 16.22000 0.4277000 0.000000       0.000000  
1 1 1 14 48 2  o 15.37000 0.3326000 14.78000 0.4969000 15.95000 0.4423000 -1.177000      0.6652000 
1 1 1 14 48 4  o 15.02000 0.3983000 14.84000 0.6815000 15.19000 0.4124000 -0.3528000     0.7966000 
1 1 1 14 48 6  o 4.505000 0.8020000 5.058000 1.174000  3.951000 1.093000  1.108000       1.604000  
1 1 1 14 48 8  o 4.775000 0.8680000 4.318000 1.401000  5.232000 1.025000  -0.9140000     1.736000  
1 1 1 14 48 10 o 6.819000 0.5933000 7.485000 0.9535000 6.153000 0.7063000 1.331000       1.187000  
1 1 1 14 48 12 o 14.01000 0.3871000 14.44000 0.5553000 13.59000 0.5395000 0.8502000      0.7742000 
1 1 1 14 48 14 o 12.65000 0.3669000 13.00000 0.5966000 12.29000 0.4273000 0.7167000      0.7338000 
1 1 1 14 48 16 o 16.77000 0.3360000 17.72000 0.4581000 15.82000 0.4918000 1.904000       0.6720000 
1 1 1 14 48 18 o 11.47000 0.5099000 10.65000 0.5944000 12.29000 0.8286000 -1.636000      1.020000  
1 1 1 14 48 20 o 14.21000 0.4774000 13.32000 0.5171000 15.11000 0.8027000 -1.789000      0.9548000 
1 1 1 14 48 22 o 11.00000 0.5439000 11.21000 0.5933000 10.80000 0.9117000 0.4096000      1.088000  
1 1 1 14 48 24 o 6.943000 1.016000  7.414000 0.8102000 6.473000 1.863000  0.9412000      2.031000  
1 1 1 14 48 26 o 5.937000 0.8817000 6.749000 0.9241000 5.125000 1.502000  1.624000       1.763000  
1 1 1 14 48 28 o 3.190000 0.9742000 2.609000 1.170000  3.771000 1.558000  -1.162000      1.948000  
1 1 1 14 48 30 o 9.280000 0.7607000 9.151000 0.9958000 9.409000 1.150000  -0.2579000     1.521000  
1 1 1 14 48 32 o 6.074000 1.052000  6.264000 1.221000  5.884000 1.712000  0.3799000      2.103000  
1 1 1 14 48 34 o 6.105000 1.093000  5.816000 1.490000  6.395000 1.601000  -0.5792000     2.187000  
1 1 1 14 48 36 o 4.805000 1.034000  4.845000 1.465000  4.766000 1.459000  0.7847000E-01  2.068000  
1 1 1 14 48 38 o 3.638000 0.9987000 2.863000 1.305000  4.413000 1.512000  -1.550000      1.997000  
1 1 1 14 49 1  o 3.915000 0.8284000 3.620000 1.191000  4.210000 1.152000  -0.5906000     1.657000  
1 1 1 14 49 3  o 12.47000 0.3936000 12.37000 0.6170000 12.56000 0.4888000 -0.1850000     0.7872000 
1 1 1 14 49 5  o 20.42000 0.3061000 20.25000 0.4652000 20.58000 0.3979000 -0.3290000     0.6122000 
1 1 1 14 49 7  o 5.057000 0.8245000 5.752000 1.294000  4.363000 1.022000  1.389000       1.649000  
1 1 1 14 49 9  o 8.101000 0.4559000 8.036000 0.7365000 8.167000 0.5376000 -0.1317000     0.9118000 
1 1 1 14 49 11 o 17.61000 0.2933000 17.30000 0.4488000 17.92000 0.3776000 -0.6189000     0.5865000 
1 1 1 14 49 13 o 3.174000 0.8519000 2.956000 1.170000  3.393000 1.239000  -0.4368000     1.704000  
1 1 1 14 49 15 o 3.982000 0.8779000 4.309000 1.268000  3.654000 1.214000  0.6547000      1.756000  
1 1 1 14 49 17 o 7.210000 0.6198000 7.961000 0.8700000 6.460000 0.8830000 1.501000       1.240000  
1 1 1 14 49 19 o 3.993000 0.6770000 5.665000 0.9371000 2.321000 0.9775000 3.344000       1.354000  
1 1 1 14 49 21 o 8.261000 0.7830000 7.504000 0.8215000 9.017000 1.333000  -1.513000      1.566000  
1 1 1 14 49 23 o 9.343000 0.7874000 8.937000 0.7804000 9.749000 1.368000  -0.8121000     1.575000  
1 1 1 14 49 25 o 3.773000 1.148000  2.936000 1.187000  4.610000 1.966000  -1.673000      2.297000  
1 1 1 14 49 27 o 3.220000 0.9584000 2.914000 1.202000  3.526000 1.493000  -0.6113000     1.917000  
1 1 1 14 49 29 o 5.617000 1.107000  4.971000 1.599000  6.263000 1.530000  -1.292000      2.213000  
1 1 1 14 49 31 o 4.102000 1.034000  3.466000 1.303000  4.739000 1.606000  -1.273000      2.068000  
1 1 1 14 49 33 o 4.620000 1.048000  4.490000 1.304000  4.751000 1.639000  -0.2612000     2.095000  
1 1 1 14 49 35 o 9.223000 0.6818000 9.349000 0.9188000 9.098000 1.007000  0.2514000      1.364000  
1 1 1 14 49 37 o 10.45000 0.6978000 10.76000 1.117000  10.13000 0.8364000 0.6246000      1.396000  
1 1 1 14 50 0  o 15.26000 0.4794000 15.26000 0.4794000 15.26000 0.4794000 0.000000       0.000000  
1 1 1 14 50 2  o 4.203000 0.8452000 3.368000 1.346000  5.038000 1.022000  -1.670000      1.690000  
1 1 1 14 50 4  o 6.813000 0.5554000 6.318000 0.8700000 7.309000 0.6908000 -0.9911000     1.111000  
1 1 1 14 50 6  o 7.210000 0.6017000 7.408000 0.9674000 7.011000 0.7156000 0.3976000      1.203000  
1 1 1 14 50 8  o 10.24000 0.3811000 11.00000 0.5276000 9.470000 0.5500000 1.532000       0.7621000 
1 1 1 14 50 10 o 3.789000 0.7714000 4.423000 1.119000  3.155000 1.062000  1.268000       1.543000  
1 1 1 14 50 12 o 13.37000 0.3272000 13.59000 0.5070000 13.14000 0.4137000 0.4525000      0.6544000 
1 1 1 14 50 14 o 4.006000 0.8818000 4.074000 1.251000  3.937000 1.243000  0.1370000      1.764000  
1 1 1 14 50 16 o 9.913000 0.5979000 11.26000 0.6640000 8.564000 0.9945000 2.697000       1.196000  
1 1 1 14 50 18 o 4.391000 0.7753000 4.749000 1.195000  4.033000 0.9879000 0.7167000      1.551000  
1 1 1 14 50 20 o 18.71000 0.5478000 19.00000 0.4467000 18.43000 1.000000  0.5718000      1.096000  
1 1 1 14 50 22 o 11.19000 0.5484000 10.75000 0.5978000 11.63000 0.9195000 -0.8781000     1.097000  
1 1 1 14 50 24 o 5.786000 1.190000  5.612000 1.095000  5.960000 2.113000  -0.3480000     2.380000  
1 1 1 14 50 26 o 8.670000 0.7202000 8.716000 0.7410000 8.624000 1.235000  0.9238000E-01  1.440000  
1 1 1 14 50 28 o 10.89000 0.6754000 10.72000 0.9245000 11.06000 0.9847000 -0.3446000     1.351000  
1 1 1 14 50 30 o 3.548000 1.024000  2.963000 1.247000  4.134000 1.623000  -1.171000      2.047000  
1 1 1 14 50 32 o 3.779000 0.9932000 4.089000 1.298000  3.469000 1.504000  0.6201000      1.986000  
1 1 1 14 50 34 o 7.219000 0.7636000 6.527000 1.158000  7.910000 0.9959000 -1.383000      1.527000  
1 1 1 14 50 36 o 4.352000 1.026000  4.956000 1.453000  3.748000 1.448000  1.209000       2.052000  
1 1 1 14 51 1  o 2.966000 0.8658000 3.086000 1.261000  2.846000 1.187000  0.2402000      1.732000  
1 1 1 14 51 3  o 11.47000 0.3686000 11.14000 0.5296000 11.81000 0.5128000 -0.6646000     0.7372000 
1 1 1 14 51 5  o 16.07000 0.3506000 15.90000 0.5282000 16.25000 0.4613000 -0.3512000     0.7013000 
1 1 1 14 51 7  o 10.22000 0.4107000 10.31000 0.6129000 10.12000 0.5469000 0.1925000      0.8215000 
1 1 1 14 51 9  o 10.35000 0.3804000 10.23000 0.5858000 10.47000 0.4854000 -0.2402000     0.7607000 
1 1 1 14 51 11 o 13.26000 0.3352000 13.14000 0.5149000 13.37000 0.4293000 -0.2331000     0.6704000 
1 1 1 14 51 13 o 7.033000 0.5084000 7.951000 0.7229000 6.115000 0.7151000 1.836000       1.017000  
1 1 1 14 51 15 o 6.754000 0.6681000 7.674000 0.9170000 5.834000 0.9719000 1.840000       1.336000  
1 1 1 14 51 17 o 3.199000 0.9209000 3.068000 1.228000  3.329000 1.373000  -0.2617000     1.842000  
1 1 1 14 51 19 o 5.457000 1.022000  6.083000 1.191000  4.831000 1.660000  1.252000       2.043000  
1 1 1 14 51 21 o 8.468000 0.7242000 10.05000 0.6594000 6.887000 1.290000  3.163000       1.448000  
1 1 1 14 51 23 o 4.816000 0.9877000 4.509000 1.173000  5.122000 1.589000  -0.6135000     1.975000  
1 1 1 14 51 25 o 5.068000 1.033000  4.762000 1.159000  5.373000 1.711000  -0.6113000     2.067000  
1 1 1 14 51 27 o 7.079000 0.9091000 7.349000 0.9334000 6.809000 1.560000  0.5401000      1.818000  
1 1 1 14 51 29 o 3.860000 1.044000  2.864000 1.202000  4.856000 1.707000  -1.992000      2.088000  
1 1 1 14 51 31 o 3.876000 0.9290000 4.767000 1.249000  2.986000 1.375000  1.781000       1.858000  
1 1 1 14 51 33 o 4.795000 0.8801000 6.244000 0.9140000 3.345000 1.504000  2.898000       1.760000  
1 1 1 14 52 0  o 2.476000 1.094000  2.476000 1.094000  2.476000 1.094000  0.000000       0.000000  
1 1 1 14 52 2  o 10.39000 0.3977000 10.44000 0.5796000 10.33000 0.5448000 0.1124000      0.7954000 
1 1 1 14 52 4  o 22.82000 0.3214000 22.49000 0.4855000 23.15000 0.4212000 -0.6604000     0.6427000 
1 1 1 14 52 6  o 2.747000 0.7635000 2.212000 1.010000  3.283000 1.145000  -1.072000      1.527000  
1 1 1 14 52 8  o 9.259000 0.4239000 8.999000 0.6425000 9.519000 0.5531000 -0.5204000     0.8477000 
1 1 1 14 52 10 o 8.322000 0.7387000 8.816000 0.7016000 7.829000 1.300000  0.9863000      1.477000  
1 1 1 14 52 12 o 3.540000 0.8743000 3.480000 1.225000  3.600000 1.248000  -0.1205000     1.749000  
1 1 1 14 52 14 o 3.733000 0.9821000 3.828000 1.275000  3.638000 1.494000  0.1904000      1.964000  
1 1 1 14 52 16 o 5.748000 0.9881000 6.633000 0.9248000 4.863000 1.747000  1.770000       1.976000  
1 1 1 14 52 18 o 5.790000 0.9519000 6.459000 1.076000  5.121000 1.571000  1.338000       1.904000  
1 1 1 14 52 20 o 9.275000 1.065000  10.18000 0.6475000 8.369000 2.030000  1.812000       2.130000  
1 1 1 14 52 22 o 4.016000 1.059000  3.396000 1.264000  4.635000 1.700000  -1.238000      2.118000  
1 1 1 14 52 24 o 6.939000 0.8933000 6.118000 1.173000  7.759000 1.348000  -1.641000      1.787000  
1 1 1 14 52 26 o 4.719000 1.050000  3.681000 1.312000  5.757000 1.640000  -2.077000      2.100000  
1 1 1 14 52 28 o 4.721000 1.033000  5.063000 1.270000  4.379000 1.628000  0.6843000      2.065000  
1 1 1 14 52 30 o 9.123000 0.8702000 9.342000 1.088000  8.905000 1.359000  0.4370000      1.740000  
1 1 1 14 52 32 o 3.881000 1.133000  3.086000 1.247000  4.675000 1.893000  -1.588000      2.266000  
1 1 1 14 53 1  o 5.412000 0.7576000 4.764000 1.184000  6.060000 0.9460000 -1.296000      1.515000  
1 1 1 14 53 3  o 6.963000 0.5259000 7.340000 0.7284000 6.587000 0.7587000 0.7540000      1.052000  
1 1 1 14 53 5  o 4.318000 0.8268000 4.486000 1.188000  4.149000 1.150000  0.3371000      1.654000  
1 1 1 14 53 7  o 8.740000 0.4497000 9.191000 0.6434000 8.290000 0.6286000 0.9006000      0.8995000 
1 1 1 14 53 9  o 7.697000 0.5858000 7.170000 0.8024000 8.224000 0.8538000 -1.054000      1.172000  
1 1 1 14 53 11 o 3.644000 0.9433000 3.792000 1.223000  3.496000 1.436000  0.2965000      1.887000  
1 1 1 14 53 13 o 6.377000 0.6715000 6.042000 1.029000  6.712000 0.8625000 -0.6698000     1.343000  
1 1 1 14 53 15 o 4.092000 1.050000  3.928000 1.290000  4.256000 1.656000  -0.3272000     2.099000  
1 1 1 14 53 17 o 4.494000 1.025000  5.013000 1.332000  3.976000 1.558000  1.037000       2.050000  
1 1 1 14 53 19 o 6.572000 1.087000  6.380000 0.9621000 6.763000 1.949000  -0.3831000     2.173000  
1 1 1 14 53 21 o 3.488000 0.9786000 3.128000 1.235000  3.847000 1.519000  -0.7187000     1.957000  
1 1 1 14 53 23 o 3.471000 1.026000  2.834000 1.216000  4.108000 1.653000  -1.274000      2.052000  
1 1 1 14 53 25 o 5.005000 0.9919000 5.635000 1.064000  4.375000 1.674000  1.260000       1.984000  
1 1 1 14 53 27 o 6.199000 0.9571000 5.612000 1.130000  6.787000 1.545000  -1.175000      1.914000  
1 1 1 14 53 29 o 3.469000 1.036000  3.300000 1.350000  3.637000 1.572000  -0.3374000     2.072000  
1 1 1 14 53 31 o 4.175000 1.281000  3.210000 1.474000  5.141000 2.097000  -1.931000      2.563000  
1 1 1 14 54 0  o 7.877000 0.9529000 7.877000 0.9529000 7.877000 0.9529000 0.000000       0.000000  
1 1 1 14 54 2  o 14.84000 0.3345000 14.92000 0.4876000 14.76000 0.4582000 0.1614000      0.6690000 
1 1 1 14 54 4  o 21.92000 0.2928000 21.97000 0.4359000 21.86000 0.3911000 0.1062000      0.5856000 
1 1 1 14 54 6  o 2.813000 0.7904000 2.882000 1.155000  2.744000 1.079000  0.1375000      1.581000  
1 1 1 14 54 8  o 3.462000 0.7849000 4.518000 1.177000  2.407000 1.038000  2.110000       1.570000  
1 1 1 14 54 10 o 2.501000 0.7508000 2.791000 1.145000  2.211000 0.9719000 0.5805000      1.502000  
1 1 1 14 54 12 o 5.977000 0.9301000 4.335000 1.244000  7.619000 1.383000  -3.284000      1.860000  
1 1 1 14 54 14 f 8.925000 0.6740000 9.199000 0.7056000 8.652000 1.149000  0.5473000      1.348000  
1 1 1 14 54 16 o 9.645000 1.033000  10.66000 0.7195000 8.634000 1.937000  2.024000       2.067000  
1 1 1 14 54 18 o 4.352000 1.033000  4.529000 1.214000  4.175000 1.671000  0.3540000      2.066000  
1 1 1 14 54 20 o 3.659000 0.9936000 3.706000 1.340000  3.612000 1.467000  0.9392000E-01  1.987000  
1 1 1 14 54 22 o 5.253000 1.019000  5.307000 1.152000  5.198000 1.682000  0.1087000      2.039000  
1 1 1 14 54 24 o 3.625000 1.040000  3.171000 1.258000  4.079000 1.656000  -0.9089000     2.080000  
1 1 1 14 54 26 o 4.714000 1.074000  3.633000 1.319000  5.795000 1.696000  -2.162000      2.148000  
1 1 1 14 54 28 o 5.512000 1.148000  4.221000 1.259000  6.803000 1.921000  -2.582000      2.296000  
1 1 1 14 55 1  o 8.074000 0.5772000 8.324000 0.7412000 7.824000 0.8851000 0.4995000      1.154000  
1 1 1 14 55 3  o 9.689000 0.4679000 9.991000 0.7289000 9.386000 0.5870000 0.6056000      0.9359000 
1 1 1 14 55 5  o 4.875000 0.7539000 4.811000 1.132000  4.938000 0.9964000 -0.1270000     1.508000  
1 1 1 14 55 7  o 3.168000 0.7997000 3.632000 1.193000  2.703000 1.066000  0.9296000      1.599000  
1 1 1 14 55 9  o 4.139000 0.8531000 4.624000 1.134000  3.653000 1.275000  0.9712000      1.706000  
1 1 1 14 55 11 o 4.057000 1.025000  3.863000 1.239000  4.251000 1.633000  -0.3884000     2.050000  
1 1 1 14 55 13 o 6.159000 0.8974000 7.546000 1.055000  4.771000 1.452000  2.775000       1.795000  
1 1 1 14 55 15 o 6.281000 1.074000  5.429000 1.167000  7.133000 1.802000  -1.704000      2.147000  
1 1 1 14 55 17 o 5.002000 0.9879000 4.635000 1.172000  5.370000 1.590000  -0.7346000     1.976000  
1 1 1 14 55 19 o 4.184000 1.133000  3.418000 1.329000  4.949000 1.834000  -1.530000      2.265000  
1 1 1 14 55 21 o 4.700000 0.9992000 4.945000 1.251000  4.455000 1.559000  0.4901000      1.998000  
1 1 1 14 55 23 o 9.204000 0.7579000 8.976000 0.7272000 9.431000 1.330000  -0.4545000     1.516000  
1 1 1 14 55 25 o 6.844000 1.110000  5.365000 1.379000  8.323000 1.739000  -2.959000      2.220000  
1 1 1 14 56 0  o 2.999000 1.188000  2.999000 1.188000  2.999000 1.188000  0.000000       0.000000  
1 1 1 14 56 2  o 5.513000 0.9132000 5.691000 1.295000  5.335000 1.288000  0.3560000      1.826000  
1 1 1 14 56 4  o 5.422000 0.8346000 5.617000 1.065000  5.227000 1.286000  0.3899000      1.669000  
1 1 1 14 56 6  o 3.959000 0.8741000 3.788000 1.143000  4.130000 1.322000  -0.3416000     1.748000  
1 1 1 14 56 8  o 2.952000 0.8466000 2.583000 1.122000  3.322000 1.268000  -0.7391000     1.693000  
1 1 1 14 56 10 o 3.159000 0.9161000 3.361000 1.240000  2.956000 1.349000  0.4051000      1.832000  
1 1 1 14 56 12 o 5.321000 1.212000  5.022000 1.238000  5.620000 2.083000  -0.5976000     2.423000  
1 1 1 14 56 14 o 4.470000 1.026000  3.458000 1.249000  5.483000 1.627000  -2.025000      2.051000  
1 1 1 14 56 16 o 5.308000 0.9949000 4.849000 1.227000  5.766000 1.567000  -0.9171000     1.990000  
1 1 1 14 56 18 o 5.716000 1.016000  6.169000 0.9881000 5.263000 1.775000  0.9057000      2.032000  
1 1 1 14 56 20 o 11.78000 0.6490000 12.11000 0.6026000 11.45000 1.150000  0.6607000      1.298000  
1 1 1 14 56 22 f 10.34000 0.6788000 10.76000 0.7058000 9.920000 1.160000  0.8422000      1.358000  
1 1 1 14 56 24 o 6.000000 1.397000  4.571000 1.812000  7.430000 2.126000  -2.858000      2.793000  
1 1 1 14 57 1  o 7.774000 0.5978000 6.821000 1.002000  8.726000 0.6525000 -1.905000      1.196000  
1 1 1 14 57 3  o 7.481000 0.6249000 8.192000 0.7035000 6.770000 1.033000  1.422000       1.250000  
1 1 1 14 57 5  f 5.356000 0.7961000 5.494000 1.107000  5.218000 1.144000  0.2754000      1.592000  
1 1 1 14 57 7  o 5.421000 0.9705000 5.900000 0.9746000 4.942000 1.679000  0.9581000      1.941000  
1 1 1 14 57 9  o 4.061000 1.055000  4.318000 1.204000  3.805000 1.732000  0.5129000      2.109000  
1 1 1 14 57 11 o 4.229000 1.079000  4.077000 1.410000  4.380000 1.633000  -0.3029000     2.157000  
1 1 1 14 57 13 o 2.969000 0.9029000 3.087000 1.226000  2.851000 1.326000  0.2366000      1.806000  
1 1 1 14 57 15 o 6.765000 0.9202000 6.778000 0.9383000 6.752000 1.583000  0.2588000E-01  1.840000  
1 1 1 14 57 17 o 6.718000 0.9404000 6.907000 0.9579000 6.530000 1.619000  0.3772000      1.881000  
1 1 1 14 57 19 o 5.810000 1.067000  4.734000 1.302000  6.887000 1.692000  -2.153000      2.135000  
1 1 1 14 57 21 o 4.449000 1.210000  4.708000 1.770000  4.189000 1.651000  0.5195000      2.420000  
1 1 1 14 58 0  o 3.139000 1.246000  3.139000 1.246000  3.139000 1.246000  0.000000       0.000000  
1 1 1 14 58 2  o 5.850000 0.8108000 5.822000 1.052000  5.877000 1.234000  -0.5567000E-01 1.622000  
1 1 1 14 58 4  o 4.594000 1.047000  4.104000 1.272000  5.084000 1.663000  -0.9801000     2.093000  
1 1 1 14 58 6  o 5.196000 1.113000  5.412000 1.073000  4.981000 1.951000  0.4310000      2.226000  
1 1 1 14 58 8  o 3.405000 0.9396000 2.000000 0.9622000 4.809000 1.614000  -2.809000      1.879000  
1 1 1 14 58 10 o 3.609000 1.014000  3.289000 1.314000  3.930000 1.545000  -0.6412000     2.029000  
1 1 1 14 58 12 o 4.659000 1.060000  5.263000 1.300000  4.055000 1.674000  1.208000       2.120000  
1 1 1 14 58 14 o 6.788000 0.9837000 5.434000 1.354000  8.141000 1.427000  -2.707000      1.967000  
1 1 1 14 58 16 o 2.985000 0.8980000 3.235000 1.252000  2.734000 1.288000  0.5005000      1.796000  
1 1 1 14 59 1  o 3.672000 1.126000  2.678000 1.134000  4.666000 1.946000  -1.988000      2.252000  
1 1 1 14 59 3  o 4.155000 1.103000  3.029000 1.180000  5.280000 1.864000  -2.251000      2.206000  
1 1 1 14 59 5  o 4.276000 1.048000  4.091000 1.248000  4.462000 1.683000  -0.3711000     2.095000  
1 1 1 14 59 7  o 7.020000 0.8301000 7.066000 0.8127000 6.974000 1.448000  0.9238000E-01  1.660000  
1 1 1 14 59 9  f 7.119000 0.8649000 7.387000 0.9058000 6.850000 1.474000  0.5370000      1.730000  
1 1 1 14 59 11 o 4.139000 0.9202000 5.189000 1.164000  3.089000 1.426000  2.100000       1.840000  
1 1 1 14 59 13 o 3.686000 1.117000  3.859000 1.540000  3.512000 1.618000  0.3464000      2.233000  
1 1 1 14 60 0  o 6.790000 1.801000  6.790000 1.801000  6.790000 1.801000  0.000000       0.000000  
1 1 1 14 60 2  o 10.36000 1.028000  10.08000 1.780000  10.64000 1.029000  -0.5661000     2.056000  
1 1 1 14 60 4  o 5.792000 1.192000  4.972000 1.524000  6.611000 1.834000  -1.640000      2.385000  
1 1 1 14 60 6  o 4.396000 1.227000  3.161000 1.253000  5.632000 2.109000  -2.472000      2.454000  
1 1 1 15 0  1  f 43.64000 0.4547000 43.64000 0.4547000 43.64000 0.4547000 0.000000       0.000000  
1 1 1 15 0  3  o 6.494000 0.4574000 6.494000 0.4574000 6.494000 0.4574000 0.000000       0.000000  
1 1 1 15 0  5  o 73.45000 0.8353000 73.45000 0.8353000 73.45000 0.8353000 0.000000       0.000000  
1 1 1 15 0  7  o 6.473000 0.5390000 6.473000 0.5390000 6.473000 0.5390000 0.000000       0.000000  
1 1 1 15 0  9  o 132.8000 1.814000  132.8000 1.814000  132.8000 1.814000  0.000000       0.000000  
1 1 1 15 0  11 o 70.14000 0.6968000 70.14000 0.6968000 70.14000 0.6968000 0.000000       0.000000  
1 1 1 15 0  13 o 135.0000 1.305000  135.0000 1.305000  135.0000 1.305000  0.000000       0.000000  
1 1 1 15 0  15 f 8.843000 0.5816000 8.843000 0.5816000 8.843000 0.5816000 0.000000       0.000000  
1 1 1 15 0  17 o 26.35000 0.4327000 26.35000 0.4327000 26.35000 0.4327000 0.000000       0.000000  
1 1 1 15 0  19 o 41.16000 0.4613000 41.16000 0.4613000 41.16000 0.4613000 0.000000       0.000000  
1 1 1 15 0  21 o 39.29000 0.5209000 39.29000 0.5209000 39.29000 0.5209000 0.000000       0.000000  
1 1 1 15 0  23 o 9.769000 0.6949000 9.769000 0.6949000 9.769000 0.6949000 0.000000       0.000000  
1 1 1 15 0  25 o 90.02000 0.8898000 90.02000 0.8898000 90.02000 0.8898000 0.000000       0.000000  
1 1 1 15 0  27 o 7.037000 1.169000  7.037000 1.169000  7.037000 1.169000  0.000000       0.000000  
1 1 1 15 0  29 o 29.94000 0.4277000 29.94000 0.4277000 29.94000 0.4277000 0.000000       0.000000  
1 1 1 15 0  31 o 31.67000 0.5081000 31.67000 0.5081000 31.67000 0.5081000 0.000000       0.000000  
1 1 1 15 0  33 o 59.76000 0.7226000 59.76000 0.7226000 59.76000 0.7226000 0.000000       0.000000  
1 1 1 15 0  35 o 20.02000 0.4825000 20.02000 0.4825000 20.02000 0.4825000 0.000000       0.000000  
1 1 1 15 0  37 o 10.75000 0.7265000 10.75000 0.7265000 10.75000 0.7265000 0.000000       0.000000  
1 1 1 15 0  39 o 36.14000 0.4767000 36.14000 0.4767000 36.14000 0.4767000 0.000000       0.000000  
1 1 1 15 0  41 o 33.98000 0.5472000 33.98000 0.5472000 33.98000 0.5472000 0.000000       0.000000  
1 1 1 15 0  43 o 29.59000 0.4727000 29.59000 0.4727000 29.59000 0.4727000 0.000000       0.000000  
1 1 1 15 0  45 o 26.40000 0.6753000 26.40000 0.6753000 26.40000 0.6753000 0.000000       0.000000  
1 1 1 15 0  47 o 7.768000 0.9839000 7.768000 0.9839000 7.768000 0.9839000 0.000000       0.000000  
1 1 1 15 0  49 o 5.161000 1.369000  5.161000 1.369000  5.161000 1.369000  0.000000       0.000000  
1 1 1 15 0  51 o 9.670000 0.7882000 9.670000 0.7882000 9.670000 0.7882000 0.000000       0.000000  
1 1 1 15 0  53 o 2.464000 1.130000  2.464000 1.130000  2.464000 1.130000  0.000000       0.000000  
1 1 1 15 0  55 o 3.504000 1.356000  3.504000 1.356000  3.504000 1.356000  0.000000       0.000000  
1 1 1 15 0  57 o 2.614000 1.206000  2.614000 1.206000  2.614000 1.206000  0.000000       0.000000  
1 1 1 15 0  59 o 2.678000 1.231000  2.678000 1.231000  2.678000 1.231000  0.000000       0.000000  
1 1 1 15 0  61 o 4.850000 1.461000  4.850000 1.461000  4.850000 1.461000  0.000000       0.000000  
1 1 1 15 0  63 o 3.771000 1.443000  3.771000 1.443000  3.771000 1.443000  0.000000       0.000000  
1 1 1 15 1  0  o 29.33000 0.3962000 29.33000 0.3962000 29.33000 0.3962000 0.000000       0.000000  
1 1 1 15 1  2  o 51.98000 0.4026000 52.22000 0.5296000 51.73000 0.6066000 0.4911000      0.8053000 
1 1 1 15 1  4  o 108.5000 0.8028000 108.9000 1.055000  108.1000 1.210000  0.8107000      1.606000  
1 1 1 15 1  6  o 68.75000 0.5559000 68.58000 0.7847000 68.91000 0.7875000 -0.3292000     1.112000  
1 1 1 15 1  8  o 21.59000 0.2648000 21.97000 0.3738000 21.21000 0.3752000 0.7622000      0.5296000 
1 1 1 15 1  10 o 65.93000 0.5008000 66.90000 0.6662000 64.96000 0.7480000 1.944000       1.002000  
1 1 1 15 1  12 o 93.52000 0.6460000 92.34000 0.9030000 94.70000 0.9241000 -2.357000      1.292000  
1 1 1 15 1  14 o 61.45000 0.4383000 61.45000 0.6204000 61.45000 0.6194000 -0.4501000E-03 0.8766000 
1 1 1 15 1  16 o 103.1000 0.7675000 102.9000 1.158000  103.3000 1.007000  -0.4674000     1.535000  
1 1 1 15 1  18 o 31.82000 0.2839000 31.76000 0.4008000 31.88000 0.4021000 -0.1139000     0.5677000 
1 1 1 15 1  20 o 49.83000 0.4031000 50.21000 0.5335000 49.44000 0.6045000 0.7696000      0.8062000 
1 1 1 15 1  22 o 80.86000 0.6113000 80.23000 0.9181000 81.50000 0.8074000 -1.275000      1.223000  
1 1 1 15 1  24 o 53.87000 0.4937000 53.94000 0.5699000 53.80000 0.8063000 0.1401000      0.9874000 
1 1 1 15 1  26 o 54.46000 0.4401000 54.59000 0.5757000 54.34000 0.6657000 0.2522000      0.8802000 
1 1 1 15 1  28 o 12.52000 0.4056000 12.95000 0.5536000 12.09000 0.5930000 0.8542000      0.8113000 
1 1 1 15 1  30 o 28.98000 0.3277000 29.02000 0.4224000 28.95000 0.5011000 0.7053000E-01  0.6554000 
1 1 1 15 1  32 o 41.33000 0.3982000 40.81000 0.5595000 41.86000 0.5667000 -1.051000      0.7963000 
1 1 1 15 1  34 o 15.44000 0.3747000 15.63000 0.5238000 15.24000 0.5360000 0.3882000      0.7495000 
1 1 1 15 1  36 o 27.85000 0.3550000 27.51000 0.5034000 28.18000 0.5007000 -0.6702000     0.7100000 
1 1 1 15 1  38 o 37.88000 0.3378000 37.74000 0.4747000 38.01000 0.4808000 -0.2674000     0.6756000 
1 1 1 15 1  40 o 22.36000 0.3457000 21.95000 0.4899000 22.78000 0.4880000 -0.8252000     0.6915000 
1 1 1 15 1  42 o 20.96000 0.3869000 21.70000 0.5859000 20.23000 0.5056000 1.475000       0.7739000 
1 1 1 15 1  44 o 24.20000 0.3665000 24.80000 0.4750000 23.60000 0.5584000 1.203000       0.7331000 
1 1 1 15 1  46 o 24.04000 0.3384000 23.69000 0.4724000 24.40000 0.4846000 -0.7045000     0.6768000 
1 1 1 15 1  48 o 5.547000 0.9953000 6.297000 1.364000  4.798000 1.450000  1.499000       1.991000  
1 1 1 15 1  50 o 7.872000 0.6669000 8.271000 0.8863000 7.472000 0.9968000 0.7995000      1.334000  
1 1 1 15 1  52 o 3.901000 0.9733000 4.145000 1.371000  3.657000 1.382000  0.4879000      1.947000  
1 1 1 15 1  54 o 3.120000 0.9453000 3.121000 1.304000  3.119000 1.369000  0.2280000E-02  1.891000  
1 1 1 15 1  56 o 15.94000 0.5471000 15.64000 0.6818000 16.24000 0.8558000 -0.6023000     1.094000  
1 1 1 15 1  58 o 10.95000 0.5984000 11.09000 0.8559000 10.81000 0.8364000 0.2751000      1.197000  
1 1 1 15 1  60 o 4.697000 1.031000  4.926000 1.466000  4.467000 1.452000  0.4591000      2.063000  
1 1 1 15 1  62 o 4.767000 1.008000  5.120000 1.379000  4.415000 1.472000  0.7055000      2.017000  
1 1 1 15 1  64 f 6.425000 1.001000  5.726000 1.387000  7.123000 1.444000  -1.397000      2.002000  
1 1 1 15 2  1  o 101.7000 0.8071000 103.1000 1.157000  100.3000 1.125000  2.812000       1.614000  
1 1 1 15 2  3  f 69.96000 0.4889000 68.97000 0.6824000 70.95000 0.7004000 -1.984000      0.9779000 
1 1 1 15 2  5  o 107.1000 0.7927000 108.1000 1.049000  106.2000 1.189000  1.994000       1.585000  
1 1 1 15 2  7  f 10.50000 0.2708000 10.21000 0.3822000 10.79000 0.3837000 -0.5851000     0.5416000 
1 1 1 15 2  9  o 113.0000 0.8368000 112.8000 1.093000  113.2000 1.267000  -0.3535000     1.674000  
1 1 1 15 2  11 o 15.53000 0.3277000 14.79000 0.4976000 16.26000 0.4266000 -1.470000      0.6554000 
1 1 1 15 2  13 o 35.77000 0.3346000 35.98000 0.4748000 35.56000 0.4717000 0.4244000      0.6693000 
1 1 1 15 2  15 o 42.99000 0.3298000 43.10000 0.4677000 42.88000 0.4652000 0.2185000      0.6596000 
1 1 1 15 2  17 o 64.99000 0.5011000 64.46000 0.6506000 65.51000 0.7623000 -1.051000      1.002000  
1 1 1 15 2  19 o 94.65000 0.6556000 94.12000 0.9224000 95.18000 0.9318000 -1.055000      1.311000  
1 1 1 15 2  21 o 76.85000 0.6241000 76.58000 0.8795000 77.12000 0.8858000 -0.5439000     1.248000  
1 1 1 15 2  23 o 70.73000 0.5209000 70.33000 0.6343000 71.12000 0.8266000 -0.7843000     1.042000  
1 1 1 15 2  25 o 22.70000 0.3287000 22.58000 0.4227000 22.83000 0.5034000 -0.2527000     0.6573000 
1 1 1 15 2  27 o 40.61000 0.3364000 40.48000 0.4777000 40.74000 0.4737000 -0.2519000     0.6727000 
1 1 1 15 2  29 o 63.49000 0.5008000 62.83000 0.6495000 64.15000 0.7625000 -1.320000      1.002000  
1 1 1 15 2  31 o 43.99000 0.3553000 44.48000 0.5049000 43.50000 0.4999000 0.9791000      0.7105000 
1 1 1 15 2  33 o 40.59000 0.3690000 39.51000 0.4698000 41.66000 0.5691000 -2.144000      0.7380000 
1 1 1 15 2  35 o 53.73000 0.4413000 53.57000 0.5787000 53.89000 0.6663000 -0.3213000     0.8825000 
1 1 1 15 2  37 o 25.54000 0.3162000 25.79000 0.4458000 25.28000 0.4484000 0.5034000      0.6323000 
1 1 1 15 2  39 o 30.88000 0.3288000 30.42000 0.4616000 31.34000 0.4682000 -0.9230000     0.6575000 
1 1 1 15 2  41 o 26.47000 0.3572000 26.33000 0.4795000 26.62000 0.5294000 -0.2962000     0.7143000 
1 1 1 15 2  43 o 24.25000 0.4013000 24.76000 0.5636000 23.74000 0.5714000 1.028000       0.8026000 
1 1 1 15 2  45 o 17.34000 0.4528000 17.54000 0.6261000 17.13000 0.6543000 0.4098000      0.9056000 
1 1 1 15 2  47 o 35.14000 0.3383000 35.16000 0.4791000 35.12000 0.4778000 0.4100000E-01  0.6766000 
1 1 1 15 2  49 o 4.074000 0.9222000 2.861000 1.274000  5.286000 1.334000  -2.425000      1.844000  
1 1 1 15 2  51 o 3.953000 0.9669000 4.016000 1.370000  3.890000 1.365000  0.1263000      1.934000  
1 1 1 15 2  53 o 9.896000 0.5594000 9.170000 0.7583000 10.62000 0.8226000 -1.451000      1.119000  
1 1 1 15 2  55 o 3.664000 1.002000  4.069000 1.503000  3.259000 1.324000  0.8098000      2.003000  
1 1 1 15 2  57 o 8.324000 0.7327000 8.798000 1.056000  7.850000 1.016000  0.9471000      1.465000  
1 1 1 15 2  59 o 4.273000 1.008000  4.931000 1.425000  3.615000 1.427000  1.316000       2.017000  
1 1 1 15 2  61 o 8.462000 0.6993000 9.021000 0.8753000 7.903000 1.091000  1.118000       1.399000  
1 1 1 15 2  63 o 6.592000 0.8855000 5.653000 1.309000  7.531000 1.193000  -1.878000      1.771000  
1 1 1 15 3  0  o 105.7000 1.026000  105.7000 1.026000  105.7000 1.026000  0.000000       0.000000  
1 1 1 15 3  2  o 27.98000 0.3132000 28.14000 0.4908000 27.83000 0.3894000 0.3076000      0.6265000 
1 1 1 15 3  4  o 86.20000 0.5957000 86.35000 0.8442000 86.05000 0.8407000 0.3031000      1.191000  
1 1 1 15 3  6  o 50.91000 0.3679000 51.09000 0.5225000 50.74000 0.5180000 0.3512000      0.7357000 
1 1 1 15 3  8  o 86.27000 0.5965000 85.91000 0.8403000 86.63000 0.8468000 -0.7243000     1.193000  
1 1 1 15 3  10 o 112.1000 0.7687000 111.6000 1.082000  112.7000 1.092000  -1.166000      1.537000  
1 1 1 15 3  12 o 67.99000 0.5172000 68.29000 0.6803000 67.68000 0.7791000 0.6076000      1.034000  
1 1 1 15 3  14 o 74.25000 0.5624000 74.45000 0.7383000 74.06000 0.8485000 0.3861000      1.125000  
1 1 1 15 3  16 o 76.94000 0.6955000 77.37000 1.081000  76.51000 0.8753000 0.8566000      1.391000  
1 1 1 15 3  18 o 99.47000 0.7427000 99.19000 0.9689000 99.75000 1.126000  -0.5629000     1.485000  
1 1 1 15 3  20 o 26.10000 0.3015000 26.52000 0.4066000 25.69000 0.4454000 0.8299000      0.6031000 
1 1 1 15 3  22 o 69.91000 0.5387000 68.75000 0.6924000 71.07000 0.8253000 -2.323000      1.077000  
1 1 1 15 3  24 o 93.09000 0.7653000 93.27000 0.8207000 92.92000 1.292000  0.3528000      1.531000  
1 1 1 15 3  26 o 14.78000 0.3532000 14.85000 0.4918000 14.72000 0.5070000 0.1212000      0.7064000 
1 1 1 15 3  28 f 15.00000 0.3902000 14.32000 0.5016000 15.69000 0.5978000 -1.372000      0.7804000 
1 1 1 15 3  30 o 38.92000 0.3320000 38.94000 0.4663000 38.91000 0.4728000 0.3104000E-01  0.6640000 
1 1 1 15 3  32 o 33.29000 0.4197000 33.06000 0.6571000 33.51000 0.5224000 -0.4432000     0.8394000 
1 1 1 15 3  34 o 34.76000 0.3215000 35.13000 0.4587000 34.40000 0.4506000 0.7296000      0.6430000 
1 1 1 15 3  36 o 14.62000 0.4520000 14.04000 0.6568000 15.21000 0.6212000 -1.167000      0.9041000 
1 1 1 15 3  38 o 37.58000 0.3656000 37.04000 0.4714000 38.11000 0.5589000 -1.072000      0.7312000 
1 1 1 15 3  40 o 26.42000 0.3536000 26.42000 0.4704000 26.41000 0.5280000 0.9342000E-02  0.7071000 
1 1 1 15 3  42 o 20.36000 0.3719000 19.83000 0.5267000 20.88000 0.5252000 -1.052000      0.7438000 
1 1 1 15 3  44 f 3.606000 1.002000  3.994000 1.479000  3.218000 1.353000  0.7762000      2.004000  
1 1 1 15 3  46 o 7.300000 0.8644000 7.121000 1.327000  7.479000 1.108000  -0.3575000     1.729000  
1 1 1 15 3  48 o 20.40000 0.3802000 20.48000 0.5418000 20.33000 0.5334000 0.1485000      0.7603000 
1 1 1 15 3  50 o 9.866000 0.5280000 10.30000 0.7245000 9.433000 0.7683000 0.8676000      1.056000  
1 1 1 15 3  52 o 9.711000 0.5363000 10.26000 0.7211000 9.162000 0.7941000 1.099000       1.073000  
1 1 1 15 3  54 o 7.361000 0.7297000 7.549000 1.001000  7.172000 1.062000  0.3772000      1.459000  
1 1 1 15 3  56 f 2.888000 0.9028000 2.550000 1.162000  3.226000 1.382000  -0.6761000     1.806000  
1 1 1 15 3  58 o 5.038000 1.126000  5.051000 1.763000  5.025000 1.401000  0.2654000E-01  2.252000  
1 1 1 15 3  60 o 4.694000 1.031000  5.388000 1.503000  3.999000 1.411000  1.388000       2.062000  
1 1 1 15 3  62 o 3.123000 0.9350000 2.901000 1.295000  3.346000 1.349000  -0.4449000     1.870000  
1 1 1 15 3  64 o 7.171000 0.7826000 7.266000 1.128000  7.076000 1.085000  0.1905000      1.565000  
1 1 1 15 4  1  o 188.7000 1.481000  188.3000 2.089000  189.1000 2.100000  -0.8785000     2.962000  
1 1 1 15 4  3  o 62.26000 0.5078000 62.75000 0.7235000 61.78000 0.7127000 0.9686000      1.016000  
1 1 1 15 4  5  o 62.24000 0.4393000 61.95000 0.6195000 62.54000 0.6231000 -0.5913000     0.8787000 
1 1 1 15 4  7  o 177.4000 1.206000  176.6000 1.699000  178.1000 1.713000  -1.529000      2.413000  
1 1 1 15 4  9  o 73.13000 0.5110000 73.18000 0.7231000 73.08000 0.7221000 0.1016000      1.022000  
1 1 1 15 4  11 o 76.87000 0.5358000 76.07000 0.7507000 77.66000 0.7647000 -1.598000      1.072000  
1 1 1 15 4  13 o 31.46000 0.2693000 31.17000 0.3781000 31.75000 0.3835000 -0.5805000     0.5385000 
1 1 1 15 4  15 o 24.66000 0.2946000 24.24000 0.4038000 25.09000 0.4291000 -0.8446000     0.5893000 
1 1 1 15 4  17 o 16.06000 0.3497000 15.78000 0.4066000 16.34000 0.5690000 -0.5584000     0.6993000 
1 1 1 15 4  19 o 87.43000 0.6568000 87.39000 0.8602000 87.46000 0.9927000 -0.6849000E-01 1.314000  
1 1 1 15 4  21 o 93.28000 0.6993000 94.11000 0.9238000 92.45000 1.050000  1.658000       1.399000  
1 1 1 15 4  23 o 33.62000 0.3596000 33.54000 0.3781000 33.70000 0.6118000 -0.1631000     0.7192000 
1 1 1 15 4  25 o 87.21000 0.6297000 87.36000 0.7717000 87.07000 0.9953000 0.2930000      1.259000  
1 1 1 15 4  27 o 58.54000 0.4666000 58.29000 0.6057000 58.79000 0.7099000 -0.4918000     0.9332000 
1 1 1 15 4  29 o 47.68000 0.4003000 47.97000 0.6025000 47.39000 0.5272000 0.5795000      0.8005000 
1 1 1 15 4  31 o 27.39000 0.2990000 27.07000 0.4166000 27.71000 0.4291000 -0.6444000     0.5981000 
1 1 1 15 4  33 o 64.42000 0.5440000 64.64000 0.7696000 64.20000 0.7691000 0.4470000      1.088000  
1 1 1 15 4  35 o 28.97000 0.3631000 29.13000 0.5241000 28.82000 0.5028000 0.3082000      0.7263000 
1 1 1 15 4  37 o 10.71000 0.5226000 10.60000 0.7386000 10.83000 0.7394000 -0.2243000     1.045000  
1 1 1 15 4  39 o 10.39000 0.6019000 10.63000 0.7538000 10.14000 0.9385000 0.4857000      1.204000  
1 1 1 15 4  41 o 24.60000 0.3394000 24.88000 0.4779000 24.32000 0.4820000 0.5633000      0.6787000 
1 1 1 15 4  43 o 31.94000 0.3317000 32.14000 0.4652000 31.73000 0.4729000 0.4123000      0.6634000 
1 1 1 15 4  45 o 28.77000 0.3832000 28.68000 0.5547000 28.87000 0.5289000 -0.1921000     0.7664000 
1 1 1 15 4  47 o 29.63000 0.3585000 29.14000 0.5536000 30.11000 0.4557000 -0.9742000     0.7171000 
1 1 1 15 4  49 o 18.06000 0.3605000 17.84000 0.5143000 18.27000 0.5054000 -0.4354000     0.7211000 
1 1 1 15 4  51 o 6.730000 0.7772000 6.432000 1.163000  7.028000 1.031000  -0.5960000     1.554000  
1 1 1 15 4  53 o 17.21000 0.3667000 16.86000 0.5307000 17.55000 0.5061000 -0.6890000     0.7333000 
1 1 1 15 4  55 o 16.88000 0.3788000 17.03000 0.5289000 16.73000 0.5424000 0.3039000      0.7575000 
1 1 1 15 4  57 o 4.560000 0.9719000 4.263000 1.357000  4.858000 1.392000  -0.5945000     1.944000  
1 1 1 15 4  59 o 4.733000 1.012000  4.289000 1.422000  5.178000 1.440000  -0.8889000     2.024000  
1 1 1 15 4  61 o 6.277000 0.9395000 7.017000 1.141000  5.537000 1.493000  1.481000       1.879000  
1 1 1 15 4  63 f 5.385000 1.081000  4.822000 1.457000  5.948000 1.598000  -1.126000      2.163000  
1 1 1 15 5  0  o 66.39000 0.6588000 66.39000 0.6588000 66.39000 0.6588000 0.000000       0.000000  
1 1 1 15 5  2  o 145.6000 0.9924000 145.7000 1.405000  145.5000 1.402000  0.2891000      1.985000  
1 1 1 15 5  4  o 134.2000 1.183000  133.9000 1.829000  134.5000 1.499000  -0.5746000     2.365000  
1 1 1 15 5  6  o 13.38000 0.2698000 13.41000 0.4172000 13.35000 0.3423000 0.5928000E-01  0.5397000 
1 1 1 15 5  8  o 67.98000 0.5158000 67.88000 0.7802000 68.08000 0.6750000 -0.1914000     1.032000  
1 1 1 15 5  10 o 72.92000 0.5095000 73.30000 0.7245000 72.54000 0.7166000 0.7585000      1.019000  
1 1 1 15 5  12 o 21.18000 0.2605000 21.07000 0.3873000 21.29000 0.3483000 -0.2167000     0.5209000 
1 1 1 15 5  14 o 30.80000 0.2890000 30.93000 0.4355000 30.66000 0.3800000 0.2719000      0.5780000 
1 1 1 15 5  16 o 57.13000 0.4493000 56.64000 0.5817000 57.62000 0.6849000 -0.9770000     0.8986000 
1 1 1 15 5  18 o 104.8000 0.7807000 104.4000 1.018000  105.2000 1.184000  -0.7773000     1.561000  
1 1 1 15 5  20 o 59.74000 0.6770000 60.44000 0.6178000 59.05000 1.205000  1.394000       1.354000  
1 1 1 15 5  22 o 41.52000 0.4088000 40.90000 0.4612000 42.15000 0.6750000 -1.253000      0.8175000 
1 1 1 15 5  24 o 31.09000 0.3061000 30.97000 0.3725000 31.21000 0.4857000 -0.2457000     0.6121000 
1 1 1 15 5  26 o 70.93000 0.5477000 71.12000 0.7160000 70.75000 0.8289000 0.3698000      1.095000  
1 1 1 15 5  28 o 30.59000 0.3039000 30.41000 0.4252000 30.77000 0.4342000 -0.3627000     0.6077000 
1 1 1 15 5  30 o 42.70000 0.3728000 42.90000 0.5587000 42.50000 0.4936000 0.3940000      0.7456000 
1 1 1 15 5  32 o 31.20000 0.3530000 31.23000 0.4911000 31.17000 0.5072000 0.6044000E-01  0.7060000 
1 1 1 15 5  34 o 29.59000 0.3388000 29.49000 0.5186000 29.69000 0.4363000 -0.2000000     0.6777000 
1 1 1 15 5  36 o 45.33000 0.3972000 46.36000 0.6057000 44.29000 0.5139000 2.077000       0.7944000 
1 1 1 15 5  38 o 23.21000 0.3567000 22.44000 0.4603000 23.99000 0.5451000 -1.548000      0.7134000 
1 1 1 15 5  40 o 24.72000 0.3365000 24.60000 0.4796000 24.83000 0.4721000 -0.2374000     0.6730000 
1 1 1 15 5  42 o 34.48000 0.3681000 34.36000 0.4786000 34.59000 0.5594000 -0.2298000     0.7362000 
1 1 1 15 5  44 o 26.87000 0.3638000 26.63000 0.5534000 27.11000 0.4722000 -0.4834000     0.7275000 
1 1 1 15 5  46 f 35.51000 0.3392000 35.60000 0.4830000 35.42000 0.4763000 0.1795000      0.6784000 
1 1 1 15 5  48 o 15.47000 0.4298000 15.52000 0.5922000 15.42000 0.6230000 0.9825000E-01  0.8596000 
1 1 1 15 5  50 o 11.10000 0.4723000 11.55000 0.6345000 10.65000 0.6999000 0.9002000      0.9447000 
1 1 1 15 5  52 o 18.82000 0.3408000 18.85000 0.4886000 18.79000 0.4753000 0.5773000E-01  0.6817000 
1 1 1 15 5  54 o 6.426000 0.8851000 7.053000 1.074000  5.799000 1.407000  1.254000       1.770000  
1 1 1 15 5  56 f 3.415000 0.9878000 3.702000 1.462000  3.128000 1.329000  0.5748000      1.976000  
1 1 1 15 5  58 o 6.076000 0.9312000 5.170000 1.534000  6.982000 1.057000  -1.812000      1.862000  
1 1 1 15 5  60 o 7.869000 0.7318000 7.384000 1.186000  8.354000 0.8581000 -0.9693000     1.464000  
1 1 1 15 5  62 o 6.946000 0.8830000 6.833000 1.241000  7.059000 1.257000  -0.2253000     1.766000  
1 1 1 15 5  64 o 3.820000 0.9585000 2.410000 1.149000  5.231000 1.534000  -2.821000      1.917000  
1 1 1 15 6  1  o 184.2000 1.252000  185.3000 1.782000  183.1000 1.760000  2.211000       2.505000  
1 1 1 15 6  3  o 68.01000 0.5162000 67.82000 0.7806000 68.21000 0.6757000 -0.3850000     1.032000  
1 1 1 15 6  5  o 88.61000 0.7909000 88.17000 1.222000  89.05000 1.005000  -0.8828000     1.582000  
1 1 1 15 6  7  o 114.8000 0.9086000 114.4000 1.282000  115.1000 1.288000  -0.6946000     1.817000  
1 1 1 15 6  9  o 81.63000 0.6118000 81.13000 0.9212000 82.13000 0.8053000 -1.001000      1.224000  
1 1 1 15 6  11 o 80.41000 0.6049000 80.51000 0.9159000 80.31000 0.7903000 0.1965000      1.210000  
1 1 1 15 6  13 o 49.05000 0.3903000 48.68000 0.5858000 49.42000 0.5158000 -0.7383000     0.7805000 
1 1 1 15 6  15 o 79.78000 0.5566000 79.51000 0.7848000 80.06000 0.7896000 -0.5535000     1.113000  
1 1 1 15 6  17 o 11.19000 0.4092000 11.07000 0.5195000 11.30000 0.6322000 -0.2287000     0.8183000 
1 1 1 15 6  19 o 36.79000 0.3695000 37.12000 0.4353000 36.45000 0.5972000 0.6628000      0.7390000 
1 1 1 15 6  21 o 84.23000 0.6955000 84.67000 0.7490000 83.79000 1.172000  0.8758000      1.391000  
1 1 1 15 6  23 o 27.47000 0.3014000 27.17000 0.3611000 27.76000 0.4827000 -0.5852000     0.6028000 
1 1 1 15 6  25 o 52.04000 0.4232000 51.65000 0.5440000 52.42000 0.6485000 -0.7692000     0.8465000 
1 1 1 15 6  27 o 39.75000 0.3570000 39.91000 0.4660000 39.60000 0.5409000 0.3096000      0.7139000 
1 1 1 15 6  29 o 25.41000 0.2932000 25.30000 0.4067000 25.53000 0.4226000 -0.2301000     0.5865000 
1 1 1 15 6  31 o 17.41000 0.3647000 17.27000 0.5582000 17.55000 0.4696000 -0.2803000     0.7294000 
1 1 1 15 6  33 o 27.33000 0.3345000 27.53000 0.4271000 27.13000 0.5150000 0.4002000      0.6691000 
1 1 1 15 6  35 o 53.30000 0.4721000 52.64000 0.6610000 53.96000 0.6743000 -1.322000      0.9443000 
1 1 1 15 6  37 o 45.35000 0.3988000 44.97000 0.5159000 45.74000 0.6083000 -0.7711000     0.7976000 
1 1 1 15 6  39 o 40.66000 0.3546000 40.35000 0.4941000 40.97000 0.5087000 -0.6149000     0.7091000 
1 1 1 15 6  41 o 16.85000 0.4331000 16.59000 0.5715000 17.10000 0.6509000 -0.5026000     0.8662000 
1 1 1 15 6  43 o 11.92000 0.5046000 11.71000 0.7465000 12.14000 0.6793000 -0.4300000     1.009000  
1 1 1 15 6  45 o 6.672000 1.092000  6.347000 1.694000  6.997000 1.379000  -0.6493000     2.184000  
1 1 1 15 6  47 o 17.33000 0.3613000 17.10000 0.5330000 17.56000 0.4879000 -0.4527000     0.7226000 
1 1 1 15 6  49 o 12.08000 0.4651000 12.56000 0.6482000 11.61000 0.6672000 0.9441000      0.9303000 
1 1 1 15 6  51 o 16.86000 0.4124000 16.52000 0.5761000 17.20000 0.5902000 -0.6772000     0.8248000 
1 1 1 15 6  53 o 10.11000 0.5056000 10.72000 0.7126000 9.512000 0.7175000 1.205000       1.011000  
1 1 1 15 6  55 o 11.93000 0.4782000 12.13000 0.6735000 11.73000 0.6789000 0.4047000      0.9563000 
1 1 1 15 6  57 o 4.174000 1.067000  4.629000 1.573000  3.719000 1.441000  0.9099000      2.133000  
1 1 1 15 6  59 o 7.087000 0.9161000 6.518000 1.466000  7.656000 1.099000  -1.138000      1.832000  
1 1 1 15 6  61 o 11.49000 0.5335000 10.61000 0.8148000 12.37000 0.6890000 -1.765000      1.067000  
1 1 1 15 6  63 o 5.053000 1.058000  5.439000 1.572000  4.667000 1.417000  0.7721000      2.116000  
1 1 1 15 7  0  o 11.25000 0.4342000 11.25000 0.4342000 11.25000 0.4342000 0.000000       0.000000  
1 1 1 15 7  2  o 91.79000 0.6847000 92.33000 1.041000  91.26000 0.8898000 1.068000       1.369000  
1 1 1 15 7  4  o 98.36000 0.6764000 99.13000 0.9635000 97.58000 0.9495000 1.557000       1.353000  
1 1 1 15 7  6  o 36.14000 0.2823000 35.90000 0.3965000 36.38000 0.4018000 -0.4833000     0.5645000 
1 1 1 15 7  8  o 35.68000 0.3252000 35.24000 0.4532000 36.12000 0.4665000 -0.8827000     0.6504000 
1 1 1 15 7  10 o 75.60000 0.5707000 75.74000 0.8645000 75.45000 0.7454000 0.2965000      1.141000  
1 1 1 15 7  12 o 76.00000 0.5743000 75.48000 0.8649000 76.53000 0.7559000 -1.054000      1.149000  
1 1 1 15 7  14 o 11.59000 0.3551000 11.71000 0.5412000 11.47000 0.4600000 0.2407000      0.7103000 
1 1 1 15 7  16 o 9.470000 0.4004000 9.645000 0.5680000 9.295000 0.5644000 0.3501000      0.8007000 
1 1 1 15 7  18 o 29.25000 0.3911000 29.25000 0.3911000 ?        ?         ?              ?         
1 1 1 15 7  20 o 59.06000 0.4449000 58.67000 0.5389000 59.46000 0.7081000 -0.7919000     0.8899000 
1 1 1 15 7  22 o 18.03000 0.3275000 17.71000 0.3990000 18.36000 0.5194000 -0.6574000     0.6550000 
1 1 1 15 7  24 o 32.80000 0.3919000 32.32000 0.4841000 33.27000 0.6165000 -0.9490000     0.7838000 
1 1 1 15 7  26 o 44.07000 0.3615000 44.55000 0.4427000 43.58000 0.5717000 0.9669000      0.7231000 
1 1 1 15 7  28 o 76.79000 0.5445000 76.96000 0.7678000 76.61000 0.7722000 0.3468000      1.089000  
1 1 1 15 7  30 o 22.41000 0.3020000 22.43000 0.4163000 22.38000 0.4376000 0.5075000E-01  0.6040000 
1 1 1 15 7  32 o 18.02000 0.4192000 18.15000 0.6253000 17.88000 0.5584000 0.2784000      0.8383000 
1 1 1 15 7  34 o 30.01000 0.3120000 29.86000 0.4348000 30.16000 0.4477000 -0.3022000     0.6241000 
1 1 1 15 7  36 o 60.92000 0.4894000 61.67000 0.7426000 60.17000 0.6376000 1.501000       0.9788000 
1 1 1 15 7  38 o 54.07000 0.4155000 54.05000 0.5821000 54.09000 0.5929000 -0.4638000E-01 0.8309000 
1 1 1 15 7  40 o 42.48000 0.3913000 42.42000 0.5069000 42.55000 0.5963000 -0.1333000     0.7826000 
1 1 1 15 7  42 f 4.747000 1.056000  4.362000 1.489000  5.132000 1.498000  -0.7701000     2.112000  
1 1 1 15 7  44 f 38.99000 0.3515000 39.12000 0.4970000 38.86000 0.4972000 0.2584000      0.7030000 
1 1 1 15 7  46 o 18.73000 0.3969000 19.20000 0.5960000 18.27000 0.5243000 0.9291000      0.7938000 
1 1 1 15 7  48 o 10.61000 0.5655000 10.36000 0.8516000 10.86000 0.7442000 -0.5029000     1.131000  
1 1 1 15 7  50 o 10.94000 0.4980000 11.16000 0.6570000 10.72000 0.7487000 0.4348000      0.9961000 
1 1 1 15 7  52 o 15.91000 0.3657000 16.07000 0.5101000 15.75000 0.5242000 0.3251000      0.7315000 
1 1 1 15 7  54 o 6.701000 0.7934000 6.619000 1.116000  6.783000 1.128000  -0.1636000     1.587000  
1 1 1 15 7  56 o 12.01000 0.5299000 12.25000 0.7735000 11.77000 0.7245000 0.4830000      1.060000  
1 1 1 15 7  58 o 4.776000 0.9771000 5.478000 1.290000  4.074000 1.468000  1.403000       1.954000  
1 1 1 15 7  60 o 3.052000 0.9299000 3.178000 1.326000  2.926000 1.304000  0.2526000      1.860000  
1 1 1 15 7  62 o 9.487000 0.7834000 11.19000 1.136000  7.784000 1.079000  3.405000       1.567000  
1 1 1 15 7  64 o 8.461000 0.8382000 7.239000 1.189000  9.683000 1.182000  -2.444000      1.676000  
1 1 1 15 8  1  f 154.9000 1.220000  155.5000 1.733000  154.2000 1.717000  1.216000       2.440000  
1 1 1 15 8  3  o 65.86000 0.4628000 65.37000 0.6500000 66.35000 0.6590000 -0.9840000     0.9256000 
1 1 1 15 8  5  o 81.68000 0.6116000 81.33000 0.9217000 82.03000 0.8043000 -0.6995000     1.223000  
1 1 1 15 8  7  o 28.82000 0.2494000 28.82000 0.3517000 28.83000 0.3536000 -0.1749000E-01 0.4987000 
1 1 1 15 8  9  o 29.37000 0.2552000 29.40000 0.3614000 29.33000 0.3606000 0.6904000E-01  0.5105000 
1 1 1 15 8  11 o 76.89000 0.6198000 76.99000 0.8763000 76.79000 0.8766000 0.2047000      1.240000  
1 1 1 15 8  13 o 69.86000 0.6024000 69.22000 0.9793000 70.49000 0.7018000 -1.274000      1.205000  
1 1 1 15 8  15 o 64.37000 0.4965000 63.34000 0.7441000 65.40000 0.6575000 -2.058000      0.9930000 
1 1 1 15 8  17 o 70.68000 0.5383000 71.17000 0.7104000 70.18000 0.8089000 0.9836000      1.077000  
1 1 1 15 8  19 o 12.02000 0.3812000 11.97000 0.4132000 12.06000 0.6408000 -0.9453000E-01 0.7625000 
1 1 1 15 8  21 o 31.32000 0.2992000 31.19000 0.3592000 31.45000 0.4787000 -0.2615000     0.5985000 
1 1 1 15 8  23 o 59.50000 0.4695000 59.57000 0.6096000 59.42000 0.7142000 0.1575000      0.9389000 
1 1 1 15 8  25 o 10.40000 0.4478000 10.09000 0.5346000 10.71000 0.7186000 -0.6185000     0.8957000 
1 1 1 15 8  27 o 43.36000 0.3581000 43.41000 0.4364000 43.31000 0.5678000 0.1030000      0.7161000 
1 1 1 15 8  29 o 14.62000 0.3513000 14.08000 0.4902000 15.15000 0.5034000 -1.074000      0.7027000 
1 1 1 15 8  31 o 28.09000 0.3205000 28.03000 0.4718000 28.14000 0.4340000 -0.1100000     0.6411000 
1 1 1 15 8  33 o 9.508000 0.5747000 9.648000 0.6999000 9.368000 0.9118000 0.2798000      1.149000  
1 1 1 15 8  35 o 9.994000 0.5717000 8.799000 0.8235000 11.19000 0.7934000 -2.390000      1.143000  
1 1 1 15 8  37 o 39.44000 0.3464000 39.58000 0.4895000 39.30000 0.4903000 0.2768000      0.6928000 
1 1 1 15 8  39 o 14.89000 0.4191000 15.50000 0.5673000 14.27000 0.6171000 1.231000       0.8383000 
1 1 1 15 8  41 o 5.221000 1.028000  4.551000 1.468000  5.891000 1.439000  -1.339000      2.055000  
1 1 1 15 8  43 f 15.53000 0.4071000 14.99000 0.6021000 16.07000 0.5482000 -1.076000      0.8143000 
1 1 1 15 8  45 o 4.442000 1.021000  3.134000 1.386000  5.750000 1.499000  -2.616000      2.041000  
1 1 1 15 8  47 o 8.516000 0.6403000 8.736000 0.9409000 8.295000 0.8687000 0.4415000      1.281000  
1 1 1 15 8  49 o 10.89000 0.5305000 11.07000 0.8048000 10.70000 0.6914000 0.3711000      1.061000  
1 1 1 15 8  51 o 19.50000 0.3378000 19.19000 0.4893000 19.81000 0.4658000 -0.6197000     0.6755000 
1 1 1 15 8  53 o 11.17000 0.4857000 11.34000 0.6728000 10.99000 0.7006000 0.3531000      0.9713000 
1 1 1 15 8  55 o 5.117000 0.9367000 3.904000 1.434000  6.331000 1.206000  -2.427000      1.873000  
1 1 1 15 8  57 o 8.476000 0.6836000 7.478000 1.064000  9.474000 0.8582000 -1.996000      1.367000  
1 1 1 15 8  59 o 3.317000 0.9603000 3.795000 1.429000  2.839000 1.283000  0.9559000      1.921000  
1 1 1 15 8  61 o 5.089000 1.200000  6.007000 1.822000  4.170000 1.561000  1.836000       2.399000  
1 1 1 15 8  63 o 3.478000 1.050000  3.313000 1.443000  3.644000 1.526000  -0.3307000     2.101000  
1 1 1 15 9  0  o 85.85000 0.9717000 85.85000 0.9717000 85.85000 0.9717000 0.000000       0.000000  
1 1 1 15 9  2  o 87.51000 0.6044000 87.22000 0.8518000 87.81000 0.8576000 -0.5841000     1.209000  
1 1 1 15 9  4  o 57.92000 0.4118000 57.26000 0.5758000 58.59000 0.5890000 -1.323000      0.8237000 
1 1 1 15 9  6  o 63.56000 0.4857000 63.19000 0.7310000 63.92000 0.6397000 -0.7307000     0.9714000 
1 1 1 15 9  8  o 39.30000 0.3023000 39.47000 0.4286000 39.14000 0.4266000 0.3288000      0.6047000 
1 1 1 15 9  10 o 18.25000 0.2762000 18.41000 0.3323000 18.08000 0.4413000 0.3296000      0.5524000 
1 1 1 15 9  12 o 103.7000 0.7692000 102.1000 1.146000  105.3000 1.026000  -3.236000      1.538000  
1 1 1 15 9  14 o 61.32000 0.5075000 61.56000 0.7195000 61.07000 0.7159000 0.4930000      1.015000  
1 1 1 15 9  16 o 24.72000 0.3109000 25.13000 0.4612000 24.31000 0.4171000 0.8189000      0.6218000 
1 1 1 15 9  18 o 54.60000 0.6208000 55.14000 0.5082000 54.05000 1.133000  1.089000       1.242000  
1 1 1 15 9  20 o 37.10000 0.3361000 37.43000 0.4383000 36.78000 0.5098000 0.6506000      0.6723000 
1 1 1 15 9  22 o 64.11000 0.5311000 64.41000 0.7482000 63.80000 0.7539000 0.6161000      1.062000  
1 1 1 15 9  24 o 31.63000 0.3064000 31.12000 0.3613000 32.15000 0.4950000 -1.026000      0.6128000 
1 1 1 15 9  26 o 68.42000 0.5074000 68.06000 0.6147000 68.78000 0.8075000 -0.7129000     1.015000  
1 1 1 15 9  28 o 3.838000 1.021000  3.126000 1.233000  4.549000 1.628000  -1.423000      2.042000  
1 1 1 15 9  30 o 4.278000 0.9308000 4.265000 1.298000  4.291000 1.334000  -0.2657000E-01 1.862000  
1 1 1 15 9  32 o 23.38000 0.3338000 22.66000 0.4218000 24.09000 0.5176000 -1.426000      0.6677000 
1 1 1 15 9  34 o 21.37000 0.3449000 20.81000 0.4307000 21.94000 0.5389000 -1.128000      0.6899000 
1 1 1 15 9  36 o 15.36000 0.4607000 15.54000 0.6517000 15.18000 0.6514000 0.3683000      0.9215000 
1 1 1 15 9  38 f 12.10000 0.4943000 12.30000 0.6624000 11.90000 0.7339000 0.4015000      0.9887000 
1 1 1 15 9  40 o 20.91000 0.3588000 21.19000 0.4966000 20.64000 0.5182000 0.5435000      0.7177000 
1 1 1 15 9  42 o 15.37000 0.4277000 15.40000 0.5793000 15.34000 0.6294000 0.6777000E-01  0.8555000 
1 1 1 15 9  44 o 6.030000 0.9521000 6.111000 1.342000  5.949000 1.351000  0.1621000      1.904000  
1 1 1 15 9  46 o 12.08000 0.5026000 12.54000 0.7642000 11.62000 0.6529000 0.9189000      1.005000  
1 1 1 15 9  48 o 10.93000 0.5394000 10.43000 0.7594000 11.42000 0.7663000 -0.9934000     1.079000  
1 1 1 15 9  50 o 13.76000 0.4145000 13.72000 0.5768000 13.81000 0.5953000 -0.8932000E-01 0.8289000 
1 1 1 15 9  52 o 8.512000 0.6762000 8.926000 0.7910000 8.097000 1.097000  0.8291000      1.352000  
1 1 1 15 9  54 o 5.280000 0.8817000 3.936000 1.358000  6.624000 1.125000  -2.688000      1.763000  
1 1 1 15 9  56 o 4.979000 0.9820000 4.651000 1.498000  5.307000 1.270000  -0.6565000     1.964000  
1 1 1 15 9  58 o 3.695000 1.041000  3.911000 1.560000  3.478000 1.379000  0.4336000      2.082000  
1 1 1 15 9  60 o 6.393000 1.021000  7.056000 1.363000  5.731000 1.520000  1.325000       2.041000  
1 1 1 15 9  62 o 3.730000 1.027000  4.547000 1.552000  2.912000 1.346000  1.634000       2.055000  
1 1 1 15 9  64 o 4.202000 1.201000  4.010000 1.632000  4.394000 1.763000  -0.3844000     2.403000  
1 1 1 15 10 1  o 79.98000 0.5996000 81.05000 0.7941000 78.90000 0.8986000 2.143000       1.199000  
1 1 1 15 10 3  o 73.77000 0.5139000 73.29000 0.7226000 74.25000 0.7309000 -0.9513000     1.028000  
1 1 1 15 10 5  f 101.5000 0.6984000 101.3000 0.9849000 101.7000 0.9904000 -0.3830000     1.397000  
1 1 1 15 10 7  o 80.51000 0.5595000 79.63000 0.7832000 81.39000 0.7993000 -1.765000      1.119000  
1 1 1 15 10 9  o 24.67000 0.2535000 24.78000 0.3772000 24.56000 0.3387000 0.2199000      0.5069000 
1 1 1 15 10 11 f 70.44000 0.5333000 70.35000 0.8037000 70.53000 0.7012000 -0.1815000     1.067000  
1 1 1 15 10 13 o 61.56000 0.4738000 61.35000 0.6195000 61.77000 0.7171000 -0.4197000     0.9476000 
1 1 1 15 10 15 o 72.25000 0.5486000 72.74000 0.7263000 71.76000 0.8224000 0.9750000      1.097000  
1 1 1 15 10 17 o 91.48000 1.045000  90.90000 1.031000  92.06000 1.818000  -1.158000      2.090000  
1 1 1 15 10 19 o 43.84000 0.4082000 43.75000 0.4254000 43.93000 0.6968000 -0.1779000     0.8164000 
1 1 1 15 10 21 o 22.12000 0.3235000 21.80000 0.4477000 22.45000 0.4671000 -0.6452000     0.6470000 
1 1 1 15 10 23 o 70.14000 0.5166000 70.51000 0.6327000 69.78000 0.8167000 0.7298000      1.033000  
1 1 1 15 10 25 o 19.51000 0.3048000 19.18000 0.3581000 19.84000 0.4933000 -0.6610000     0.6096000 
1 1 1 15 10 27 o 23.12000 0.2975000 23.16000 0.3548000 23.08000 0.4776000 0.8693000E-01  0.5949000 
1 1 1 15 10 29 o 31.10000 0.3290000 30.99000 0.4137000 31.21000 0.5117000 -0.2155000     0.6580000 
1 1 1 15 10 31 o 19.26000 0.3298000 19.27000 0.4639000 19.25000 0.4691000 0.2037000E-01  0.6597000 
1 1 1 15 10 33 o 5.470000 0.9422000 5.654000 1.338000  5.286000 1.327000  0.3680000      1.884000  
1 1 1 15 10 35 o 18.34000 0.3795000 18.75000 0.5223000 17.94000 0.5507000 0.8110000      0.7590000 
1 1 1 15 10 37 o 15.68000 0.4356000 14.77000 0.6612000 16.59000 0.5674000 -1.811000      0.8712000 
1 1 1 15 10 39 o 17.25000 0.3929000 18.10000 0.5408000 16.41000 0.5702000 1.687000       0.7858000 
1 1 1 15 10 41 o 28.33000 0.3326000 28.05000 0.4627000 28.62000 0.4779000 -0.5674000     0.6652000 
1 1 1 15 10 43 o 14.24000 0.4306000 14.30000 0.5968000 14.18000 0.6208000 0.1193000      0.8611000 
1 1 1 15 10 45 o 16.32000 0.4519000 16.46000 0.6014000 16.18000 0.6748000 0.2759000      0.9039000 
1 1 1 15 10 47 o 14.35000 0.6780000 14.24000 1.235000  14.47000 0.5605000 -0.2349000     1.356000  
1 1 1 15 10 49 o 7.936000 0.6223000 8.278000 0.9060000 7.593000 0.8535000 0.6848000      1.245000  
1 1 1 15 10 51 o 14.71000 0.4276000 14.82000 0.5560000 14.59000 0.6498000 0.2300000      0.8552000 
1 1 1 15 10 53 o 5.820000 0.8441000 6.793000 1.040000  4.847000 1.330000  1.945000       1.688000  
1 1 1 15 10 55 o 6.655000 0.8479000 6.574000 1.111000  6.736000 1.281000  -0.1621000     1.696000  
1 1 1 15 10 57 o 5.992000 0.9637000 5.881000 1.489000  6.103000 1.224000  -0.2226000     1.927000  
1 1 1 15 10 59 o 3.982000 1.035000  3.351000 1.400000  4.613000 1.526000  -1.262000      2.071000  
1 1 1 15 10 61 o 3.143000 0.9391000 2.788000 1.312000  3.497000 1.344000  -0.7097000     1.878000  
1 1 1 15 10 63 o 3.404000 0.9497000 3.520000 1.388000  3.288000 1.296000  0.2320000      1.899000  
1 1 1 15 11 0  o 92.03000 0.8973000 92.03000 0.8973000 92.03000 0.8973000 0.000000       0.000000  
1 1 1 15 11 2  o 104.9000 0.7803000 103.4000 1.004000  106.4000 1.195000  -2.954000      1.561000  
1 1 1 15 11 4  o 93.99000 0.6474000 93.51000 0.9112000 94.46000 0.9199000 -0.9489000     1.295000  
1 1 1 15 11 6  f 134.2000 0.9913000 135.1000 1.507000  133.3000 1.288000  1.850000       1.983000  
1 1 1 15 11 8  o 113.4000 0.8398000 113.5000 1.270000  113.3000 1.099000  0.1958000      1.680000  
1 1 1 15 11 10 o 47.11000 0.3770000 47.40000 0.5694000 46.83000 0.4943000 0.5754000      0.7540000 
1 1 1 15 11 12 o 28.91000 0.3310000 29.25000 0.4329000 28.56000 0.5009000 0.6956000      0.6620000 
1 1 1 15 11 14 o 74.94000 0.5687000 74.43000 0.8572000 75.44000 0.7477000 -1.014000      1.137000  
1 1 1 15 11 16 o 90.19000 0.7431000 89.42000 0.7844000 90.96000 1.262000  -1.534000      1.486000  
1 1 1 15 11 18 o 37.22000 0.4029000 36.81000 0.4963000 37.63000 0.6349000 -0.8204000     0.8059000 
1 1 1 15 11 20 o 78.46000 0.7104000 79.72000 0.9057000 77.19000 1.095000  2.523000       1.421000  
1 1 1 15 11 22 o 37.92000 0.3649000 38.00000 0.5105000 37.84000 0.5216000 0.1617000      0.7298000 
1 1 1 15 11 24 o 16.81000 0.3207000 16.58000 0.3725000 17.05000 0.5221000 -0.4701000     0.6414000 
1 1 1 15 11 26 o 23.57000 0.3009000 23.87000 0.3540000 23.27000 0.4867000 0.6061000      0.6018000 
1 1 1 15 11 28 o 50.16000 0.3951000 50.55000 0.4830000 49.76000 0.6253000 0.7816000      0.7901000 
1 1 1 15 11 30 o 24.85000 0.3093000 24.60000 0.4389000 25.10000 0.4360000 -0.5046000     0.6187000 
1 1 1 15 11 32 o 22.20000 0.5140000 22.51000 0.4176000 21.89000 0.9394000 0.6182000      1.028000  
1 1 1 15 11 34 o 17.74000 0.4495000 17.06000 0.5606000 18.42000 0.7027000 -1.366000      0.8990000 
1 1 1 15 11 36 o 37.20000 0.3378000 36.58000 0.4626000 37.83000 0.4924000 -1.256000      0.6757000 
1 1 1 15 11 38 f 6.682000 0.9998000 6.876000 1.324000  6.487000 1.498000  0.3890000      2.000000  
1 1 1 15 11 40 o 18.05000 0.3853000 17.80000 0.5302000 18.29000 0.5591000 -0.4850000     0.7705000 
1 1 1 15 11 42 o 16.45000 0.4009000 15.72000 0.5659000 17.18000 0.5678000 -1.469000      0.8017000 
1 1 1 15 11 44 o 16.35000 0.4175000 15.85000 0.5524000 16.84000 0.6262000 -0.9890000     0.8351000 
1 1 1 15 11 46 o 8.808000 0.6214000 8.321000 0.9002000 9.294000 0.8569000 -0.9729000     1.243000  
1 1 1 15 11 48 o 12.74000 0.5287000 12.54000 0.7525000 12.94000 0.7428000 -0.4054000     1.057000  
1 1 1 15 11 50 o 2.869000 0.9012000 3.207000 1.398000  2.530000 1.137000  0.6776000      1.802000  
1 1 1 15 11 52 o 9.416000 0.5867000 8.845000 0.8563000 9.986000 0.8022000 -1.141000      1.173000  
1 1 1 15 11 54 o 4.263000 0.9773000 4.118000 1.463000  4.408000 1.296000  -0.2900000     1.955000  
1 1 1 15 11 56 o 3.687000 1.000000  3.929000 1.497000  3.446000 1.328000  0.4839000      2.001000  
1 1 1 15 11 58 o 5.817000 1.007000  5.484000 1.490000  6.151000 1.354000  -0.6664000     2.013000  
1 1 1 15 11 60 o 9.261000 0.6947000 10.25000 0.8732000 8.275000 1.081000  1.971000       1.389000  
1 1 1 15 11 62 o 7.567000 0.7843000 7.256000 1.160000  7.877000 1.056000  -0.6208000     1.569000  
1 1 1 15 12 1  o 63.51000 0.4476000 63.53000 0.6330000 63.48000 0.6329000 0.4991000E-01  0.8951000 
1 1 1 15 12 3  o 19.34000 0.2456000 18.88000 0.3142000 19.80000 0.3776000 -0.9204000     0.4912000 
1 1 1 15 12 5  o 52.44000 0.4376000 52.09000 0.6106000 52.78000 0.6270000 -0.6968000     0.8752000 
1 1 1 15 12 7  o 99.10000 0.8354000 98.95000 1.362000  99.25000 0.9676000 -0.2936000     1.671000  
1 1 1 15 12 9  f 26.86000 0.2622000 27.00000 0.3511000 26.73000 0.3895000 0.2654000      0.5244000 
1 1 1 15 12 11 o 24.36000 0.2591000 24.55000 0.3437000 24.18000 0.3879000 0.3612000      0.5183000 
1 1 1 15 12 13 o 17.86000 0.2990000 17.64000 0.3890000 18.09000 0.4541000 -0.4427000     0.5980000 
1 1 1 15 12 15 o 96.50000 0.7897000 96.41000 0.8415000 96.59000 1.337000  -0.1773000     1.579000  
1 1 1 15 12 17 o 59.61000 0.4661000 59.05000 0.5955000 60.18000 0.7173000 -1.129000      0.9323000 
1 1 1 15 12 19 o 41.95000 0.3814000 41.82000 0.5305000 42.08000 0.5481000 -0.2584000     0.7628000 
1 1 1 15 12 21 o 31.80000 0.3081000 32.17000 0.3958000 31.42000 0.4724000 0.7502000      0.6163000 
1 1 1 15 12 23 o 55.57000 0.4439000 56.60000 0.5898000 54.55000 0.6637000 2.047000       0.8878000 
1 1 1 15 12 25 o 17.48000 0.3116000 17.33000 0.3582000 17.63000 0.5099000 -0.2950000     0.6231000 
1 1 1 15 12 27 o 35.05000 0.3178000 35.63000 0.3855000 34.48000 0.5054000 1.149000       0.6357000 
1 1 1 15 12 29 o 22.27000 0.3028000 22.30000 0.3656000 22.24000 0.4829000 0.6188000E-01  0.6056000 
1 1 1 15 12 31 o 18.38000 0.3179000 17.71000 0.4333000 19.05000 0.4653000 -1.342000      0.6358000 
1 1 1 15 12 33 o 32.48000 0.3487000 32.39000 0.4307000 32.57000 0.5484000 -0.1778000     0.6973000 
1 1 1 15 12 35 o 3.651000 1.033000  3.335000 1.469000  3.966000 1.454000  -0.6314000     2.066000  
1 1 1 15 12 37 o 10.80000 0.5629000 9.637000 0.7601000 11.97000 0.8304000 -2.328000      1.126000  
1 1 1 15 12 39 o 21.26000 0.3487000 20.92000 0.4767000 21.61000 0.5090000 -0.6963000     0.6973000 
1 1 1 15 12 41 o 8.366000 0.7081000 8.188000 0.9806000 8.544000 1.022000  -0.3556000     1.416000  
1 1 1 15 12 43 o 10.69000 0.5450000 10.36000 0.7643000 11.03000 0.7772000 -0.6664000     1.090000  
1 1 1 15 12 45 o 4.384000 0.9840000 4.803000 1.362000  3.965000 1.420000  0.8384000      1.968000  
1 1 1 15 12 47 f 13.17000 0.5205000 12.30000 0.7500000 14.04000 0.7219000 -1.738000      1.041000  
1 1 1 15 12 49 o 12.82000 0.4484000 13.15000 0.6172000 12.49000 0.6506000 0.6670000      0.8968000 
1 1 1 15 12 51 o 8.800000 0.6638000 8.607000 1.029000  8.994000 0.8390000 -0.3867000     1.328000  
1 1 1 15 12 53 o 5.956000 0.8556000 5.514000 1.304000  6.397000 1.108000  -0.8838000     1.711000  
1 1 1 15 12 55 o 9.643000 0.7815000 9.348000 1.055000  9.937000 1.153000  -0.5887000     1.563000  
1 1 1 15 12 57 o 3.068000 0.9426000 3.409000 1.415000  2.727000 1.245000  0.6817000      1.885000  
1 1 1 15 12 59 o 6.137000 1.055000  5.990000 1.575000  6.283000 1.403000  -0.2932000     2.109000  
1 1 1 15 12 61 o 3.549000 1.032000  3.611000 1.453000  3.488000 1.467000  0.1228000      2.064000  
1 1 1 15 12 63 o 5.290000 1.002000  5.597000 1.441000  4.984000 1.393000  0.6130000      2.005000  
1 1 1 15 13 0  o 12.61000 0.4047000 12.61000 0.4047000 12.61000 0.4047000 0.000000       0.000000  
1 1 1 15 13 2  o 50.53000 0.4709000 51.08000 0.5974000 49.97000 0.7282000 1.111000       0.9419000 
1 1 1 15 13 4  o 52.77000 0.4358000 52.29000 0.6109000 53.25000 0.6218000 -0.9655000     0.8717000 
1 1 1 15 13 6  o 61.10000 0.7008000 62.70000 1.221000  59.50000 0.6874000 3.198000       1.402000  
1 1 1 15 13 8  o 117.7000 0.8706000 117.6000 1.139000  117.8000 1.317000  -0.2456000     1.741000  
1 1 1 15 13 10 o 48.10000 0.3557000 47.37000 0.4952000 48.84000 0.5107000 -1.471000      0.7114000 
1 1 1 15 13 12 o 16.37000 0.2447000 16.70000 0.3486000 16.04000 0.3434000 0.6577000      0.4893000 
1 1 1 15 13 14 o 93.03000 0.7609000 93.29000 0.8152000 92.77000 1.285000  0.5240000      1.522000  
1 1 1 15 13 16 o 53.10000 0.4209000 53.11000 0.5417000 53.08000 0.6443000 0.3198000E-01  0.8417000 
1 1 1 15 13 18 o 89.42000 0.7389000 89.36000 0.7834000 89.49000 1.253000  -0.1308000     1.478000  
1 1 1 15 13 20 o 42.87000 0.3672000 42.69000 0.4741000 43.05000 0.5608000 -0.3634000     0.7343000 
1 1 1 15 13 22 o 37.94000 0.3383000 37.63000 0.4276000 38.25000 0.5244000 -0.6196000     0.6767000 
1 1 1 15 13 24 o 35.88000 0.3991000 36.00000 0.5029000 35.76000 0.6199000 0.2435000      0.7982000 
1 1 1 15 13 26 o 52.67000 0.4282000 51.99000 0.5508000 53.36000 0.6558000 -1.367000      0.8564000 
1 1 1 15 13 28 o 49.04000 0.3899000 49.24000 0.4730000 48.85000 0.6199000 0.3888000      0.7798000 
1 1 1 15 13 30 o 35.57000 0.3397000 36.24000 0.4377000 34.90000 0.5196000 1.338000       0.6794000 
1 1 1 15 13 32 o 11.41000 0.5807000 11.36000 0.6013000 11.46000 0.9936000 -0.1013000     1.161000  
1 1 1 15 13 34 f 44.00000 0.3933000 43.44000 0.4988000 44.56000 0.6083000 -1.123000      0.7867000 
1 1 1 15 13 36 o 20.26000 0.4196000 20.50000 0.4580000 20.01000 0.7031000 0.4842000      0.8391000 
1 1 1 15 13 38 o 12.29000 0.5283000 11.97000 0.8155000 12.60000 0.6717000 -0.6282000     1.057000  
1 1 1 15 13 40 o 23.76000 0.3367000 23.27000 0.4653000 24.25000 0.4869000 -0.9769000     0.6735000 
1 1 1 15 13 42 o 13.59000 0.4470000 13.85000 0.6068000 13.32000 0.6567000 0.5250000      0.8941000 
1 1 1 15 13 44 o 10.32000 0.6249000 9.911000 0.9070000 10.74000 0.8598000 -0.8265000     1.250000  
1 1 1 15 13 46 o 7.417000 0.6927000 7.050000 1.062000  7.783000 0.8903000 -0.7338000     1.385000  
1 1 1 15 13 48 o 13.47000 0.4509000 13.41000 0.6698000 13.53000 0.6037000 -0.1227000     0.9017000 
1 1 1 15 13 50 o 13.49000 0.4117000 13.53000 0.5918000 13.45000 0.5724000 0.8456000E-01  0.8233000 
1 1 1 15 13 52 o 7.044000 0.7345000 6.577000 1.054000  7.510000 1.023000  -0.9327000     1.469000  
1 1 1 15 13 54 o 13.21000 0.7044000 14.46000 1.256000  11.95000 0.6384000 2.517000       1.409000  
1 1 1 15 13 56 o 7.011000 0.8951000 5.569000 1.546000  8.453000 0.9016000 -2.884000      1.790000  
1 1 1 15 13 58 o 5.115000 1.079000  5.800000 1.407000  4.430000 1.636000  1.369000       2.158000  
1 1 1 15 13 60 o 3.045000 0.9764000 2.924000 1.344000  3.165000 1.417000  -0.2407000     1.953000  
1 1 1 15 13 62 o 3.773000 1.057000  3.875000 1.542000  3.672000 1.447000  0.2023000      2.115000  
1 1 1 15 14 1  o 80.08000 0.6392000 79.28000 0.8950000 80.88000 0.9129000 -1.597000      1.278000  
1 1 1 15 14 3  o 25.00000 0.3137000 24.50000 0.4202000 25.51000 0.4659000 -1.012000      0.6274000 
1 1 1 15 14 5  o 95.23000 0.7087000 94.65000 0.9229000 95.81000 1.076000  -1.152000      1.417000  
1 1 1 15 14 7  o 55.26000 0.4296000 54.89000 0.6472000 55.63000 0.5653000 -0.7471000     0.8593000 
1 1 1 15 14 9  o 94.09000 0.6497000 93.64000 0.9149000 94.54000 0.9227000 -0.8990000     1.299000  
1 1 1 15 14 11 o 50.09000 0.3672000 50.02000 0.5178000 50.16000 0.5208000 -0.1318000     0.7344000 
1 1 1 15 14 13 o 37.82000 0.3900000 37.93000 0.4817000 37.71000 0.6134000 0.2254000      0.7799000 
1 1 1 15 14 15 o 52.16000 0.4144000 52.17000 0.5312000 52.16000 0.6361000 0.8240000E-02  0.8288000 
1 1 1 15 14 17 o 87.91000 0.6334000 87.38000 0.7665000 88.44000 1.009000  -1.057000      1.267000  
1 1 1 15 14 19 o 99.41000 0.7092000 100.6000 0.8774000 98.26000 1.114000  2.298000       1.418000  
1 1 1 15 14 21 o 12.99000 0.3774000 13.35000 0.4808000 12.63000 0.5818000 0.7178000      0.7547000 
1 1 1 15 14 23 o 26.23000 0.2844000 25.93000 0.3353000 26.54000 0.4595000 -0.6123000     0.5689000 
1 1 1 15 14 25 o 24.03000 0.3095000 24.08000 0.4041000 23.98000 0.4690000 0.1032000      0.6191000 
1 1 1 15 14 27 o 28.09000 0.3593000 27.82000 0.3859000 28.36000 0.6061000 -0.5386000     0.7185000 
1 1 1 15 14 29 o 35.28000 0.3569000 35.01000 0.4860000 35.55000 0.5229000 -0.5364000     0.7139000 
1 1 1 15 14 31 o 48.55000 0.4100000 48.45000 0.5241000 48.66000 0.6306000 -0.2131000     0.8199000 
1 1 1 15 14 33 o 21.26000 0.3478000 21.51000 0.4283000 21.01000 0.5481000 0.4955000      0.6956000 
1 1 1 15 14 35 o 7.129000 0.8313000 6.266000 1.277000  7.991000 1.065000  -1.725000      1.663000  
1 1 1 15 14 37 o 6.854000 0.8213000 7.643000 0.9839000 6.065000 1.315000  1.578000       1.643000  
1 1 1 15 14 39 o 43.07000 0.3995000 42.85000 0.5960000 43.30000 0.5320000 -0.4468000     0.7989000 
1 1 1 15 14 41 o 17.36000 0.3994000 17.88000 0.5435000 16.85000 0.5854000 1.038000       0.7988000 
1 1 1 15 14 43 o 3.635000 1.004000  4.008000 1.456000  3.263000 1.383000  0.7449000      2.008000  
1 1 1 15 14 45 o 13.02000 0.4492000 13.19000 0.6228000 12.84000 0.6474000 0.3497000      0.8983000 
1 1 1 15 14 47 o 12.15000 0.5004000 12.76000 0.6385000 11.53000 0.7706000 1.227000       1.001000  
1 1 1 15 14 49 o 8.107000 0.7287000 7.751000 1.044000  8.464000 1.017000  -0.7134000     1.457000  
1 1 1 15 14 51 f 6.224000 0.9634000 5.647000 1.553000  6.801000 1.141000  -1.154000      1.927000  
1 1 1 15 14 53 o 15.26000 0.5098000 14.51000 0.8516000 16.00000 0.5606000 -1.482000      1.020000  
1 1 1 15 14 55 o 6.105000 0.8968000 7.376000 1.104000  4.834000 1.414000  2.542000       1.794000  
1 1 1 15 14 57 o 11.29000 0.5318000 12.73000 0.6987000 9.848000 0.8019000 2.879000       1.064000  
1 1 1 15 14 59 o 8.870000 0.6082000 9.586000 0.9022000 8.154000 0.8159000 1.432000       1.216000  
1 1 1 15 14 61 o 4.092000 1.012000  4.525000 1.532000  3.659000 1.322000  0.8659000      2.024000  
1 1 1 15 14 63 o 3.986000 1.760000  ?        ?         3.986000 1.760000  ?              ?         
1 1 1 15 15 0  o 20.52000 0.3210000 20.52000 0.3210000 20.52000 0.3210000 0.000000       0.000000  
1 1 1 15 15 2  o 11.45000 0.2823000 11.66000 0.3903000 11.25000 0.4079000 0.4139000      0.5645000 
1 1 1 15 15 4  o 102.0000 0.7014000 102.5000 0.9963000 101.5000 0.9875000 1.005000       1.403000  
1 1 1 15 15 6  o 128.1000 0.8763000 127.8000 1.236000  128.5000 1.243000  -0.6920000     1.753000  
1 1 1 15 15 8  o 155.5000 1.061000  156.5000 1.510000  154.4000 1.490000  2.172000       2.121000  
1 1 1 15 15 10 o 34.92000 0.3386000 34.61000 0.3969000 35.22000 0.5488000 -0.6189000     0.6773000 
1 1 1 15 15 12 o 44.54000 0.4382000 43.96000 0.5382000 45.13000 0.6915000 -1.164000      0.8763000 
1 1 1 15 15 14 o 50.03000 0.4003000 50.02000 0.5124000 50.03000 0.6153000 -0.1791000E-01 0.8007000 
1 1 1 15 15 16 o 9.628000 0.3902000 9.074000 0.4178000 10.18000 0.6591000 -1.109000      0.7803000 
1 1 1 15 15 18 f 29.05000 0.3385000 28.91000 0.3253000 29.19000 0.5938000 -0.2792000     0.6771000 
1 1 1 15 15 20 o 7.543000 0.5192000 7.475000 0.5558000 7.611000 0.8772000 -0.1359000     1.038000  
1 1 1 15 15 22 o 16.88000 0.3028000 15.95000 0.3743000 17.81000 0.4760000 -1.856000      0.6056000 
1 1 1 15 15 24 o 58.19000 0.4411000 58.81000 0.5404000 57.57000 0.6973000 1.246000       0.8822000 
1 1 1 15 15 26 o 70.23000 0.5440000 70.48000 0.7118000 69.97000 0.8228000 0.5089000      1.088000  
1 1 1 15 15 28 o 15.46000 0.3327000 15.16000 0.3768000 15.76000 0.5485000 -0.6013000     0.6655000 
1 1 1 15 15 30 o 57.72000 0.6908000 56.93000 0.5921000 58.52000 1.248000  -1.589000      1.382000  
1 1 1 15 15 32 o 33.32000 0.3502000 33.12000 0.4258000 33.52000 0.5562000 -0.3970000     0.7005000 
1 1 1 15 15 34 o 21.99000 0.3600000 21.75000 0.4817000 22.23000 0.5350000 -0.4853000     0.7199000 
1 1 1 15 15 36 o 23.50000 0.3558000 23.36000 0.5298000 23.64000 0.4751000 -0.2816000     0.7116000 
1 1 1 15 15 38 o 41.90000 0.3603000 42.11000 0.5001000 41.69000 0.5189000 0.4212000      0.7206000 
1 1 1 15 15 40 o 18.48000 0.4523000 18.11000 0.4930000 18.86000 0.7584000 -0.7488000     0.9045000 
1 1 1 15 15 42 o 9.120000 0.6142000 9.627000 0.8481000 8.613000 0.8888000 1.014000       1.228000  
1 1 1 15 15 44 o 8.001000 0.7878000 7.077000 1.178000  8.926000 1.046000  -1.849000      1.576000  
1 1 1 15 15 46 o 24.15000 0.3555000 24.49000 0.5070000 23.81000 0.4984000 0.6788000      0.7110000 
1 1 1 15 15 48 o 8.232000 0.6902000 8.350000 0.9061000 8.113000 1.041000  0.2369000      1.380000  
1 1 1 15 15 50 o 4.236000 0.9949000 3.689000 1.464000  4.784000 1.347000  -1.095000      1.990000  
1 1 1 15 15 52 o 6.152000 0.9903000 5.746000 1.565000  6.559000 1.214000  -0.8130000     1.981000  
1 1 1 15 15 54 o 6.723000 0.8265000 5.961000 1.291000  7.484000 1.033000  -1.523000      1.653000  
1 1 1 15 15 56 o 3.698000 1.062000  4.160000 1.665000  3.236000 1.319000  0.9245000      2.124000  
1 1 1 15 15 58 o 4.890000 1.048000  5.657000 1.402000  4.123000 1.558000  1.534000       2.096000  
1 1 1 15 15 60 o 7.858000 0.8324000 7.800000 1.358000  7.915000 0.9635000 -0.1146000     1.665000  
1 1 1 15 15 62 o 3.077000 0.9130000 3.523000 1.394000  2.631000 1.179000  0.8921000      1.826000  
1 1 1 15 16 1  o 61.81000 0.4720000 62.05000 0.7127000 61.58000 0.6191000 0.4762000      0.9440000 
1 1 1 15 16 3  o 181.3000 1.335000  179.8000 1.730000  182.9000 2.034000  -3.041000      2.670000  
1 1 1 15 16 5  o 88.17000 0.6105000 88.17000 0.8635000 88.18000 0.8633000 -0.8537000E-02 1.221000  
1 1 1 15 16 7  o 42.12000 0.4286000 41.98000 0.6746000 42.26000 0.5288000 -0.2720000     0.8572000 
1 1 1 15 16 9  o 41.56000 0.5473000 40.60000 0.8768000 42.51000 0.6554000 -1.914000      1.095000  
1 1 1 15 16 11 o 43.53000 0.4290000 42.98000 0.5269000 44.08000 0.6771000 -1.101000      0.8579000 
1 1 1 15 16 13 f 53.21000 0.4046000 52.91000 0.4841000 53.51000 0.6484000 -0.5938000     0.8092000 
1 1 1 15 16 15 o 46.98000 0.3667000 46.56000 0.4359000 47.40000 0.5898000 -0.8449000     0.7334000 
1 1 1 15 16 17 o 67.76000 0.4971000 68.23000 0.6084000 67.29000 0.7864000 0.9481000      0.9943000 
1 1 1 15 16 19 o 50.07000 0.3879000 50.32000 0.4682000 49.83000 0.6185000 0.4936000      0.7757000 
1 1 1 15 16 21 o 46.71000 0.3858000 46.62000 0.4946000 46.80000 0.5923000 -0.1766000     0.7716000 
1 1 1 15 16 23 o 37.55000 0.3400000 38.03000 0.4426000 37.07000 0.5161000 0.9666000      0.6799000 
1 1 1 15 16 25 o 47.38000 0.3784000 47.05000 0.4544000 47.70000 0.6052000 -0.6477000     0.7568000 
1 1 1 15 16 27 o 29.66000 0.3026000 29.02000 0.3511000 30.29000 0.4929000 -1.265000      0.6052000 
1 1 1 15 16 29 o 40.95000 0.4135000 40.65000 0.4637000 41.25000 0.6848000 -0.6033000     0.8270000 
1 1 1 15 16 31 o 24.41000 0.3645000 24.26000 0.3626000 24.56000 0.6325000 -0.2988000     0.7291000 
1 1 1 15 16 33 o 25.63000 0.5083000 25.87000 0.4706000 25.40000 0.9011000 0.4669000      1.017000  
1 1 1 15 16 35 o 16.20000 0.3714000 15.65000 0.4994000 16.76000 0.5498000 -1.111000      0.7428000 
1 1 1 15 16 37 o 29.02000 0.3504000 28.93000 0.5176000 29.11000 0.4725000 -0.1824000     0.7008000 
1 1 1 15 16 39 o 6.003000 0.9326000 5.602000 1.381000  6.403000 1.254000  -0.8017000     1.865000  
1 1 1 15 16 41 o 6.154000 0.8957000 5.099000 1.433000  7.210000 1.075000  -2.111000      1.791000  
1 1 1 15 16 43 o 18.20000 0.4106000 17.71000 0.5091000 18.69000 0.6443000 -0.9794000     0.8212000 
1 1 1 15 16 45 o 5.606000 0.9009000 4.631000 1.412000  6.582000 1.120000  -1.951000      1.802000  
1 1 1 15 16 47 o 11.34000 0.6224000 10.98000 0.7215000 11.70000 1.014000  -0.7190000     1.245000  
1 1 1 15 16 49 o 19.28000 0.3981000 19.59000 0.6084000 18.97000 0.5136000 0.6170000      0.7963000 
1 1 1 15 16 51 o 10.52000 0.5281000 11.13000 0.7546000 9.919000 0.7391000 1.208000       1.056000  
1 1 1 15 16 53 o 4.676000 0.9943000 4.098000 1.458000  5.254000 1.352000  -1.157000      1.989000  
1 1 1 15 16 55 o 9.545000 0.5890000 8.823000 0.9265000 10.27000 0.7274000 -1.443000      1.178000  
1 1 1 15 16 57 o 4.951000 1.009000  4.835000 1.490000  5.066000 1.360000  -0.2307000     2.017000  
1 1 1 15 16 59 o 6.928000 0.8084000 6.707000 1.296000  7.149000 0.9671000 -0.4420000     1.617000  
1 1 1 15 16 61 o 3.897000 1.070000  4.143000 1.651000  3.652000 1.362000  0.4914000      2.140000  
1 1 1 15 17 0  o 112.5000 1.090000  112.5000 1.090000  112.5000 1.090000  0.000000       0.000000  
1 1 1 15 17 2  o 88.36000 0.6111000 88.78000 0.8681000 87.94000 0.8604000 0.8429000      1.222000  
1 1 1 15 17 4  o 52.96000 0.3843000 52.77000 0.5420000 53.16000 0.5451000 -0.3923000     0.7687000 
1 1 1 15 17 6  o 80.24000 0.6431000 81.81000 0.9261000 78.66000 0.8925000 3.143000       1.286000  
1 1 1 15 17 8  o 56.13000 0.5760000 56.06000 0.8143000 56.20000 0.8149000 -0.1351000     1.152000  
1 1 1 15 17 10 o 8.389000 0.6419000 8.050000 1.090000  8.728000 0.6790000 -0.6786000     1.284000  
1 1 1 15 17 12 o 67.30000 0.5567000 67.79000 0.7930000 66.82000 0.7815000 0.9697000      1.113000  
1 1 1 15 17 14 o 55.12000 0.4353000 55.69000 0.5657000 54.56000 0.6617000 1.132000       0.8705000 
1 1 1 15 17 16 o 32.26000 0.3580000 31.78000 0.3882000 32.74000 0.6017000 -0.9634000     0.7160000 
1 1 1 15 17 18 o 41.58000 0.3955000 41.08000 0.3968000 42.08000 0.6842000 -1.001000      0.7909000 
1 1 1 15 17 20 o 33.20000 0.3002000 33.43000 0.3549000 32.98000 0.4843000 0.4550000      0.6004000 
1 1 1 15 17 22 o 26.47000 0.2926000 26.91000 0.3574000 26.03000 0.4633000 0.8766000      0.5851000 
1 1 1 15 17 24 o 29.90000 0.3087000 30.10000 0.3982000 29.71000 0.4718000 0.3872000      0.6174000 
1 1 1 15 17 26 o 7.722000 0.5358000 7.167000 0.6270000 8.276000 0.8691000 -1.109000      1.072000  
1 1 1 15 17 28 o 58.85000 0.5306000 59.32000 0.6092000 58.38000 0.8690000 0.9433000      1.061000  
1 1 1 15 17 30 o 41.49000 0.3568000 41.63000 0.4293000 41.36000 0.5701000 0.2666000      0.7137000 
1 1 1 15 17 32 o 24.08000 0.3711000 24.48000 0.4045000 23.68000 0.6223000 0.8020000      0.7423000 
1 1 1 15 17 34 o 34.24000 0.3455000 34.47000 0.4977000 34.00000 0.4794000 0.4750000      0.6910000 
1 1 1 15 17 36 o 38.46000 0.3931000 38.77000 0.5395000 38.15000 0.5720000 0.6194000      0.7862000 
1 1 1 15 17 38 o 3.817000 1.028000  3.851000 1.477000  3.783000 1.429000  0.6812000E-01  2.055000  
1 1 1 15 17 40 o 17.09000 0.4273000 17.04000 0.6613000 17.15000 0.5414000 -0.1163000     0.8547000 
1 1 1 15 17 42 o 38.98000 0.3503000 39.41000 0.4895000 38.55000 0.5013000 0.8633000      0.7006000 
1 1 1 15 17 44 o 10.42000 0.7154000 10.83000 0.7145000 10.01000 1.240000  0.8183000      1.431000  
1 1 1 15 17 46 o 4.687000 1.098000  4.567000 1.596000  4.808000 1.508000  -0.2416000     2.196000  
1 1 1 15 17 48 o 16.69000 0.5006000 15.65000 0.8473000 17.72000 0.5335000 -2.066000      1.001000  
1 1 1 15 17 50 o 17.25000 0.4123000 16.80000 0.6219000 17.69000 0.5416000 -0.8936000     0.8247000 
1 1 1 15 17 52 o 8.041000 0.6667000 7.283000 0.9915000 8.799000 0.8915000 -1.516000      1.333000  
1 1 1 15 17 54 o 4.634000 0.9733000 5.282000 1.333000  3.987000 1.419000  1.295000       1.947000  
1 1 1 15 17 56 o 8.713000 0.8185000 7.864000 1.277000  9.562000 1.024000  -1.698000      1.637000  
1 1 1 15 17 58 o 3.429000 1.010000  3.560000 1.447000  3.299000 1.410000  0.2610000      2.021000  
1 1 1 15 17 60 o 6.404000 0.9121000 7.148000 1.230000  5.659000 1.347000  1.489000       1.824000  
1 1 1 15 17 62 o 4.665000 1.129000  5.990000 1.739000  3.340000 1.441000  2.650000       2.259000  
1 1 1 15 18 1  o 83.01000 0.6621000 82.37000 0.9290000 83.65000 0.9436000 -1.282000      1.324000  
1 1 1 15 18 3  o 80.09000 0.7169000 80.69000 0.9124000 79.48000 1.106000  1.209000       1.434000  
1 1 1 15 18 5  o 58.80000 0.4816000 58.36000 0.6757000 59.23000 0.6863000 -0.8711000     0.9631000 
1 1 1 15 18 7  o 99.65000 1.203000  101.7000 1.993000  97.59000 1.349000  4.124000       2.406000  
1 1 1 15 18 9  o 45.44000 0.4042000 45.36000 0.5717000 45.52000 0.5716000 -0.1643000     0.8085000 
1 1 1 15 18 11 o 49.08000 0.4285000 48.85000 0.6041000 49.30000 0.6080000 -0.4412000     0.8570000 
1 1 1 15 18 13 o 94.83000 0.7613000 94.83000 1.077000  94.83000 1.076000  0.3960000E-02  1.523000  
1 1 1 15 18 15 o 64.07000 0.5339000 64.75000 0.7624000 63.38000 0.7477000 1.367000       1.068000  
1 1 1 15 18 17 o 18.84000 0.3308000 18.11000 0.2825000 19.58000 0.5982000 -1.469000      0.6616000 
1 1 1 15 18 19 o 13.52000 0.3184000 13.45000 0.3206000 13.59000 0.5502000 -0.1430000     0.6368000 
1 1 1 15 18 21 o 8.059000 0.4826000 7.802000 0.5297000 8.316000 0.8068000 -0.5146000     0.9651000 
1 1 1 15 18 23 o 47.49000 0.3781000 47.32000 0.4507000 47.66000 0.6073000 -0.3428000     0.7562000 
1 1 1 15 18 25 o 21.18000 0.2921000 20.89000 0.3340000 21.48000 0.4794000 -0.5918000     0.5843000 
1 1 1 15 18 27 o 53.31000 0.5203000 52.72000 0.6464000 53.90000 0.8154000 -1.184000      1.041000  
1 1 1 15 18 29 o 42.24000 0.3587000 42.41000 0.4278000 42.08000 0.5759000 0.3316000      0.7174000 
1 1 1 15 18 31 o 13.67000 0.6069000 14.56000 0.4643000 12.77000 1.122000  1.793000       1.214000  
1 1 1 15 18 33 o 13.05000 0.4202000 13.07000 0.5534000 13.03000 0.6324000 0.4033000E-01  0.8403000 
1 1 1 15 18 35 o 24.23000 0.3193000 24.31000 0.4360000 24.15000 0.4665000 0.1599000      0.6386000 
1 1 1 15 18 37 o 51.67000 0.4055000 51.67000 0.5666000 51.68000 0.5804000 -0.1059000E-01 0.8111000 
1 1 1 15 18 39 o 36.70000 0.3945000 36.95000 0.5474000 36.45000 0.5684000 0.5015000      0.7891000 
1 1 1 15 18 41 o 36.91000 0.4576000 37.45000 0.7050000 36.38000 0.5834000 1.071000       0.9151000 
1 1 1 15 18 43 o 20.34000 0.5815000 19.98000 0.5344000 20.70000 1.033000  -0.7177000     1.163000  
1 1 1 15 18 45 o 5.811000 1.120000  5.100000 1.594000  6.522000 1.572000  -1.422000      2.239000  
1 1 1 15 18 47 o 14.75000 0.5526000 13.95000 0.9288000 15.54000 0.5990000 -1.593000      1.105000  
1 1 1 15 18 49 o 15.50000 0.4022000 15.53000 0.5844000 15.47000 0.5526000 0.6124000E-01  0.8044000 
1 1 1 15 18 51 o 5.255000 0.9255000 5.763000 1.255000  4.747000 1.361000  1.016000       1.851000  
1 1 1 15 18 53 o 3.198000 0.9635000 4.076000 1.583000  2.320000 1.098000  1.756000       1.927000  
1 1 1 15 18 55 o 3.756000 1.061000  3.655000 1.576000  3.857000 1.422000  -0.2016000     2.123000  
1 1 1 15 18 57 o 4.353000 1.102000  4.817000 1.484000  3.889000 1.631000  0.9281000      2.205000  
1 1 1 15 18 59 o 7.893000 0.7729000 7.267000 1.253000  8.520000 0.9047000 -1.253000      1.546000  
1 1 1 15 18 61 o 9.293000 0.7008000 9.735000 1.133000  8.850000 0.8254000 0.8852000      1.402000  
1 1 1 15 19 0  o 64.17000 0.7352000 64.17000 0.7352000 64.17000 0.7352000 0.000000       0.000000  
1 1 1 15 19 2  o 49.93000 0.4167000 50.04000 0.5914000 49.82000 0.5871000 0.2187000      0.8333000 
1 1 1 15 19 4  o 28.22000 0.2635000 28.06000 0.3537000 28.38000 0.3907000 -0.3233000     0.5270000 
1 1 1 15 19 6  o 37.35000 0.3922000 37.05000 0.5992000 37.65000 0.5062000 -0.6025000     0.7844000 
1 1 1 15 19 8  o 15.58000 0.3643000 15.16000 0.5331000 15.99000 0.4966000 -0.8334000     0.7286000 
1 1 1 15 19 10 o 13.22000 0.3963000 12.93000 0.5724000 13.51000 0.5484000 -0.5800000     0.7927000 
1 1 1 15 19 12 o 69.40000 0.5716000 68.62000 0.8001000 70.18000 0.8165000 -1.559000      1.143000  
1 1 1 15 19 14 o 70.70000 0.5827000 69.55000 0.8110000 71.85000 0.8369000 -2.300000      1.165000  
1 1 1 15 19 16 o 77.12000 0.6304000 76.81000 0.8873000 77.44000 0.8958000 -0.6315000     1.261000  
1 1 1 15 19 18 o 48.76000 0.3820000 48.18000 0.4505000 49.35000 0.6169000 -1.173000      0.7639000 
1 1 1 15 19 20 o 15.70000 0.3033000 14.93000 0.3306000 16.47000 0.5086000 -1.546000      0.6066000 
1 1 1 15 19 22 f 14.66000 0.3200000 14.06000 0.3508000 15.26000 0.5354000 -1.200000      0.6400000 
1 1 1 15 19 24 o 7.264000 0.5588000 6.994000 0.6065000 7.535000 0.9387000 -0.5404000     1.118000  
1 1 1 15 19 26 o 20.35000 0.4510000 19.17000 0.3725000 21.53000 0.8215000 -2.365000      0.9021000 
1 1 1 15 19 28 o 17.56000 0.3557000 17.79000 0.4496000 17.32000 0.5515000 0.4719000      0.7115000 
1 1 1 15 19 30 o 16.53000 0.3577000 16.61000 0.4206000 16.45000 0.5786000 0.1605000      0.7153000 
1 1 1 15 19 32 o 29.95000 0.3216000 30.15000 0.3785000 29.75000 0.5201000 0.3926000      0.6432000 
1 1 1 15 19 34 o 8.821000 0.6309000 9.234000 0.8874000 8.408000 0.8972000 0.8268000      1.262000  
1 1 1 15 19 36 o 7.760000 0.7415000 6.655000 1.202000  8.864000 0.8693000 -2.210000      1.483000  
1 1 1 15 19 38 o 14.60000 0.4538000 15.28000 0.6639000 13.91000 0.6188000 1.367000       0.9076000 
1 1 1 15 19 40 o 16.74000 0.3903000 16.25000 0.5327000 17.22000 0.5706000 -0.9753000     0.7806000 
1 1 1 15 19 42 o 5.848000 1.033000  5.590000 1.526000  6.106000 1.392000  -0.5156000     2.065000  
1 1 1 15 19 44 f 15.79000 0.4130000 15.79000 0.6458000 15.79000 0.5149000 0.6634000E-02  0.8259000 
1 1 1 15 19 46 o 16.01000 0.4306000 15.34000 0.5778000 16.69000 0.6387000 -1.347000      0.8613000 
1 1 1 15 19 48 o 4.563000 0.9296000 5.814000 1.269000  3.313000 1.358000  2.501000       1.859000  
1 1 1 15 19 50 o 9.614000 0.5792000 9.129000 0.8624000 10.10000 0.7734000 -0.9688000     1.158000  
1 1 1 15 19 52 o 5.049000 1.005000  5.424000 1.446000  4.674000 1.397000  0.7502000      2.010000  
1 1 1 15 19 54 o 3.374000 0.9826000 2.998000 1.325000  3.751000 1.452000  -0.7535000     1.965000  
1 1 1 15 19 56 o 5.064000 1.005000  5.513000 1.460000  4.615000 1.383000  0.8981000      2.011000  
1 1 1 15 19 58 o 11.70000 0.5314000 12.43000 0.7441000 10.97000 0.7588000 1.468000       1.063000  
1 1 1 15 19 60 o 3.978000 1.022000  4.636000 1.535000  3.320000 1.351000  1.316000       2.045000  
1 1 1 15 20 1  o 34.76000 0.3019000 34.69000 0.4000000 34.82000 0.4523000 -0.1311000     0.6038000 
1 1 1 15 20 3  o 54.25000 0.4280000 53.97000 0.5562000 54.54000 0.6507000 -0.5686000     0.8560000 
1 1 1 15 20 5  o 53.46000 0.4562000 53.60000 0.6473000 53.32000 0.6429000 0.2833000      0.9123000 
1 1 1 15 20 7  o 88.14000 0.7976000 88.95000 1.247000  87.33000 0.9951000 1.620000       1.595000  
1 1 1 15 20 9  o 50.26000 0.4365000 50.55000 0.6193000 49.98000 0.6153000 0.5688000      0.8730000 
1 1 1 15 20 11 o 75.03000 0.6145000 75.14000 0.8693000 74.92000 0.8687000 0.2173000      1.229000  
1 1 1 15 20 13 o 124.3000 0.9877000 125.4000 1.406000  123.3000 1.387000  2.062000       1.975000  
1 1 1 15 20 15 o 55.60000 0.4782000 55.82000 0.6781000 55.39000 0.6743000 0.4302000      0.9563000 
1 1 1 15 20 17 o 38.92000 0.4207000 38.64000 0.5231000 39.21000 0.6589000 -0.5703000     0.8413000 
1 1 1 15 20 19 o 29.55000 0.3171000 29.97000 0.4323000 29.12000 0.4641000 0.8550000      0.6343000 
1 1 1 15 20 21 o 33.38000 0.3155000 32.81000 0.3850000 33.94000 0.4999000 -1.135000      0.6310000 
1 1 1 15 20 23 o 39.43000 0.3385000 38.99000 0.3956000 39.87000 0.5494000 -0.8809000     0.6771000 
1 1 1 15 20 25 o 29.78000 0.3584000 29.88000 0.3986000 29.68000 0.5958000 0.1967000      0.7168000 
1 1 1 15 20 27 o 42.37000 0.3540000 42.67000 0.4254000 42.07000 0.5659000 0.5948000      0.7080000 
1 1 1 15 20 29 o 8.573000 0.5540000 7.742000 0.6995000 9.404000 0.8592000 -1.662000      1.108000  
1 1 1 15 20 31 o 4.382000 0.9190000 5.285000 1.075000  3.479000 1.491000  1.805000       1.838000  
1 1 1 15 20 33 o 29.87000 0.3337000 29.58000 0.4842000 30.16000 0.4593000 -0.5816000     0.6673000 
1 1 1 15 20 35 o 23.93000 0.3221000 24.59000 0.4367000 23.28000 0.4735000 1.305000       0.6442000 
1 1 1 15 20 37 o 24.74000 0.3260000 24.61000 0.4467000 24.87000 0.4749000 -0.2579000     0.6520000 
1 1 1 15 20 39 o 14.76000 0.4672000 14.71000 0.6623000 14.81000 0.6592000 -0.1049000     0.9345000 
1 1 1 15 20 41 o 19.85000 0.3825000 20.39000 0.4813000 19.31000 0.5947000 1.083000       0.7650000 
1 1 1 15 20 43 o 9.894000 0.5873000 9.355000 0.9018000 10.43000 0.7525000 -1.079000      1.175000  
1 1 1 15 20 45 o 7.573000 0.7859000 8.572000 0.9593000 6.573000 1.245000  1.999000       1.572000  
1 1 1 15 20 47 o 9.974000 0.6146000 10.33000 0.8362000 9.615000 0.9011000 0.7181000      1.229000  
1 1 1 15 20 49 o 15.08000 0.4892000 15.37000 0.5637000 14.78000 0.7996000 0.5858000      0.9784000 
1 1 1 15 20 51 o 9.044000 0.6985000 9.355000 1.014000  8.733000 0.9614000 0.6221000      1.397000  
1 1 1 15 20 53 o 18.92000 0.4051000 18.86000 0.5354000 18.98000 0.6079000 -0.1169000     0.8101000 
1 1 1 15 20 55 f 4.183000 1.113000  4.732000 1.697000  3.635000 1.440000  1.097000       2.225000  
1 1 1 15 20 57 o 3.623000 1.007000  4.040000 1.493000  3.205000 1.352000  0.8353000      2.015000  
1 1 1 15 20 59 o 4.841000 1.071000  4.906000 1.557000  4.776000 1.471000  0.1299000      2.142000  
1 1 1 15 20 61 o 5.606000 1.199000  5.867000 1.720000  5.345000 1.671000  0.5219000      2.399000  
1 1 1 15 21 0  o 47.93000 0.5005000 47.93000 0.5005000 47.93000 0.5005000 0.000000       0.000000  
1 1 1 15 21 2  o 20.43000 0.2701000 20.88000 0.3359000 19.98000 0.4231000 0.9007000      0.5402000 
1 1 1 15 21 4  o 74.65000 0.5424000 74.70000 0.8607000 74.61000 0.6603000 0.9145000E-01  1.085000  
1 1 1 15 21 6  o 51.62000 0.5038000 50.98000 0.7793000 52.26000 0.6389000 -1.277000      1.008000  
1 1 1 15 21 8  o 57.53000 0.4870000 57.10000 0.6836000 57.97000 0.6938000 -0.8711000     0.9740000 
1 1 1 15 21 10 o 47.66000 0.4219000 47.25000 0.5911000 48.06000 0.6021000 -0.8127000     0.8437000 
1 1 1 15 21 12 o 23.14000 0.3310000 22.55000 0.4698000 23.73000 0.4665000 -1.177000      0.6621000 
1 1 1 15 21 14 o 26.15000 0.3286000 26.14000 0.4672000 26.16000 0.4621000 -0.2506000E-01 0.6571000 
1 1 1 15 21 16 o 50.19000 0.4423000 49.14000 0.6146000 51.24000 0.6363000 -2.094000      0.8846000 
1 1 1 15 21 18 o 57.38000 0.4903000 56.90000 0.6879000 57.85000 0.6987000 -0.9425000     0.9805000 
1 1 1 15 21 20 o 43.92000 0.3713000 43.33000 0.4627000 44.52000 0.5809000 -1.195000      0.7426000 
1 1 1 15 21 22 f 13.87000 0.3329000 13.85000 0.3472000 13.90000 0.5680000 -0.5326000E-01 0.6657000 
1 1 1 15 21 24 o 22.74000 0.3383000 22.36000 0.3218000 23.13000 0.5951000 -0.7711000     0.6765000 
1 1 1 15 21 26 o 17.48000 0.4083000 16.72000 0.4812000 18.24000 0.6598000 -1.520000      0.8166000 
1 1 1 15 21 28 o 54.37000 0.4431000 54.21000 0.5638000 54.53000 0.6836000 -0.3268000     0.8862000 
1 1 1 15 21 30 o 15.57000 0.5560000 14.32000 0.4353000 16.81000 1.023000  -2.486000      1.112000  
1 1 1 15 21 32 o 29.01000 0.3265000 29.03000 0.3838000 29.00000 0.5282000 0.3612000E-01  0.6529000 
1 1 1 15 21 34 o 11.46000 0.4943000 11.33000 0.6720000 11.59000 0.7250000 -0.2547000     0.9885000 
1 1 1 15 21 36 o 22.34000 0.3294000 22.12000 0.4553000 22.57000 0.4761000 -0.4469000     0.6587000 
1 1 1 15 21 38 o 5.301000 0.9742000 6.147000 1.339000  4.456000 1.415000  1.691000       1.948000  
1 1 1 15 21 40 o 14.81000 0.4527000 14.47000 0.5787000 15.14000 0.6964000 -0.6729000     0.9054000 
1 1 1 15 21 42 o 29.89000 0.5323000 29.84000 0.9084000 29.95000 0.5551000 -0.1055000     1.065000  
1 1 1 15 21 44 o 7.980000 0.6898000 7.624000 0.9598000 8.336000 0.9909000 -0.7119000     1.380000  
1 1 1 15 21 46 o 7.819000 0.6448000 7.247000 0.9895000 8.391000 0.8269000 -1.144000      1.290000  
1 1 1 15 21 48 o 14.37000 0.4190000 14.73000 0.5474000 14.01000 0.6345000 0.7186000      0.8380000 
1 1 1 15 21 50 o 12.30000 0.5345000 11.68000 0.7810000 12.91000 0.7300000 -1.230000      1.069000  
1 1 1 15 21 52 o 4.283000 1.022000  3.932000 1.417000  4.633000 1.474000  -0.7013000     2.044000  
1 1 1 15 21 54 o 4.363000 1.040000  4.361000 1.549000  4.364000 1.389000  -0.2397000E-02 2.080000  
1 1 1 15 21 56 o 16.69000 0.4211000 16.87000 0.5978000 16.51000 0.5933000 0.3578000      0.8422000 
1 1 1 15 21 58 o 8.946000 0.6453000 9.167000 0.9387000 8.724000 0.8856000 0.4428000      1.291000  
1 1 1 15 21 60 o 5.707000 0.9664000 5.072000 1.540000  6.342000 1.168000  -1.269000      1.933000  
1 1 1 15 22 1  o 23.93000 0.2427000 23.69000 0.3419000 24.16000 0.3446000 -0.4744000     0.4854000 
1 1 1 15 22 3  o 22.64000 0.3310000 23.46000 0.5854000 21.83000 0.3090000 1.623000       0.6620000 
1 1 1 15 22 5  o 45.39000 0.4046000 45.54000 0.5714000 45.24000 0.5729000 0.2984000      0.8091000 
1 1 1 15 22 7  o 29.68000 0.3800000 29.65000 0.5962000 29.71000 0.4714000 -0.6815000E-01 0.7600000 
1 1 1 15 22 9  o 77.55000 0.6328000 77.94000 0.8988000 77.15000 0.8909000 0.7882000      1.266000  
1 1 1 15 22 11 f 17.23000 0.3527000 17.14000 0.5161000 17.32000 0.4810000 -0.1741000     0.7055000 
1 1 1 15 22 13 f 89.33000 0.7212000 89.03000 1.016000  89.64000 1.024000  -0.6120000     1.442000  
1 1 1 15 22 15 o 57.95000 0.4938000 58.44000 0.7017000 57.46000 0.6950000 0.9780000      0.9876000 
1 1 1 15 22 17 o 11.99000 0.5042000 12.10000 0.6365000 11.89000 0.7822000 0.2077000      1.008000  
1 1 1 15 22 19 o 25.10000 0.3340000 25.07000 0.4726000 25.13000 0.4722000 -0.5445000E-01 0.6681000 
1 1 1 15 22 21 o 41.95000 0.3641000 41.75000 0.4623000 42.15000 0.5627000 -0.3935000     0.7282000 
1 1 1 15 22 23 o 14.91000 0.3763000 14.51000 0.3316000 15.32000 0.6756000 -0.8120000     0.7526000 
1 1 1 15 22 25 o 44.54000 0.3813000 44.05000 0.4794000 45.04000 0.5932000 -0.9898000     0.7627000 
1 1 1 15 22 27 o 14.04000 0.4105000 13.45000 0.5422000 14.64000 0.6165000 -1.193000      0.8210000 
1 1 1 15 22 29 o 23.65000 0.3777000 23.65000 0.4194000 23.64000 0.6284000 0.9382000E-02  0.7555000 
1 1 1 15 22 31 o 27.46000 0.3229000 27.56000 0.3745000 27.36000 0.5261000 0.2030000      0.6458000 
1 1 1 15 22 33 o 37.32000 0.3640000 37.95000 0.4601000 36.70000 0.5642000 1.246000       0.7280000 
1 1 1 15 22 35 o 16.14000 0.4325000 15.74000 0.5923000 16.53000 0.6303000 -0.7932000     0.8650000 
1 1 1 15 22 37 o 20.86000 0.3379000 20.09000 0.4740000 21.64000 0.4818000 -1.545000      0.6759000 
1 1 1 15 22 39 o 9.867000 0.5300000 9.651000 0.7576000 10.08000 0.7413000 -0.4314000     1.060000  
1 1 1 15 22 41 o 8.393000 0.6087000 8.903000 0.7854000 7.883000 0.9301000 1.020000       1.217000  
1 1 1 15 22 43 o 3.751000 0.9873000 3.127000 1.270000  4.376000 1.512000  -1.249000      1.975000  
1 1 1 15 22 45 o 9.386000 0.6522000 9.341000 0.9714000 9.432000 0.8706000 -0.9041000E-01 1.304000  
1 1 1 15 22 47 o 4.124000 1.038000  4.487000 1.559000  3.762000 1.370000  0.7253000      2.075000  
1 1 1 15 22 49 o 3.282000 0.9647000 3.209000 1.422000  3.355000 1.304000  -0.1466000     1.929000  
1 1 1 15 22 51 o 3.688000 1.005000  3.455000 1.401000  3.921000 1.441000  -0.4660000     2.010000  
1 1 1 15 22 53 o 10.90000 0.9674000 10.80000 0.8914000 11.00000 1.717000  -0.2007000     1.935000  
1 1 1 15 22 55 o 12.49000 0.5131000 12.58000 0.7401000 12.41000 0.7108000 0.1744000      1.026000  
1 1 1 15 22 57 o 3.100000 0.9296000 3.304000 1.387000  2.897000 1.238000  0.4071000      1.859000  
1 1 1 15 22 59 o 3.810000 0.9373000 2.818000 1.293000  4.801000 1.357000  -1.983000      1.875000  
1 1 1 15 23 0  o 6.918000 0.6508000 6.918000 0.6508000 6.918000 0.6508000 0.000000       0.000000  
1 1 1 15 23 2  f 42.35000 0.3546000 42.44000 0.5462000 42.25000 0.4524000 0.1883000      0.7092000 
1 1 1 15 23 4  o 42.64000 0.4029000 42.89000 0.6961000 42.39000 0.4059000 0.4964000      0.8058000 
1 1 1 15 23 6  o 20.89000 0.3854000 21.00000 0.6167000 20.78000 0.4623000 0.2255000      0.7707000 
1 1 1 15 23 8  o 14.94000 0.3674000 15.54000 0.5083000 14.33000 0.5306000 1.208000       0.7348000 
1 1 1 15 23 10 o 29.67000 0.3312000 29.21000 0.4634000 30.14000 0.4733000 -0.9323000     0.6624000 
1 1 1 15 23 12 o 46.77000 0.4185000 46.50000 0.5879000 47.03000 0.5956000 -0.5349000     0.8369000 
1 1 1 15 23 14 o 29.78000 0.3359000 29.11000 0.4729000 30.44000 0.4771000 -1.333000      0.6717000 
1 1 1 15 23 16 o 50.75000 0.5033000 51.28000 0.6382000 50.22000 0.7784000 1.057000       1.007000  
1 1 1 15 23 18 o 67.50000 0.5634000 68.33000 0.8041000 66.67000 0.7894000 1.660000       1.127000  
1 1 1 15 23 20 o 55.94000 0.7382000 55.27000 0.8422000 56.61000 1.213000  -1.341000      1.476000  
1 1 1 15 23 22 o 19.73000 0.2867000 19.56000 0.3025000 19.91000 0.4871000 -0.3421000     0.5733000 
1 1 1 15 23 24 o 21.11000 0.3023000 20.51000 0.3474000 21.72000 0.4948000 -1.211000      0.6046000 
1 1 1 15 23 26 o 10.36000 0.4805000 10.21000 0.5491000 10.51000 0.7888000 -0.3074000     0.9611000 
1 1 1 15 23 28 o 50.86000 0.4654000 50.66000 0.4848000 51.06000 0.7945000 -0.4032000     0.9307000 
1 1 1 15 23 30 o 30.30000 0.3930000 30.63000 0.4385000 29.97000 0.6524000 0.6529000      0.7861000 
1 1 1 15 23 32 o 32.94000 0.3943000 33.69000 0.4335000 32.19000 0.6587000 1.500000       0.7886000 
1 1 1 15 23 34 o 27.93000 0.3424000 27.77000 0.4935000 28.10000 0.4747000 -0.3359000     0.6848000 
1 1 1 15 23 36 o 12.18000 0.4618000 12.23000 0.6436000 12.13000 0.6625000 0.9289000E-01  0.9237000 
1 1 1 15 23 38 o 15.12000 0.5122000 14.86000 0.8635000 15.37000 0.5510000 -0.5136000     1.024000  
1 1 1 15 23 40 o 19.54000 0.3750000 19.26000 0.5669000 19.81000 0.4911000 -0.5550000     0.7500000 
1 1 1 15 23 42 o 7.848000 0.7957000 7.185000 1.274000  8.510000 0.9534000 -1.325000      1.591000  
1 1 1 15 23 44 o 9.224000 0.7752000 8.155000 1.379000  10.29000 0.7089000 -2.138000      1.550000  
1 1 1 15 23 46 o 7.386000 0.7007000 9.163000 0.9301000 5.610000 1.048000  3.553000       1.401000  
1 1 1 15 23 48 f 21.81000 0.3592000 21.59000 0.5697000 22.02000 0.4377000 -0.4229000     0.7184000 
1 1 1 15 23 50 o 8.714000 0.6444000 8.783000 1.036000  8.644000 0.7671000 0.1386000      1.289000  
1 1 1 15 23 52 o 7.282000 0.9609000 7.841000 1.267000  6.723000 1.445000  1.118000       1.922000  
1 1 1 15 23 54 o 7.718000 1.192000  8.165000 1.788000  7.271000 1.577000  0.8939000      2.384000  
1 1 1 15 23 56 o 5.152000 1.124000  5.500000 1.621000  4.804000 1.557000  0.6955000      2.248000  
1 1 1 15 23 58 o 3.398000 0.9995000 3.938000 1.552000  2.857000 1.260000  1.081000       1.999000  
1 1 1 15 24 1  o 82.44000 0.5750000 82.13000 0.8116000 82.74000 0.8149000 -0.6058000     1.150000  
1 1 1 15 24 3  o 45.28000 0.3740000 45.88000 0.5772000 44.68000 0.4758000 1.199000       0.7480000 
1 1 1 15 24 5  o 20.43000 0.3249000 20.67000 0.4624000 20.18000 0.4565000 0.4925000      0.6498000 
1 1 1 15 24 7  o 47.60000 0.4227000 47.43000 0.5929000 47.78000 0.6026000 -0.3473000     0.8453000 
1 1 1 15 24 9  o 61.40000 0.5171000 61.02000 0.7244000 61.77000 0.7380000 -0.7516000     1.034000  
1 1 1 15 24 11 o 52.04000 0.4540000 51.98000 0.6401000 52.10000 0.6439000 -0.1203000     0.9080000 
1 1 1 15 24 13 o 69.81000 0.5782000 69.79000 0.8167000 69.83000 0.8187000 -0.4231000E-01 1.156000  
1 1 1 15 24 15 o 22.52000 0.3345000 23.06000 0.4648000 21.99000 0.4811000 1.073000       0.6689000 
1 1 1 15 24 17 o 46.68000 0.4218000 45.67000 0.5832000 47.68000 0.6096000 -2.012000      0.8436000 
1 1 1 15 24 19 o 65.54000 0.6768000 65.30000 0.9561000 65.77000 0.9583000 -0.4759000     1.354000  
1 1 1 15 24 21 o 30.96000 0.3573000 30.44000 0.4962000 31.49000 0.5143000 -1.046000      0.7146000 
1 1 1 15 24 23 o 23.71000 0.3976000 23.23000 0.6164000 24.19000 0.5024000 -0.9517000     0.7952000 
1 1 1 15 24 25 o 31.76000 0.3277000 31.07000 0.3912000 32.46000 0.5259000 -1.397000      0.6555000 
1 1 1 15 24 27 o 15.01000 0.3729000 15.02000 0.4585000 15.00000 0.5882000 0.2037000E-01  0.7458000 
1 1 1 15 24 29 f 11.50000 0.5469000 11.23000 0.5286000 11.77000 0.9575000 -0.5355000     1.094000  
1 1 1 15 24 31 o 29.01000 0.4068000 29.35000 0.5065000 28.67000 0.6368000 0.6786000      0.8137000 
1 1 1 15 24 33 o 31.01000 0.3363000 31.07000 0.3951000 30.95000 0.5442000 0.1173000      0.6725000 
1 1 1 15 24 35 o 20.34000 0.3454000 20.35000 0.4699000 20.33000 0.5063000 0.2304000E-01  0.6908000 
1 1 1 15 24 37 o 10.96000 0.6689000 10.95000 1.099000  10.97000 0.7626000 -0.2443000E-01 1.338000  
1 1 1 15 24 39 o 17.86000 0.3897000 18.24000 0.5854000 17.48000 0.5144000 0.7632000      0.7793000 
1 1 1 15 24 41 o 18.57000 0.4379000 18.51000 0.6582000 18.64000 0.5779000 -0.1245000     0.8759000 
1 1 1 15 24 43 o 13.70000 0.5131000 13.31000 0.8887000 14.09000 0.5131000 -0.7713000     1.026000  
1 1 1 15 24 45 o 7.431000 0.7106000 7.504000 1.220000  7.358000 0.7292000 0.1457000      1.421000  
1 1 1 15 24 47 o 12.64000 0.5470000 12.90000 0.9389000 12.38000 0.5615000 0.5296000      1.094000  
1 1 1 15 24 49 o 5.388000 0.9944000 6.278000 1.490000  4.499000 1.318000  1.779000       1.989000  
1 1 1 15 24 51 o 15.05000 0.4525000 15.13000 0.7029000 14.97000 0.5701000 0.1558000      0.9050000 
1 1 1 15 24 53 o 9.198000 0.7043000 9.226000 1.084000  9.170000 0.9001000 0.5587000E-01  1.409000  
1 1 1 15 24 55 o 4.135000 1.096000  4.217000 1.757000  4.054000 1.311000  0.1631000      2.192000  
1 1 1 15 24 57 o 9.115000 0.6312000 9.369000 0.8723000 8.860000 0.9126000 0.5087000      1.262000  
1 1 1 15 24 59 o 5.148000 0.9398000 4.205000 1.520000  6.091000 1.105000  -1.886000      1.880000  
1 1 1 15 25 0  o 77.33000 0.7669000 77.33000 0.7669000 77.33000 0.7669000 0.000000       0.000000  
1 1 1 15 25 2  o 68.94000 0.5283000 68.72000 0.7984000 69.16000 0.6921000 -0.4454000     1.057000  
1 1 1 15 25 4  o 14.02000 0.2827000 14.27000 0.4992000 13.77000 0.2655000 0.4939000      0.5654000 
1 1 1 15 25 6  f 18.78000 0.4031000 18.48000 0.6552000 19.09000 0.4699000 -0.6120000     0.8063000 
1 1 1 15 25 8  o 14.47000 0.3868000 14.34000 0.5517000 14.60000 0.5423000 -0.2661000     0.7736000 
1 1 1 15 25 10 o 20.63000 0.3350000 20.58000 0.4782000 20.68000 0.4692000 -0.1008000     0.6700000 
1 1 1 15 25 12 o 17.50000 0.3618000 16.79000 0.5216000 18.21000 0.5016000 -1.418000      0.7236000 
1 1 1 15 25 14 o 33.37000 0.3510000 33.56000 0.4959000 33.19000 0.4968000 0.3729000      0.7019000 
1 1 1 15 25 16 o 15.33000 0.4435000 15.05000 0.5441000 15.60000 0.7006000 -0.5505000     0.8871000 
1 1 1 15 25 18 o 29.14000 0.3833000 29.46000 0.4822000 28.81000 0.5958000 0.6519000      0.7665000 
1 1 1 15 25 20 o 79.30000 0.6517000 79.58000 0.9232000 79.02000 0.9202000 0.5602000      1.303000  
1 1 1 15 25 22 o 21.80000 0.3933000 21.85000 0.6079000 21.76000 0.4991000 0.8923000E-01  0.7866000 
1 1 1 15 25 24 o 19.50000 0.3431000 19.69000 0.4392000 19.32000 0.5273000 0.3630000      0.6863000 
1 1 1 15 25 26 o 27.71000 0.3129000 27.07000 0.3492000 28.35000 0.5192000 -1.281000      0.6258000 
1 1 1 15 25 28 o 37.66000 0.4092000 37.39000 0.4531000 37.94000 0.6816000 -0.5469000     0.8184000 
1 1 1 15 25 30 o 40.71000 0.3764000 40.96000 0.4737000 40.46000 0.5851000 0.4969000      0.7529000 
1 1 1 15 25 32 o 33.17000 0.3544000 33.75000 0.4416000 32.58000 0.5546000 1.177000       0.7089000 
1 1 1 15 25 34 o 47.61000 0.5425000 46.59000 0.7300000 48.64000 0.8027000 -2.050000      1.085000  
1 1 1 15 25 36 o 15.10000 0.4066000 14.33000 0.5637000 15.88000 0.5861000 -1.547000      0.8132000 
1 1 1 15 25 38 o 18.89000 0.3585000 18.63000 0.5597000 19.15000 0.4481000 -0.5186000     0.7170000 
1 1 1 15 25 40 o 11.63000 0.5252000 11.62000 0.8650000 11.65000 0.5960000 -0.3437000E-01 1.050000  
1 1 1 15 25 42 o 19.29000 0.3552000 19.40000 0.5574000 19.18000 0.4404000 0.2253000      0.7104000 
1 1 1 15 25 44 o 10.67000 0.6930000 9.688000 1.240000  11.64000 0.6189000 -1.956000      1.386000  
1 1 1 15 25 46 o 9.053000 0.5723000 9.246000 0.9294000 8.860000 0.6682000 0.3860000      1.145000  
1 1 1 15 25 48 o 8.901000 0.6307000 8.834000 1.028000  8.969000 0.7312000 -0.1351000     1.261000  
1 1 1 15 25 50 o 4.130000 1.025000  3.658000 1.463000  4.602000 1.436000  -0.9447000     2.050000  
1 1 1 15 25 52 o 6.117000 0.9370000 8.005000 1.223000  4.229000 1.420000  3.777000       1.874000  
1 1 1 15 25 54 o 4.615000 0.9884000 4.133000 1.541000  5.097000 1.238000  -0.9637000     1.977000  
1 1 1 15 25 56 o 6.882000 0.9329000 6.211000 1.604000  7.554000 0.9527000 -1.344000      1.866000  
1 1 1 15 25 58 o 6.029000 1.185000  6.839000 1.482000  5.220000 1.849000  1.619000       2.370000  
1 1 1 15 26 1  o 53.55000 0.3924000 53.18000 0.5530000 53.91000 0.5567000 -0.7247000     0.7847000 
1 1 1 15 26 3  o 28.37000 0.2574000 27.93000 0.3728000 28.81000 0.3551000 -0.8761000     0.5148000 
1 1 1 15 26 5  o 34.81000 0.4542000 34.57000 0.6340000 35.04000 0.6506000 -0.4671000     0.9084000 
1 1 1 15 26 7  o 37.70000 0.3671000 37.84000 0.5138000 37.56000 0.5244000 0.2791000      0.7342000 
1 1 1 15 26 9  o 30.99000 0.3375000 31.01000 0.4758000 30.97000 0.4788000 0.4895000E-01  0.6750000 
1 1 1 15 26 11 o 40.11000 0.3832000 40.43000 0.5417000 39.80000 0.5421000 0.6247000      0.7663000 
1 1 1 15 26 13 o 10.64000 0.4707000 10.33000 0.6636000 10.94000 0.6677000 -0.6056000     0.9414000 
1 1 1 15 26 15 o 62.44000 0.7546000 61.94000 0.7413000 62.94000 1.315000  -1.002000      1.509000  
1 1 1 15 26 17 o 50.03000 0.4984000 50.15000 0.6284000 49.91000 0.7739000 0.2429000      0.9969000 
1 1 1 15 26 19 o 5.989000 0.8753000 5.997000 1.279000  5.980000 1.196000  0.1704000E-01  1.751000  
1 1 1 15 26 21 o 14.04000 0.6218000 14.08000 1.093000  14.01000 0.5936000 0.6189000E-01  1.244000  
1 1 1 15 26 23 o 33.40000 0.3681000 33.61000 0.5235000 33.20000 0.5178000 0.4101000      0.7363000 
1 1 1 15 26 25 o 16.88000 0.3433000 17.18000 0.3628000 16.59000 0.5830000 0.5898000      0.6866000 
1 1 1 15 26 27 o 22.04000 0.3794000 21.13000 0.3893000 22.94000 0.6512000 -1.805000      0.7587000 
1 1 1 15 26 29 o 49.93000 0.4837000 49.92000 0.5457000 49.94000 0.7989000 -0.2669000E-01 0.9675000 
1 1 1 15 26 31 o 27.12000 0.3713000 27.86000 0.4974000 26.38000 0.5514000 1.475000       0.7426000 
1 1 1 15 26 33 f 24.41000 0.3910000 24.58000 0.5501000 24.25000 0.5558000 0.3350000      0.7820000 
1 1 1 15 26 35 o 4.387000 1.043000  4.781000 1.512000  3.994000 1.438000  0.7870000      2.086000  
1 1 1 15 26 37 o 24.99000 0.3184000 24.40000 0.4876000 25.58000 0.4097000 -1.187000      0.6369000 
1 1 1 15 26 39 o 22.20000 0.3451000 22.05000 0.5280000 22.36000 0.4446000 -0.3114000     0.6902000 
1 1 1 15 26 41 o 19.62000 0.3888000 19.59000 0.5462000 19.64000 0.5534000 -0.4558000E-01 0.7775000 
1 1 1 15 26 43 o 7.523000 0.8354000 8.415000 1.293000  6.632000 1.059000  1.783000       1.671000  
1 1 1 15 26 45 o 4.306000 0.9945000 4.553000 1.564000  4.060000 1.229000  0.4929000      1.989000  
1 1 1 15 26 47 o 8.481000 0.6439000 8.894000 1.029000  8.068000 0.7749000 0.8259000      1.288000  
1 1 1 15 26 49 f 6.921000 0.8928000 6.661000 1.432000  7.180000 1.066000  -0.5195000     1.786000  
1 1 1 15 26 51 o 3.527000 1.004000  3.823000 1.520000  3.231000 1.311000  0.5913000      2.007000  
1 1 1 15 26 53 o 5.304000 1.237000  5.395000 2.065000  5.213000 1.363000  0.1814000      2.475000  
1 1 1 15 26 55 o 3.712000 1.006000  4.544000 1.592000  2.881000 1.231000  1.662000       2.012000  
1 1 1 15 26 57 o 4.418000 1.015000  4.307000 1.663000  4.529000 1.163000  -0.2223000     2.030000  
1 1 1 15 27 0  o 92.95000 0.9120000 92.95000 0.9120000 92.95000 0.9120000 0.000000       0.000000  
1 1 1 15 27 2  f 51.10000 0.4099000 51.51000 0.6275000 50.69000 0.5275000 0.8140000      0.8197000 
1 1 1 15 27 4  o 18.25000 0.2722000 17.88000 0.4538000 18.63000 0.3009000 -0.7438000     0.5444000 
1 1 1 15 27 6  o 24.63000 0.3556000 24.68000 0.3752000 24.58000 0.6041000 0.1026000      0.7112000 
1 1 1 15 27 8  o 47.36000 0.4254000 48.19000 0.6045000 46.52000 0.5987000 1.670000       0.8508000 
1 1 1 15 27 10 o 44.07000 0.4062000 44.00000 0.5706000 44.15000 0.5783000 -0.1498000     0.8124000 
1 1 1 15 27 12 f 19.28000 0.3461000 19.28000 0.4781000 19.28000 0.5007000 0.2098000E-02  0.6923000 
1 1 1 15 27 14 o 28.66000 0.3827000 28.65000 0.4787000 28.67000 0.5972000 -0.1657000E-01 0.7654000 
1 1 1 15 27 16 o 20.39000 0.3511000 20.25000 0.4703000 20.52000 0.5215000 -0.2644000     0.7022000 
1 1 1 15 27 18 o 25.46000 0.5351000 25.68000 0.9439000 25.23000 0.5044000 0.4439000      1.070000  
1 1 1 15 27 20 o 21.77000 0.4940000 22.63000 0.8391000 20.92000 0.5213000 1.718000       0.9879000 
1 1 1 15 27 22 o 32.63000 0.3657000 33.07000 0.5136000 32.19000 0.5208000 0.8805000      0.7315000 
1 1 1 15 27 24 o 15.68000 0.4193000 15.68000 0.4193000 ?        ?         ?              ?         
1 1 1 15 27 26 o 32.15000 0.3694000 32.16000 0.3741000 32.14000 0.6372000 0.2122000E-01  0.7389000 
1 1 1 15 27 28 o 10.23000 0.5768000 9.702000 0.5451000 10.75000 1.017000  -1.050000      1.154000  
1 1 1 15 27 30 o 3.973000 0.9080000 2.392000 1.085000  5.553000 1.456000  -3.162000      1.816000  
1 1 1 15 27 32 o 4.095000 0.9990000 3.437000 1.350000  4.753000 1.473000  -1.317000      1.998000  
1 1 1 15 27 34 o 29.19000 0.3435000 29.24000 0.4294000 29.14000 0.5362000 0.1014000      0.6869000 
1 1 1 15 27 36 o 14.19000 0.3898000 13.73000 0.6247000 14.65000 0.4666000 -0.9223000     0.7797000 
1 1 1 15 27 38 f 9.089000 0.5823000 8.402000 0.9336000 9.775000 0.6963000 -1.372000      1.165000  
1 1 1 15 27 40 o 7.049000 0.7884000 7.895000 1.105000  6.204000 1.125000  1.690000       1.577000  
1 1 1 15 27 42 o 13.53000 0.4335000 13.84000 0.6819000 13.22000 0.5354000 0.6180000      0.8670000 
1 1 1 15 27 44 o 8.488000 0.7687000 8.365000 1.359000  8.611000 0.7197000 -0.2456000     1.537000  
1 1 1 15 27 46 o 3.058000 0.8999000 3.787000 1.473000  2.330000 1.034000  1.457000       1.800000  
1 1 1 15 27 48 o 10.92000 0.5318000 11.31000 0.8610000 10.54000 0.6246000 0.7687000      1.064000  
1 1 1 15 27 50 o 2.507000 0.8235000 2.846000 1.290000  2.169000 1.024000  0.6771000      1.647000  
1 1 1 15 27 52 o 4.333000 1.066000  4.436000 1.660000  4.231000 1.339000  0.2048000      2.132000  
1 1 1 15 27 54 o 3.510000 0.9155000 2.915000 1.314000  4.105000 1.275000  -1.190000      1.831000  
1 1 1 15 27 56 o 5.032000 1.161000  6.406000 1.879000  3.659000 1.364000  2.746000       2.322000  
1 1 1 15 28 1  o 28.87000 0.2888000 29.06000 0.4448000 28.69000 0.3683000 0.3770000      0.5775000 
1 1 1 15 28 3  o 16.27000 0.2451000 16.77000 0.3731000 15.76000 0.3179000 1.013000       0.4902000 
1 1 1 15 28 5  o 56.32000 0.5453000 56.52000 0.6829000 56.12000 0.8503000 0.4000000      1.091000  
1 1 1 15 28 7  o 37.89000 0.4001000 38.24000 0.4440000 37.53000 0.6656000 0.7126000      0.8001000 
1 1 1 15 28 9  o 46.10000 0.4194000 45.06000 0.5762000 47.14000 0.6095000 -2.081000      0.8387000 
1 1 1 15 28 11 o 20.29000 0.3766000 19.84000 0.4696000 20.73000 0.5889000 -0.8957000     0.7532000 
1 1 1 15 28 13 o 38.28000 0.4216000 38.01000 0.5224000 38.56000 0.6618000 -0.5508000     0.8431000 
1 1 1 15 28 15 o 35.59000 0.4158000 36.19000 0.5168000 35.00000 0.6515000 1.192000       0.8317000 
1 1 1 15 28 17 o 63.92000 0.6068000 63.85000 0.9356000 63.99000 0.7729000 -0.1430000     1.214000  
1 1 1 15 28 19 o 25.68000 0.4260000 25.74000 0.5867000 25.63000 0.6179000 0.1159000      0.8520000 
1 1 1 15 28 21 o 34.83000 0.4126000 35.26000 0.5297000 34.40000 0.6329000 0.8642000      0.8253000 
1 1 1 15 28 23 o 34.14000 0.4176000 33.89000 0.6353000 34.40000 0.5423000 -0.5112000     0.8353000 
1 1 1 15 28 25 o 11.94000 0.5274000 12.43000 0.4097000 11.45000 0.9721000 0.9833000      1.055000  
1 1 1 15 28 27 o 28.57000 0.3200000 27.66000 0.3555000 29.48000 0.5321000 -1.816000      0.6400000 
1 1 1 15 28 29 o 10.83000 0.6038000 10.81000 0.8137000 10.85000 0.8924000 -0.3404000E-01 1.208000  
1 1 1 15 28 31 o 18.87000 0.3576000 18.81000 0.4260000 18.92000 0.5745000 -0.1055000     0.7152000 
1 1 1 15 28 33 o 10.65000 0.5209000 10.88000 0.6340000 10.41000 0.8268000 0.4636000      1.042000  
1 1 1 15 28 35 o 4.264000 0.9332000 4.530000 1.416000  3.997000 1.215000  0.5329000      1.866000  
1 1 1 15 28 37 o 8.839000 0.5761000 8.973000 0.8486000 8.705000 0.7793000 0.2679000      1.152000  
1 1 1 15 28 39 o 9.805000 0.5596000 10.46000 0.8799000 9.144000 0.6917000 1.320000       1.119000  
1 1 1 15 28 41 o 15.71000 0.3786000 16.21000 0.5811000 15.20000 0.4853000 1.004000       0.7571000 
1 1 1 15 28 43 o 9.873000 0.5436000 9.310000 0.9031000 10.44000 0.6054000 -1.127000      1.087000  
1 1 1 15 28 45 o 6.796000 0.9258000 6.808000 1.672000  6.785000 0.7967000 0.2220000E-01  1.852000  
1 1 1 15 28 47 o 4.630000 1.003000  4.791000 1.536000  4.470000 1.289000  0.3209000      2.005000  
1 1 1 15 28 49 o 5.030000 0.9884000 4.550000 1.604000  5.510000 1.155000  -0.9600000     1.977000  
1 1 1 15 28 51 o 6.025000 0.9031000 6.654000 1.307000  5.395000 1.247000  1.259000       1.806000  
1 1 1 15 28 53 o 6.224000 0.9314000 5.347000 1.633000  7.101000 0.8956000 -1.753000      1.863000  
1 1 1 15 28 55 o 5.881000 1.009000  6.261000 1.453000  5.501000 1.400000  0.7601000      2.018000  
1 1 1 15 28 57 o 4.632000 0.9920000 3.734000 1.585000  5.531000 1.193000  -1.796000      1.984000  
1 1 1 15 29 0  o 9.918000 0.4688000 9.918000 0.4688000 9.918000 0.4688000 0.000000       0.000000  
1 1 1 15 29 2  o 48.51000 0.3624000 48.23000 0.5128000 48.79000 0.5122000 -0.5616000     0.7248000 
1 1 1 15 29 4  o 68.14000 0.5256000 67.39000 0.7930000 68.89000 0.6900000 -1.507000      1.051000  
1 1 1 15 29 6  o 39.97000 0.4170000 39.05000 0.4464000 40.88000 0.7045000 -1.833000      0.8340000 
1 1 1 15 29 8  o 28.61000 0.4900000 28.49000 0.3872000 28.72000 0.9003000 -0.2267000     0.9801000 
1 1 1 15 29 10 o 29.16000 0.4975000 28.65000 0.3949000 29.67000 0.9132000 -1.018000      0.9950000 
1 1 1 15 29 12 f 22.80000 0.3376000 22.83000 0.4597000 22.76000 0.4946000 0.7067000E-01  0.6752000 
1 1 1 15 29 14 o 17.22000 0.6323000 18.14000 1.048000  16.31000 0.7080000 1.836000       1.265000  
1 1 1 15 29 16 o 39.98000 0.5842000 38.53000 0.6495000 41.43000 0.9713000 -2.895000      1.168000  
1 1 1 15 29 18 o 14.69000 0.6226000 14.99000 1.075000  14.39000 0.6290000 0.6049000      1.245000  
1 1 1 15 29 20 o 16.68000 0.4517000 17.08000 0.6928000 16.28000 0.5797000 0.8022000      0.9034000 
1 1 1 15 29 22 o 19.81000 0.3708000 20.49000 0.5193000 19.13000 0.5293000 1.359000       0.7416000 
1 1 1 15 29 24 o 5.972000 1.096000  5.622000 1.502000  6.322000 1.597000  -0.7001000     2.192000  
1 1 1 15 29 26 o 21.06000 0.3424000 20.43000 0.4277000 21.70000 0.5347000 -1.270000      0.6847000 
1 1 1 15 29 28 o 12.50000 0.4453000 11.96000 0.5615000 13.04000 0.6914000 -1.085000      0.8907000 
1 1 1 15 29 30 o 13.58000 0.4641000 13.66000 0.6058000 13.51000 0.7032000 0.1464000      0.9281000 
1 1 1 15 29 32 o 12.76000 0.4484000 12.53000 0.5650000 13.00000 0.6966000 -0.4743000     0.8969000 
1 1 1 15 29 34 o 10.73000 0.4351000 10.74000 0.6067000 10.73000 0.6238000 0.1465000E-01  0.8702000 
1 1 1 15 29 36 o 12.35000 0.4297000 12.32000 0.6400000 12.38000 0.5737000 -0.6319000E-01 0.8595000 
1 1 1 15 29 38 o 22.60000 0.3579000 22.07000 0.5835000 23.12000 0.4148000 -1.046000      0.7159000 
1 1 1 15 29 40 o 14.40000 0.3935000 14.55000 0.6038000 14.24000 0.5048000 0.3124000      0.7870000 
1 1 1 15 29 42 o 11.94000 0.5645000 11.37000 0.8923000 12.52000 0.6919000 -1.154000      1.129000  
1 1 1 15 29 44 o 13.54000 0.4193000 13.80000 0.6680000 13.27000 0.5068000 0.5361000      0.8386000 
1 1 1 15 29 46 o 13.15000 0.4774000 12.30000 0.7782000 14.00000 0.5532000 -1.697000      0.9548000 
1 1 1 15 29 48 o 16.08000 0.4052000 16.29000 0.6415000 15.86000 0.4950000 0.4295000      0.8103000 
1 1 1 15 29 50 o 10.61000 0.5792000 11.03000 0.8752000 10.20000 0.7589000 0.8263000      1.158000  
1 1 1 15 29 52 o 12.30000 0.7008000 13.04000 1.231000  11.56000 0.6702000 1.478000       1.402000  
1 1 1 15 29 54 o 7.347000 0.8743000 7.243000 1.385000  7.451000 1.067000  -0.2074000     1.749000  
1 1 1 15 29 56 o 3.467000 0.9784000 4.151000 1.577000  2.784000 1.158000  1.366000       1.957000  
1 1 1 15 30 1  o 19.27000 0.2805000 19.03000 0.4374000 19.51000 0.3512000 -0.4844000     0.5610000 
1 1 1 15 30 3  o 24.23000 0.2505000 24.05000 0.3667000 24.40000 0.3413000 -0.3571000     0.5009000 
1 1 1 15 30 5  o 25.29000 0.4808000 25.35000 0.3751000 25.24000 0.8854000 0.1036000      0.9616000 
1 1 1 15 30 7  o 49.85000 0.6241000 49.17000 0.5269000 50.53000 1.132000  -1.362000      1.248000  
1 1 1 15 30 9  o 9.486000 0.6131000 9.338000 0.6000000 9.633000 1.069000  -0.2948000     1.226000  
1 1 1 15 30 11 o 7.905000 0.7129000 7.292000 0.8607000 8.517000 1.137000  -1.224000      1.426000  
1 1 1 15 30 13 o 36.15000 0.4626000 36.61000 0.6407000 35.68000 0.6676000 0.9211000      0.9253000 
1 1 1 15 30 15 o 37.26000 0.5100000 36.75000 0.8603000 37.78000 0.5480000 -1.037000      1.020000  
1 1 1 15 30 17 o 25.70000 0.5742000 25.02000 0.9656000 26.38000 0.6215000 -1.364000      1.148000  
1 1 1 15 30 19 o 44.52000 0.4801000 44.29000 0.7452000 44.75000 0.6054000 -0.4578000     0.9601000 
1 1 1 15 30 21 o 30.49000 0.4025000 30.80000 0.5099000 30.18000 0.6229000 0.6157000      0.8050000 
1 1 1 15 30 23 o 43.07000 0.4635000 43.78000 0.5901000 42.37000 0.7148000 1.411000       0.9269000 
1 1 1 15 30 25 o 20.23000 0.3930000 19.99000 0.5495000 20.46000 0.5620000 -0.4764000     0.7860000 
1 1 1 15 30 27 o 16.73000 0.4108000 16.49000 0.3762000 16.98000 0.7305000 -0.4880000     0.8216000 
1 1 1 15 30 29 o 8.983000 0.5726000 8.401000 0.6532000 9.565000 0.9407000 -1.163000      1.145000  
1 1 1 15 30 31 o 22.31000 0.3758000 21.54000 0.3798000 23.08000 0.6485000 -1.540000      0.7515000 
1 1 1 15 30 33 o 25.66000 0.3374000 25.50000 0.5185000 25.82000 0.4318000 -0.3156000     0.6747000 
1 1 1 15 30 35 o 10.02000 0.4977000 9.338000 0.7910000 10.71000 0.6042000 -1.374000      0.9954000 
1 1 1 15 30 37 o 14.57000 0.4136000 14.62000 0.6706000 14.51000 0.4843000 0.1114000      0.8272000 
1 1 1 15 30 39 o 5.878000 0.8428000 6.445000 1.205000  5.311000 1.179000  1.133000       1.686000  
1 1 1 15 30 41 o 3.576000 0.9588000 3.533000 1.394000  3.619000 1.316000  -0.8646000E-01 1.918000  
1 1 1 15 30 43 o 15.19000 0.4089000 15.35000 0.6040000 15.03000 0.5512000 0.3185000      0.8177000 
1 1 1 15 30 45 o 8.062000 0.7894000 8.250000 1.380000  7.874000 0.7673000 0.3761000      1.579000  
1 1 1 15 30 47 o 6.609000 0.7525000 6.665000 1.207000  6.553000 0.8990000 0.1119000      1.505000  
1 1 1 15 30 49 o 8.129000 0.7337000 7.810000 1.259000  8.448000 0.7546000 -0.6382000     1.467000  
1 1 1 15 30 51 o 11.62000 0.5510000 10.03000 0.9206000 13.22000 0.6058000 -3.195000      1.102000  
1 1 1 15 30 53 o 3.300000 0.9938000 3.788000 1.580000  2.811000 1.206000  0.9769000      1.988000  
1 1 1 15 30 55 o 4.316000 1.016000  4.447000 1.624000  4.185000 1.221000  0.2615000      2.032000  
1 1 1 15 31 0  o 25.55000 0.5061000 25.55000 0.5061000 25.55000 0.5061000 0.000000       0.000000  
1 1 1 15 31 2  o 31.37000 0.3356000 31.21000 0.5139000 31.52000 0.4319000 -0.3053000     0.6713000 
1 1 1 15 31 4  f 8.939000 0.4782000 9.491000 0.8350000 8.387000 0.4664000 1.104000       0.9565000 
1 1 1 15 31 6  o 14.29000 0.4600000 14.34000 0.4786000 14.23000 0.7858000 0.1075000      0.9201000 
1 1 1 15 31 8  o 30.95000 0.3982000 30.39000 0.4565000 31.52000 0.6527000 -1.129000      0.7965000 
1 1 1 15 31 10 o 14.80000 0.4539000 14.43000 0.5180000 15.16000 0.7456000 -0.7277000     0.9079000 
1 1 1 15 31 12 o 26.64000 0.3924000 26.14000 0.4488000 27.15000 0.6438000 -1.005000      0.7848000 
1 1 1 15 31 14 o 21.95000 0.4826000 21.32000 0.4590000 22.57000 0.8492000 -1.253000      0.9653000 
1 1 1 15 31 16 o 22.11000 0.4101000 21.31000 0.4927000 22.92000 0.6556000 -1.618000      0.8201000 
1 1 1 15 31 18 o 19.62000 0.3865000 19.16000 0.5472000 20.09000 0.5459000 -0.9266000     0.7729000 
1 1 1 15 31 20 o 8.264000 0.7997000 8.906000 0.9781000 7.621000 1.265000  1.284000       1.599000  
1 1 1 15 31 22 f 35.12000 0.3806000 35.27000 0.5270000 34.97000 0.5492000 0.3019000      0.7611000 
1 1 1 15 31 24 o 36.26000 0.3886000 36.53000 0.5409000 35.98000 0.5581000 0.5469000      0.7772000 
1 1 1 15 31 26 o 18.17000 0.3661000 18.00000 0.4405000 18.35000 0.5848000 -0.3474000     0.7322000 
1 1 1 15 31 28 o 8.923000 0.5625000 9.206000 0.5371000 8.640000 0.9885000 0.5656000      1.125000  
1 1 1 15 31 30 o 16.89000 0.4183000 16.08000 0.4156000 17.69000 0.7261000 -1.612000      0.8366000 
1 1 1 15 31 32 o 17.31000 0.3237000 17.51000 0.4657000 17.12000 0.4498000 0.4000000      0.6475000 
1 1 1 15 31 34 o 5.902000 0.7412000 5.497000 1.170000  6.307000 0.9109000 -0.8101000     1.482000  
1 1 1 15 31 36 f 16.28000 0.3422000 16.93000 0.5213000 15.62000 0.4434000 1.314000       0.6844000 
1 1 1 15 31 38 o 14.04000 0.3839000 14.38000 0.5943000 13.69000 0.4863000 0.6892000      0.7679000 
1 1 1 15 31 40 o 7.477000 0.6537000 6.860000 1.089000  8.093000 0.7240000 -1.232000      1.307000  
1 1 1 15 31 42 o 8.747000 0.6054000 8.830000 0.9832000 8.664000 0.7065000 0.1664000      1.211000  
1 1 1 15 31 44 o 9.076000 0.5918000 9.351000 0.9434000 8.801000 0.7150000 0.5506000      1.184000  
1 1 1 15 31 46 o 25.29000 0.4031000 25.06000 0.6876000 25.51000 0.4210000 -0.4535000     0.8063000 
1 1 1 15 31 48 o 10.48000 0.5507000 10.45000 0.8569000 10.51000 0.6919000 -0.6081000E-01 1.101000  
1 1 1 15 31 50 o 9.996000 0.6085000 9.346000 1.036000  10.65000 0.6383000 -1.300000      1.217000  
1 1 1 15 31 52 o 7.000000 0.8455000 7.726000 1.264000  6.274000 1.123000  1.452000       1.691000  
1 1 1 15 31 54 o 3.210000 0.9746000 4.254000 1.660000  2.166000 1.022000  2.089000       1.949000  
1 1 1 15 32 1  o 51.64000 0.4137000 52.30000 0.6272000 50.98000 0.5396000 1.322000       0.8274000 
1 1 1 15 32 3  o 45.31000 0.4476000 44.63000 0.7001000 45.98000 0.5579000 -1.341000      0.8952000 
1 1 1 15 32 5  o 38.32000 0.3628000 38.20000 0.5117000 38.45000 0.5144000 -0.2536000     0.7256000 
1 1 1 15 32 7  o 13.08000 0.5164000 12.58000 0.5448000 13.59000 0.8773000 -1.014000      1.033000  
1 1 1 15 32 9  o 40.64000 0.4234000 41.13000 0.4771000 40.14000 0.6997000 0.9888000      0.8469000 
1 1 1 15 32 11 o 3.783000 0.9937000 3.765000 1.304000  3.801000 1.500000  -0.3620000E-01 1.987000  
1 1 1 15 32 13 o 17.63000 0.4840000 17.12000 0.6523000 18.13000 0.7152000 -1.010000      0.9680000 
1 1 1 15 32 15 o 21.07000 0.4084000 20.80000 0.4369000 21.34000 0.6901000 -0.5401000     0.8168000 
1 1 1 15 32 17 o 26.95000 0.5245000 26.84000 0.5077000 27.07000 0.9180000 -0.2323000     1.049000  
1 1 1 15 32 19 o 43.21000 0.4677000 42.95000 0.5824000 43.48000 0.7320000 -0.5311000     0.9355000 
1 1 1 15 32 21 o 19.72000 0.3909000 19.58000 0.5304000 19.86000 0.5744000 -0.2797000     0.7818000 
1 1 1 15 32 23 o 16.06000 0.4366000 15.88000 0.6161000 16.25000 0.6188000 -0.3678000     0.8732000 
1 1 1 15 32 25 o 9.633000 0.6591000 9.250000 0.9568000 10.02000 0.9068000 -0.7673000     1.318000  
1 1 1 15 32 27 o 18.51000 0.3592000 18.18000 0.4192000 18.84000 0.5833000 -0.6587000     0.7184000 
1 1 1 15 32 29 o 25.42000 0.3798000 26.05000 0.3774000 24.79000 0.6591000 1.261000       0.7595000 
1 1 1 15 32 31 o 10.32000 0.4855000 9.846000 0.6198000 10.79000 0.7473000 -0.9437000     0.9709000 
1 1 1 15 32 33 o 17.03000 0.3966000 17.09000 0.6620000 16.97000 0.4372000 0.1227000      0.7933000 
1 1 1 15 32 35 o 11.90000 0.4333000 12.51000 0.6644000 11.29000 0.5564000 1.222000       0.8666000 
1 1 1 15 32 37 o 15.05000 0.3737000 14.78000 0.6067000 15.32000 0.4367000 -0.5361000     0.7475000 
1 1 1 15 32 39 o 17.52000 0.3439000 17.82000 0.5350000 17.23000 0.4323000 0.5915000      0.6879000 
1 1 1 15 32 41 o 16.51000 0.4085000 16.32000 0.6838000 16.69000 0.4469000 -0.3722000     0.8169000 
1 1 1 15 32 43 o 12.04000 0.4824000 11.89000 0.7209000 12.19000 0.6411000 -0.3008000     0.9647000 
1 1 1 15 32 45 o 11.97000 0.4828000 11.94000 0.7682000 12.00000 0.5848000 -0.5570000E-01 0.9655000 
1 1 1 15 32 47 o 2.959000 0.9195000 2.956000 1.344000  2.961000 1.255000  -0.5577000E-02 1.839000  
1 1 1 15 32 49 o 8.637000 0.6774000 8.761000 1.069000  8.513000 0.8329000 0.2477000      1.355000  
1 1 1 15 32 51 o 5.840000 1.159000  5.555000 2.049000  6.125000 1.085000  -0.5698000     2.319000  
1 1 1 15 32 53 o 6.406000 0.9117000 7.348000 1.408000  5.465000 1.158000  1.882000       1.823000  
1 1 1 15 33 0  o 12.25000 0.5664000 12.25000 0.5664000 12.25000 0.5664000 0.000000       0.000000  
1 1 1 15 33 2  o 9.995000 0.3501000 9.650000 0.5347000 10.34000 0.4521000 -0.6914000     0.7002000 
1 1 1 15 33 4  f 52.21000 0.4190000 52.17000 0.6338000 52.25000 0.5482000 -0.8178000E-01 0.8380000 
1 1 1 15 33 6  o 53.78000 0.4363000 53.04000 0.5645000 54.52000 0.6653000 -1.486000      0.8725000 
1 1 1 15 33 8  o 12.37000 0.5340000 12.58000 0.5576000 12.15000 0.9110000 0.4304000      1.068000  
1 1 1 15 33 10 o 16.65000 0.4607000 17.26000 0.5597000 16.04000 0.7321000 1.223000       0.9215000 
1 1 1 15 33 12 o 17.91000 0.4426000 17.40000 0.5346000 18.43000 0.7056000 -1.028000      0.8853000 
1 1 1 15 33 14 o 17.09000 0.4465000 17.98000 0.4511000 16.19000 0.7707000 1.790000       0.8930000 
1 1 1 15 33 16 o 14.25000 0.6159000 14.10000 0.6016000 14.39000 1.075000  -0.2852000     1.232000  
1 1 1 15 33 18 o 23.93000 0.5049000 23.92000 0.4309000 23.95000 0.9131000 -0.2516000E-01 1.010000  
1 1 1 15 33 20 o 20.48000 0.4194000 21.19000 0.4517000 19.78000 0.7069000 1.411000       0.8389000 
1 1 1 15 33 22 o 20.18000 0.3902000 20.17000 0.5465000 20.18000 0.5572000 -0.1510000E-01 0.7804000 
1 1 1 15 33 24 o 27.45000 0.3729000 27.90000 0.5147000 27.00000 0.5396000 0.9013000      0.7457000 
1 1 1 15 33 26 o 10.09000 0.6735000 9.673000 0.9045000 10.50000 0.9982000 -0.8271000     1.347000  
1 1 1 15 33 28 o 7.236000 0.7512000 6.190000 0.8327000 8.283000 1.251000  -2.093000      1.502000  
1 1 1 15 33 30 o 19.83000 0.2960000 19.48000 0.4059000 20.19000 0.4311000 -0.7057000     0.5921000 
1 1 1 15 33 32 o 26.62000 0.3067000 26.58000 0.4509000 26.66000 0.4160000 -0.7677000E-01 0.6135000 
1 1 1 15 33 34 o 3.468000 0.9307000 3.655000 1.417000  3.280000 1.207000  0.3751000      1.861000  
1 1 1 15 33 36 o 14.06000 0.4129000 13.91000 0.7007000 14.22000 0.4371000 -0.3053000     0.8258000 
1 1 1 15 33 38 o 13.63000 0.3930000 13.86000 0.6062000 13.40000 0.5003000 0.4598000      0.7860000 
1 1 1 15 33 40 o 17.11000 0.4128000 16.97000 0.6779000 17.25000 0.4712000 -0.2772000     0.8256000 
1 1 1 15 33 42 f 9.999000 0.5219000 9.494000 0.8532000 10.50000 0.6012000 -1.010000      1.044000  
1 1 1 15 33 44 o 4.024000 0.9906000 4.702000 1.466000  3.347000 1.333000  1.355000       1.981000  
1 1 1 15 33 46 o 10.73000 0.6508000 10.99000 1.091000  10.47000 0.7104000 0.5229000      1.302000  
1 1 1 15 33 48 o 6.915000 0.8376000 7.346000 1.239000  6.484000 1.127000  0.8623000      1.675000  
1 1 1 15 33 50 o 6.512000 1.137000  5.793000 2.082000  7.231000 0.9146000 -1.438000      2.274000  
1 1 1 15 33 52 o 3.158000 0.9338000 2.839000 1.304000  3.477000 1.337000  -0.6377000     1.868000  
1 1 1 15 33 54 o 6.453000 2.017000  6.453000 2.017000  ?        ?         ?              ?         
1 1 1 15 34 1  o 4.361000 0.8304000 4.422000 1.091000  4.299000 1.252000  0.1226000      1.661000  
1 1 1 15 34 3  o 42.34000 0.3574000 42.37000 0.5388000 42.31000 0.4696000 0.5407000E-01  0.7147000 
1 1 1 15 34 5  o 43.33000 0.3639000 42.94000 0.5484000 43.72000 0.4784000 -0.7794000     0.7277000 
1 1 1 15 34 7  o 41.23000 0.5913000 41.27000 0.6419000 41.19000 0.9932000 0.7216000E-01  1.183000  
1 1 1 15 34 9  o 29.61000 0.3879000 30.02000 0.4199000 29.20000 0.6524000 0.8243000      0.7758000 
1 1 1 15 34 11 o 40.50000 0.5480000 40.66000 0.4794000 40.34000 0.9856000 0.3204000      1.096000  
1 1 1 15 34 13 o 16.12000 0.5493000 17.10000 0.4783000 15.14000 0.9889000 1.964000       1.099000  
1 1 1 15 34 15 o 22.42000 0.4990000 21.46000 0.4995000 23.38000 0.8639000 -1.918000      0.9979000 
1 1 1 15 34 17 o 37.93000 0.4248000 37.87000 0.4712000 37.99000 0.7070000 -0.1133000     0.8496000 
1 1 1 15 34 19 o 29.94000 0.4127000 30.13000 0.4471000 29.75000 0.6938000 0.3774000      0.8254000 
1 1 1 15 34 21 o 17.51000 0.4732000 17.18000 0.4899000 17.84000 0.8098000 -0.6638000     0.9465000 
1 1 1 15 34 23 o 21.67000 0.4117000 21.74000 0.4606000 21.61000 0.6827000 0.1289000      0.8235000 
1 1 1 15 34 25 o 15.72000 0.4871000 16.30000 0.6013000 15.14000 0.7665000 1.162000       0.9742000 
1 1 1 15 34 27 o 16.11000 0.4020000 15.17000 0.3447000 17.06000 0.7263000 -1.895000      0.8040000 
1 1 1 15 34 29 o 28.11000 0.3364000 28.15000 0.4191000 28.07000 0.5265000 0.8629000E-01  0.6729000 
1 1 1 15 34 31 o 12.15000 0.3593000 12.59000 0.5221000 11.71000 0.4937000 0.8793000      0.7186000 
1 1 1 15 34 33 o 6.206000 0.6389000 6.786000 0.7998000 5.625000 0.9965000 1.161000       1.278000  
1 1 1 15 34 35 o 4.338000 0.9599000 4.404000 1.500000  4.272000 1.198000  0.1316000      1.920000  
1 1 1 15 34 37 o 5.966000 0.7413000 5.758000 1.166000  6.173000 0.9162000 -0.4150000     1.483000  
1 1 1 15 34 39 f 16.33000 0.3770000 16.32000 0.5854000 16.34000 0.4750000 -0.2309000E-01 0.7539000 
1 1 1 15 34 41 o 7.895000 0.6123000 8.492000 0.9441000 7.298000 0.7800000 1.193000       1.225000  
1 1 1 15 34 43 o 14.14000 0.4113000 14.22000 0.6342000 14.06000 0.5238000 0.1624000      0.8225000 
1 1 1 15 34 45 o 4.300000 0.9885000 4.810000 1.435000  3.790000 1.360000  1.020000       1.977000  
1 1 1 15 34 47 o 3.462000 1.026000  3.636000 1.587000  3.288000 1.302000  0.3485000      2.053000  
1 1 1 15 34 49 o 11.92000 0.5062000 11.29000 0.8438000 12.55000 0.5595000 -1.259000      1.012000  
1 1 1 15 34 51 o 7.591000 0.8045000 7.034000 1.372000  8.147000 0.8407000 -1.113000      1.609000  
1 1 1 15 34 53 o 3.750000 1.015000  4.214000 1.586000  3.286000 1.266000  0.9278000      2.029000  
1 1 1 15 35 0  o 30.52000 0.4373000 30.52000 0.4373000 30.52000 0.4373000 0.000000       0.000000  
1 1 1 15 35 2  f 12.35000 0.4513000 12.14000 0.6763000 12.55000 0.5978000 -0.4097000     0.9026000 
1 1 1 15 35 4  f 11.59000 0.3649000 11.59000 0.5739000 11.59000 0.4509000 -0.8443000E-02 0.7299000 
1 1 1 15 35 6  o 37.69000 0.3498000 37.52000 0.5113000 37.86000 0.4776000 -0.3456000     0.6997000 
1 1 1 15 35 8  o 24.80000 0.4921000 25.04000 0.4137000 24.56000 0.8930000 0.4783000      0.9842000 
1 1 1 15 35 10 o 15.59000 0.5806000 15.51000 0.4745000 15.67000 1.060000  -0.1586000     1.161000  
1 1 1 15 35 12 o 35.71000 0.5371000 36.04000 0.5340000 35.39000 0.9321000 0.6590000      1.074000  
1 1 1 15 35 14 o 14.10000 0.5090000 14.42000 0.5231000 13.79000 0.8734000 0.6298000      1.018000  
1 1 1 15 35 16 o 33.76000 0.4073000 33.85000 0.4520000 33.68000 0.6776000 0.1785000      0.8145000 
1 1 1 15 35 18 o 50.67000 0.4951000 51.52000 0.5679000 49.82000 0.8112000 1.702000       0.9903000 
1 1 1 15 35 20 o 36.26000 0.4278000 36.83000 0.4726000 35.68000 0.7132000 1.153000       0.8556000 
1 1 1 15 35 22 o 28.51000 0.4080000 27.95000 0.4429000 29.06000 0.6854000 -1.110000      0.8161000 
1 1 1 15 35 24 o 15.86000 0.4722000 15.30000 0.5358000 16.43000 0.7777000 -1.127000      0.9444000 
1 1 1 15 35 26 o 5.052000 1.166000  4.815000 1.379000  5.290000 1.881000  -0.4744000     2.332000  
1 1 1 15 35 28 o 19.87000 0.3773000 19.46000 0.3846000 20.29000 0.6492000 -0.8336000     0.7545000 
1 1 1 15 35 30 o 10.67000 0.4063000 10.46000 0.6136000 10.88000 0.5328000 -0.4254000     0.8126000 
1 1 1 15 35 32 o 11.73000 0.4253000 11.51000 0.5169000 11.94000 0.6755000 -0.4335000     0.8506000 
1 1 1 15 35 34 o 4.863000 0.8125000 4.943000 1.175000  4.782000 1.122000  0.1608000      1.625000  
1 1 1 15 35 36 o 13.59000 0.3660000 13.33000 0.5700000 13.85000 0.4593000 -0.5175000     0.7321000 
1 1 1 15 35 38 o 8.514000 0.5621000 8.445000 0.8740000 8.584000 0.7072000 -0.1392000     1.124000  
1 1 1 15 35 40 o 3.755000 0.9231000 3.569000 1.389000  3.941000 1.216000  -0.3717000     1.846000  
1 1 1 15 35 42 o 3.341000 0.9242000 4.125000 1.455000  2.558000 1.140000  1.567000       1.848000  
1 1 1 15 35 44 o 8.314000 0.6967000 8.604000 0.9204000 8.024000 1.046000  0.5795000      1.393000  
1 1 1 15 35 46 o 5.412000 0.9437000 5.922000 1.376000  4.901000 1.292000  1.020000       1.887000  
1 1 1 15 35 48 o 3.245000 0.9459000 3.398000 1.423000  3.092000 1.247000  0.3061000      1.892000  
1 1 1 15 35 50 o 3.307000 0.9666000 3.685000 1.479000  2.930000 1.245000  0.7554000      1.933000  
1 1 1 15 35 52 o 3.270000 0.9552000 3.261000 1.449000  3.279000 1.245000  -0.1773000E-01 1.910000  
1 1 1 15 36 1  o 39.68000 0.4053000 38.83000 0.5418000 40.53000 0.6030000 -1.695000      0.8107000 
1 1 1 15 36 3  o 16.73000 0.3135000 17.50000 0.4773000 15.96000 0.4067000 1.535000       0.6271000 
1 1 1 15 36 5  o 64.75000 0.5031000 64.53000 0.6659000 64.96000 0.7544000 -0.4310000     1.006000  
1 1 1 15 36 7  o 46.93000 0.4434000 46.70000 0.5218000 47.16000 0.7172000 -0.4628000     0.8869000 
1 1 1 15 36 9  o 28.36000 0.4002000 29.05000 0.4317000 27.67000 0.6740000 1.377000       0.8004000 
1 1 1 15 36 11 o 25.10000 0.4105000 25.06000 0.4862000 25.13000 0.6616000 -0.6569000E-01 0.8211000 
1 1 1 15 36 13 o 30.15000 0.3932000 30.41000 0.4361000 29.90000 0.6545000 0.5067000      0.7865000 
1 1 1 15 36 15 o 23.98000 0.4257000 23.39000 0.5082000 24.57000 0.6832000 -1.182000      0.8514000 
1 1 1 15 36 17 o 20.13000 0.4229000 20.23000 0.4523000 20.03000 0.7147000 0.2046000      0.8458000 
1 1 1 15 36 19 o 16.40000 0.4741000 16.37000 0.5043000 16.43000 0.8030000 -0.6388000E-01 0.9482000 
1 1 1 15 36 21 o 17.93000 0.4695000 17.33000 0.4936000 18.52000 0.7988000 -1.195000      0.9390000 
1 1 1 15 36 23 o 17.41000 0.4663000 17.90000 0.4835000 16.92000 0.7974000 0.9776000      0.9326000 
1 1 1 15 36 25 o 30.52000 0.3984000 29.94000 0.4469000 31.10000 0.6597000 -1.158000      0.7968000 
1 1 1 15 36 27 o 14.25000 0.4917000 14.36000 0.6192000 14.13000 0.7641000 0.2214000      0.9835000 
1 1 1 15 36 29 o 8.118000 0.4899000 7.767000 0.6484000 8.470000 0.7344000 -0.7029000     0.9797000 
1 1 1 15 36 31 o 5.313000 0.7466000 5.498000 0.9893000 5.128000 1.118000  0.3696000      1.493000  
1 1 1 15 36 33 o 7.789000 0.5147000 7.698000 0.6634000 7.881000 0.7870000 -0.1834000     1.029000  
1 1 1 15 36 35 o 2.654000 0.8233000 2.706000 1.188000  2.602000 1.140000  0.1040000      1.647000  
1 1 1 15 36 37 o 5.761000 0.7590000 5.531000 1.170000  5.991000 0.9677000 -0.4601000     1.518000  
1 1 1 15 36 39 o 7.215000 0.7076000 7.306000 1.187000  7.124000 0.7708000 0.1829000      1.415000  
1 1 1 15 36 41 o 4.325000 0.9484000 4.073000 1.423000  4.576000 1.254000  -0.5036000     1.897000  
1 1 1 15 36 43 o 10.26000 0.5376000 10.47000 0.8356000 10.05000 0.6768000 0.4204000      1.075000  
1 1 1 15 36 45 o 4.862000 1.047000  5.030000 1.542000  4.694000 1.416000  0.3361000      2.093000  
1 1 1 15 36 47 o 3.174000 0.9172000 3.796000 1.428000  2.553000 1.152000  1.243000       1.834000  
1 1 1 15 36 49 o 6.186000 1.011000  5.283000 1.781000  7.089000 0.9560000 -1.806000      2.022000  
1 1 1 15 36 51 o 5.742000 0.9230000 5.614000 1.509000  5.871000 1.064000  -0.2570000     1.846000  
1 1 1 15 37 0  o 36.83000 0.4998000 36.83000 0.4998000 36.83000 0.4998000 0.000000       0.000000  
1 1 1 15 37 2  o 41.40000 0.5122000 41.52000 0.5380000 41.27000 0.8718000 0.2541000      1.024000  
1 1 1 15 37 4  o 46.80000 0.4280000 46.31000 0.5182000 47.29000 0.6814000 -0.9729000     0.8561000 
1 1 1 15 37 6  o 11.96000 0.3454000 12.33000 0.5428000 11.58000 0.4272000 0.7434000      0.6907000 
1 1 1 15 37 8  o 11.39000 0.5852000 10.99000 0.5998000 11.78000 1.005000  -0.7905000     1.170000  
1 1 1 15 37 10 o 10.19000 0.6526000 10.35000 0.6616000 10.03000 1.125000  0.3265000      1.305000  
1 1 1 15 37 12 o 28.86000 0.3912000 29.13000 0.4351000 28.58000 0.6502000 0.5453000      0.7824000 
1 1 1 15 37 14 o 15.96000 0.5058000 16.79000 0.5776000 15.13000 0.8305000 1.666000       1.012000  
1 1 1 15 37 16 o 15.29000 0.4734000 14.77000 0.5228000 15.81000 0.7895000 -1.043000      0.9469000 
1 1 1 15 37 18 o 10.16000 0.6524000 9.649000 0.7255000 10.66000 1.084000  -1.013000      1.305000  
1 1 1 15 37 20 o 16.58000 0.4876000 16.91000 0.4833000 16.25000 0.8470000 0.6605000      0.9751000 
1 1 1 15 37 22 o 5.768000 1.215000  6.088000 1.144000  5.448000 2.143000  0.6401000      2.429000  
1 1 1 15 37 24 o 11.62000 0.6528000 12.03000 0.6795000 11.20000 1.115000  0.8237000      1.306000  
1 1 1 15 37 26 o 17.47000 0.4116000 18.07000 0.4718000 16.86000 0.6746000 1.205000       0.8232000 
1 1 1 15 37 28 o 11.51000 0.4874000 11.50000 0.4252000 11.52000 0.8772000 -0.2520000E-01 0.9748000 
1 1 1 15 37 30 o 3.529000 0.8124000 3.512000 1.108000  3.546000 1.189000  -0.3439000E-01 1.625000  
1 1 1 15 37 32 o 15.70000 0.3757000 15.69000 0.5667000 15.70000 0.4934000 -0.7961000E-02 0.7514000 
1 1 1 15 37 34 o 15.79000 0.3188000 16.03000 0.3986000 15.55000 0.4977000 0.4769000      0.6376000 
1 1 1 15 37 36 o 9.951000 0.5898000 10.32000 0.9751000 9.583000 0.6638000 0.7348000      1.180000  
1 1 1 15 37 38 o 12.60000 0.4064000 12.50000 0.5939000 12.69000 0.5548000 -0.1944000     0.8127000 
1 1 1 15 37 40 o 7.603000 0.6143000 7.049000 0.8528000 8.158000 0.8844000 -1.109000      1.229000  
1 1 1 15 37 42 o 6.640000 0.7032000 6.835000 0.9165000 6.445000 1.067000  0.3898000      1.406000  
1 1 1 15 37 44 o 5.425000 0.8262000 4.159000 1.327000  6.690000 0.9850000 -2.532000      1.652000  
1 1 1 15 37 46 o 7.574000 0.7316000 7.543000 1.163000  7.605000 0.8875000 -0.6190000E-01 1.463000  
1 1 1 15 37 48 o 5.327000 1.018000  5.385000 1.570000  5.269000 1.297000  0.1154000      2.037000  
1 1 1 15 37 50 o 4.335000 1.028000  3.785000 1.382000  4.885000 1.524000  -1.101000      2.057000  
1 1 1 15 38 1  o 28.85000 0.3185000 29.41000 0.4630000 28.28000 0.4375000 1.126000       0.6370000 
1 1 1 15 38 3  o 34.51000 0.3941000 34.52000 0.4878000 34.49000 0.6191000 0.3628000E-01  0.7882000 
1 1 1 15 38 5  o 14.54000 0.5093000 14.43000 0.4841000 14.65000 0.8962000 -0.2177000     1.019000  
1 1 1 15 38 7  o 20.00000 0.3183000 19.98000 0.4270000 20.02000 0.4720000 -0.3810000E-01 0.6365000 
1 1 1 15 38 9  o 20.46000 0.4207000 19.88000 0.4373000 21.03000 0.7189000 -1.148000      0.8415000 
1 1 1 15 38 11 o 9.177000 0.7316000 8.868000 0.7510000 9.487000 1.256000  -0.6191000     1.463000  
1 1 1 15 38 13 o 4.506000 1.007000  5.363000 1.248000  3.650000 1.581000  1.713000       2.014000  
1 1 1 15 38 15 o 4.332000 0.9815000 5.218000 1.235000  3.446000 1.526000  1.771000       1.963000  
1 1 1 15 38 17 o 16.42000 0.4649000 16.71000 0.4958000 16.14000 0.7866000 0.5657000      0.9298000 
1 1 1 15 38 19 o 8.183000 0.8056000 8.593000 0.7753000 7.772000 1.412000  0.8212000      1.611000  
1 1 1 15 38 21 o 16.16000 0.7044000 16.62000 0.4886000 15.71000 1.321000  0.9157000      1.409000  
1 1 1 15 38 23 o 16.54000 0.4800000 16.55000 0.5541000 16.53000 0.7840000 0.2355000E-01  0.9600000 
1 1 1 15 38 25 o 3.788000 1.040000  3.233000 1.319000  4.344000 1.609000  -1.111000      2.080000  
1 1 1 15 38 27 o 11.17000 0.5307000 11.63000 0.5658000 10.71000 0.8981000 0.9245000      1.061000  
1 1 1 15 38 29 o 17.18000 0.3234000 17.99000 0.4729000 16.37000 0.4414000 1.623000       0.6469000 
1 1 1 15 38 31 o 9.030000 0.4423000 8.691000 0.6058000 9.369000 0.6445000 -0.6780000     0.8845000 
1 1 1 15 38 33 o 6.808000 0.7575000 6.858000 0.7212000 6.759000 1.332000  0.9889000E-01  1.515000  
1 1 1 15 38 35 o 12.15000 0.4481000 12.47000 0.6113000 11.84000 0.6555000 0.6334000      0.8963000 
1 1 1 15 38 37 o 5.118000 0.7845000 4.253000 1.204000  5.984000 1.006000  -1.731000      1.569000  
1 1 1 15 38 39 o 3.261000 0.8716000 2.889000 1.184000  3.634000 1.279000  -0.7452000     1.743000  
1 1 1 15 38 41 o 11.39000 0.4404000 11.38000 0.5913000 11.40000 0.6529000 -0.2868000E-01 0.8808000 
1 1 1 15 38 43 o 5.372000 0.8561000 4.744000 1.297000  6.001000 1.118000  -1.257000      1.712000  
1 1 1 15 38 45 o 5.489000 0.9513000 4.540000 1.380000  6.438000 1.310000  -1.899000      1.903000  
1 1 1 15 38 47 o 6.240000 0.8491000 4.674000 1.348000  7.807000 1.032000  -3.133000      1.698000  
1 1 1 15 38 49 o 4.231000 1.014000  3.660000 1.410000  4.803000 1.457000  -1.144000      2.028000  
1 1 1 15 39 0  o 19.50000 0.5081000 19.50000 0.5081000 19.50000 0.5081000 0.000000       0.000000  
1 1 1 15 39 2  o 25.35000 0.3920000 25.59000 0.4036000 25.11000 0.6722000 0.4813000      0.7840000 
1 1 1 15 39 4  o 14.33000 0.5045000 14.22000 0.4930000 14.44000 0.8804000 -0.2211000     1.009000  
1 1 1 15 39 6  o 14.55000 0.3412000 14.28000 0.5283000 14.83000 0.4318000 -0.5524000     0.6823000 
1 1 1 15 39 8  o 21.30000 0.3083000 21.67000 0.4172000 20.94000 0.4540000 0.7343000      0.6166000 
1 1 1 15 39 10 o 11.25000 0.6295000 11.00000 0.7257000 11.49000 1.029000  -0.4935000     1.259000  
1 1 1 15 39 12 o 27.39000 0.4033000 27.81000 0.4380000 26.97000 0.6773000 0.8390000      0.8066000 
1 1 1 15 39 14 o 9.988000 0.6871000 10.75000 0.6323000 9.223000 1.220000  1.529000       1.374000  
1 1 1 15 39 16 o 16.04000 0.4613000 15.75000 0.4966000 16.33000 0.7774000 -0.5878000     0.9225000 
1 1 1 15 39 18 f 10.15000 0.6326000 9.748000 0.7072000 10.56000 1.049000  -0.8096000     1.265000  
1 1 1 15 39 20 o 18.46000 0.5907000 19.05000 0.4549000 17.87000 1.090000  1.183000       1.181000  
1 1 1 15 39 22 o 7.149000 0.8409000 6.870000 0.8951000 7.427000 1.424000  -0.5578000     1.682000  
1 1 1 15 39 24 o 29.47000 0.4599000 28.38000 0.5916000 30.57000 0.7044000 -2.188000      0.9199000 
1 1 1 15 39 26 o 14.86000 0.4923000 14.95000 0.5600000 14.77000 0.8098000 0.1829000      0.9846000 
1 1 1 15 39 28 o 11.69000 0.5345000 12.47000 0.5469000 10.91000 0.9186000 1.555000       1.069000  
1 1 1 15 39 30 o 7.110000 0.6241000 7.410000 0.9919000 6.811000 0.7576000 0.5985000      1.248000  
1 1 1 15 39 32 o 14.57000 0.3253000 14.74000 0.3902000 14.40000 0.5206000 0.3446000      0.6506000 
1 1 1 15 39 34 o 16.45000 0.5119000 16.38000 0.4092000 16.53000 0.9384000 -0.1510000     1.024000  
1 1 1 15 39 36 o 10.84000 0.4578000 11.17000 0.7133000 10.51000 0.5741000 0.6533000      0.9156000 
1 1 1 15 39 38 o 3.796000 0.8813000 3.259000 1.230000  4.332000 1.262000  -1.073000      1.763000  
1 1 1 15 39 40 o 10.50000 0.4466000 10.75000 0.5770000 10.25000 0.6818000 0.4938000      0.8932000 
1 1 1 15 39 42 o 10.55000 0.4688000 10.55000 0.6778000 10.55000 0.6477000 -0.4273000E-02 0.9375000 
1 1 1 15 39 44 o 3.466000 0.9326000 3.739000 1.295000  3.193000 1.342000  0.5464000      1.865000  
1 1 1 15 39 46 o 5.557000 0.8761000 4.081000 1.381000  7.033000 1.079000  -2.952000      1.752000  
1 1 1 15 39 48 o 6.521000 0.9174000 5.572000 1.458000  7.470000 1.114000  -1.898000      1.835000  
1 1 1 15 40 1  o 17.20000 0.4598000 17.08000 0.7748000 17.32000 0.4954000 -0.2338000     0.9197000 
1 1 1 15 40 3  o 12.70000 0.3548000 12.58000 0.5320000 12.81000 0.4695000 -0.2224000     0.7095000 
1 1 1 15 40 5  o 23.23000 0.2793000 23.24000 0.4129000 23.22000 0.3762000 0.1960000E-01  0.5585000 
1 1 1 15 40 7  o 17.59000 0.3180000 17.78000 0.4450000 17.41000 0.4545000 0.3671000      0.6361000 
1 1 1 15 40 9  o 3.903000 0.9015000 4.448000 1.484000  3.359000 1.023000  1.090000       1.803000  
1 1 1 15 40 11 o 27.00000 0.4000000 26.71000 0.4275000 27.29000 0.6761000 -0.5722000     0.8000000 
1 1 1 15 40 13 o 20.38000 0.4399000 21.13000 0.5423000 19.62000 0.6927000 1.511000       0.8797000 
1 1 1 15 40 15 o 21.27000 0.4070000 21.35000 0.4386000 21.19000 0.6857000 0.1602000      0.8140000 
1 1 1 15 40 17 o 6.590000 1.102000  7.486000 0.8425000 5.695000 2.036000  1.791000       2.204000  
1 1 1 15 40 19 o 20.45000 0.4165000 21.50000 0.4333000 19.40000 0.7114000 2.090000       0.8330000 
1 1 1 15 40 21 o 17.94000 0.4130000 18.20000 0.4479000 17.67000 0.6940000 0.5337000      0.8260000 
1 1 1 15 40 23 o 15.38000 0.5088000 15.46000 0.5426000 15.30000 0.8610000 0.1553000      1.018000  
1 1 1 15 40 25 o 20.96000 0.4443000 21.45000 0.5151000 20.47000 0.7240000 0.9832000      0.8886000 
1 1 1 15 40 27 o 7.791000 0.8080000 7.974000 0.7731000 7.608000 1.419000  0.3657000      1.616000  
1 1 1 15 40 29 o 13.51000 0.5159000 14.41000 0.5715000 12.60000 0.8591000 1.809000       1.032000  
1 1 1 15 40 31 o 8.387000 0.6618000 8.748000 0.7144000 8.026000 1.114000  0.7220000      1.324000  
1 1 1 15 40 33 o 9.714000 0.4601000 10.57000 0.4981000 8.859000 0.7738000 1.710000       0.9202000 
1 1 1 15 40 35 o 7.138000 0.5665000 7.651000 0.6360000 6.625000 0.9378000 1.026000       1.133000  
1 1 1 15 40 37 o 4.594000 0.9944000 3.785000 1.502000  5.402000 1.303000  -1.617000      1.989000  
1 1 1 15 40 39 o 6.029000 0.7462000 6.568000 0.8769000 5.489000 1.208000  1.079000       1.492000  
1 1 1 15 40 41 o 8.375000 0.5129000 8.049000 0.7303000 8.701000 0.7203000 -0.6526000     1.026000  
1 1 1 15 40 43 o 5.533000 0.8890000 4.212000 1.319000  6.854000 1.192000  -2.642000      1.778000  
1 1 1 15 40 45 o 3.090000 0.8970000 2.271000 1.043000  3.910000 1.459000  -1.639000      1.794000  
1 1 1 15 40 47 o 5.451000 0.9504000 3.716000 1.492000  7.186000 1.178000  -3.470000      1.901000  
1 1 1 15 41 0  o 31.20000 0.4146000 31.20000 0.4146000 31.20000 0.4146000 0.000000       0.000000  
1 1 1 15 41 2  o 18.52000 0.3228000 18.53000 0.4198000 18.52000 0.4904000 0.7088000E-02  0.6456000 
1 1 1 15 41 4  o 25.65000 0.3709000 26.15000 0.6356000 25.14000 0.3824000 1.003000       0.7418000 
1 1 1 15 41 6  o 14.48000 0.3146000 14.16000 0.4885000 14.79000 0.3967000 -0.6309000     0.6292000 
1 1 1 15 41 8  o 5.244000 0.6726000 5.710000 0.9887000 4.778000 0.9122000 0.9325000      1.345000  
1 1 1 15 41 10 o 12.96000 0.3369000 12.92000 0.5383000 13.01000 0.4052000 -0.9113000E-01 0.6737000 
1 1 1 15 41 12 o 19.13000 0.4667000 19.83000 0.6124000 18.43000 0.7044000 1.405000       0.9334000 
1 1 1 15 41 14 o 7.942000 0.7874000 7.927000 0.7987000 7.957000 1.357000  -0.3046000E-01 1.575000  
1 1 1 15 41 16 o 17.65000 0.6238000 18.72000 0.4566000 16.58000 1.161000  2.132000       1.248000  
1 1 1 15 41 18 o 14.45000 0.4605000 14.51000 0.5093000 14.39000 0.7675000 0.1179000      0.9211000 
1 1 1 15 41 20 o 11.42000 0.5225000 10.63000 0.6025000 12.21000 0.8539000 -1.583000      1.045000  
1 1 1 15 41 22 f 12.16000 0.5747000 12.46000 0.6706000 11.86000 0.9335000 0.5984000      1.149000  
1 1 1 15 41 24 o 21.40000 0.4322000 21.23000 0.4319000 21.57000 0.7489000 -0.3446000     0.8645000 
1 1 1 15 41 26 o 19.00000 0.4618000 19.07000 0.5229000 18.93000 0.7613000 0.1437000      0.9236000 
1 1 1 15 41 28 o 15.64000 0.5007000 16.07000 0.5391000 15.21000 0.8440000 0.8590000      1.001000  
1 1 1 15 41 30 o 3.335000 0.9036000 3.632000 1.247000  3.038000 1.308000  0.5938000      1.807000  
1 1 1 15 41 32 o 8.683000 0.8989000 9.407000 0.6493000 7.959000 1.676000  1.448000       1.798000  
1 1 1 15 41 34 o 6.076000 0.8518000 6.181000 0.8504000 5.971000 1.476000  0.2101000      1.704000  
1 1 1 15 41 36 o 3.690000 0.8926000 3.101000 1.139000  4.278000 1.375000  -1.177000      1.785000  
1 1 1 15 41 38 o 7.278000 0.7638000 6.477000 0.9950000 8.078000 1.159000  -1.601000      1.528000  
1 1 1 15 41 40 o 11.66000 0.4077000 11.25000 0.5703000 12.07000 0.5827000 -0.8255000     0.8154000 
1 1 1 15 41 42 o 6.724000 0.8720000 7.534000 1.146000  5.914000 1.315000  1.620000       1.744000  
1 1 1 15 41 44 o 5.134000 1.092000  4.187000 1.683000  6.080000 1.393000  -1.893000      2.185000  
1 1 1 15 41 46 o 9.743000 0.6389000 9.933000 0.9564000 9.552000 0.8473000 0.3818000      1.278000  
1 1 1 15 42 1  o 14.78000 0.3152000 15.23000 0.4520000 14.33000 0.4395000 0.9003000      0.6305000 
1 1 1 15 42 3  o 6.349000 0.6474000 6.319000 1.001000  6.379000 0.8218000 -0.6015000E-01 1.295000  
1 1 1 15 42 5  f 12.35000 0.3984000 12.62000 0.5177000 12.08000 0.6056000 0.5390000      0.7967000 
1 1 1 15 42 7  o 27.15000 0.4927000 27.34000 0.9108000 26.97000 0.3762000 0.3671000      0.9854000 
1 1 1 15 42 9  o 14.57000 0.2949000 14.66000 0.4598000 14.48000 0.3692000 0.1756000      0.5897000 
1 1 1 15 42 11 o 6.324000 0.9960000 6.492000 1.120000  6.156000 1.647000  0.3360000      1.992000  
1 1 1 15 42 13 o 13.74000 0.5806000 13.74000 0.5806000 ?        ?         ?              ?         
1 1 1 15 42 15 o 11.96000 0.5612000 12.29000 0.6287000 11.62000 0.9299000 0.6756000      1.122000  
1 1 1 15 42 17 o 12.71000 0.4726000 12.16000 0.5598000 13.26000 0.7616000 -1.100000      0.9452000 
1 1 1 15 42 19 o 17.01000 0.4478000 17.94000 0.5057000 16.07000 0.7391000 1.870000       0.8956000 
1 1 1 15 42 21 o 14.91000 0.4740000 15.48000 0.5521000 14.35000 0.7706000 1.123000       0.9479000 
1 1 1 15 42 23 o 7.257000 0.8577000 7.221000 0.8933000 7.292000 1.465000  -0.7122000E-01 1.715000  
1 1 1 15 42 25 o 6.154000 0.9855000 5.869000 1.196000  6.439000 1.567000  -0.5700000     1.971000  
1 1 1 15 42 27 o 11.10000 0.5940000 11.07000 0.6082000 11.13000 1.020000  -0.6479000E-01 1.188000  
1 1 1 15 42 29 o 8.162000 0.7828000 7.960000 0.7231000 8.364000 1.389000  -0.4045000     1.566000  
1 1 1 15 42 31 o 13.26000 0.5884000 13.18000 0.5482000 13.35000 1.041000  -0.1697000     1.177000  
1 1 1 15 42 33 o 4.748000 0.9826000 3.623000 1.397000  5.873000 1.382000  -2.250000      1.965000  
1 1 1 15 42 35 o 4.156000 0.9663000 3.927000 1.122000  4.386000 1.574000  -0.4593000     1.933000  
1 1 1 15 42 37 o 4.240000 0.9679000 3.581000 1.212000  4.899000 1.510000  -1.318000      1.936000  
1 1 1 15 42 39 o 7.000000 0.7775000 5.453000 1.217000  8.546000 0.9683000 -3.093000      1.555000  
1 1 1 15 42 41 o 4.711000 1.006000  4.570000 1.458000  4.851000 1.386000  -0.2809000     2.012000  
1 1 1 15 42 43 o 3.256000 0.9685000 2.665000 1.241000  3.848000 1.487000  -1.184000      1.937000  
1 1 1 15 42 45 o 5.457000 1.068000  6.101000 1.571000  4.813000 1.447000  1.288000       2.136000  
1 1 1 15 43 0  o 24.95000 0.3954000 24.95000 0.3954000 24.95000 0.3954000 0.000000       0.000000  
1 1 1 15 43 2  o 23.06000 0.3085000 23.13000 0.4010000 23.00000 0.4690000 0.1276000      0.6171000 
1 1 1 15 43 4  o 15.96000 0.3043000 16.32000 0.4513000 15.60000 0.4085000 0.7220000      0.6087000 
1 1 1 15 43 6  o 31.67000 0.3571000 31.62000 0.4295000 31.72000 0.5707000 -0.1049000     0.7143000 
1 1 1 15 43 8  o 26.90000 0.3185000 26.16000 0.4845000 27.65000 0.4135000 -1.494000      0.6370000 
1 1 1 15 43 10 o 3.495000 0.8122000 4.211000 1.244000  2.780000 1.045000  1.431000       1.624000  
1 1 1 15 43 12 o 8.359000 0.9493000 8.371000 0.8874000 8.347000 1.678000  0.2363000E-01  1.899000  
1 1 1 15 43 14 o 12.45000 0.5040000 12.39000 0.5543000 12.52000 0.8418000 -0.1346000     1.008000  
1 1 1 15 43 16 o 16.51000 0.5634000 16.15000 0.4887000 16.87000 1.015000  -0.7257000     1.127000  
1 1 1 15 43 18 o 13.75000 0.4984000 13.94000 0.5845000 13.56000 0.8075000 0.3817000      0.9968000 
1 1 1 15 43 20 o 6.031000 0.9074000 5.453000 1.162000  6.609000 1.394000  -1.156000      1.815000  
1 1 1 15 43 22 o 6.935000 0.8256000 7.153000 0.7698000 6.717000 1.461000  0.4369000      1.651000  
1 1 1 15 43 24 o 8.703000 0.8108000 8.280000 1.169000  9.125000 1.124000  -0.8453000     1.622000  
1 1 1 15 43 26 o 7.551000 0.8786000 8.506000 0.7398000 6.596000 1.594000  1.910000       1.757000  
1 1 1 15 43 28 o 7.564000 0.8608000 7.595000 0.7352000 7.532000 1.557000  0.6283000E-01  1.722000  
1 1 1 15 43 30 o 3.319000 1.028000  2.726000 1.144000  3.913000 1.708000  -1.187000      2.055000  
1 1 1 15 43 32 o 10.54000 0.9316000 13.13000 0.5660000 7.946000 1.775000  5.180000       1.863000  
1 1 1 15 43 34 o 7.820000 0.7115000 7.710000 0.8424000 7.930000 1.147000  -0.2200000     1.423000  
1 1 1 15 43 36 o 14.13000 0.5126000 13.99000 0.6189000 14.27000 0.8173000 -0.2792000     1.025000  
1 1 1 15 43 38 o 14.17000 0.4914000 13.56000 0.6975000 14.79000 0.6923000 -1.229000      0.9828000 
1 1 1 15 43 40 o 8.565000 0.7019000 8.462000 1.015000  8.668000 0.9699000 -0.2060000     1.404000  
1 1 1 15 43 42 o 13.65000 0.5070000 13.05000 0.7438000 14.25000 0.6890000 -1.202000      1.014000  
1 1 1 15 43 44 o 3.993000 1.059000  3.894000 1.528000  4.092000 1.468000  -0.1980000     2.119000  
1 1 1 15 44 1  o 8.990000 0.4159000 8.747000 0.6012000 9.234000 0.5747000 -0.4865000     0.8317000 
1 1 1 15 44 3  o 27.68000 0.3153000 27.22000 0.4039000 28.14000 0.4842000 -0.9186000     0.6305000 
1 1 1 15 44 5  o 17.33000 0.2829000 17.00000 0.4242000 17.65000 0.3744000 -0.6532000     0.5658000 
1 1 1 15 44 7  o 18.23000 0.3711000 19.24000 0.5142000 17.21000 0.5353000 2.035000       0.7422000 
1 1 1 15 44 9  o 25.04000 0.3318000 25.35000 0.4185000 24.72000 0.5151000 0.6349000      0.6637000 
1 1 1 15 44 11 o 13.34000 0.3018000 13.31000 0.4823000 13.38000 0.3629000 -0.7598000E-01 0.6036000 
1 1 1 15 44 13 o 22.23000 0.3968000 22.16000 0.4194000 22.30000 0.6736000 -0.1386000     0.7935000 
1 1 1 15 44 15 o 3.934000 1.091000  3.252000 1.486000  4.615000 1.598000  -1.363000      2.182000  
1 1 1 15 44 17 o 12.75000 0.6052000 13.07000 0.9090000 12.42000 0.7991000 0.6494000      1.210000  
1 1 1 15 44 19 o 10.95000 0.5546000 11.85000 0.5805000 10.05000 0.9451000 1.796000       1.109000  
1 1 1 15 44 21 o 4.910000 1.065000  5.043000 1.441000  4.777000 1.568000  0.2663000      2.130000  
1 1 1 15 44 23 o 7.285000 0.8405000 7.862000 0.9292000 6.708000 1.401000  1.154000       1.681000  
1 1 1 15 44 25 f 12.27000 0.5432000 12.20000 0.5771000 12.35000 0.9205000 -0.1509000     1.086000  
1 1 1 15 44 27 o 10.62000 0.6848000 10.78000 0.6081000 10.47000 1.227000  0.3104000      1.370000  
1 1 1 15 44 29 f 18.30000 0.5793000 18.50000 0.4603000 18.10000 1.063000  0.3988000      1.159000  
1 1 1 15 44 31 o 5.167000 1.308000  4.022000 1.301000  6.311000 2.270000  -2.289000      2.617000  
1 1 1 15 44 33 o 8.207000 0.7289000 8.438000 0.5636000 7.975000 1.345000  0.4632000      1.458000  
1 1 1 15 44 35 o 9.924000 0.7236000 10.76000 0.7171000 9.084000 1.257000  1.680000       1.447000  
1 1 1 15 44 37 o 6.920000 0.8135000 5.873000 1.284000  7.966000 0.9997000 -2.093000      1.627000  
1 1 1 15 44 39 o 5.851000 0.9765000 5.113000 1.502000  6.588000 1.248000  -1.475000      1.953000  
1 1 1 15 44 41 o 3.187000 0.9400000 3.314000 1.367000  3.060000 1.291000  0.2541000      1.880000  
1 1 1 15 44 43 o 7.507000 1.165000  7.132000 2.051000  7.883000 1.107000  -0.7515000     2.331000  
1 1 1 15 45 0  o 6.972000 0.7312000 6.972000 0.7312000 6.972000 0.7312000 0.000000       0.000000  
1 1 1 15 45 2  o 11.33000 0.3517000 11.11000 0.5107000 11.56000 0.4836000 -0.4508000     0.7033000 
1 1 1 15 45 4  o 10.28000 0.4280000 10.06000 0.5639000 10.50000 0.6441000 -0.4378000     0.8561000 
1 1 1 15 45 6  o 10.07000 0.4327000 10.50000 0.6980000 9.636000 0.5116000 0.8682000      0.8654000 
1 1 1 15 45 8  o 15.04000 0.2940000 15.46000 0.4530000 14.63000 0.3749000 0.8331000      0.5880000 
1 1 1 15 45 10 o 24.03000 0.3386000 23.98000 0.4975000 24.09000 0.4595000 -0.1071000     0.6772000 
1 1 1 15 45 12 o 8.500000 0.4627000 8.362000 0.7882000 8.638000 0.4850000 -0.2760000     0.9255000 
1 1 1 15 45 14 o 22.56000 0.4050000 22.82000 0.4724000 22.29000 0.6581000 0.5289000      0.8101000 
1 1 1 15 45 16 o 16.19000 0.4444000 15.45000 0.4884000 16.94000 0.7425000 -1.491000      0.8887000 
1 1 1 15 45 18 o 5.080000 1.062000  4.741000 1.396000  5.418000 1.600000  -0.6765000     2.123000  
1 1 1 15 45 20 o 14.00000 0.6527000 14.07000 1.058000  13.93000 0.7645000 0.1370000      1.305000  
1 1 1 15 45 22 o 3.603000 0.9436000 2.647000 1.115000  4.560000 1.522000  -1.912000      1.887000  
1 1 1 15 45 24 o 9.405000 0.6772000 10.28000 0.7253000 8.527000 1.144000  1.756000       1.354000  
1 1 1 15 45 26 o 3.811000 1.121000  3.048000 1.253000  4.573000 1.860000  -1.525000      2.243000  
1 1 1 15 45 28 o 7.924000 0.8134000 7.995000 0.8500000 7.852000 1.387000  0.1435000      1.627000  
1 1 1 15 45 30 o 4.414000 1.302000  3.316000 1.272000  5.512000 2.272000  -2.196000      2.604000  
1 1 1 15 45 32 o 11.95000 0.6072000 12.60000 0.5714000 11.30000 1.072000  1.304000       1.214000  
1 1 1 15 45 34 o 3.734000 1.043000  2.968000 1.284000  4.499000 1.644000  -1.531000      2.086000  
1 1 1 15 45 36 o 4.288000 1.038000  4.017000 1.435000  4.559000 1.500000  -0.5425000     2.076000  
1 1 1 15 45 38 o 3.463000 1.002000  3.617000 1.454000  3.309000 1.380000  0.3076000      2.005000  
1 1 1 15 45 40 o 5.252000 1.017000  6.049000 1.384000  4.455000 1.491000  1.594000       2.034000  
1 1 1 15 45 42 o 7.705000 1.044000  8.935000 1.718000  6.476000 1.186000  2.460000       2.087000  
1 1 1 15 46 1  o 14.54000 0.3376000 15.17000 0.4713000 13.90000 0.4834000 1.267000       0.6752000 
1 1 1 15 46 3  o 12.19000 0.3868000 12.19000 0.5816000 12.20000 0.5101000 -0.1856000E-01 0.7736000 
1 1 1 15 46 5  o 5.957000 0.5739000 6.272000 0.8014000 5.641000 0.8219000 0.6308000      1.148000  
1 1 1 15 46 7  o 13.11000 0.3148000 13.27000 0.4902000 12.94000 0.3951000 0.3292000      0.6296000 
1 1 1 15 46 9  o 11.16000 0.3824000 11.12000 0.6414000 11.19000 0.4165000 -0.7263000E-01 0.7647000 
1 1 1 15 46 11 o 12.80000 0.3788000 13.67000 0.6387000 11.93000 0.4075000 1.740000       0.7576000 
1 1 1 15 46 13 o 4.879000 1.046000  4.398000 1.293000  5.359000 1.644000  -0.9617000     2.092000  
1 1 1 15 46 15 o 3.583000 0.9209000 4.276000 1.269000  2.891000 1.335000  1.384000       1.842000  
1 1 1 15 46 17 f 8.338000 0.7474000 8.679000 0.8493000 7.997000 1.230000  0.6818000      1.495000  
1 1 1 15 46 19 o 9.359000 0.6225000 8.959000 0.8391000 9.758000 0.9198000 -0.7988000     1.245000  
1 1 1 15 46 21 o 4.869000 0.9891000 5.169000 1.220000  4.568000 1.557000  0.6010000      1.978000  
1 1 1 15 46 23 o 3.128000 0.9396000 3.101000 1.256000  3.155000 1.398000  -0.5311000E-01 1.879000  
1 1 1 15 46 25 o 4.306000 1.104000  3.374000 1.380000  5.238000 1.724000  -1.864000      2.208000  
1 1 1 15 46 27 o 3.897000 1.063000  3.601000 1.414000  4.193000 1.587000  -0.5918000     2.126000  
1 1 1 15 46 29 o 3.768000 1.106000  3.043000 1.216000  4.492000 1.847000  -1.450000      2.212000  
1 1 1 15 46 31 o 5.672000 1.040000  4.467000 1.379000  6.877000 1.557000  -2.411000      2.080000  
1 1 1 15 46 33 o 7.443000 0.8685000 8.133000 0.8542000 6.753000 1.512000  1.381000       1.737000  
1 1 1 15 46 35 o 4.337000 1.073000  3.955000 1.357000  4.719000 1.663000  -0.7633000     2.146000  
1 1 1 15 46 37 o 3.592000 0.9287000 2.982000 1.270000  4.202000 1.356000  -1.219000      1.857000  
1 1 1 15 46 39 o 6.989000 0.8826000 5.621000 1.474000  8.356000 0.9712000 -2.735000      1.765000  
1 1 1 15 46 41 o 4.589000 0.9615000 5.765000 1.410000  3.412000 1.307000  2.352000       1.923000  
1 1 1 15 47 0  o 23.28000 0.3949000 23.28000 0.3949000 23.28000 0.3949000 0.000000       0.000000  
1 1 1 15 47 2  o 21.34000 0.2817000 20.93000 0.4018000 21.76000 0.3950000 -0.8341000     0.5634000 
1 1 1 15 47 4  o 10.57000 0.3940000 10.78000 0.6124000 10.36000 0.4958000 0.4173000      0.7879000 
1 1 1 15 47 6  o 13.29000 0.3478000 13.03000 0.5602000 13.55000 0.4125000 -0.5129000     0.6957000 
1 1 1 15 47 8  o 10.84000 0.5536000 11.88000 0.9065000 9.799000 0.6356000 2.083000       1.107000  
1 1 1 15 47 10 f 20.38000 0.3035000 21.11000 0.4910000 19.65000 0.3567000 1.466000       0.6069000 
1 1 1 15 47 12 o 12.34000 0.3556000 11.35000 0.5369000 13.32000 0.4663000 -1.964000      0.7111000 
1 1 1 15 47 14 o 12.73000 0.5041000 12.67000 0.5127000 12.79000 0.8680000 -0.1237000     1.008000  
1 1 1 15 47 16 o 16.61000 0.4196000 17.33000 0.4575000 15.90000 0.7036000 1.433000       0.8393000 
1 1 1 15 47 18 o 7.536000 0.8438000 8.046000 0.9004000 7.026000 1.427000  1.020000       1.688000  
1 1 1 15 47 20 o 6.962000 0.8629000 7.190000 0.8431000 6.734000 1.506000  0.4556000      1.726000  
1 1 1 15 47 22 o 6.150000 1.126000  5.707000 1.253000  6.594000 1.870000  -0.8869000     2.251000  
1 1 1 15 47 24 o 5.923000 1.059000  4.927000 1.201000  6.919000 1.744000  -1.992000      2.117000  
1 1 1 15 47 26 o 3.845000 1.030000  3.409000 1.267000  4.281000 1.623000  -0.8723000     2.060000  
1 1 1 15 47 28 o 4.786000 1.053000  3.366000 1.323000  6.205000 1.639000  -2.839000      2.106000  
1 1 1 15 47 30 o 7.342000 0.9153000 6.174000 1.425000  8.511000 1.150000  -2.338000      1.831000  
1 1 1 15 47 32 o 6.731000 0.9363000 7.428000 0.9708000 6.033000 1.601000  1.395000       1.873000  
1 1 1 15 47 34 o 5.251000 1.013000  5.711000 1.191000  4.791000 1.640000  0.9199000      2.027000  
1 1 1 15 47 36 o 9.711000 0.6711000 9.778000 0.9419000 9.643000 0.9563000 0.1350000      1.342000  
1 1 1 15 47 38 o 3.607000 1.007000  3.923000 1.473000  3.291000 1.374000  0.6318000      2.014000  
1 1 1 15 47 40 o 4.882000 1.360000  5.306000 1.989000  4.457000 1.854000  0.8487000      2.719000  
1 1 1 15 48 1  o 8.591000 0.4432000 8.775000 0.6128000 8.408000 0.6405000 0.3679000      0.8865000 
1 1 1 15 48 3  o 10.18000 0.3869000 10.64000 0.5544000 9.721000 0.5398000 0.9216000      0.7738000 
1 1 1 15 48 5  o 7.028000 0.6834000 6.783000 1.111000  7.272000 0.7956000 -0.4890000     1.367000  
1 1 1 15 48 7  o 10.53000 0.3687000 11.20000 0.5397000 9.872000 0.5025000 1.323000       0.7374000 
1 1 1 15 48 9  o 12.32000 0.3858000 12.90000 0.5125000 11.74000 0.5769000 1.153000       0.7716000 
1 1 1 15 48 11 o 14.06000 0.3423000 13.32000 0.4946000 14.81000 0.4733000 -1.487000      0.6846000 
1 1 1 15 48 13 o 4.630000 0.7050000 5.175000 1.068000  4.085000 0.9211000 1.090000       1.410000  
1 1 1 15 48 15 o 12.01000 0.5285000 12.11000 0.5359000 11.91000 0.9111000 0.2061000      1.057000  
1 1 1 15 48 17 o 7.137000 0.8735000 8.251000 0.6896000 6.023000 1.605000  2.227000       1.747000  
1 1 1 15 48 19 o 9.459000 0.7026000 10.30000 0.6014000 8.620000 1.270000  1.677000       1.405000  
1 1 1 15 48 21 f 7.784000 0.9773000 6.556000 1.081000  9.012000 1.628000  -2.456000      1.955000  
1 1 1 15 48 23 o 3.253000 0.9497000 2.836000 1.202000  3.671000 1.471000  -0.8346000     1.899000  
1 1 1 15 48 25 o 4.690000 1.204000  2.949000 1.229000  6.432000 2.070000  -3.483000      2.407000  
1 1 1 15 48 27 o 3.617000 1.002000  2.715000 1.164000  4.519000 1.630000  -1.804000      2.003000  
1 1 1 15 48 29 o 4.699000 1.099000  4.896000 1.431000  4.502000 1.667000  0.3944000      2.198000  
1 1 1 15 48 31 o 2.918000 0.9058000 2.886000 1.221000  2.950000 1.338000  -0.6461000E-01 1.812000  
1 1 1 15 48 33 o 5.031000 1.032000  5.655000 1.338000  4.407000 1.572000  1.247000       2.064000  
1 1 1 15 48 35 o 5.781000 1.178000  5.695000 1.656000  5.867000 1.677000  -0.1723000     2.356000  
1 1 1 15 48 37 o 3.534000 1.003000  3.163000 1.463000  3.905000 1.372000  -0.7420000     2.005000  
1 1 1 15 49 0  o 5.767000 0.9658000 5.767000 0.9658000 5.767000 0.9658000 0.000000       0.000000  
1 1 1 15 49 2  o 3.225000 0.8426000 3.017000 1.165000  3.434000 1.217000  -0.4169000     1.685000  
1 1 1 15 49 4  o 13.45000 0.3669000 13.76000 0.5834000 13.15000 0.4451000 0.6144000      0.7338000 
1 1 1 15 49 6  o 2.872000 0.7945000 3.199000 1.159000  2.544000 1.087000  0.6553000      1.589000  
1 1 1 15 49 8  o 2.992000 0.7837000 3.057000 1.162000  2.926000 1.052000  0.1312000      1.567000  
1 1 1 15 49 10 o 5.338000 0.7633000 5.682000 0.9210000 4.994000 1.218000  0.6886000      1.527000  
1 1 1 15 49 12 o 12.17000 0.3893000 12.62000 0.5152000 11.72000 0.5838000 0.9009000      0.7786000 
1 1 1 15 49 14 o 3.367000 0.7439000 2.759000 1.164000  3.974000 0.9261000 -1.215000      1.488000  
1 1 1 15 49 16 o 4.268000 0.9654000 4.966000 1.209000  3.570000 1.506000  1.396000       1.931000  
1 1 1 15 49 18 o 2.968000 0.9486000 2.109000 0.9835000 3.828000 1.622000  -1.719000      1.897000  
1 1 1 15 49 20 o 9.290000 0.7071000 9.923000 0.7164000 8.657000 1.219000  1.266000       1.414000  
1 1 1 15 49 22 o 8.236000 0.7366000 8.928000 0.6920000 7.543000 1.301000  1.385000       1.473000  
1 1 1 15 49 24 o 3.254000 1.038000  2.723000 1.167000  3.786000 1.716000  -1.063000      2.075000  
1 1 1 15 49 26 o 9.819000 0.6690000 9.497000 0.7370000 10.14000 1.117000  -0.6440000     1.338000  
1 1 1 15 49 28 o 8.912000 0.7587000 9.132000 0.8727000 8.692000 1.241000  0.4399000      1.517000  
1 1 1 15 49 30 o 4.428000 1.059000  3.500000 1.354000  5.356000 1.629000  -1.856000      2.118000  
1 1 1 15 49 32 f 3.797000 1.047000  3.055000 1.308000  4.539000 1.636000  -1.484000      2.095000  
1 1 1 15 49 34 o 5.083000 1.071000  4.441000 1.318000  5.724000 1.689000  -1.283000      2.142000  
1 1 1 15 49 36 o 5.515000 1.305000  4.813000 1.497000  6.217000 2.138000  -1.404000      2.610000  
1 1 1 15 50 1  o 2.905000 0.8058000 3.109000 1.146000  2.700000 1.133000  0.4084000      1.612000  
1 1 1 15 50 3  o 3.858000 0.9037000 3.943000 1.362000  3.773000 1.188000  0.1701000      1.807000  
1 1 1 15 50 5  o 12.30000 0.3489000 12.25000 0.4765000 12.35000 0.5099000 -0.1047000     0.6979000 
1 1 1 15 50 7  o 15.03000 0.3845000 15.75000 0.5547000 14.31000 0.5326000 1.445000       0.7690000 
1 1 1 15 50 9  o 12.63000 0.3391000 12.82000 0.5188000 12.45000 0.4369000 0.3644000      0.6783000 
1 1 1 15 50 11 o 11.42000 0.4198000 11.63000 0.5393000 11.20000 0.6435000 0.4325000      0.8396000 
1 1 1 15 50 13 o 7.360000 0.8891000 6.518000 0.9043000 8.201000 1.531000  -1.683000      1.778000  
1 1 1 15 50 15 o 7.661000 0.7787000 7.035000 0.8691000 8.287000 1.292000  -1.253000      1.557000  
1 1 1 15 50 17 o 9.626000 0.6076000 9.481000 0.6615000 9.771000 1.019000  -0.2903000     1.215000  
1 1 1 15 50 19 o 17.21000 0.4611000 16.75000 0.5549000 17.68000 0.7366000 -0.9221000     0.9222000 
1 1 1 15 50 21 o 4.769000 1.022000  3.622000 1.250000  5.916000 1.617000  -2.294000      2.044000  
1 1 1 15 50 23 o 4.474000 1.111000  4.306000 1.238000  4.641000 1.846000  -0.3353000     2.223000  
1 1 1 15 50 25 f 7.367000 0.8796000 7.880000 0.7965000 6.854000 1.569000  1.026000       1.759000  
1 1 1 15 50 27 o 5.958000 0.9888000 4.696000 1.347000  7.220000 1.448000  -2.524000      1.978000  
1 1 1 15 50 29 o 4.548000 1.094000  4.450000 1.415000  4.646000 1.668000  -0.1955000     2.188000  
1 1 1 15 50 31 o 4.907000 1.085000  4.913000 1.399000  4.901000 1.658000  0.1212000E-01  2.169000  
1 1 1 15 50 33 o 6.760000 0.9417000 6.242000 1.034000  7.278000 1.574000  -1.037000      1.883000  
1 1 1 15 50 35 o 11.34000 0.5432000 12.53000 0.6636000 10.16000 0.8603000 2.379000       1.086000  
1 1 1 15 51 0  f 2.798000 1.136000  2.798000 1.136000  2.798000 1.136000  0.000000       0.000000  
1 1 1 15 51 2  o 3.000000 0.8139000 2.579000 1.091000  3.421000 1.208000  -0.8422000     1.628000  
1 1 1 15 51 4  o 9.385000 0.4082000 9.636000 0.5674000 9.133000 0.5870000 0.5039000      0.8164000 
1 1 1 15 51 6  o 7.677000 0.5288000 8.249000 0.7910000 7.106000 0.7020000 1.143000       1.058000  
1 1 1 15 51 8  o 7.501000 0.4713000 8.026000 0.7133000 6.977000 0.6163000 1.049000       0.9427000 
1 1 1 15 51 10 o 6.822000 0.5218000 6.581000 0.8790000 7.064000 0.5625000 -0.4834000     1.044000  
1 1 1 15 51 12 o 7.176000 0.5480000 8.472000 0.7019000 5.881000 0.8417000 2.591000       1.096000  
1 1 1 15 51 14 o 2.496000 0.7634000 2.721000 1.174000  2.272000 0.9764000 0.4487000      1.527000  
1 1 1 15 51 16 f 10.62000 0.6734000 10.50000 0.7379000 10.75000 1.127000  -0.2506000     1.347000  
1 1 1 15 51 18 o 3.838000 0.9610000 3.307000 1.222000  4.369000 1.483000  -1.062000      1.922000  
1 1 1 15 51 20 o 6.834000 1.141000  6.332000 0.9716000 7.336000 2.066000  -1.004000      2.283000  
1 1 1 15 51 22 o 4.189000 1.000000  4.125000 1.261000  4.253000 1.553000  -0.1284000     2.000000  
1 1 1 15 51 24 o 8.746000 0.6875000 7.967000 0.8844000 9.526000 1.053000  -1.559000      1.375000  
1 1 1 15 51 26 o 4.167000 1.044000  4.079000 1.286000  4.256000 1.645000  -0.1763000     2.088000  
1 1 1 15 51 28 o 3.297000 0.9928000 2.671000 1.228000  3.923000 1.560000  -1.252000      1.986000  
1 1 1 15 51 30 o 6.106000 0.9615000 5.129000 1.185000  7.083000 1.515000  -1.954000      1.923000  
1 1 1 15 51 32 o 5.848000 1.005000  6.049000 1.097000  5.646000 1.684000  0.4034000      2.010000  
1 1 1 15 51 34 f 4.197000 1.631000  4.197000 1.631000  ?        ?         ?              ?         
1 1 1 15 52 1  o 6.188000 0.6705000 7.506000 0.7300000 4.869000 1.125000  2.636000       1.341000  
1 1 1 15 52 3  o 25.32000 0.2862000 25.38000 0.4147000 25.26000 0.3945000 0.1189000      0.5724000 
1 1 1 15 52 5  o 15.14000 0.3562000 15.22000 0.5651000 15.06000 0.4338000 0.1620000      0.7124000 
1 1 1 15 52 7  o 13.99000 0.3905000 14.30000 0.5055000 13.68000 0.5953000 0.6170000      0.7810000 
1 1 1 15 52 9  f 9.553000 0.4676000 9.843000 0.5959000 9.262000 0.7208000 0.5807000      0.9352000 
1 1 1 15 52 11 o 6.519000 0.8889000 7.044000 0.8061000 5.994000 1.585000  1.050000       1.778000  
1 1 1 15 52 13 o 7.076000 0.8238000 7.201000 0.8884000 6.951000 1.388000  0.2494000      1.648000  
1 1 1 15 52 15 o 16.52000 0.5033000 16.78000 0.6329000 16.26000 0.7826000 0.5218000      1.007000  
1 1 1 15 52 17 o 9.995000 0.8201000 11.65000 0.6152000 8.336000 1.520000  3.318000       1.640000  
1 1 1 15 52 19 o 6.227000 1.088000  5.786000 0.9623000 6.668000 1.953000  -0.8816000     2.177000  
1 1 1 15 52 21 o 4.461000 1.041000  4.131000 1.261000  4.792000 1.658000  -0.6604000     2.083000  
1 1 1 15 52 23 o 4.591000 1.064000  4.063000 1.344000  5.119000 1.651000  -1.056000      2.129000  
1 1 1 15 52 25 o 4.072000 0.9738000 2.465000 1.100000  5.678000 1.607000  -3.213000      1.948000  
1 1 1 15 52 27 o 4.011000 1.106000  3.729000 1.409000  4.292000 1.706000  -0.5635000     2.213000  
1 1 1 15 52 29 o 3.909000 1.033000  3.294000 1.269000  4.525000 1.631000  -1.231000      2.067000  
1 1 1 15 52 31 o 3.367000 0.9571000 3.596000 1.263000  3.138000 1.438000  0.4586000      1.914000  
1 1 1 15 53 0  o 7.326000 0.8082000 7.326000 0.8082000 7.326000 0.8082000 0.000000       0.000000  
1 1 1 15 53 2  o 6.148000 0.6540000 5.863000 0.9899000 6.434000 0.8549000 -0.5710000     1.308000  
1 1 1 15 53 4  o 5.295000 0.6887000 5.442000 1.004000  5.149000 0.9425000 0.2931000      1.377000  
1 1 1 15 53 6  o 2.422000 0.7467000 2.527000 1.105000  2.317000 1.005000  0.2104000      1.493000  
1 1 1 15 53 8  o 4.834000 0.8377000 5.710000 1.033000  3.959000 1.319000  1.751000       1.675000  
1 1 1 15 53 10 o 8.969000 0.5027000 9.207000 0.6634000 8.732000 0.7555000 0.4747000      1.005000  
1 1 1 15 53 12 o 6.608000 0.8716000 6.595000 0.9605000 6.622000 1.455000  -0.2640000E-01 1.743000  
1 1 1 15 53 14 o 6.250000 0.9821000 5.392000 1.362000  7.109000 1.416000  -1.717000      1.964000  
1 1 1 15 53 16 o 13.93000 0.7531000 14.90000 0.5123000 12.96000 1.416000  1.943000       1.506000  
1 1 1 15 53 18 o 3.577000 1.004000  3.323000 1.314000  3.831000 1.519000  -0.5080000     2.008000  
1 1 1 15 53 20 o 3.645000 0.9977000 3.661000 1.321000  3.629000 1.495000  0.3237000E-01  1.995000  
1 1 1 15 53 22 o 3.352000 0.9715000 2.756000 1.195000  3.948000 1.532000  -1.192000      1.943000  
1 1 1 15 53 24 o 3.968000 0.9959000 2.181000 1.029000  5.755000 1.706000  -3.574000      1.992000  
1 1 1 15 53 26 o 5.203000 1.040000  4.626000 1.174000  5.779000 1.716000  -1.154000      2.080000  
1 1 1 15 53 28 o 5.056000 1.023000  5.741000 1.110000  4.371000 1.720000  1.370000       2.047000  
1 1 1 15 53 30 o 4.384000 1.308000  3.716000 1.528000  5.051000 2.124000  -1.334000      2.616000  
1 1 1 15 54 1  o 10.60000 0.4507000 10.92000 0.6759000 10.29000 0.5964000 0.6253000      0.9014000 
1 1 1 15 54 3  o 5.105000 0.7362000 5.787000 1.011000  4.424000 1.071000  1.363000       1.472000  
1 1 1 15 54 5  o 9.534000 0.4254000 9.700000 0.6457000 9.368000 0.5539000 0.3325000      0.8507000 
1 1 1 15 54 7  o 5.847000 0.6047000 5.838000 0.9077000 5.855000 0.7991000 -0.1700000E-01 1.209000  
1 1 1 15 54 9  o 5.001000 0.9712000 4.727000 1.070000  5.276000 1.621000  -0.5486000     1.942000  
1 1 1 15 54 11 o 4.004000 1.019000  3.768000 1.272000  4.239000 1.591000  -0.4710000     2.037000  
1 1 1 15 54 13 o 4.972000 1.090000  5.426000 1.135000  4.518000 1.861000  0.9079000      2.180000  
1 1 1 15 54 15 o 8.729000 0.9911000 9.023000 0.7576000 8.434000 1.832000  0.5888000      1.982000  
1 1 1 15 54 17 o 4.267000 1.018000  4.491000 1.290000  4.043000 1.574000  0.4487000      2.035000  
1 1 1 15 54 19 o 3.685000 1.043000  3.649000 1.352000  3.720000 1.587000  -0.7169000E-01 2.085000  
1 1 1 15 54 21 o 3.115000 0.9382000 2.581000 1.154000  3.649000 1.480000  -1.068000      1.876000  
1 1 1 15 54 23 o 5.362000 1.008000  4.803000 1.219000  5.921000 1.607000  -1.118000      2.017000  
1 1 1 15 54 25 o 8.092000 0.8145000 7.303000 0.8960000 8.881000 1.360000  -1.578000      1.629000  
1 1 1 15 54 27 o 8.054000 0.8327000 7.199000 0.8568000 8.909000 1.428000  -1.710000      1.665000  
1 1 1 15 55 0  o 3.461000 1.348000  3.461000 1.348000  3.461000 1.348000  0.000000       0.000000  
1 1 1 15 55 2  o 8.300000 0.5639000 8.234000 0.7092000 8.366000 0.8769000 -0.1319000     1.128000  
1 1 1 15 55 4  o 6.695000 0.6173000 6.977000 0.9677000 6.414000 0.7666000 0.5631000      1.235000  
1 1 1 15 55 6  o 4.395000 0.8043000 3.792000 1.176000  4.997000 1.097000  -1.205000      1.609000  
1 1 1 15 55 8  o 2.529000 0.8460000 1.894000 0.9121000 3.164000 1.425000  -1.270000      1.692000  
1 1 1 15 55 10 o 6.090000 0.9550000 6.850000 0.8565000 5.329000 1.707000  1.521000       1.910000  
1 1 1 15 55 12 o 6.747000 1.084000  6.199000 1.138000  7.295000 1.845000  -1.096000      2.167000  
1 1 1 15 55 14 o 3.008000 0.8805000 3.443000 1.272000  2.572000 1.218000  0.8710000      1.761000  
1 1 1 15 55 16 o 6.296000 1.071000  5.996000 1.374000  6.596000 1.645000  -0.6001000     2.143000  
1 1 1 15 55 18 o 4.193000 0.9751000 2.914000 1.204000  5.472000 1.534000  -2.558000      1.950000  
1 1 1 15 55 20 o 5.351000 0.9989000 6.318000 0.9817000 4.383000 1.740000  1.934000       1.998000  
1 1 1 15 55 22 o 8.277000 0.7237000 7.726000 0.9012000 8.828000 1.133000  -1.102000      1.447000  
1 1 1 15 55 24 o 7.273000 0.9105000 6.866000 0.8683000 7.680000 1.601000  -0.8135000     1.821000  
1 1 1 15 56 1  o 7.024000 0.6537000 6.543000 0.8168000 7.505000 1.021000  -0.9621000     1.307000  
1 1 1 15 56 3  o 3.424000 0.9347000 3.435000 1.322000  3.412000 1.322000  0.2321000E-01  1.869000  
1 1 1 15 56 5  o 7.378000 0.6325000 7.736000 0.7890000 7.020000 0.9889000 0.7163000      1.265000  
1 1 1 15 56 7  o 3.518000 0.9526000 3.627000 1.228000  3.408000 1.457000  0.2195000      1.905000  
1 1 1 15 56 9  o 3.963000 1.137000  3.449000 1.186000  4.477000 1.941000  -1.029000      2.274000  
1 1 1 15 56 11 o 3.791000 0.9272000 4.440000 1.211000  3.141000 1.405000  1.300000       1.854000  
1 1 1 15 56 13 o 4.043000 1.001000  3.794000 1.218000  4.292000 1.589000  -0.4981000     2.002000  
1 1 1 15 56 15 o 8.186000 0.7988000 7.746000 0.8747000 8.625000 1.337000  -0.8783000     1.598000  
1 1 1 15 56 17 o 3.127000 0.9271000 3.340000 1.271000  2.914000 1.350000  0.4253000      1.854000  
1 1 1 15 56 19 o 2.916000 0.9291000 2.720000 1.189000  3.113000 1.428000  -0.3931000     1.858000  
1 1 1 15 56 21 o 2.678000 0.8798000 2.229000 1.029000  3.126000 1.427000  -0.8964000     1.760000  
1 1 1 15 57 0  o 6.279000 0.8833000 6.279000 0.8833000 6.279000 0.8833000 0.000000       0.000000  
1 1 1 15 57 2  o 5.843000 0.8692000 6.086000 1.262000  5.601000 1.195000  0.4850000      1.738000  
1 1 1 15 57 4  o 4.725000 0.9889000 5.770000 0.9985000 3.681000 1.707000  2.089000       1.978000  
1 1 1 15 57 6  o 4.133000 1.178000  3.104000 1.177000  5.162000 2.041000  -2.058000      2.356000  
1 1 1 15 57 8  o 3.336000 0.9080000 3.639000 1.208000  3.034000 1.356000  0.6053000      1.816000  
1 1 1 15 57 10 o 4.149000 0.9143000 5.082000 1.115000  3.216000 1.449000  1.866000       1.829000  
1 1 1 15 57 12 o 5.799000 1.144000  6.314000 1.376000  5.284000 1.828000  1.030000       2.288000  
1 1 1 15 57 14 o 9.325000 0.7022000 7.965000 0.9726000 10.68000 1.013000  -2.719000      1.404000  
1 1 1 15 57 16 o 4.644000 1.102000  3.666000 1.293000  5.623000 1.785000  -1.956000      2.204000  
1 1 1 15 57 18 o 3.540000 1.037000  2.470000 1.102000  4.610000 1.756000  -2.140000      2.073000  
1 1 1 15 58 1  o 8.038000 1.021000  5.499000 1.090000  10.58000 1.727000  -5.079000      2.042000  
1 1 1 15 58 3  o 6.021000 1.172000  4.155000 1.245000  7.887000 1.987000  -3.732000      2.345000  
1 1 1 15 58 5  o 6.588000 0.8130000 6.246000 0.9463000 6.930000 1.322000  -0.6836000     1.626000  
1 1 1 15 58 7  o 10.05000 0.6605000 10.23000 0.6009000 9.864000 1.176000  0.3632000      1.321000  
1 1 1 15 58 9  o 9.140000 0.8236000 10.64000 0.6937000 7.640000 1.494000  3.000000       1.647000  
1 1 1 15 58 11 o 4.555000 1.069000  4.160000 1.352000  4.951000 1.656000  -0.7918000     2.138000  
1 1 1 15 58 13 o 10.71000 0.6394000 10.47000 0.6376000 10.94000 1.109000  -0.4646000     1.279000  
1 1 1 15 58 15 o 9.581000 0.7194000 9.969000 0.6837000 9.193000 1.266000  0.7766000      1.439000  
1 1 1 15 59 0  f 3.776000 1.477000  3.776000 1.477000  3.776000 1.477000  0.000000       0.000000  
1 1 1 15 59 2  o 5.737000 1.097000  4.724000 1.579000  6.751000 1.523000  -2.028000      2.194000  
1 1 1 15 59 4  o 4.808000 1.102000  3.698000 1.344000  5.918000 1.746000  -2.220000      2.204000  
1 1 1 15 59 6  o 4.021000 1.058000  3.168000 1.312000  4.874000 1.662000  -1.707000      2.117000  
1 1 1 15 59 8  o 5.100000 1.035000  5.471000 1.153000  4.730000 1.720000  0.7411000      2.071000  
1 1 1 15 59 10 o 7.148000 0.9877000 7.052000 0.8671000 7.244000 1.775000  -0.1924000     1.975000  
1 1 1 16 0  0  o 56.19000 0.8039000 56.19000 0.8039000 56.19000 0.8039000 0.000000       0.000000  
1 1 1 16 0  2  f 29.34000 0.3542000 29.34000 0.3542000 29.34000 0.3542000 0.000000       0.000000  
1 1 1 16 0  4  o 13.22000 0.3426000 13.22000 0.3426000 13.22000 0.3426000 0.000000       0.000000  
1 1 1 16 0  6  o 96.05000 1.325000  96.05000 1.325000  96.05000 1.325000  0.000000       0.000000  
1 1 1 16 0  8  o 45.30000 0.4790000 45.30000 0.4790000 45.30000 0.4790000 0.000000       0.000000  
1 1 1 16 0  10 o 150.3000 1.450000  150.3000 1.450000  150.3000 1.450000  0.000000       0.000000  
1 1 1 16 0  12 o 71.29000 0.7092000 71.29000 0.7092000 71.29000 0.7092000 0.000000       0.000000  
1 1 1 16 0  14 o 31.29000 0.4002000 31.29000 0.4002000 31.29000 0.4002000 0.000000       0.000000  
1 1 1 16 0  16 o 54.03000 0.6466000 54.03000 0.6466000 54.03000 0.6466000 0.000000       0.000000  
1 1 1 16 0  18 o 26.48000 0.3878000 26.48000 0.3878000 26.48000 0.3878000 0.000000       0.000000  
1 1 1 16 0  20 o 126.3000 1.413000  126.3000 1.413000  126.3000 1.413000  0.000000       0.000000  
1 1 1 16 0  22 o 51.70000 0.5480000 51.70000 0.5480000 51.70000 0.5480000 0.000000       0.000000  
1 1 1 16 0  24 o 4.754000 1.292000  4.754000 1.292000  4.754000 1.292000  0.000000       0.000000  
1 1 1 16 0  26 o 55.19000 0.6740000 55.19000 0.6740000 55.19000 0.6740000 0.000000       0.000000  
1 1 1 16 0  28 o 17.68000 0.4620000 17.68000 0.4620000 17.68000 0.4620000 0.000000       0.000000  
1 1 1 16 0  30 o 43.93000 0.5786000 43.93000 0.5786000 43.93000 0.5786000 0.000000       0.000000  
1 1 1 16 0  32 o 13.85000 0.6533000 13.85000 0.6533000 13.85000 0.6533000 0.000000       0.000000  
1 1 1 16 0  34 o 37.21000 0.4678000 37.21000 0.4678000 37.21000 0.4678000 0.000000       0.000000  
1 1 1 16 0  36 o 32.65000 0.4610000 32.65000 0.4610000 32.65000 0.4610000 0.000000       0.000000  
1 1 1 16 0  38 o 30.55000 0.6202000 30.55000 0.6202000 30.55000 0.6202000 0.000000       0.000000  
1 1 1 16 0  40 o 5.446000 1.450000  5.446000 1.450000  5.446000 1.450000  0.000000       0.000000  
1 1 1 16 0  42 o 36.76000 0.5569000 36.76000 0.5569000 36.76000 0.5569000 0.000000       0.000000  
1 1 1 16 0  44 o 37.15000 0.5733000 37.15000 0.5733000 37.15000 0.5733000 0.000000       0.000000  
1 1 1 16 0  46 o 22.49000 0.5554000 22.49000 0.5554000 22.49000 0.5554000 0.000000       0.000000  
1 1 1 16 0  48 o 9.465000 0.8425000 9.465000 0.8425000 9.465000 0.8425000 0.000000       0.000000  
1 1 1 16 0  50 o 2.640000 1.191000  2.640000 1.191000  2.640000 1.191000  0.000000       0.000000  
1 1 1 16 0  52 o 3.420000 1.321000  3.420000 1.321000  3.420000 1.321000  0.000000       0.000000  
1 1 1 16 0  54 o 5.643000 1.473000  5.643000 1.473000  5.643000 1.473000  0.000000       0.000000  
1 1 1 16 0  56 o 13.10000 0.9693000 13.10000 0.9693000 13.10000 0.9693000 0.000000       0.000000  
1 1 1 16 0  58 o 3.664000 1.476000  3.664000 1.476000  3.664000 1.476000  0.000000       0.000000  
1 1 1 16 0  60 o 3.289000 1.374000  3.289000 1.374000  3.289000 1.374000  0.000000       0.000000  
1 1 1 16 0  62 o 2.813000 1.261000  2.813000 1.261000  2.813000 1.261000  0.000000       0.000000  
1 1 1 16 0  64 o 5.510000 1.573000  5.510000 1.573000  5.510000 1.573000  0.000000       0.000000  
1 1 1 16 1  1  o 75.95000 0.5294000 77.16000 0.7602000 74.74000 0.7369000 2.425000       1.059000  
1 1 1 16 1  3  o 134.1000 1.058000  134.2000 1.497000  134.1000 1.495000  0.9862000E-01  2.116000  
1 1 1 16 1  5  o 65.26000 0.4600000 65.40000 0.6515000 65.13000 0.6496000 0.2686000      0.9200000 
1 1 1 16 1  7  f 118.6000 0.8127000 118.9000 1.152000  118.4000 1.147000  0.5191000      1.625000  
1 1 1 16 1  9  o 100.3000 0.7466000 100.6000 1.130000  100.1000 0.9756000 0.4684000      1.493000  
1 1 1 16 1  11 o 74.18000 0.5199000 74.06000 0.7352000 74.29000 0.7352000 -0.2347000     1.040000  
1 1 1 16 1  13 o 80.03000 0.5583000 80.36000 0.7921000 79.71000 0.7870000 0.6518000      1.117000  
1 1 1 16 1  15 o 75.68000 0.6135000 74.96000 0.8605000 76.39000 0.8748000 -1.433000      1.227000  
1 1 1 16 1  17 o 69.82000 0.4951000 70.03000 0.7020000 69.60000 0.6983000 0.4321000      0.9901000 
1 1 1 16 1  19 o 61.68000 0.4794000 61.95000 0.6324000 61.42000 0.7206000 0.5280000      0.9588000 
1 1 1 16 1  21 o 45.49000 0.3520000 45.60000 0.4996000 45.38000 0.4960000 0.2193000      0.7040000 
1 1 1 16 1  23 o 66.05000 0.4739000 65.94000 0.6690000 66.16000 0.6713000 -0.2227000     0.9478000 
1 1 1 16 1  25 o 15.37000 0.4150000 15.57000 0.4108000 15.17000 0.7212000 0.3952000      0.8300000 
1 1 1 16 1  27 o 55.50000 0.4470000 55.50000 0.6743000 55.50000 0.5870000 0.7057000E-02  0.8940000 
1 1 1 16 1  29 o 61.82000 0.4876000 62.26000 0.6437000 61.38000 0.7326000 0.8783000      0.9753000 
1 1 1 16 1  31 o 29.08000 0.3795000 29.76000 0.6249000 28.41000 0.4307000 1.348000       0.7589000 
1 1 1 16 1  33 o 29.15000 0.3110000 29.00000 0.4377000 29.30000 0.4419000 -0.2969000     0.6220000 
1 1 1 16 1  35 f 25.55000 0.3557000 25.42000 0.5094000 25.68000 0.4965000 -0.2647000     0.7114000 
1 1 1 16 1  37 o 40.96000 0.3530000 41.18000 0.5006000 40.75000 0.4977000 0.4283000      0.7060000 
1 1 1 16 1  39 o 20.15000 0.3520000 20.39000 0.4817000 19.90000 0.5135000 0.4851000      0.7041000 
1 1 1 16 1  41 o 16.20000 0.4422000 15.99000 0.5850000 16.41000 0.6634000 -0.4248000     0.8844000 
1 1 1 16 1  43 o 19.84000 0.3729000 20.00000 0.5325000 19.67000 0.5221000 0.3352000      0.7458000 
1 1 1 16 1  45 o 6.739000 1.069000  7.294000 1.546000  6.185000 1.476000  1.108000       2.138000  
1 1 1 16 1  47 o 14.61000 0.4543000 15.36000 0.6275000 13.86000 0.6571000 1.507000       0.9086000 
1 1 1 16 1  49 o 15.50000 0.3822000 15.00000 0.5501000 16.01000 0.5308000 -1.005000      0.7644000 
1 1 1 16 1  51 o 9.065000 0.5834000 8.735000 0.8440000 9.395000 0.8056000 -0.6598000     1.167000  
1 1 1 16 1  53 o 5.873000 0.9530000 6.362000 1.143000  5.384000 1.525000  0.9778000      1.906000  
1 1 1 16 1  55 o 3.513000 0.9067000 4.353000 1.365000  2.673000 1.194000  1.680000       1.813000  
1 1 1 16 1  57 o 7.266000 0.8156000 7.296000 1.196000  7.236000 1.110000  0.5974000E-01  1.631000  
1 1 1 16 1  59 o 10.17000 0.5712000 10.11000 0.8209000 10.22000 0.7946000 -0.1091000     1.142000  
1 1 1 16 1  61 o 8.314000 0.6539000 8.652000 0.8940000 7.977000 0.9546000 0.6751000      1.308000  
1 1 1 16 1  63 f 3.547000 0.9890000 3.522000 1.372000  3.573000 1.425000  -0.5141000E-01 1.978000  
1 1 1 16 2  0  o 45.48000 0.5496000 45.48000 0.5496000 45.48000 0.5496000 0.000000       0.000000  
1 1 1 16 2  2  o 35.78000 0.3034000 35.69000 0.3963000 35.88000 0.4594000 -0.1918000     0.6067000 
1 1 1 16 2  4  o 14.57000 0.2589000 14.47000 0.3317000 14.67000 0.3975000 -0.2009000     0.5177000 
1 1 1 16 2  6  o 43.73000 0.3536000 43.53000 0.4613000 43.92000 0.5360000 -0.3908000     0.7072000 
1 1 1 16 2  8  o 57.47000 0.4456000 57.46000 0.5825000 57.48000 0.6745000 -0.2363000E-01 0.8912000 
1 1 1 16 2  10 o 96.35000 0.7670000 96.50000 1.087000  96.20000 1.083000  0.2949000      1.534000  
1 1 1 16 2  12 o 47.01000 0.3510000 46.81000 0.4952000 47.22000 0.4976000 -0.4124000     0.7021000 
1 1 1 16 2  14 o 60.59000 0.4697000 60.35000 0.7085000 60.83000 0.6168000 -0.4724000     0.9393000 
1 1 1 16 2  16 o 59.88000 0.4660000 60.02000 0.6113000 59.74000 0.7035000 0.2737000      0.9320000 
1 1 1 16 2  18 o 13.93000 0.3285000 14.06000 0.4662000 13.81000 0.4630000 0.2578000      0.6571000 
1 1 1 16 2  20 o 18.84000 0.3276000 18.48000 0.4673000 19.19000 0.4592000 -0.7092000     0.6552000 
1 1 1 16 2  22 f 33.67000 0.3238000 33.77000 0.4891000 33.58000 0.4246000 0.1883000      0.6477000 
1 1 1 16 2  24 o 44.64000 0.4178000 44.47000 0.4422000 44.81000 0.7090000 -0.3353000     0.8356000 
1 1 1 16 2  26 o 52.81000 0.3979000 52.78000 0.5622000 52.85000 0.5631000 -0.7488000E-01 0.7957000 
1 1 1 16 2  28 o 30.78000 0.3501000 30.47000 0.4963000 31.09000 0.4939000 -0.6160000     0.7002000 
1 1 1 16 2  30 o 10.94000 0.4499000 10.73000 0.6473000 11.15000 0.6251000 -0.4177000     0.8999000 
1 1 1 16 2  32 o 46.50000 0.4796000 46.31000 0.7427000 46.70000 0.6070000 -0.3885000     0.9591000 
1 1 1 16 2  34 o 66.13000 0.4827000 66.01000 0.6803000 66.24000 0.6849000 -0.2329000     0.9654000 
1 1 1 16 2  36 o 41.50000 0.3520000 42.14000 0.5018000 40.87000 0.4937000 1.267000       0.7039000 
1 1 1 16 2  38 o 7.528000 0.7923000 6.279000 1.323000  8.777000 0.8719000 -2.499000      1.585000  
1 1 1 16 2  40 o 2.956000 0.9424000 2.595000 1.214000  3.317000 1.442000  -0.7220000     1.885000  
1 1 1 16 2  42 o 21.43000 0.3819000 21.71000 0.5780000 21.16000 0.4992000 0.5524000      0.7638000 
1 1 1 16 2  44 o 19.59000 0.3720000 19.31000 0.5431000 19.88000 0.5085000 -0.5677000     0.7440000 
1 1 1 16 2  46 o 23.14000 0.3619000 22.99000 0.5520000 23.30000 0.4681000 -0.3091000     0.7238000 
1 1 1 16 2  48 o 6.870000 0.7755000 7.021000 1.052000  6.719000 1.140000  0.3019000      1.551000  
1 1 1 16 2  50 o 15.27000 0.3843000 15.50000 0.5440000 15.04000 0.5430000 0.4645000      0.7687000 
1 1 1 16 2  52 o 8.013000 0.6264000 8.293000 0.7942000 7.733000 0.9689000 0.5603000      1.253000  
1 1 1 16 2  54 o 12.35000 0.4630000 11.75000 0.6766000 12.96000 0.6322000 -1.211000      0.9260000 
1 1 1 16 2  56 o 6.272000 0.9799000 7.305000 1.221000  5.240000 1.533000  2.065000       1.960000  
1 1 1 16 2  58 o 3.562000 0.9923000 2.945000 1.306000  4.179000 1.495000  -1.234000      1.985000  
1 1 1 16 2  60 f 7.804000 0.7579000 7.425000 1.174000  8.183000 0.9587000 -0.7588000     1.516000  
1 1 1 16 2  62 o 3.120000 0.9369000 3.030000 1.332000  3.210000 1.318000  -0.1797000     1.874000  
1 1 1 16 2  64 o 6.800000 0.9234000 7.402000 1.212000  6.198000 1.393000  1.205000       1.847000  
1 1 1 16 3  1  o 47.03000 0.4471000 47.54000 0.5708000 46.53000 0.6883000 1.007000       0.8942000 
1 1 1 16 3  3  o 85.06000 0.6388000 83.33000 0.8165000 86.79000 0.9825000 -3.460000      1.278000  
1 1 1 16 3  5  o 70.93000 0.5372000 70.56000 0.7001000 71.29000 0.8151000 -0.7323000     1.074000  
1 1 1 16 3  7  o 60.29000 0.4639000 60.14000 0.6065000 60.44000 0.7021000 -0.3037000     0.9278000 
1 1 1 16 3  9  o 39.71000 0.3328000 39.68000 0.4348000 39.73000 0.5039000 -0.5611000E-01 0.6655000 
1 1 1 16 3  11 o 60.48000 0.4673000 60.44000 0.6104000 60.52000 0.7076000 -0.8099000E-01 0.9345000 
1 1 1 16 3  13 o 23.75000 0.2964000 23.54000 0.4136000 23.96000 0.4246000 -0.4229000     0.5928000 
1 1 1 16 3  15 o 50.06000 0.3721000 49.24000 0.5192000 50.88000 0.5332000 -1.639000      0.7442000 
1 1 1 16 3  17 o 23.40000 0.2868000 23.01000 0.3839000 23.79000 0.4262000 -0.7785000     0.5736000 
1 1 1 16 3  19 o 94.38000 0.7063000 94.53000 0.9273000 94.23000 1.066000  0.2937000      1.413000  
1 1 1 16 3  21 o 40.73000 0.3530000 40.91000 0.5319000 40.54000 0.4644000 0.3725000      0.7061000 
1 1 1 16 3  23 o 74.03000 0.6195000 74.48000 0.6666000 73.59000 1.045000  0.8933000      1.239000  
1 1 1 16 3  25 f 13.19000 0.3874000 13.09000 0.4519000 13.29000 0.6293000 -0.2011000     0.7747000 
1 1 1 16 3  27 o 97.24000 0.7297000 98.08000 0.9639000 96.41000 1.096000  1.665000       1.459000  
1 1 1 16 3  29 o 72.35000 0.5593000 72.55000 0.8444000 72.16000 0.7337000 0.3902000      1.119000  
1 1 1 16 3  31 o 14.13000 0.4136000 14.64000 0.6108000 13.61000 0.5580000 1.032000       0.8273000 
1 1 1 16 3  33 o 16.26000 0.3560000 15.64000 0.4837000 16.88000 0.5226000 -1.245000      0.7121000 
1 1 1 16 3  35 o 46.27000 0.4808000 45.29000 0.5964000 47.25000 0.7544000 -1.954000      0.9617000 
1 1 1 16 3  37 o 28.21000 0.3173000 27.84000 0.4534000 28.58000 0.4440000 -0.7337000     0.6346000 
1 1 1 16 3  39 o 31.87000 0.3503000 32.28000 0.4573000 31.45000 0.5307000 0.8281000      0.7006000 
1 1 1 16 3  41 o 18.44000 0.3744000 18.28000 0.5384000 18.60000 0.5204000 -0.3148000     0.7488000 
1 1 1 16 3  43 o 22.07000 0.4046000 21.67000 0.5628000 22.46000 0.5813000 -0.7962000     0.8091000 
1 1 1 16 3  45 o 7.618000 0.8776000 6.721000 1.359000  8.515000 1.111000  -1.794000      1.755000  
1 1 1 16 3  47 o 18.32000 0.4034000 18.76000 0.5708000 17.87000 0.5703000 0.8907000      0.8069000 
1 1 1 16 3  49 o 8.672000 0.5771000 8.707000 0.8065000 8.638000 0.8258000 0.6955000E-01  1.154000  
1 1 1 16 3  51 o 7.994000 0.6365000 7.732000 0.9483000 8.257000 0.8493000 -0.5246000     1.273000  
1 1 1 16 3  53 o 11.49000 0.4793000 11.02000 0.7153000 11.96000 0.6382000 -0.9373000     0.9586000 
1 1 1 16 3  55 o 20.96000 0.4664000 21.00000 0.5814000 20.92000 0.7294000 0.8723000E-01  0.9328000 
1 1 1 16 3  57 o 12.37000 0.4682000 12.44000 0.6287000 12.29000 0.6938000 0.1550000      0.9363000 
1 1 1 16 3  59 o 7.222000 0.7665000 7.365000 1.017000  7.080000 1.147000  0.2851000      1.533000  
1 1 1 16 3  61 o 5.993000 0.9325000 5.868000 1.317000  6.119000 1.321000  -0.2502000     1.865000  
1 1 1 16 3  63 o 3.484000 0.9989000 3.956000 1.460000  3.013000 1.363000  0.9424000      1.998000  
1 1 1 16 4  0  o 6.696000 0.6280000 6.696000 0.6280000 6.696000 0.6280000 0.000000       0.000000  
1 1 1 16 4  2  o 23.99000 0.2302000 23.86000 0.3270000 24.12000 0.3241000 -0.2558000     0.4604000 
1 1 1 16 4  4  o 45.28000 0.3879000 44.80000 0.5435000 45.76000 0.5536000 -0.9566000     0.7758000 
1 1 1 16 4  6  o 21.20000 0.2307000 21.24000 0.3217000 21.16000 0.3308000 0.8631000E-01  0.4615000 
1 1 1 16 4  8  o 94.81000 0.6537000 94.73000 0.9240000 94.88000 0.9248000 -0.1466000     1.307000  
1 1 1 16 4  10 o 19.88000 0.2448000 19.95000 0.3436000 19.82000 0.3488000 0.1239000      0.4896000 
1 1 1 16 4  12 o 103.2000 0.7699000 102.2000 0.9955000 104.2000 1.175000  -1.999000      1.540000  
1 1 1 16 4  14 o 33.98000 0.3752000 33.71000 0.4672000 34.26000 0.5872000 -0.5483000     0.7504000 
1 1 1 16 4  16 o 29.47000 0.3595000 29.73000 0.5640000 29.22000 0.4459000 0.5048000      0.7190000 
1 1 1 16 4  18 o 11.13000 0.4087000 11.08000 0.5388000 11.19000 0.6148000 -0.1048000     0.8175000 
1 1 1 16 4  20 o 48.93000 0.4003000 49.32000 0.6086000 48.54000 0.5203000 0.7773000      0.8007000 
1 1 1 16 4  22 o 36.81000 0.3735000 36.69000 0.3903000 36.92000 0.6369000 -0.2204000     0.7470000 
1 1 1 16 4  24 o 51.25000 0.3999000 51.24000 0.4883000 51.25000 0.6334000 -0.6668000E-02 0.7998000 
1 1 1 16 4  26 o 18.79000 0.3355000 18.43000 0.4445000 19.16000 0.5026000 -0.7329000     0.6709000 
1 1 1 16 4  28 o 50.66000 0.3883000 50.40000 0.5435000 50.92000 0.5548000 -0.5167000     0.7766000 
1 1 1 16 4  30 o 3.120000 0.9137000 3.176000 1.299000  3.065000 1.285000  0.1106000      1.827000  
1 1 1 16 4  32 o 25.56000 0.3275000 25.44000 0.4241000 25.69000 0.4992000 -0.2572000     0.6550000 
1 1 1 16 4  34 o 34.84000 0.3501000 34.32000 0.4562000 35.35000 0.5312000 -1.035000      0.7003000 
1 1 1 16 4  36 o 37.47000 0.3373000 37.69000 0.4777000 37.26000 0.4764000 0.4265000      0.6747000 
1 1 1 16 4  38 o 25.30000 0.3532000 25.21000 0.4681000 25.38000 0.5291000 -0.1745000     0.7064000 
1 1 1 16 4  40 o 12.77000 0.4699000 12.74000 0.6583000 12.79000 0.6708000 -0.5167000E-01 0.9398000 
1 1 1 16 4  42 o 24.83000 0.3691000 24.61000 0.4724000 25.05000 0.5672000 -0.4409000     0.7382000 
1 1 1 16 4  44 o 37.62000 0.4898000 37.54000 0.6892000 37.69000 0.6960000 -0.1520000     0.9795000 
1 1 1 16 4  46 o 23.18000 0.3322000 22.51000 0.4807000 23.86000 0.4586000 -1.342000      0.6644000 
1 1 1 16 4  48 o 4.441000 0.9344000 3.217000 1.344000  5.666000 1.298000  -2.449000      1.869000  
1 1 1 16 4  50 o 8.267000 0.5915000 8.534000 0.8484000 8.001000 0.8245000 0.5327000      1.183000  
1 1 1 16 4  52 o 6.269000 0.8821000 6.596000 1.082000  5.942000 1.393000  0.6546000      1.764000  
1 1 1 16 4  54 o 10.14000 0.6047000 10.14000 0.7708000 10.14000 0.9319000 0.4196000E-04  1.209000  
1 1 1 16 4  56 o 4.489000 1.126000  5.093000 1.738000  3.884000 1.431000  1.209000       2.251000  
1 1 1 16 4  58 o 7.511000 0.8725000 6.139000 1.480000  8.883000 0.9244000 -2.745000      1.745000  
1 1 1 16 4  60 o 5.424000 1.000000  5.465000 1.430000  5.382000 1.398000  0.8218000E-01  2.000000  
1 1 1 16 4  62 o 4.546000 1.033000  4.286000 1.486000  4.806000 1.436000  -0.5202000     2.067000  
1 1 1 16 4  64 o 7.059000 1.577000  7.543000 1.863000  6.575000 2.544000  0.9671000      3.153000  
1 1 1 16 5  1  o 80.99000 0.6073000 80.59000 0.9149000 81.40000 0.7991000 -0.8153000     1.215000  
1 1 1 16 5  3  o 80.41000 0.5586000 80.25000 0.7886000 80.57000 0.7913000 -0.3190000     1.117000  
1 1 1 16 5  5  o 139.4000 0.9510000 139.1000 1.342000  139.6000 1.347000  -0.5870000     1.902000  
1 1 1 16 5  7  o 34.45000 0.3215000 34.43000 0.4524000 34.47000 0.4568000 -0.4690000E-01 0.6430000 
1 1 1 16 5  9  o 90.65000 0.6266000 90.88000 0.8878000 90.41000 0.8844000 0.4739000      1.253000  
1 1 1 16 5  11 o 5.409000 0.6350000 5.369000 0.8940000 5.449000 0.9021000 -0.8016000E-01 1.270000  
1 1 1 16 5  13 o 112.3000 0.8339000 112.7000 1.263000  112.0000 1.089000  0.6558000      1.668000  
1 1 1 16 5  15 o 97.98000 0.7320000 97.52000 0.9530000 98.44000 1.111000  -0.9200000     1.464000  
1 1 1 16 5  17 o 31.22000 0.3627000 30.74000 0.4481000 31.70000 0.5704000 -0.9602000     0.7254000 
1 1 1 16 5  19 o 82.20000 0.6216000 82.69000 0.8184000 81.72000 0.9359000 0.9716000      1.243000  
1 1 1 16 5  21 o 26.55000 0.3616000 26.44000 0.4509000 26.66000 0.5654000 -0.2176000     0.7231000 
1 1 1 16 5  23 o 92.66000 0.6671000 92.31000 0.8124000 93.02000 1.058000  -0.7171000     1.334000  
1 1 1 16 5  25 o 68.24000 0.5278000 68.51000 0.6915000 67.97000 0.7976000 0.5348000      1.056000  
1 1 1 16 5  27 o 30.43000 0.3541000 30.73000 0.3757000 30.12000 0.6002000 0.6081000      0.7081000 
1 1 1 16 5  29 o 36.86000 0.3211000 36.91000 0.4490000 36.81000 0.4593000 0.1009000      0.6423000 
1 1 1 16 5  31 o 23.19000 0.3220000 22.58000 0.4746000 23.79000 0.4354000 -1.205000      0.6441000 
1 1 1 16 5  33 o 27.76000 0.3331000 28.09000 0.5052000 27.43000 0.4342000 0.6650000      0.6662000 
1 1 1 16 5  35 o 16.78000 0.3867000 16.62000 0.5910000 16.93000 0.4990000 -0.3132000     0.7735000 
1 1 1 16 5  37 o 18.07000 0.3666000 18.25000 0.5158000 17.90000 0.5212000 0.3440000      0.7333000 
1 1 1 16 5  39 o 26.76000 0.3368000 27.05000 0.4714000 26.47000 0.4811000 0.5755000      0.6735000 
1 1 1 16 5  41 o 18.41000 0.4030000 17.55000 0.5570000 19.28000 0.5827000 -1.731000      0.8061000 
1 1 1 16 5  43 o 27.49000 0.3327000 27.51000 0.4634000 27.48000 0.4777000 0.3324000E-01  0.6655000 
1 1 1 16 5  45 o 13.10000 0.5727000 11.45000 0.8054000 14.75000 0.8143000 -3.305000      1.145000  
1 1 1 16 5  47 o 18.87000 0.4437000 19.06000 0.6968000 18.69000 0.5495000 0.3759000      0.8874000 
1 1 1 16 5  49 o 3.013000 0.8921000 2.459000 1.147000  3.568000 1.367000  -1.109000      1.784000  
1 1 1 16 5  51 o 10.40000 0.5471000 10.46000 0.7188000 10.34000 0.8248000 0.1147000      1.094000  
1 1 1 16 5  53 o 15.75000 0.3798000 15.48000 0.5631000 16.01000 0.5099000 -0.5279000     0.7596000 
1 1 1 16 5  55 o 17.01000 0.4220000 16.41000 0.5724000 17.61000 0.6202000 -1.199000      0.8440000 
1 1 1 16 5  57 o 9.079000 0.6920000 8.523000 1.081000  9.635000 0.8640000 -1.112000      1.384000  
1 1 1 16 5  59 o 4.991000 1.066000  4.625000 1.588000  5.357000 1.424000  -0.7319000     2.133000  
1 1 1 16 5  61 f 11.25000 0.5419000 10.56000 0.8199000 11.93000 0.7087000 -1.376000      1.084000  
1 1 1 16 5  63 o 7.701000 1.045000  8.139000 1.780000  7.263000 1.095000  0.8755000      2.090000  
1 1 1 16 6  0  o 56.49000 0.6568000 56.49000 0.6568000 56.49000 0.6568000 0.000000       0.000000  
1 1 1 16 6  2  o 60.08000 0.4610000 59.70000 0.6931000 60.47000 0.6079000 -0.7652000     0.9219000 
1 1 1 16 6  4  o 44.71000 0.3320000 45.12000 0.4724000 44.30000 0.4665000 0.8167000      0.6640000 
1 1 1 16 6  6  o 32.90000 0.2704000 33.18000 0.3850000 32.62000 0.3798000 0.5613000      0.5408000 
1 1 1 16 6  8  o 43.70000 0.4074000 43.74000 0.6679000 43.66000 0.4667000 0.7359000E-01  0.8148000 
1 1 1 16 6  10 o 76.80000 0.5802000 76.06000 0.7509000 77.54000 0.8846000 -1.480000      1.160000  
1 1 1 16 6  12 o 109.3000 0.9224000 110.5000 1.516000  108.1000 1.052000  2.358000       1.845000  
1 1 1 16 6  14 o 9.440000 0.4063000 9.156000 0.5859000 9.724000 0.5631000 -0.5675000     0.8126000 
1 1 1 16 6  16 o 81.24000 0.6147000 80.50000 0.7955000 81.97000 0.9374000 -1.468000      1.229000  
1 1 1 16 6  18 o 80.37000 0.6872000 80.23000 0.7939000 80.50000 1.122000  -0.2719000     1.374000  
1 1 1 16 6  20 o 24.52000 0.2974000 25.13000 0.4543000 23.90000 0.3839000 1.231000       0.5948000 
1 1 1 16 6  22 o 37.24000 0.3433000 37.18000 0.4444000 37.30000 0.5234000 -0.1212000     0.6866000 
1 1 1 16 6  24 o 29.04000 0.3377000 28.44000 0.4588000 29.64000 0.4956000 -1.199000      0.6753000 
1 1 1 16 6  26 o 89.72000 0.6472000 89.84000 0.7929000 89.61000 1.023000  0.2341000      1.294000  
1 1 1 16 6  28 o 55.65000 0.4783000 56.52000 0.6812000 54.77000 0.6716000 1.753000       0.9566000 
1 1 1 16 6  30 o 59.71000 0.5417000 60.91000 0.8920000 58.50000 0.6148000 2.412000       1.083000  
1 1 1 16 6  32 o 14.28000 0.4048000 14.44000 0.5259000 14.11000 0.6156000 0.3291000      0.8096000 
1 1 1 16 6  34 o 5.360000 1.026000  4.681000 1.517000  6.039000 1.382000  -1.358000      2.052000  
1 1 1 16 6  36 o 25.38000 0.3245000 25.82000 0.4530000 24.94000 0.4647000 0.8746000      0.6489000 
1 1 1 16 6  38 o 13.73000 0.4592000 14.23000 0.6067000 13.24000 0.6896000 0.9823000      0.9185000 
1 1 1 16 6  40 o 13.35000 0.4691000 13.92000 0.6449000 12.77000 0.6815000 1.153000       0.9383000 
1 1 1 16 6  42 f 18.30000 0.3823000 18.69000 0.5287000 17.92000 0.5524000 0.7742000      0.7647000 
1 1 1 16 6  44 o 15.44000 0.4767000 15.15000 0.6708000 15.74000 0.6776000 -0.5969000     0.9534000 
1 1 1 16 6  46 o 38.06000 0.3443000 37.58000 0.4817000 38.54000 0.4920000 -0.9653000     0.6886000 
1 1 1 16 6  48 o 9.793000 0.6021000 9.468000 0.9380000 10.12000 0.7551000 -0.6497000     1.204000  
1 1 1 16 6  50 o 12.66000 0.4307000 12.92000 0.6107000 12.39000 0.6075000 0.5328000      0.8613000 
1 1 1 16 6  52 o 12.87000 0.4163000 12.90000 0.6059000 12.84000 0.5710000 0.6060000E-01  0.8326000 
1 1 1 16 6  54 o 3.267000 0.9293000 3.537000 1.349000  2.997000 1.279000  0.5401000      1.859000  
1 1 1 16 6  56 o 7.863000 0.7122000 7.306000 1.185000  8.421000 0.7908000 -1.115000      1.424000  
1 1 1 16 6  58 o 10.08000 0.5786000 9.531000 0.8112000 10.63000 0.8251000 -1.101000      1.157000  
1 1 1 16 6  60 o 3.066000 0.9250000 3.274000 1.350000  2.858000 1.265000  0.4163000      1.850000  
1 1 1 16 6  62 o 3.860000 1.064000  4.400000 1.611000  3.321000 1.390000  1.079000       2.128000  
1 1 1 16 7  1  o 44.04000 0.3278000 43.70000 0.4607000 44.37000 0.4664000 -0.6798000     0.6556000 
1 1 1 16 7  3  o 34.62000 0.3471000 35.22000 0.5766000 34.03000 0.3866000 1.192000       0.6942000 
1 1 1 16 7  5  o 54.52000 0.4250000 53.77000 0.6377000 55.28000 0.5618000 -1.503000      0.8499000 
1 1 1 16 7  7  o 59.49000 0.4594000 59.11000 0.6927000 59.88000 0.6037000 -0.7622000     0.9189000 
1 1 1 16 7  9  o 54.03000 0.4247000 53.88000 0.6426000 54.19000 0.5555000 -0.3144000     0.8494000 
1 1 1 16 7  11 o 79.00000 0.9060000 79.46000 1.574000  78.53000 0.8978000 0.9246000      1.812000  
1 1 1 16 7  13 o 81.18000 0.6122000 80.76000 0.7958000 81.60000 0.9304000 -0.8417000     1.224000  
1 1 1 16 7  15 o 36.38000 0.3004000 36.38000 0.4250000 36.38000 0.4246000 0.4395000E-02  0.6008000 
1 1 1 16 7  17 o 16.35000 0.3952000 16.35000 0.3952000 ?        ?         ?              ?         
1 1 1 16 7  19 o 32.75000 0.3193000 32.71000 0.4104000 32.79000 0.4892000 -0.8499000E-01 0.6386000 
1 1 1 16 7  21 o 52.55000 0.5021000 53.32000 0.6390000 51.77000 0.7746000 1.542000       1.004000  
1 1 1 16 7  23 o 26.32000 0.3056000 26.20000 0.3864000 26.44000 0.4734000 -0.2447000     0.6111000 
1 1 1 16 7  25 o 66.76000 0.4973000 66.83000 0.6081000 66.69000 0.7871000 0.1401000      0.9946000 
1 1 1 16 7  27 o 16.20000 0.3438000 16.34000 0.4162000 16.06000 0.5474000 0.2737000      0.6876000 
1 1 1 16 7  29 o 50.54000 0.4185000 50.99000 0.6318000 50.10000 0.5489000 0.8897000      0.8370000 
1 1 1 16 7  31 o 28.29000 0.3631000 28.99000 0.5873000 27.59000 0.4269000 1.399000       0.7261000 
1 1 1 16 7  33 o 35.66000 0.3230000 35.58000 0.4495000 35.74000 0.4640000 -0.1594000     0.6460000 
1 1 1 16 7  35 o 45.90000 0.4520000 45.77000 0.7319000 46.02000 0.5307000 -0.2516000     0.9040000 
1 1 1 16 7  37 o 29.35000 0.3510000 28.91000 0.4531000 29.80000 0.5362000 -0.8915000     0.7020000 
1 1 1 16 7  39 o 7.740000 0.7689000 7.190000 1.163000  8.290000 1.007000  -1.099000      1.538000  
1 1 1 16 7  41 o 15.75000 0.4052000 15.81000 0.5656000 15.68000 0.5803000 0.1269000      0.8103000 
1 1 1 16 7  43 o 29.75000 0.3338000 30.21000 0.4735000 29.30000 0.4707000 0.9119000      0.6676000 
1 1 1 16 7  45 o 15.00000 0.4570000 14.89000 0.6945000 15.11000 0.5943000 -0.2271000     0.9141000 
1 1 1 16 7  47 o 13.72000 0.4721000 13.25000 0.6753000 14.20000 0.6598000 -0.9557000     0.9441000 
1 1 1 16 7  49 o 6.085000 0.8022000 6.241000 1.173000  5.929000 1.094000  0.3125000      1.604000  
1 1 1 16 7  51 o 13.81000 0.3975000 13.94000 0.5655000 13.69000 0.5588000 0.2461000      0.7950000 
1 1 1 16 7  53 o 6.950000 0.7635000 6.815000 1.070000  7.084000 1.090000  -0.2681000     1.527000  
1 1 1 16 7  55 o 12.78000 0.5038000 12.23000 0.6797000 13.33000 0.7440000 -1.108000      1.008000  
1 1 1 16 7  57 o 9.426000 0.7092000 9.595000 1.140000  9.257000 0.8440000 0.3378000      1.418000  
1 1 1 16 7  59 o 4.083000 1.040000  3.965000 1.438000  4.200000 1.503000  -0.2347000     2.080000  
1 1 1 16 7  61 o 3.933000 1.054000  3.458000 1.401000  4.407000 1.575000  -0.9483000     2.108000  
1 1 1 16 7  63 o 3.143000 0.9589000 3.041000 1.339000  3.246000 1.373000  -0.2056000     1.918000  
1 1 1 16 8  0  o 110.0000 1.066000  110.0000 1.066000  110.0000 1.066000  0.000000       0.000000  
1 1 1 16 8  2  o 123.1000 0.9108000 123.9000 1.385000  122.3000 1.183000  1.532000       1.822000  
1 1 1 16 8  4  o 175.6000 1.470000  177.6000 2.420000  173.6000 1.671000  4.010000       2.941000  
1 1 1 16 8  6  o 49.50000 0.3943000 49.51000 0.5982000 49.48000 0.5138000 0.3582000E-01  0.7886000 
1 1 1 16 8  8  o 48.88000 0.3877000 48.83000 0.5847000 48.94000 0.5094000 -0.1095000     0.7754000 
1 1 1 16 8  10 o 10.17000 0.4346000 10.08000 0.7282000 10.26000 0.4747000 -0.1760000     0.8692000 
1 1 1 16 8  12 f 108.9000 0.8088000 108.1000 1.216000  109.8000 1.067000  -1.642000      1.618000  
1 1 1 16 8  14 o 61.11000 0.5066000 60.84000 0.7120000 61.38000 0.7209000 -0.5394000     1.013000  
1 1 1 16 8  16 o 21.81000 0.3154000 21.90000 0.3824000 21.72000 0.5016000 0.1798000      0.6307000 
1 1 1 16 8  18 o 16.28000 0.2888000 16.54000 0.4152000 16.02000 0.4016000 0.5263000      0.5776000 
1 1 1 16 8  20 o 23.60000 0.2813000 23.66000 0.3410000 23.54000 0.4474000 0.1238000      0.5625000 
1 1 1 16 8  22 o 36.15000 0.3337000 35.96000 0.4259000 36.35000 0.5138000 -0.3905000     0.6674000 
1 1 1 16 8  24 o 23.45000 0.3506000 23.18000 0.3844000 23.71000 0.5863000 -0.5306000     0.7011000 
1 1 1 16 8  26 o 37.98000 0.3501000 38.30000 0.4579000 37.65000 0.5298000 0.6527000      0.7003000 
1 1 1 16 8  28 o 41.36000 0.3488000 41.69000 0.4264000 41.02000 0.5522000 0.6676000      0.6977000 
1 1 1 16 8  30 o 34.21000 0.3363000 34.24000 0.4992000 34.19000 0.4509000 0.4925000E-01  0.6727000 
1 1 1 16 8  32 o 9.474000 0.5988000 9.614000 0.8153000 9.334000 0.8773000 0.2800000      1.198000  
1 1 1 16 8  34 o 32.96000 0.3441000 33.13000 0.4443000 32.79000 0.5256000 0.3366000      0.6882000 
1 1 1 16 8  36 o 39.76000 0.3978000 40.51000 0.5666000 39.01000 0.5585000 1.504000       0.7956000 
1 1 1 16 8  38 o 19.44000 0.3584000 19.94000 0.4906000 18.93000 0.5226000 1.001000       0.7168000 
1 1 1 16 8  40 o 9.005000 0.6758000 9.324000 0.8943000 8.687000 1.013000  0.6373000      1.352000  
1 1 1 16 8  42 o 13.82000 0.4459000 13.54000 0.6229000 14.09000 0.6382000 -0.5490000     0.8918000 
1 1 1 16 8  44 o 4.841000 1.063000  5.715000 1.533000  3.967000 1.473000  1.748000       2.125000  
1 1 1 16 8  46 o 19.53000 0.3801000 19.50000 0.5623000 19.57000 0.5116000 -0.7029000E-01 0.7602000 
1 1 1 16 8  48 o 3.823000 0.9858000 4.000000 1.403000  3.645000 1.385000  0.3551000      1.972000  
1 1 1 16 8  50 o 15.70000 0.3604000 16.15000 0.5252000 15.25000 0.4937000 0.8964000      0.7208000 
1 1 1 16 8  52 o 4.008000 1.024000  3.964000 1.379000  4.053000 1.515000  -0.8939000E-01 2.049000  
1 1 1 16 8  54 o 6.537000 0.8220000 6.843000 1.113000  6.231000 1.210000  0.6119000      1.644000  
1 1 1 16 8  56 o 6.465000 0.8749000 6.476000 1.339000  6.454000 1.127000  0.2231000E-01  1.750000  
1 1 1 16 8  58 o 10.13000 0.6526000 9.303000 1.016000  10.96000 0.8199000 -1.658000      1.305000  
1 1 1 16 8  60 o 3.269000 1.002000  2.851000 1.338000  3.688000 1.493000  -0.8370000     2.004000  
1 1 1 16 8  62 o 9.220000 0.7132000 10.10000 0.8683000 8.343000 1.132000  1.753000       1.426000  
1 1 1 16 9  1  o 53.88000 0.4211000 54.15000 0.6405000 53.61000 0.5469000 0.5411000      0.8422000 
1 1 1 16 9  3  o 95.76000 0.7131000 95.28000 1.075000  96.25000 0.9378000 -0.9629000     1.426000  
1 1 1 16 9  5  o 45.61000 0.3667000 45.18000 0.5521000 46.04000 0.4828000 -0.8631000     0.7334000 
1 1 1 16 9  7  o 119.4000 0.8184000 118.9000 1.152000  120.0000 1.162000  -1.091000      1.637000  
1 1 1 16 9  9  o 72.13000 0.5456000 71.31000 0.8160000 72.95000 0.7244000 -1.645000      1.091000  
1 1 1 16 9  11 o 42.74000 0.3270000 42.63000 0.4599000 42.85000 0.4650000 -0.2270000     0.6540000 
1 1 1 16 9  13 o 67.61000 0.5534000 68.21000 0.7925000 67.01000 0.7728000 1.201000       1.107000  
1 1 1 16 9  15 o 73.98000 0.6700000 73.90000 0.8540000 74.07000 1.033000  -0.1747000     1.340000  
1 1 1 16 9  17 o 31.90000 0.3226000 31.92000 0.4518000 31.87000 0.4606000 0.4583000E-01  0.6452000 
1 1 1 16 9  19 o 32.79000 0.3183000 32.78000 0.4120000 32.79000 0.4853000 -0.7336000E-02 0.6366000 
1 1 1 16 9  21 o 18.35000 0.3610000 18.48000 0.5147000 18.22000 0.5062000 0.2659000      0.7219000 
1 1 1 16 9  23 o 3.103000 0.8753000 2.538000 1.070000  3.668000 1.385000  -1.130000      1.751000  
1 1 1 16 9  25 o 52.30000 0.4810000 52.09000 0.5462000 52.50000 0.7918000 -0.4084000     0.9619000 
1 1 1 16 9  27 o 25.63000 0.2977000 25.78000 0.3611000 25.48000 0.4734000 0.2989000      0.5953000 
1 1 1 16 9  29 o 19.82000 0.3141000 19.71000 0.3755000 19.94000 0.5036000 -0.2366000     0.6281000 
1 1 1 16 9  31 o 16.23000 0.3396000 15.73000 0.4616000 16.74000 0.4982000 -1.006000      0.6792000 
1 1 1 16 9  33 o 11.15000 0.5463000 11.39000 0.7195000 10.91000 0.8221000 0.4798000      1.093000  
1 1 1 16 9  35 o 14.30000 0.4702000 14.35000 0.6041000 14.26000 0.7208000 0.8492000E-01  0.9405000 
1 1 1 16 9  37 o 29.83000 0.3227000 28.81000 0.4412000 30.84000 0.4711000 -2.029000      0.6454000 
1 1 1 16 9  39 o 11.88000 0.5500000 11.29000 0.7418000 12.48000 0.8123000 -1.194000      1.100000  
1 1 1 16 9  41 o 17.42000 0.3908000 17.43000 0.5396000 17.42000 0.5656000 0.4393000E-02  0.7817000 
1 1 1 16 9  43 o 10.22000 0.5720000 10.21000 0.7884000 10.23000 0.8290000 -0.2405000E-01 1.144000  
1 1 1 16 9  45 o 22.31000 0.3386000 22.68000 0.4781000 21.94000 0.4796000 0.7424000      0.6772000 
1 1 1 16 9  47 o 5.492000 0.9371000 5.190000 1.324000  5.793000 1.327000  -0.6028000     1.874000  
1 1 1 16 9  49 o 6.549000 0.8877000 4.531000 1.523000  8.566000 0.9126000 -4.035000      1.775000  
1 1 1 16 9  51 o 13.59000 0.4472000 13.48000 0.5859000 13.71000 0.6757000 -0.2236000     0.8943000 
1 1 1 16 9  53 o 9.418000 0.5463000 9.389000 0.7476000 9.446000 0.7968000 -0.5665000E-01 1.093000  
1 1 1 16 9  55 o 5.629000 0.9767000 4.691000 1.396000  6.568000 1.367000  -1.877000      1.953000  
1 1 1 16 9  57 o 6.535000 0.9085000 5.227000 1.538000  7.842000 0.9671000 -2.615000      1.817000  
1 1 1 16 9  59 o 3.476000 0.9670000 3.945000 1.469000  3.006000 1.258000  0.9390000      1.934000  
1 1 1 16 9  61 o 11.08000 0.5290000 11.36000 0.7319000 10.80000 0.7640000 0.5626000      1.058000  
1 1 1 16 9  63 o 4.543000 1.033000  4.096000 1.466000  4.990000 1.455000  -0.8938000     2.066000  
1 1 1 16 10 0  o 52.26000 0.7732000 52.26000 0.7732000 52.26000 0.7732000 0.000000       0.000000  
1 1 1 16 10 2  o 84.50000 0.5859000 84.82000 0.8314000 84.19000 0.8258000 0.6226000      1.172000  
1 1 1 16 10 4  o 116.6000 0.7986000 116.4000 1.128000  116.7000 1.131000  -0.2777000     1.597000  
1 1 1 16 10 6  o 42.87000 0.3476000 42.68000 0.5218000 43.07000 0.4595000 -0.3887000     0.6953000 
1 1 1 16 10 8  o 66.28000 0.5047000 66.40000 0.7626000 66.15000 0.6613000 0.2477000      1.009000  
1 1 1 16 10 10 o 96.01000 0.7143000 96.19000 0.9383000 95.83000 1.077000  0.3563000      1.429000  
1 1 1 16 10 12 o 12.29000 0.3523000 12.60000 0.4875000 11.97000 0.5088000 0.6272000      0.7047000 
1 1 1 16 10 14 o 32.99000 0.3349000 32.93000 0.4000000 33.04000 0.5372000 -0.1073000     0.6697000 
1 1 1 16 10 16 o 44.34000 0.3738000 44.38000 0.5707000 44.31000 0.4829000 0.6472000E-01  0.7476000 
1 1 1 16 10 18 o 28.59000 0.4524000 28.24000 0.3426000 28.94000 0.8374000 -0.7031000     0.9048000 
1 1 1 16 10 20 o 63.10000 0.5882000 62.64000 0.7269000 63.57000 0.9249000 -0.9300000     1.176000  
1 1 1 16 10 22 o 30.18000 0.3116000 30.42000 0.4064000 29.93000 0.4724000 0.4976000      0.6231000 
1 1 1 16 10 24 o 34.49000 0.3162000 34.71000 0.3804000 34.26000 0.5053000 0.4446000      0.6325000 
1 1 1 16 10 26 o 39.84000 0.3408000 40.05000 0.4128000 39.64000 0.5424000 0.4114000      0.6816000 
1 1 1 16 10 28 o 39.34000 0.3996000 39.54000 0.4561000 39.14000 0.6562000 0.4001000      0.7991000 
1 1 1 16 10 30 o 20.13000 0.3461000 20.18000 0.4633000 20.08000 0.5144000 0.1015000      0.6922000 
1 1 1 16 10 32 o 36.01000 0.3535000 35.62000 0.4421000 36.40000 0.5518000 -0.7785000     0.7071000 
1 1 1 16 10 34 o 42.76000 0.4614000 43.28000 0.5802000 42.23000 0.7175000 1.046000       0.9227000 
1 1 1 16 10 36 o 14.41000 0.4318000 14.15000 0.5949000 14.66000 0.6261000 -0.5034000     0.8636000 
1 1 1 16 10 38 o 5.688000 1.039000  5.063000 1.401000  6.313000 1.534000  -1.250000      2.077000  
1 1 1 16 10 40 o 14.48000 0.4474000 14.50000 0.6148000 14.46000 0.6501000 0.4065000E-01  0.8948000 
1 1 1 16 10 42 o 5.416000 0.9641000 4.095000 1.456000  6.736000 1.264000  -2.641000      1.928000  
1 1 1 16 10 44 o 11.67000 0.5610000 12.14000 0.7413000 11.20000 0.8422000 0.9466000      1.122000  
1 1 1 16 10 46 o 14.02000 0.4224000 13.40000 0.6023000 14.64000 0.5924000 -1.244000      0.8448000 
1 1 1 16 10 48 o 18.57000 0.3739000 18.13000 0.4903000 19.02000 0.5645000 -0.8904000     0.7477000 
1 1 1 16 10 50 o 4.329000 0.9952000 3.524000 1.456000  5.134000 1.357000  -1.609000      1.990000  
1 1 1 16 10 52 o 16.00000 0.3945000 15.57000 0.5449000 16.42000 0.5707000 -0.8508000     0.7891000 
1 1 1 16 10 54 o 10.08000 0.5380000 10.07000 0.8077000 10.09000 0.7109000 -0.1577000E-01 1.076000  
1 1 1 16 10 56 o 3.289000 0.9777000 3.579000 1.502000  3.000000 1.252000  0.5786000      1.955000  
1 1 1 16 10 58 o 3.593000 0.9684000 4.174000 1.456000  3.012000 1.277000  1.162000       1.937000  
1 1 1 16 10 60 o 6.202000 0.8705000 6.638000 1.192000  5.766000 1.269000  0.8727000      1.741000  
1 1 1 16 10 62 o 3.876000 1.074000  4.205000 1.605000  3.547000 1.427000  0.6577000      2.148000  
1 1 1 16 11 1  o 103.7000 0.7714000 104.1000 1.013000  103.3000 1.163000  0.8030000      1.543000  
1 1 1 16 11 3  o 71.29000 0.5376000 70.44000 0.8036000 72.13000 0.7143000 -1.690000      1.075000  
1 1 1 16 11 5  o 16.19000 0.3020000 15.53000 0.4578000 16.85000 0.3941000 -1.321000      0.6041000 
1 1 1 16 11 7  f 78.25000 0.6279000 78.31000 0.8883000 78.19000 0.8877000 0.1183000      1.256000  
1 1 1 16 11 9  o 45.21000 0.3647000 44.90000 0.4789000 45.52000 0.5503000 -0.6140000     0.7295000 
1 1 1 16 11 11 o 78.89000 0.5931000 79.46000 0.7838000 78.32000 0.8904000 1.137000       1.186000  
1 1 1 16 11 13 o 45.08000 0.3671000 45.02000 0.4848000 45.14000 0.5513000 -0.1185000     0.7342000 
1 1 1 16 11 15 o 25.10000 0.2771000 25.44000 0.3768000 24.76000 0.4064000 0.6848000      0.5543000 
1 1 1 16 11 17 o 7.135000 0.7305000 7.111000 0.8342000 7.160000 1.199000  -0.4887000E-01 1.461000  
1 1 1 16 11 19 o 28.44000 0.2855000 28.08000 0.3318000 28.80000 0.4646000 -0.7276000     0.5709000 
1 1 1 16 11 21 o 19.14000 0.2951000 18.54000 0.3659000 19.74000 0.4631000 -1.201000      0.5902000 
1 1 1 16 11 23 o 32.97000 0.3646000 32.51000 0.3999000 33.43000 0.6096000 -0.9204000     0.7291000 
1 1 1 16 11 25 o 32.19000 0.3059000 32.34000 0.3662000 32.05000 0.4901000 0.2876000      0.6117000 
1 1 1 16 11 27 f 34.22000 0.3188000 34.04000 0.3774000 34.39000 0.5139000 -0.3528000     0.6376000 
1 1 1 16 11 29 o 22.61000 0.3562000 22.43000 0.3947000 22.79000 0.5931000 -0.3601000     0.7124000 
1 1 1 16 11 31 o 20.68000 0.4083000 21.19000 0.5195000 20.18000 0.6299000 1.005000       0.8165000 
1 1 1 16 11 33 o 33.08000 0.3918000 32.77000 0.4383000 33.40000 0.6494000 -0.6244000     0.7835000 
1 1 1 16 11 35 o 9.770000 0.5826000 9.783000 0.8350000 9.757000 0.8128000 0.2536000E-01  1.165000  
1 1 1 16 11 37 o 22.07000 0.4117000 21.24000 0.5852000 22.90000 0.5792000 -1.656000      0.8233000 
1 1 1 16 11 39 o 43.28000 0.3691000 42.93000 0.5135000 43.62000 0.5303000 -0.6957000     0.7382000 
1 1 1 16 11 41 f 19.45000 0.3702000 19.23000 0.5193000 19.68000 0.5278000 -0.4449000     0.7404000 
1 1 1 16 11 43 o 13.71000 0.4475000 12.86000 0.6584000 14.56000 0.6062000 -1.706000      0.8949000 
1 1 1 16 11 45 o 23.11000 0.3296000 22.76000 0.4695000 23.46000 0.4628000 -0.6996000     0.6593000 
1 1 1 16 11 47 o 12.60000 0.5187000 12.58000 0.7765000 12.61000 0.6879000 -0.2821000E-01 1.037000  
1 1 1 16 11 49 o 4.862000 0.9662000 5.381000 1.318000  4.343000 1.413000  1.038000       1.932000  
1 1 1 16 11 51 f 4.084000 0.9602000 3.507000 1.370000  4.661000 1.346000  -1.154000      1.920000  
1 1 1 16 11 53 o 5.534000 0.9288000 6.103000 1.201000  4.965000 1.417000  1.138000       1.858000  
1 1 1 16 11 55 o 6.274000 1.204000  6.486000 2.034000  6.063000 1.290000  0.4225000      2.408000  
1 1 1 16 11 57 o 10.86000 0.5827000 11.06000 0.6992000 10.65000 0.9325000 0.4167000      1.165000  
1 1 1 16 11 59 o 2.985000 0.9648000 3.465000 1.495000  2.505000 1.220000  0.9608000      1.930000  
1 1 1 16 11 61 o 3.442000 1.006000  4.332000 1.623000  2.551000 1.191000  1.781000       2.013000  
1 1 1 16 11 63 f 7.565000 0.8158000 7.453000 1.128000  7.677000 1.179000  -0.2244000     1.632000  
1 1 1 16 12 0  o 14.29000 0.5059000 14.29000 0.5059000 14.29000 0.5059000 0.000000       0.000000  
1 1 1 16 12 2  o 45.10000 0.4320000 44.94000 0.5415000 45.25000 0.6731000 -0.3088000     0.8639000 
1 1 1 16 12 4  o 38.47000 0.3413000 38.51000 0.4826000 38.42000 0.4826000 0.8553000E-01  0.6825000 
1 1 1 16 12 6  o 85.03000 0.6805000 85.64000 0.9714000 84.42000 0.9533000 1.221000       1.361000  
1 1 1 16 12 8  o 74.15000 0.5596000 74.35000 0.7372000 73.94000 0.8420000 0.4082000      1.119000  
1 1 1 16 12 10 o 55.76000 0.4033000 55.76000 0.5706000 55.77000 0.5700000 -0.7206000E-02 0.8065000 
1 1 1 16 12 12 o 52.52000 0.4130000 52.19000 0.5404000 52.85000 0.6246000 -0.6591000     0.8259000 
1 1 1 16 12 14 o 74.21000 0.5619000 74.01000 0.7351000 74.41000 0.8500000 -0.4015000     1.124000  
1 1 1 16 12 16 o 28.33000 0.2915000 27.82000 0.3566000 28.84000 0.4611000 -1.029000      0.5830000 
1 1 1 16 12 18 o 77.31000 0.6695000 77.32000 0.7689000 77.31000 1.096000  0.9850000E-02  1.339000  
1 1 1 16 12 20 o 79.76000 0.5787000 79.86000 0.7069000 79.67000 0.9165000 0.1871000      1.157000  
1 1 1 16 12 22 o 15.90000 0.3791000 15.94000 0.3917000 15.86000 0.6491000 0.7181000E-01  0.7582000 
1 1 1 16 12 24 o 18.39000 0.2981000 18.44000 0.3533000 18.34000 0.4802000 0.9247000E-01  0.5961000 
1 1 1 16 12 26 o 35.53000 0.3840000 35.59000 0.4243000 35.46000 0.6400000 0.1287000      0.7679000 
1 1 1 16 12 28 o 19.16000 0.3144000 19.20000 0.3629000 19.12000 0.5136000 0.8273000E-01  0.6289000 
1 1 1 16 12 30 o 18.27000 0.3482000 18.30000 0.4511000 18.24000 0.5307000 0.5623000E-01  0.6965000 
1 1 1 16 12 32 o 39.81000 0.4662000 39.81000 0.4662000 ?        ?         ?              ?         
1 1 1 16 12 34 o 18.45000 0.6036000 19.39000 1.092000  17.51000 0.5157000 1.873000       1.207000  
1 1 1 16 12 36 f 47.51000 0.4138000 47.24000 0.5305000 47.79000 0.6353000 -0.5587000     0.8277000 
1 1 1 16 12 38 o 49.57000 0.4306000 49.31000 0.6448000 49.84000 0.5710000 -0.5317000     0.8613000 
1 1 1 16 12 40 o 4.250000 1.026000  3.347000 1.391000  5.153000 1.509000  -1.806000      2.052000  
1 1 1 16 12 42 o 29.92000 0.3291000 29.96000 0.4534000 29.88000 0.4771000 0.8526000E-01  0.6582000 
1 1 1 16 12 44 o 33.77000 0.3900000 33.75000 0.5336000 33.78000 0.5688000 -0.3128000E-01 0.7799000 
1 1 1 16 12 46 o 16.47000 0.4379000 16.12000 0.6057000 16.83000 0.6326000 -0.7142000     0.8758000 
1 1 1 16 12 48 o 7.486000 0.7963000 6.702000 1.331000  8.270000 0.8742000 -1.568000      1.593000  
1 1 1 16 12 50 o 12.90000 0.4789000 13.21000 0.6086000 12.60000 0.7395000 0.6100000      0.9577000 
1 1 1 16 12 52 o 4.478000 0.9589000 4.098000 1.406000  4.857000 1.304000  -0.7590000     1.918000  
1 1 1 16 12 54 o 13.76000 0.5652000 12.77000 0.9223000 14.75000 0.6536000 -1.980000      1.130000  
1 1 1 16 12 56 o 3.114000 0.9655000 3.237000 1.428000  2.991000 1.300000  0.2456000      1.931000  
1 1 1 16 12 58 o 4.901000 1.121000  4.012000 1.583000  5.789000 1.587000  -1.777000      2.242000  
1 1 1 16 12 60 o 5.079000 1.098000  4.883000 1.477000  5.275000 1.624000  -0.3916000     2.195000  
1 1 1 16 12 62 o 4.556000 1.004000  4.714000 1.416000  4.398000 1.424000  0.3160000      2.008000  
1 1 1 16 13 1  o 180.6000 1.505000  180.5000 1.737000  180.8000 2.460000  -0.3079000     3.011000  
1 1 1 16 13 3  o 32.90000 0.3312000 33.57000 0.3897000 32.23000 0.5356000 1.342000       0.6624000 
1 1 1 16 13 5  o 109.3000 0.8116000 109.3000 1.227000  109.4000 1.063000  -0.1772000     1.623000  
1 1 1 16 13 7  o 37.90000 0.2991000 37.63000 0.4200000 38.17000 0.4259000 -0.5403000     0.5981000 
1 1 1 16 13 9  o 124.3000 0.8511000 122.6000 1.188000  126.0000 1.219000  -3.364000      1.702000  
1 1 1 16 13 11 o 47.23000 0.3773000 47.42000 0.5002000 47.04000 0.5651000 0.3811000      0.7547000 
1 1 1 16 13 13 f 9.146000 0.3563000 9.087000 0.5119000 9.205000 0.4958000 -0.1185000     0.7127000 
1 1 1 16 13 15 o 58.22000 0.4549000 58.02000 0.5845000 58.41000 0.6972000 -0.3890000     0.9098000 
1 1 1 16 13 17 o 37.39000 0.3824000 37.77000 0.4242000 37.01000 0.6364000 0.7568000      0.7648000 
1 1 1 16 13 19 o 66.95000 0.5189000 66.53000 0.6714000 67.36000 0.7914000 -0.8320000     1.038000  
1 1 1 16 13 21 o 13.94000 0.3395000 13.77000 0.3878000 14.12000 0.5574000 -0.3524000     0.6790000 
1 1 1 16 13 23 o 15.68000 0.3232000 15.61000 0.3662000 15.76000 0.5328000 -0.1561000     0.6465000 
1 1 1 16 13 25 o 46.76000 0.3734000 46.71000 0.4515000 46.81000 0.5949000 -0.1015000     0.7468000 
1 1 1 16 13 27 o 21.30000 0.3038000 21.58000 0.3547000 21.02000 0.4934000 0.5601000      0.6076000 
1 1 1 16 13 29 o 23.18000 0.3815000 23.53000 0.4452000 22.83000 0.6195000 0.7002000      0.7629000 
1 1 1 16 13 31 o 53.34000 0.6364000 53.37000 0.5069000 53.31000 1.168000  0.5994000E-01  1.273000  
1 1 1 16 13 33 o 25.99000 0.5239000 25.09000 0.5013000 26.89000 0.9202000 -1.808000      1.048000  
1 1 1 16 13 35 o 20.71000 0.3973000 20.82000 0.5415000 20.61000 0.5814000 0.2133000      0.7946000 
1 1 1 16 13 37 o 4.208000 1.026000  4.450000 1.447000  3.967000 1.455000  0.4830000      2.052000  
1 1 1 16 13 39 o 23.59000 0.3722000 23.05000 0.5681000 24.12000 0.4809000 -1.073000      0.7444000 
1 1 1 16 13 41 f 24.43000 0.3590000 23.69000 0.4752000 25.18000 0.5381000 -1.492000      0.7179000 
1 1 1 16 13 43 o 28.01000 0.3771000 28.33000 0.5139000 27.69000 0.5518000 0.6378000      0.7541000 
1 1 1 16 13 45 o 22.00000 0.3360000 22.36000 0.4616000 21.64000 0.4884000 0.7172000      0.6720000 
1 1 1 16 13 47 o 7.900000 0.7128000 7.549000 1.041000  8.250000 0.9739000 -0.7008000     1.426000  
1 1 1 16 13 49 o 14.83000 0.5061000 15.85000 0.5290000 13.81000 0.8629000 2.046000       1.012000  
1 1 1 16 13 51 o 11.94000 0.5434000 11.79000 0.8610000 12.09000 0.6631000 -0.2951000     1.087000  
1 1 1 16 13 53 o 12.96000 0.4600000 12.12000 0.6864000 13.79000 0.6126000 -1.672000      0.9200000 
1 1 1 16 13 55 o 3.834000 1.037000  4.233000 1.561000  3.435000 1.365000  0.7974000      2.074000  
1 1 1 16 13 57 o 3.344000 0.9901000 3.339000 1.391000  3.349000 1.409000  -0.1057000E-01 1.980000  
1 1 1 16 13 59 o 6.356000 0.9333000 5.618000 1.463000  7.094000 1.159000  -1.476000      1.867000  
1 1 1 16 13 61 o 3.596000 1.013000  3.970000 1.523000  3.222000 1.336000  0.7485000      2.026000  
1 1 1 16 14 0  o 40.94000 0.5207000 40.94000 0.5207000 40.94000 0.5207000 0.000000       0.000000  
1 1 1 16 14 2  o 58.60000 0.4871000 57.96000 0.6829000 59.25000 0.6948000 -1.289000      0.9742000 
1 1 1 16 14 4  o 95.76000 0.6602000 95.18000 0.9280000 96.33000 0.9393000 -1.156000      1.320000  
1 1 1 16 14 6  o 88.54000 0.6633000 88.40000 1.002000  88.67000 0.8693000 -0.2769000     1.327000  
1 1 1 16 14 8  o 101.8000 0.7014000 102.4000 0.9971000 101.2000 0.9868000 1.140000       1.403000  
1 1 1 16 14 10 o 53.99000 0.4222000 53.81000 0.5536000 54.16000 0.6377000 -0.3458000     0.8445000 
1 1 1 16 14 12 o 57.46000 0.4447000 57.06000 0.6649000 57.85000 0.5905000 -0.7845000     0.8893000 
1 1 1 16 14 14 o 32.48000 0.2918000 32.50000 0.3415000 32.46000 0.4732000 0.4190000E-01  0.5836000 
1 1 1 16 14 16 o 27.21000 0.2935000 27.10000 0.3745000 27.33000 0.4519000 -0.2229000     0.5869000 
1 1 1 16 14 18 o 24.08000 0.2715000 24.42000 0.3186000 23.73000 0.4398000 0.6915000      0.5431000 
1 1 1 16 14 20 o 15.53000 0.3937000 15.33000 0.5825000 15.74000 0.5298000 -0.4099000     0.7874000 
1 1 1 16 14 22 o 9.239000 0.4458000 9.572000 0.4704000 8.906000 0.7574000 0.6657000      0.8916000 
1 1 1 16 14 24 o 18.98000 0.2924000 18.61000 0.3306000 19.35000 0.4824000 -0.7386000     0.5849000 
1 1 1 16 14 26 o 25.41000 0.2917000 25.72000 0.3492000 25.10000 0.4674000 0.6222000      0.5834000 
1 1 1 16 14 28 o 29.95000 0.3157000 30.36000 0.3999000 29.53000 0.4887000 0.8277000      0.6315000 
1 1 1 16 14 30 o 38.30000 0.4023000 38.52000 0.4539000 38.08000 0.6643000 0.4438000      0.8045000 
1 1 1 16 14 32 o 52.29000 0.5231000 51.76000 0.6343000 52.81000 0.8321000 -1.052000      1.046000  
1 1 1 16 14 34 o 57.73000 0.5000000 57.62000 0.6937000 57.83000 0.7202000 -0.2077000     0.9999000 
1 1 1 16 14 36 o 14.30000 0.4375000 15.29000 0.6422000 13.30000 0.5942000 1.990000       0.8750000 
1 1 1 16 14 38 o 16.95000 0.3882000 16.90000 0.5413000 17.00000 0.5567000 -0.1029000     0.7765000 
1 1 1 16 14 40 o 15.84000 0.4041000 15.89000 0.5626000 15.78000 0.5802000 0.1122000      0.8082000 
1 1 1 16 14 42 o 6.329000 0.8832000 6.510000 1.200000  6.147000 1.296000  0.3629000      1.766000  
1 1 1 16 14 44 o 15.11000 0.4026000 15.43000 0.5468000 14.79000 0.5912000 0.6449000      0.8053000 
1 1 1 16 14 46 o 22.80000 0.3730000 22.70000 0.5137000 22.90000 0.5409000 -0.1991000     0.7459000 
1 1 1 16 14 48 o 20.39000 0.3761000 20.38000 0.4948000 20.40000 0.5666000 -0.1232000E-01 0.7522000 
1 1 1 16 14 50 o 12.47000 0.4621000 13.27000 0.6578000 11.67000 0.6491000 1.605000       0.9242000 
1 1 1 16 14 52 o 10.84000 0.4957000 10.31000 0.7334000 11.38000 0.6670000 -1.071000      0.9913000 
1 1 1 16 14 54 o 3.764000 1.042000  3.558000 1.455000  3.971000 1.492000  -0.4128000     2.084000  
1 1 1 16 14 56 o 3.364000 0.9794000 3.199000 1.400000  3.530000 1.370000  -0.3313000     1.959000  
1 1 1 16 14 58 o 3.613000 1.008000  3.801000 1.467000  3.424000 1.383000  0.3764000      2.016000  
1 1 1 16 14 60 o 6.832000 0.8933000 7.468000 1.341000  6.196000 1.180000  1.272000       1.787000  
1 1 1 16 14 62 o 4.793000 1.092000  5.280000 1.665000  4.306000 1.412000  0.9734000      2.183000  
1 1 1 16 15 1  o 114.9000 0.7884000 115.3000 1.119000  114.5000 1.111000  0.8239000      1.577000  
1 1 1 16 15 3  o 78.79000 0.5486000 78.51000 0.7731000 79.08000 0.7785000 -0.5732000     1.097000  
1 1 1 16 15 5  o 27.02000 0.2636000 26.80000 0.3522000 27.24000 0.3924000 -0.4371000     0.5272000 
1 1 1 16 15 7  o 24.30000 0.2699000 24.94000 0.3447000 23.66000 0.4154000 1.281000       0.5398000 
1 1 1 16 15 9  o 93.72000 0.7463000 93.14000 1.049000  94.30000 1.062000  -1.158000      1.493000  
1 1 1 16 15 11 o 115.3000 0.8541000 114.9000 1.286000  115.8000 1.124000  -0.8971000     1.708000  
1 1 1 16 15 13 o 65.01000 0.4787000 65.42000 0.5850000 64.60000 0.7579000 0.8132000      0.9574000 
1 1 1 16 15 15 o 71.22000 0.5193000 72.18000 0.6404000 70.26000 0.8177000 1.926000       1.039000  
1 1 1 16 15 17 o 72.71000 0.6152000 71.64000 0.6364000 73.79000 1.053000  -2.145000      1.230000  
1 1 1 16 15 19 o 33.59000 0.3020000 33.44000 0.3554000 33.74000 0.4885000 -0.3012000     0.6041000 
1 1 1 16 15 21 o 15.23000 0.3319000 15.37000 0.4286000 15.08000 0.5069000 0.2990000      0.6638000 
1 1 1 16 15 23 o 17.45000 0.2931000 17.28000 0.3310000 17.63000 0.4839000 -0.3548000     0.5863000 
1 1 1 16 15 25 o 16.93000 0.3382000 16.61000 0.4427000 17.25000 0.5115000 -0.6347000     0.6765000 
1 1 1 16 15 27 o 56.35000 0.4511000 56.80000 0.5883000 55.90000 0.6840000 0.9001000      0.9022000 
1 1 1 16 15 29 o 20.89000 0.3567000 20.20000 0.3581000 21.58000 0.6171000 -1.387000      0.7135000 
1 1 1 16 15 31 o 23.66000 0.4864000 23.83000 0.3705000 23.49000 0.8994000 0.3330000      0.9727000 
1 1 1 16 15 33 o 12.29000 0.4725000 12.06000 0.6182000 12.51000 0.7148000 -0.4478000     0.9451000 
1 1 1 16 15 35 o 28.81000 0.3657000 28.65000 0.4806000 28.97000 0.5512000 -0.3221000     0.7313000 
1 1 1 16 15 37 o 15.66000 0.4828000 14.98000 0.5463000 16.35000 0.7963000 -1.367000      0.9657000 
1 1 1 16 15 39 o 12.39000 0.5305000 12.02000 0.8177000 12.76000 0.6761000 -0.7404000     1.061000  
1 1 1 16 15 41 o 19.32000 0.3578000 19.09000 0.5029000 19.55000 0.5092000 -0.4582000     0.7157000 
1 1 1 16 15 43 o 8.025000 0.7743000 8.754000 0.9540000 7.297000 1.220000  1.456000       1.549000  
1 1 1 16 15 45 o 7.147000 0.8176000 6.855000 1.102000  7.440000 1.208000  -0.5853000     1.635000  
1 1 1 16 15 47 o 11.01000 0.5042000 11.30000 0.6979000 10.71000 0.7280000 0.5884000      1.008000  
1 1 1 16 15 49 o 4.451000 1.116000  4.731000 1.756000  4.170000 1.376000  0.5615000      2.231000  
1 1 1 16 15 51 o 11.95000 0.5269000 11.66000 0.7308000 12.24000 0.7591000 -0.5727000     1.054000  
1 1 1 16 15 53 o 6.553000 0.8357000 6.097000 1.290000  7.009000 1.063000  -0.9116000     1.671000  
1 1 1 16 15 55 o 7.523000 0.8017000 7.445000 1.270000  7.601000 0.9789000 -0.1561000     1.603000  
1 1 1 16 15 57 o 3.360000 1.030000  3.314000 1.392000  3.406000 1.519000  -0.9185000E-01 2.061000  
1 1 1 16 15 59 o 10.02000 0.6262000 10.38000 0.8349000 9.666000 0.9336000 0.7185000      1.252000  
1 1 1 16 15 61 o 5.077000 0.9717000 4.854000 1.511000  5.300000 1.222000  -0.4458000     1.943000  
1 1 1 16 16 0  o 87.90000 0.9903000 87.90000 0.9903000 87.90000 0.9903000 0.000000       0.000000  
1 1 1 16 16 2  o 103.8000 0.9202000 104.0000 1.165000  103.6000 1.425000  0.4049000      1.840000  
1 1 1 16 16 4  f 50.98000 0.4765000 51.84000 0.6127000 50.11000 0.7298000 1.735000       0.9529000 
1 1 1 16 16 6  o 60.03000 0.5472000 59.40000 0.8409000 60.66000 0.7005000 -1.258000      1.094000  
1 1 1 16 16 8  o 41.57000 0.3608000 40.55000 0.4998000 42.58000 0.5205000 -2.037000      0.7216000 
1 1 1 16 16 10 o 41.83000 0.3218000 41.55000 0.4536000 42.10000 0.4566000 -0.5449000     0.6436000 
1 1 1 16 16 12 o 64.80000 0.4785000 64.72000 0.5788000 64.89000 0.7622000 -0.1697000     0.9570000 
1 1 1 16 16 14 f 15.85000 0.2934000 16.15000 0.2806000 15.55000 0.5154000 0.5984000      0.5869000 
1 1 1 16 16 16 o 14.64000 0.3253000 13.85000 0.3787000 15.43000 0.5289000 -1.579000      0.6505000 
1 1 1 16 16 18 o 38.99000 0.3253000 39.21000 0.3877000 38.78000 0.5224000 0.4301000      0.6506000 
1 1 1 16 16 20 o 40.84000 0.3511000 40.62000 0.4451000 41.06000 0.5431000 -0.4402000     0.7022000 
1 1 1 16 16 22 o 43.97000 0.3737000 43.77000 0.4823000 44.17000 0.5710000 -0.3981000     0.7475000 
1 1 1 16 16 24 f 11.11000 0.3849000 10.52000 0.4543000 11.69000 0.6215000 -1.169000      0.7699000 
1 1 1 16 16 26 o 51.66000 0.4532000 51.61000 0.6388000 51.72000 0.6430000 -0.1094000     0.9064000 
1 1 1 16 16 28 o 29.91000 0.3674000 29.68000 0.4195000 30.14000 0.6032000 -0.4654000     0.7348000 
1 1 1 16 16 30 o 25.76000 0.3103000 25.84000 0.3618000 25.69000 0.5042000 0.1590000      0.6206000 
1 1 1 16 16 32 o 20.12000 0.3400000 19.85000 0.4244000 20.39000 0.5312000 -0.5365000     0.6799000 
1 1 1 16 16 34 o 32.53000 0.3402000 32.45000 0.4906000 32.61000 0.4713000 -0.1631000     0.6803000 
1 1 1 16 16 36 o 5.084000 1.010000  4.642000 1.464000  5.526000 1.392000  -0.8846000     2.021000  
1 1 1 16 16 38 o 11.55000 0.5835000 11.48000 0.8183000 11.62000 0.8319000 -0.1432000     1.167000  
1 1 1 16 16 40 o 16.74000 0.4395000 17.48000 0.6611000 16.01000 0.5793000 1.469000       0.8790000 
1 1 1 16 16 42 o 19.71000 0.3779000 19.32000 0.5531000 20.10000 0.5151000 -0.7807000     0.7558000 
1 1 1 16 16 44 o 10.71000 0.5492000 10.57000 0.6937000 10.85000 0.8517000 -0.2753000     1.098000  
1 1 1 16 16 46 o 10.44000 0.5550000 11.33000 0.6858000 9.545000 0.8729000 1.782000       1.110000  
1 1 1 16 16 48 f 6.796000 0.9684000 7.260000 1.572000  6.333000 1.131000  0.9268000      1.937000  
1 1 1 16 16 50 o 5.288000 1.118000  6.263000 1.654000  4.312000 1.503000  1.951000       2.235000  
1 1 1 16 16 52 o 17.12000 0.4346000 17.16000 0.6842000 17.09000 0.5360000 0.6531000E-01  0.8692000 
1 1 1 16 16 54 f 5.379000 0.9860000 6.080000 1.284000  4.678000 1.496000  1.402000       1.972000  
1 1 1 16 16 56 o 6.725000 0.8516000 6.628000 1.216000  6.821000 1.193000  -0.1929000     1.703000  
1 1 1 16 16 58 o 3.332000 1.002000  2.750000 1.266000  3.915000 1.555000  -1.165000      2.005000  
1 1 1 16 16 60 o 5.245000 0.9802000 4.521000 1.528000  5.970000 1.229000  -1.449000      1.960000  
1 1 1 16 17 1  o 72.21000 0.5818000 72.58000 0.8256000 71.83000 0.8199000 0.7430000      1.164000  
1 1 1 16 17 3  o 21.35000 0.2862000 21.79000 0.3659000 20.91000 0.4401000 0.8820000      0.5723000 
1 1 1 16 17 5  o 66.49000 0.5389000 65.85000 0.7537000 67.13000 0.7704000 -1.279000      1.078000  
1 1 1 16 17 7  o 54.94000 0.4313000 55.11000 0.6543000 54.78000 0.5619000 0.3373000      0.8625000 
1 1 1 16 17 9  o 46.10000 0.4091000 46.37000 0.5802000 45.83000 0.5769000 0.5401000      0.8182000 
1 1 1 16 17 11 o 24.13000 0.3175000 24.19000 0.4587000 24.07000 0.4391000 0.1181000      0.6350000 
1 1 1 16 17 13 o 38.04000 0.3166000 37.60000 0.3671000 38.47000 0.5160000 -0.8629000     0.6333000 
1 1 1 16 17 15 o 99.20000 0.7094000 99.91000 0.8720000 98.50000 1.119000  1.407000       1.419000  
1 1 1 16 17 17 o 41.80000 0.3968000 42.10000 0.4066000 41.50000 0.6815000 0.6030000      0.7936000 
1 1 1 16 17 19 o 55.79000 0.4232000 55.64000 0.5098000 55.94000 0.6757000 -0.2976000     0.8465000 
1 1 1 16 17 21 o 7.369000 0.5247000 6.388000 0.6441000 8.351000 0.8283000 -1.963000      1.049000  
1 1 1 16 17 23 o 31.19000 0.3131000 31.18000 0.4001000 31.21000 0.4816000 -0.2741000E-01 0.6261000 
1 1 1 16 17 25 o 29.29000 0.2927000 29.62000 0.3490000 28.95000 0.4699000 0.6694000      0.5853000 
1 1 1 16 17 27 o 54.08000 0.5240000 54.30000 0.6631000 53.86000 0.8115000 0.4433000      1.048000  
1 1 1 16 17 29 o 37.79000 0.3391000 37.33000 0.3996000 38.24000 0.5481000 -0.9160000     0.6783000 
1 1 1 16 17 31 o 24.87000 0.4928000 24.31000 0.3982000 25.44000 0.9017000 -1.127000      0.9857000 
1 1 1 16 17 33 o 28.35000 0.3257000 27.73000 0.4662000 28.97000 0.4550000 -1.233000      0.6514000 
1 1 1 16 17 35 o 7.057000 0.7425000 7.528000 0.9606000 6.585000 1.133000  0.9435000      1.485000  
1 1 1 16 17 37 o 29.45000 0.3528000 29.46000 0.5271000 29.44000 0.4692000 0.2001000E-01  0.7057000 
1 1 1 16 17 39 o 8.992000 0.6349000 8.043000 1.000000  9.941000 0.7825000 -1.898000      1.270000  
1 1 1 16 17 41 o 22.58000 0.6084000 22.52000 0.7108000 22.65000 0.9877000 -0.1301000     1.217000  
1 1 1 16 17 43 f 9.219000 0.6935000 9.279000 0.8477000 9.159000 1.098000  0.1200000      1.387000  
1 1 1 16 17 45 o 12.96000 0.4912000 13.75000 0.6624000 12.18000 0.7255000 1.571000       0.9824000 
1 1 1 16 17 47 f 16.54000 0.4293000 16.68000 0.5506000 16.40000 0.6587000 0.2710000      0.8585000 
1 1 1 16 17 49 o 9.687000 0.5976000 8.953000 0.9596000 10.42000 0.7125000 -1.469000      1.195000  
1 1 1 16 17 51 o 3.200000 0.9307000 3.798000 1.431000  2.602000 1.190000  1.196000       1.861000  
1 1 1 16 17 53 o 5.439000 1.097000  5.505000 1.598000  5.373000 1.505000  0.1323000      2.195000  
1 1 1 16 17 55 o 4.305000 1.047000  5.216000 1.563000  3.394000 1.393000  1.823000       2.094000  
1 1 1 16 17 57 o 4.683000 1.062000  3.964000 1.488000  5.401000 1.516000  -1.437000      2.124000  
1 1 1 16 17 59 o 6.462000 0.8763000 7.162000 1.194000  5.762000 1.283000  1.400000       1.753000  
1 1 1 16 17 61 f 6.434000 0.9957000 6.884000 1.603000  5.985000 1.181000  0.8990000      1.991000  
1 1 1 16 18 0  o 4.668000 0.8505000 4.668000 0.8505000 4.668000 0.8505000 0.000000       0.000000  
1 1 1 16 18 2  o 54.92000 0.4314000 54.31000 0.5551000 55.54000 0.6605000 -1.227000      0.8628000 
1 1 1 16 18 4  o 22.20000 0.2583000 22.58000 0.3989000 21.82000 0.3282000 0.7533000      0.5165000 
1 1 1 16 18 6  o 67.48000 0.5162000 67.60000 0.7824000 67.35000 0.6737000 0.2518000      1.032000  
1 1 1 16 18 8  o 85.43000 0.6896000 85.79000 0.9788000 85.08000 0.9716000 0.7107000      1.379000  
1 1 1 16 18 10 o 65.99000 0.5454000 65.96000 0.7709000 66.01000 0.7716000 -0.4176000E-01 1.091000  
1 1 1 16 18 12 o 34.19000 0.3475000 34.35000 0.4949000 34.03000 0.4878000 0.3276000      0.6949000 
1 1 1 16 18 14 f 41.64000 0.3861000 41.40000 0.5438000 41.88000 0.5483000 -0.4752000     0.7722000 
1 1 1 16 18 16 o 47.87000 0.3756000 47.51000 0.4442000 48.24000 0.6057000 -0.7295000     0.7512000 
1 1 1 16 18 18 o 38.55000 0.3253000 38.73000 0.3867000 38.36000 0.5231000 0.3722000      0.6505000 
1 1 1 16 18 20 o 22.51000 0.3271000 23.05000 0.4625000 21.97000 0.4627000 1.082000       0.6542000 
1 1 1 16 18 22 o 67.19000 0.4981000 67.08000 0.6034000 67.30000 0.7926000 -0.2144000     0.9961000 
1 1 1 16 18 24 o 5.098000 0.8127000 5.141000 0.9907000 5.056000 1.288000  0.8511000E-01  1.625000  
1 1 1 16 18 26 o 36.63000 0.3824000 36.67000 0.4282000 36.58000 0.6336000 0.9078000E-01  0.7648000 
1 1 1 16 18 28 o 17.91000 0.3437000 17.91000 0.4415000 17.92000 0.5270000 -0.5615000E-02 0.6875000 
1 1 1 16 18 30 o 32.72000 0.5213000 31.90000 0.4901000 33.54000 0.9201000 -1.642000      1.043000  
1 1 1 16 18 32 o 4.879000 0.8775000 6.126000 1.001000  3.632000 1.442000  2.494000       1.755000  
1 1 1 16 18 34 o 31.63000 0.3437000 31.99000 0.5006000 31.26000 0.4712000 0.7270000      0.6875000 
1 1 1 16 18 36 o 11.78000 0.4847000 11.51000 0.6953000 12.04000 0.6754000 -0.5285000     0.9693000 
1 1 1 16 18 38 o 10.11000 0.5874000 11.15000 0.8184000 9.074000 0.8428000 2.075000       1.175000  
1 1 1 16 18 40 o 8.928000 0.6191000 8.767000 0.8746000 9.090000 0.8763000 -0.3229000     1.238000  
1 1 1 16 18 42 o 17.55000 0.5050000 17.69000 0.5961000 17.40000 0.8152000 0.2877000      1.010000  
1 1 1 16 18 44 o 18.22000 0.4266000 18.46000 0.5855000 17.98000 0.6207000 0.4860000      0.8533000 
1 1 1 16 18 46 f 9.432000 0.6287000 8.870000 0.9883000 9.994000 0.7775000 -1.124000      1.257000  
1 1 1 16 18 48 f 8.234000 0.6260000 7.947000 0.9281000 8.520000 0.8403000 -0.5731000     1.252000  
1 1 1 16 18 50 o 13.63000 0.4323000 12.53000 0.6244000 14.73000 0.5981000 -2.200000      0.8646000 
1 1 1 16 18 52 o 15.91000 0.4021000 16.18000 0.5910000 15.64000 0.5455000 0.5361000      0.8043000 
1 1 1 16 18 54 o 9.213000 0.6666000 9.270000 1.032000  9.155000 0.8440000 0.1150000      1.333000  
1 1 1 16 18 56 o 5.384000 1.002000  4.917000 1.471000  5.851000 1.360000  -0.9343000     2.004000  
1 1 1 16 18 58 o 4.170000 1.049000  3.985000 1.536000  4.355000 1.429000  -0.3702000     2.098000  
1 1 1 16 18 60 o 5.995000 0.8940000 6.454000 1.365000  5.535000 1.154000  0.9185000      1.788000  
1 1 1 16 19 1  o 21.46000 0.2304000 21.38000 0.3251000 21.54000 0.3265000 -0.1606000     0.4607000 
1 1 1 16 19 3  o 61.87000 0.4781000 62.07000 0.6260000 61.67000 0.7227000 0.4023000      0.9561000 
1 1 1 16 19 5  o 63.31000 0.4508000 62.33000 0.6280000 64.29000 0.6469000 -1.959000      0.9016000 
1 1 1 16 19 7  o 94.34000 0.7564000 93.98000 1.066000  94.70000 1.074000  -0.7223000     1.513000  
1 1 1 16 19 9  o 41.00000 0.3785000 41.05000 0.5371000 40.95000 0.5335000 0.1024000      0.7570000 
1 1 1 16 19 11 o 55.82000 0.4755000 55.62000 0.6709000 56.01000 0.6741000 -0.3872000     0.9511000 
1 1 1 16 19 13 o 55.63000 0.4756000 55.28000 0.6688000 55.99000 0.6763000 -0.7095000     0.9512000 
1 1 1 16 19 15 o 41.56000 0.3884000 41.48000 0.5488000 41.64000 0.5496000 -0.1535000     0.7767000 
1 1 1 16 19 17 o 52.28000 0.4680000 51.90000 0.4786000 52.66000 0.8043000 -0.7537000     0.9359000 
1 1 1 16 19 19 o 30.80000 0.2975000 31.00000 0.3652000 30.61000 0.4698000 0.3945000      0.5950000 
1 1 1 16 19 21 o 32.68000 0.3015000 31.87000 0.3461000 33.49000 0.4939000 -1.620000      0.6030000 
1 1 1 16 19 23 o 11.21000 0.3787000 10.71000 0.4119000 11.71000 0.6357000 -0.9978000     0.7574000 
1 1 1 16 19 25 o 14.18000 0.4345000 13.72000 0.5122000 14.64000 0.7020000 -0.9217000     0.8690000 
1 1 1 16 19 27 o 32.42000 0.3143000 32.59000 0.3703000 32.24000 0.5080000 0.3505000      0.6287000 
1 1 1 16 19 29 o 34.84000 0.3816000 35.29000 0.4250000 34.38000 0.6340000 0.9091000      0.7632000 
1 1 1 16 19 31 f 24.28000 0.3212000 24.19000 0.3643000 24.37000 0.5292000 -0.1828000     0.6425000 
1 1 1 16 19 33 o 54.87000 0.4516000 55.30000 0.5851000 54.45000 0.6881000 0.8535000      0.9032000 
1 1 1 16 19 35 o 38.68000 0.3405000 38.95000 0.4702000 38.41000 0.4925000 0.5349000      0.6809000 
1 1 1 16 19 37 o 36.22000 0.3352000 37.26000 0.4662000 35.18000 0.4818000 2.079000       0.6704000 
1 1 1 16 19 39 o 31.76000 0.3539000 31.56000 0.5262000 31.95000 0.4733000 -0.3949000     0.7078000 
1 1 1 16 19 41 o 9.935000 0.6607000 9.336000 0.9652000 10.53000 0.9025000 -1.197000      1.321000  
1 1 1 16 19 43 o 16.50000 0.5117000 16.62000 0.8017000 16.37000 0.6360000 0.2464000      1.023000  
1 1 1 16 19 45 o 4.660000 1.263000  4.076000 1.573000  5.243000 1.977000  -1.167000      2.527000  
1 1 1 16 19 47 o 10.99000 0.5630000 10.86000 0.8050000 11.13000 0.7874000 -0.2686000     1.126000  
1 1 1 16 19 49 o 10.05000 0.5530000 9.798000 0.7969000 10.29000 0.7668000 -0.4950000     1.106000  
1 1 1 16 19 51 o 13.49000 0.4715000 13.74000 0.7332000 13.23000 0.5931000 0.5147000      0.9431000 
1 1 1 16 19 53 f 13.51000 0.5593000 14.13000 0.7801000 12.88000 0.8017000 1.247000       1.119000  
1 1 1 16 19 55 o 4.827000 0.9482000 6.589000 1.412000  3.065000 1.266000  3.524000       1.896000  
1 1 1 16 19 57 o 5.321000 0.9998000 6.611000 1.342000  4.031000 1.482000  2.580000       2.000000  
1 1 1 16 19 59 o 9.492000 0.6090000 9.162000 0.9388000 9.822000 0.7762000 -0.6604000     1.218000  
1 1 1 16 20 0  o 51.09000 0.5274000 51.09000 0.5274000 51.09000 0.5274000 0.000000       0.000000  
1 1 1 16 20 2  o 15.57000 0.2918000 16.07000 0.4063000 15.06000 0.4190000 1.006000       0.5836000 
1 1 1 16 20 4  o 69.32000 0.4889000 69.30000 0.6911000 69.34000 0.6916000 -0.4816000E-01 0.9778000 
1 1 1 16 20 6  o 84.62000 0.7672000 84.24000 1.187000  84.99000 0.9721000 -0.7464000     1.534000  
1 1 1 16 20 8  o 29.93000 0.3799000 30.46000 0.6041000 29.39000 0.4608000 1.064000       0.7598000 
1 1 1 16 20 10 f 42.04000 0.3870000 41.65000 0.5474000 42.43000 0.5473000 -0.7737000     0.7741000 
1 1 1 16 20 12 o 36.72000 0.3613000 36.47000 0.5108000 36.97000 0.5111000 -0.4979000     0.7226000 
1 1 1 16 20 14 o 30.83000 0.3386000 30.83000 0.4792000 30.84000 0.4787000 -0.4152000E-02 0.6773000 
1 1 1 16 20 16 o 40.51000 0.4331000 40.66000 0.5407000 40.36000 0.6768000 0.3024000      0.8663000 
1 1 1 16 20 18 o 48.32000 0.3801000 47.57000 0.4453000 49.06000 0.6162000 -1.490000      0.7603000 
1 1 1 16 20 20 o 29.74000 0.2963000 29.39000 0.3556000 30.09000 0.4742000 -0.7045000     0.5927000 
1 1 1 16 20 22 o 31.65000 0.3005000 30.90000 0.3405000 32.41000 0.4953000 -1.505000      0.6010000 
1 1 1 16 20 24 o 14.47000 0.4109000 14.16000 0.3905000 14.79000 0.7232000 -0.6297000     0.8219000 
1 1 1 16 20 26 o 26.94000 0.3160000 27.02000 0.3995000 26.85000 0.4898000 0.1763000      0.6321000 
1 1 1 16 20 28 o 40.95000 0.3648000 40.31000 0.4563000 41.58000 0.5694000 -1.270000      0.7297000 
1 1 1 16 20 30 f 13.96000 0.4651000 14.45000 0.4413000 13.47000 0.8189000 0.9787000      0.9302000 
1 1 1 16 20 32 o 31.06000 0.3303000 31.31000 0.3913000 30.80000 0.5321000 0.5074000      0.6605000 
1 1 1 16 20 34 o 15.18000 0.3842000 14.77000 0.5490000 15.58000 0.5375000 -0.8187000     0.7683000 
1 1 1 16 20 36 o 33.99000 0.3324000 33.96000 0.4554000 34.02000 0.4844000 -0.6039000E-01 0.6648000 
1 1 1 16 20 38 o 3.123000 0.9255000 3.185000 1.342000  3.061000 1.274000  0.1245000      1.851000  
1 1 1 16 20 40 o 18.16000 0.3965000 18.85000 0.6016000 17.47000 0.5166000 1.376000       0.7929000 
1 1 1 16 20 42 o 12.23000 0.5958000 12.23000 0.9523000 12.23000 0.7164000 -0.7552000E-02 1.192000  
1 1 1 16 20 44 o 18.20000 0.4643000 17.72000 0.5861000 18.67000 0.7203000 -0.9512000     0.9286000 
1 1 1 16 20 46 f 8.744000 0.5825000 8.996000 0.8233000 8.492000 0.8242000 0.5047000      1.165000  
1 1 1 16 20 48 o 12.84000 0.4516000 13.01000 0.6393000 12.67000 0.6379000 0.3404000      0.9031000 
1 1 1 16 20 50 o 16.80000 0.4418000 16.69000 0.6407000 16.92000 0.6086000 -0.2251000     0.8837000 
1 1 1 16 20 52 f 11.71000 0.5067000 12.06000 0.7302000 11.36000 0.7026000 0.6980000      1.013000  
1 1 1 16 20 54 o 4.187000 1.100000  4.030000 1.670000  4.343000 1.433000  -0.3131000     2.201000  
1 1 1 16 20 56 o 4.780000 0.9722000 6.281000 1.340000  3.280000 1.408000  3.001000       1.944000  
1 1 1 16 20 58 o 5.807000 0.9816000 5.759000 1.481000  5.856000 1.289000  -0.9680000E-01 1.963000  
1 1 1 16 20 60 o 4.594000 0.9961000 4.199000 1.528000  4.989000 1.278000  -0.7896000     1.992000  
1 1 1 16 21 1  o 54.26000 0.4495000 54.73000 0.6395000 53.79000 0.6319000 0.9334000      0.8991000 
1 1 1 16 21 3  o 70.01000 0.5348000 70.73000 0.7061000 69.29000 0.8035000 1.446000       1.070000  
1 1 1 16 21 5  o 54.02000 0.4635000 54.05000 0.6544000 53.99000 0.6565000 0.6570000E-01  0.9269000 
1 1 1 16 21 7  o 32.79000 0.3407000 32.98000 0.4872000 32.59000 0.4762000 0.3850000      0.6813000 
1 1 1 16 21 9  o 8.786000 0.5457000 8.839000 0.7937000 8.733000 0.7491000 0.1056000      1.091000  
1 1 1 16 21 11 o 53.39000 0.4602000 53.32000 0.6498000 53.46000 0.6518000 -0.1388000     0.9204000 
1 1 1 16 21 13 o 47.02000 0.4207000 47.30000 0.5977000 46.75000 0.5922000 0.5490000      0.8414000 
1 1 1 16 21 15 o 46.02000 0.4161000 46.21000 0.5895000 45.82000 0.5875000 0.3935000      0.8323000 
1 1 1 16 21 17 o 22.69000 0.3736000 22.18000 0.4699000 23.19000 0.5810000 -1.010000      0.7472000 
1 1 1 16 21 19 o 32.58000 0.3496000 32.30000 0.4953000 32.85000 0.4935000 -0.5442000     0.6992000 
1 1 1 16 21 21 o 28.86000 0.3418000 28.57000 0.4849000 29.15000 0.4818000 -0.5766000     0.6836000 
1 1 1 16 21 23 o 24.16000 0.4250000 23.03000 0.3696000 25.30000 0.7655000 -2.274000      0.8500000 
1 1 1 16 21 25 o 27.65000 0.2975000 27.79000 0.3387000 27.52000 0.4892000 0.2689000      0.5950000 
1 1 1 16 21 27 o 32.08000 0.3779000 32.27000 0.4013000 31.89000 0.6405000 0.3728000      0.7559000 
1 1 1 16 21 29 o 4.674000 1.054000  4.195000 1.333000  5.152000 1.631000  -0.9574000     2.107000  
1 1 1 16 21 31 o 33.38000 0.3310000 33.71000 0.3939000 33.06000 0.5321000 0.6507000      0.6620000 
1 1 1 16 21 33 o 11.59000 0.5005000 11.00000 0.6470000 12.18000 0.7637000 -1.178000      1.001000  
1 1 1 16 21 35 o 20.01000 0.3515000 20.47000 0.4670000 19.55000 0.5256000 0.9210000      0.7031000 
1 1 1 16 21 37 o 15.86000 0.3901000 16.12000 0.5194000 15.59000 0.5822000 0.5307000      0.7802000 
1 1 1 16 21 39 o 6.039000 0.9789000 5.755000 1.487000  6.324000 1.274000  -0.5692000     1.958000  
1 1 1 16 21 41 o 3.747000 0.9923000 4.211000 1.478000  3.282000 1.324000  0.9297000      1.985000  
1 1 1 16 21 43 o 17.41000 0.3956000 17.25000 0.5024000 17.57000 0.6112000 -0.3188000     0.7911000 
1 1 1 16 21 45 o 7.061000 0.7164000 6.330000 1.165000  7.793000 0.8339000 -1.463000      1.433000  
1 1 1 16 21 47 o 9.285000 0.5614000 8.919000 0.8448000 9.651000 0.7394000 -0.7329000     1.123000  
1 1 1 16 21 49 o 13.13000 0.4525000 13.45000 0.6029000 12.80000 0.6750000 0.6578000      0.9050000 
1 1 1 16 21 51 o 6.122000 0.8774000 5.550000 1.384000  6.693000 1.078000  -1.143000      1.755000  
1 1 1 16 21 53 o 6.574000 1.096000  7.235000 1.331000  5.914000 1.742000  1.320000       2.192000  
1 1 1 16 21 55 o 8.174000 0.8175000 8.524000 1.128000  7.824000 1.184000  0.6999000      1.635000  
1 1 1 16 21 57 o 3.306000 0.9872000 3.238000 1.401000  3.374000 1.391000  -0.1361000     1.974000  
1 1 1 16 21 59 o 3.858000 0.9885000 3.690000 1.461000  4.026000 1.332000  -0.3362000     1.977000  
1 1 1 16 22 0  o 132.7000 1.284000  132.7000 1.284000  132.7000 1.284000  0.000000       0.000000  
1 1 1 16 22 2  o 80.41000 0.6083000 80.67000 0.7984000 80.14000 0.9179000 0.5331000      1.217000  
1 1 1 16 22 4  o 31.91000 0.2944000 32.55000 0.4730000 31.27000 0.3505000 1.276000       0.5888000 
1 1 1 16 22 6  o 56.06000 0.7374000 55.45000 0.8351000 56.67000 1.216000  -1.222000      1.475000  
1 1 1 16 22 8  o 39.13000 0.3713000 38.86000 0.5211000 39.40000 0.5290000 -0.5348000     0.7426000 
1 1 1 16 22 10 o 55.00000 0.4722000 54.63000 0.6631000 55.37000 0.6723000 -0.7391000     0.9443000 
1 1 1 16 22 12 o 48.92000 0.4324000 48.84000 0.6109000 49.00000 0.6121000 -0.1566000     0.8648000 
1 1 1 16 22 14 o 45.59000 0.4124000 44.89000 0.5759000 46.29000 0.5905000 -1.398000      0.8248000 
1 1 1 16 22 16 o 13.91000 0.4797000 13.78000 0.5925000 14.05000 0.7545000 -0.2644000     0.9593000 
1 1 1 16 22 18 o 11.15000 0.4691000 11.25000 0.6684000 11.06000 0.6583000 0.1968000      0.9382000 
1 1 1 16 22 20 o 31.22000 0.4289000 31.13000 0.6099000 31.31000 0.6033000 -0.1798000     0.8579000 
1 1 1 16 22 22 f 16.75000 0.3152000 16.32000 0.3332000 17.18000 0.5350000 -0.8558000     0.6303000 
1 1 1 16 22 24 o 23.32000 0.2991000 23.18000 0.3331000 23.45000 0.4968000 -0.2734000     0.5982000 
1 1 1 16 22 26 o 17.23000 0.3388000 16.89000 0.3901000 17.58000 0.5541000 -0.6860000     0.6777000 
1 1 1 16 22 28 o 38.31000 0.3930000 38.09000 0.4031000 38.53000 0.6747000 -0.4350000     0.7860000 
1 1 1 16 22 30 o 34.95000 0.4023000 35.12000 0.4495000 34.78000 0.6674000 0.3469000      0.8046000 
1 1 1 16 22 32 o 42.78000 0.3860000 43.38000 0.4933000 42.19000 0.5938000 1.197000       0.7720000 
1 1 1 16 22 34 o 7.258000 0.8231000 8.138000 0.7863000 6.377000 1.446000  1.761000       1.646000  
1 1 1 16 22 36 o 15.48000 0.3996000 15.76000 0.5274000 15.20000 0.6004000 0.5533000      0.7991000 
1 1 1 16 22 38 o 9.898000 0.9188000 10.49000 1.630000  9.308000 0.8482000 1.179000       1.838000  
1 1 1 16 22 40 o 12.58000 0.5394000 11.83000 0.9101000 13.33000 0.5792000 -1.499000      1.079000  
1 1 1 16 22 42 o 11.72000 0.4969000 11.01000 0.6958000 12.42000 0.7096000 -1.402000      0.9939000 
1 1 1 16 22 44 o 5.802000 0.9490000 5.008000 1.467000  6.597000 1.204000  -1.589000      1.898000  
1 1 1 16 22 46 o 6.221000 0.7517000 5.914000 1.137000  6.529000 0.9841000 -0.6152000     1.503000  
1 1 1 16 22 48 o 3.201000 0.9434000 3.058000 1.309000  3.345000 1.359000  -0.2864000     1.887000  
1 1 1 16 22 50 o 8.605000 0.7667000 7.994000 1.001000  9.216000 1.162000  -1.222000      1.533000  
1 1 1 16 22 52 o 8.815000 0.9449000 10.94000 0.8706000 6.692000 1.677000  4.246000       1.890000  
1 1 1 16 22 54 o 9.210000 0.7860000 8.586000 1.247000  9.835000 0.9573000 -1.249000      1.572000  
1 1 1 16 22 56 o 6.759000 0.8466000 7.235000 1.145000  6.282000 1.247000  0.9529000      1.693000  
1 1 1 16 22 58 o 6.914000 0.9052000 6.616000 1.469000  7.211000 1.058000  -0.5946000     1.810000  
1 1 1 16 23 1  o 95.82000 0.6637000 95.21000 0.9332000 96.42000 0.9441000 -1.215000      1.327000  
1 1 1 16 23 3  o 36.13000 0.3197000 35.81000 0.4920000 36.44000 0.4084000 -0.6327000     0.6395000 
1 1 1 16 23 5  o 23.35000 0.3157000 23.07000 0.4399000 23.63000 0.4529000 -0.5620000     0.6314000 
1 1 1 16 23 7  o 24.96000 0.3239000 24.71000 0.4519000 25.21000 0.4642000 -0.4957000     0.6478000 
1 1 1 16 23 9  o 30.34000 0.3335000 30.81000 0.4771000 29.88000 0.4660000 0.9293000      0.6669000 
1 1 1 16 23 11 o 33.41000 0.3454000 33.06000 0.4873000 33.76000 0.4897000 -0.7086000     0.6908000 
1 1 1 16 23 13 o 23.93000 0.3238000 24.23000 0.4568000 23.63000 0.4591000 0.6034000      0.6477000 
1 1 1 16 23 15 o 21.13000 0.3326000 21.07000 0.4736000 21.19000 0.4672000 -0.1232000     0.6652000 
1 1 1 16 23 17 o 43.32000 0.4027000 42.60000 0.5604000 44.04000 0.5783000 -1.441000      0.8053000 
1 1 1 16 23 19 o 29.21000 0.4238000 29.12000 0.6065000 29.30000 0.5920000 -0.1796000     0.8475000 
1 1 1 16 23 21 o 58.14000 0.5598000 58.12000 0.8644000 58.17000 0.7117000 -0.5149000E-01 1.120000  
1 1 1 16 23 23 o 61.23000 0.4653000 60.84000 0.5563000 61.63000 0.7459000 -0.7864000     0.9305000 
1 1 1 16 23 25 o 12.45000 0.3881000 11.34000 0.4704000 13.56000 0.6173000 -2.229000      0.7761000 
1 1 1 16 23 27 o 23.47000 0.3697000 23.21000 0.4070000 23.72000 0.6173000 -0.5024000     0.7394000 
1 1 1 16 23 29 o 33.67000 0.3849000 33.21000 0.3818000 34.14000 0.6685000 -0.9344000     0.7698000 
1 1 1 16 23 31 o 28.35000 0.3901000 28.40000 0.4366000 28.30000 0.6466000 0.9158000E-01  0.7802000 
1 1 1 16 23 33 o 35.75000 0.3462000 35.27000 0.4047000 36.24000 0.5618000 -0.9726000     0.6923000 
1 1 1 16 23 35 f 26.38000 0.3506000 26.36000 0.4593000 26.40000 0.5298000 -0.4772000E-01 0.7012000 
1 1 1 16 23 37 o 31.69000 0.3526000 31.05000 0.5186000 32.33000 0.4779000 -1.281000      0.7052000 
1 1 1 16 23 39 o 13.04000 0.4349000 12.97000 0.6269000 13.10000 0.6031000 -0.1328000     0.8699000 
1 1 1 16 23 41 o 8.580000 0.7034000 7.330000 1.003000  9.830000 0.9859000 -2.501000      1.407000  
1 1 1 16 23 43 o 19.80000 0.4010000 19.21000 0.5602000 20.40000 0.5738000 -1.183000      0.8019000 
1 1 1 16 23 45 o 9.389000 0.5499000 8.903000 0.8202000 9.875000 0.7327000 -0.9726000     1.100000  
1 1 1 16 23 47 o 4.125000 0.9435000 3.582000 1.376000  4.668000 1.291000  -1.086000      1.887000  
1 1 1 16 23 49 o 4.206000 0.9766000 4.543000 1.383000  3.868000 1.379000  0.6744000      1.953000  
1 1 1 16 23 51 o 6.545000 0.9614000 6.546000 1.239000  6.544000 1.470000  0.1708000E-02  1.923000  
1 1 1 16 23 53 o 10.98000 0.6875000 12.73000 0.9164000 9.228000 1.025000  3.501000       1.375000  
1 1 1 16 23 55 o 3.251000 0.9951000 3.052000 1.405000  3.449000 1.410000  -0.3977000     1.990000  
1 1 1 16 23 57 o 4.206000 1.025000  4.804000 1.545000  3.609000 1.349000  1.195000       2.051000  
1 1 1 16 23 59 o 7.779000 0.7518000 8.312000 1.048000  7.246000 1.078000  1.066000       1.504000  
1 1 1 16 24 0  o 15.19000 0.3683000 15.19000 0.3683000 15.19000 0.3683000 0.000000       0.000000  
1 1 1 16 24 2  o 29.50000 0.2937000 30.03000 0.4636000 28.98000 0.3609000 1.057000       0.5875000 
1 1 1 16 24 4  o 16.38000 0.2698000 17.27000 0.4728000 15.49000 0.2601000 1.778000       0.5396000 
1 1 1 16 24 6  o 39.97000 0.4310000 40.31000 0.6788000 39.63000 0.5314000 0.6834000      0.8621000 
1 1 1 16 24 8  o 25.36000 0.3270000 24.47000 0.4584000 26.25000 0.4663000 -1.775000      0.6539000 
1 1 1 16 24 10 o 41.14000 0.3858000 41.08000 0.5420000 41.21000 0.5491000 -0.1349000     0.7715000 
1 1 1 16 24 12 o 25.77000 0.3286000 25.56000 0.4660000 25.99000 0.4633000 -0.4312000     0.6571000 
1 1 1 16 24 14 o 26.05000 0.3284000 26.21000 0.4719000 25.89000 0.4568000 0.3146000      0.6568000 
1 1 1 16 24 16 o 22.76000 0.3892000 22.66000 0.4816000 22.85000 0.6115000 -0.1931000     0.7784000 
1 1 1 16 24 18 f 34.21000 0.3979000 34.46000 0.5084000 33.95000 0.6123000 0.5046000      0.7959000 
1 1 1 16 24 20 o 43.82000 0.4581000 43.88000 0.7068000 43.76000 0.5830000 0.1178000      0.9162000 
1 1 1 16 24 22 f 45.02000 0.4200000 45.39000 0.5964000 44.65000 0.5914000 0.7340000      0.8400000 
1 1 1 16 24 24 o 33.87000 0.3511000 33.46000 0.4717000 34.28000 0.5202000 -0.8191000     0.7022000 
1 1 1 16 24 26 o 35.36000 0.3712000 35.14000 0.3791000 35.59000 0.6382000 -0.4527000     0.7423000 
1 1 1 16 24 28 o 18.88000 0.3567000 18.85000 0.4375000 18.90000 0.5636000 -0.4996000E-01 0.7135000 
1 1 1 16 24 30 o 23.29000 0.3327000 22.75000 0.3878000 23.83000 0.5407000 -1.082000      0.6654000 
1 1 1 16 24 32 f 6.212000 0.8651000 7.184000 0.9581000 5.241000 1.441000  1.944000       1.730000  
1 1 1 16 24 34 o 18.29000 0.4678000 18.48000 0.7288000 18.10000 0.5866000 0.3856000      0.9355000 
1 1 1 16 24 36 o 17.45000 0.3629000 17.01000 0.5008000 17.90000 0.5253000 -0.8839000     0.7258000 
1 1 1 16 24 38 o 17.29000 0.3670000 17.31000 0.5004000 17.27000 0.5370000 0.4264000E-01  0.7340000 
1 1 1 16 24 40 o 8.689000 0.6783000 9.077000 0.9190000 8.300000 0.9979000 0.7774000      1.357000  
1 1 1 16 24 42 o 13.84000 0.4130000 13.93000 0.5529000 13.75000 0.6136000 0.1810000      0.8260000 
1 1 1 16 24 44 o 10.73000 0.5436000 10.77000 0.8359000 10.69000 0.6951000 0.7509000E-01  1.087000  
1 1 1 16 24 46 o 15.41000 0.3659000 14.76000 0.5347000 16.06000 0.4995000 -1.297000      0.7317000 
1 1 1 16 24 48 o 11.08000 0.5049000 10.92000 0.7301000 11.23000 0.6977000 -0.3175000     1.010000  
1 1 1 16 24 50 o 10.92000 0.5526000 9.824000 0.8015000 12.01000 0.7609000 -2.184000      1.105000  
1 1 1 16 24 52 o 3.575000 0.9849000 3.536000 1.407000  3.615000 1.379000  -0.7939000E-01 1.970000  
1 1 1 16 24 54 o 7.419000 0.9712000 7.731000 1.184000  7.106000 1.540000  0.6248000      1.942000  
1 1 1 16 24 56 o 4.577000 0.9432000 5.899000 1.320000  3.255000 1.348000  2.644000       1.886000  
1 1 1 16 24 58 o 7.705000 0.7433000 7.613000 1.195000  7.796000 0.8836000 -0.1830000     1.487000  
1 1 1 16 25 1  o 20.55000 0.2426000 20.73000 0.3533000 20.37000 0.3327000 0.3557000      0.4853000 
1 1 1 16 25 3  o 54.85000 0.4148000 54.66000 0.6591000 55.03000 0.5037000 -0.3666000     0.8295000 
1 1 1 16 25 5  o 33.08000 0.3995000 33.04000 0.6310000 33.13000 0.4901000 -0.8127000E-01 0.7990000 
1 1 1 16 25 7  o 63.56000 0.5320000 63.31000 0.7480000 63.82000 0.7566000 -0.5046000     1.064000  
1 1 1 16 25 9  o 73.33000 0.6037000 73.57000 0.8545000 73.10000 0.8531000 0.4659000      1.207000  
1 1 1 16 25 11 o 36.22000 0.3617000 36.46000 0.5138000 35.98000 0.5093000 0.4791000      0.7234000 
1 1 1 16 25 13 o 37.18000 0.3687000 36.90000 0.5144000 37.46000 0.5283000 -0.5650000     0.7374000 
1 1 1 16 25 15 o 21.02000 0.5187000 21.17000 0.4933000 20.88000 0.9127000 0.2869000      1.037000  
1 1 1 16 25 17 o 10.91000 0.5020000 10.30000 0.7375000 11.53000 0.6811000 -1.236000      1.004000  
1 1 1 16 25 19 o 28.57000 0.5207000 28.32000 0.9181000 28.81000 0.4916000 -0.4936000     1.041000  
1 1 1 16 25 21 o 15.53000 0.4544000 14.91000 0.7277000 16.15000 0.5443000 -1.240000      0.9087000 
1 1 1 16 25 23 o 19.50000 0.3264000 18.74000 0.3866000 20.25000 0.5259000 -1.508000      0.6528000 
1 1 1 16 25 25 o 25.98000 0.3500000 25.82000 0.3385000 26.14000 0.6127000 -0.3256000     0.7000000 
1 1 1 16 25 27 o 28.74000 0.3702000 27.75000 0.3544000 29.73000 0.6501000 -1.982000      0.7404000 
1 1 1 16 25 29 o 8.180000 0.8032000 8.323000 0.7993000 8.038000 1.394000  0.2845000      1.606000  
1 1 1 16 25 31 f 30.59000 0.4485000 30.09000 0.6234000 31.09000 0.6449000 -0.9981000     0.8970000 
1 1 1 16 25 33 o 45.48000 0.4389000 45.30000 0.6171000 45.66000 0.6243000 -0.3607000     0.8778000 
1 1 1 16 25 35 o 14.41000 0.4096000 13.78000 0.5497000 15.04000 0.6073000 -1.255000      0.8191000 
1 1 1 16 25 37 o 16.76000 0.3806000 17.14000 0.4966000 16.38000 0.5768000 0.7596000      0.7611000 
1 1 1 16 25 39 o 3.853000 1.010000  3.558000 1.402000  4.149000 1.454000  -0.5918000     2.020000  
1 1 1 16 25 41 o 22.12000 0.3827000 21.63000 0.5256000 22.61000 0.5564000 -0.9766000     0.7654000 
1 1 1 16 25 43 o 4.078000 1.029000  4.007000 1.473000  4.148000 1.437000  -0.1407000     2.058000  
1 1 1 16 25 45 o 3.144000 0.9001000 2.844000 1.251000  3.444000 1.294000  -0.5996000     1.800000  
1 1 1 16 25 47 f 4.185000 0.9499000 5.017000 1.382000  3.354000 1.304000  1.662000       1.900000  
1 1 1 16 25 49 o 5.445000 0.9035000 5.391000 1.302000  5.500000 1.253000  -0.1098000     1.807000  
1 1 1 16 25 51 o 5.368000 0.9765000 5.398000 1.408000  5.337000 1.353000  0.6052000E-01  1.953000  
1 1 1 16 25 53 o 5.545000 1.173000  5.962000 1.854000  5.129000 1.437000  0.8328000      2.346000  
1 1 1 16 25 55 o 3.342000 0.9751000 2.668000 1.234000  4.015000 1.510000  -1.347000      1.950000  
1 1 1 16 25 57 o 3.616000 0.9924000 3.707000 1.442000  3.525000 1.364000  0.1828000      1.985000  
1 1 1 16 26 0  o 11.38000 0.4253000 11.38000 0.4253000 11.38000 0.4253000 0.000000       0.000000  
1 1 1 16 26 2  o 54.94000 0.4349000 54.38000 0.6569000 55.51000 0.5702000 -1.133000      0.8698000 
1 1 1 16 26 4  o 20.70000 0.2612000 21.23000 0.4482000 20.18000 0.2683000 1.050000       0.5224000 
1 1 1 16 26 6  o 18.81000 0.4126000 18.75000 0.6694000 18.87000 0.4826000 -0.1241000     0.8252000 
1 1 1 16 26 8  o 29.26000 0.3368000 29.22000 0.4720000 29.29000 0.4806000 -0.7604000E-01 0.6736000 
1 1 1 16 26 10 o 5.295000 0.9194000 4.737000 1.410000  5.852000 1.180000  -1.116000      1.839000  
1 1 1 16 26 12 o 28.43000 0.3351000 28.62000 0.4773000 28.25000 0.4706000 0.3697000      0.6703000 
1 1 1 16 26 14 o 21.36000 0.3779000 21.30000 0.4878000 21.42000 0.5773000 -0.1176000     0.7558000 
1 1 1 16 26 16 o 29.10000 0.3835000 29.11000 0.5877000 29.10000 0.4928000 0.1249000E-01  0.7670000 
1 1 1 16 26 18 o 58.25000 0.7255000 58.99000 1.265000  57.51000 0.7103000 1.481000       1.451000  
1 1 1 16 26 20 o 23.59000 0.3859000 22.76000 0.5916000 24.43000 0.4957000 -1.676000      0.7718000 
1 1 1 16 26 22 o 52.01000 0.4638000 52.30000 0.6566000 51.71000 0.6551000 0.5922000      0.9275000 
1 1 1 16 26 24 o 22.11000 0.4791000 23.10000 0.3484000 21.11000 0.8925000 1.992000       0.9581000 
1 1 1 16 26 26 o 25.57000 0.3148000 25.16000 0.3481000 25.98000 0.5245000 -0.8238000     0.6295000 
1 1 1 16 26 28 o 27.16000 0.4993000 27.44000 0.3588000 26.89000 0.9318000 0.5550000      0.9985000 
1 1 1 16 26 30 o 30.21000 0.3318000 29.58000 0.3852000 30.84000 0.5403000 -1.264000      0.6636000 
1 1 1 16 26 32 o 43.08000 0.4524000 42.87000 0.5096000 43.29000 0.7476000 -0.4210000     0.9048000 
1 1 1 16 26 34 f 20.38000 0.3549000 19.96000 0.4072000 20.80000 0.5814000 -0.8396000     0.7098000 
1 1 1 16 26 36 o 15.91000 0.3758000 15.27000 0.5014000 16.56000 0.5599000 -1.289000      0.7516000 
1 1 1 16 26 38 o 5.094000 0.9503000 5.799000 1.232000  4.388000 1.447000  1.411000       1.901000  
1 1 1 16 26 40 o 11.92000 0.4708000 11.75000 0.5944000 12.08000 0.7302000 -0.3366000     0.9415000 
1 1 1 16 26 42 o 6.165000 0.9418000 7.002000 1.244000  5.328000 1.414000  1.673000       1.884000  
1 1 1 16 26 44 o 6.618000 0.8357000 5.355000 1.418000  7.881000 0.8853000 -2.525000      1.671000  
1 1 1 16 26 46 o 11.21000 0.4642000 11.10000 0.6810000 11.33000 0.6309000 -0.2311000     0.9283000 
1 1 1 16 26 48 o 4.874000 0.9807000 5.545000 1.381000  4.203000 1.393000  1.342000       1.961000  
1 1 1 16 26 50 o 4.752000 0.9780000 4.098000 1.441000  5.406000 1.322000  -1.308000      1.956000  
1 1 1 16 26 52 o 3.841000 1.037000  4.070000 1.584000  3.612000 1.338000  0.4579000      2.073000  
1 1 1 16 26 54 o 3.409000 1.000000  3.090000 1.393000  3.729000 1.436000  -0.6391000     2.000000  
1 1 1 16 26 56 o 4.339000 0.9933000 3.602000 1.501000  5.075000 1.301000  -1.473000      1.987000  
1 1 1 16 27 1  o 4.350000 0.6567000 4.643000 0.8519000 4.057000 0.9997000 0.5866000      1.313000  
1 1 1 16 27 3  o 46.43000 0.3495000 47.07000 0.5030000 45.80000 0.4853000 1.269000       0.6989000 
1 1 1 16 27 5  f 60.27000 0.6357000 60.31000 0.9006000 60.23000 0.8974000 0.8238000E-01  1.271000  
1 1 1 16 27 7  o 19.49000 0.3384000 19.53000 0.4759000 19.44000 0.4812000 0.9481000E-01  0.6768000 
1 1 1 16 27 9  o 59.38000 0.5060000 59.16000 0.7100000 59.60000 0.7213000 -0.4436000     1.012000  
1 1 1 16 27 11 o 12.28000 0.4892000 12.35000 0.6262000 12.21000 0.7518000 0.1369000      0.9784000 
1 1 1 16 27 13 o 47.17000 0.4275000 47.55000 0.6035000 46.79000 0.6055000 0.7586000      0.8549000 
1 1 1 16 27 15 o 19.74000 0.4402000 19.06000 0.6097000 20.42000 0.6350000 -1.358000      0.8804000 
1 1 1 16 27 17 o 29.33000 0.3894000 28.73000 0.5918000 29.93000 0.5062000 -1.197000      0.7788000 
1 1 1 16 27 19 o 10.49000 0.5997000 9.727000 0.9711000 11.26000 0.7040000 -1.533000      1.199000  
1 1 1 16 27 21 o 34.74000 0.4684000 34.81000 0.6709000 34.67000 0.6539000 0.1345000      0.9369000 
1 1 1 16 27 23 o 18.02000 0.4205000 18.21000 0.5513000 17.84000 0.6352000 0.3739000      0.8411000 
1 1 1 16 27 25 o 36.46000 0.3861000 35.56000 0.5397000 37.35000 0.5523000 -1.793000      0.7722000 
1 1 1 16 27 27 o 26.62000 0.3232000 26.69000 0.3845000 26.54000 0.5196000 0.1497000      0.6464000 
1 1 1 16 27 29 o 20.97000 0.3893000 20.95000 0.5329000 20.99000 0.5676000 -0.4026000E-01 0.7786000 
1 1 1 16 27 31 o 14.86000 0.4063000 14.46000 0.4892000 15.25000 0.6488000 -0.7897000     0.8125000 
1 1 1 16 27 33 o 3.078000 0.9359000 3.078000 1.291000  3.078000 1.356000  -0.2146000E-04 1.872000  
1 1 1 16 27 35 o 6.607000 0.7410000 6.420000 0.8661000 6.795000 1.203000  -0.3745000     1.482000  
1 1 1 16 27 37 o 16.20000 0.3850000 16.01000 0.4663000 16.39000 0.6127000 -0.3807000     0.7699000 
1 1 1 16 27 39 o 15.19000 0.3798000 14.43000 0.5381000 15.95000 0.5363000 -1.524000      0.7597000 
1 1 1 16 27 41 o 10.20000 0.5327000 9.431000 0.7322000 10.96000 0.7739000 -1.532000      1.065000  
1 1 1 16 27 43 o 11.19000 0.4781000 10.80000 0.6844000 11.58000 0.6677000 -0.7764000     0.9561000 
1 1 1 16 27 45 o 3.052000 0.9110000 3.794000 1.470000  2.310000 1.076000  1.484000       1.822000  
1 1 1 16 27 47 o 8.970000 0.5647000 8.840000 0.8750000 9.100000 0.7141000 -0.2603000     1.129000  
1 1 1 16 27 49 o 13.89000 0.4411000 13.44000 0.6182000 14.33000 0.6295000 -0.8869000     0.8823000 
1 1 1 16 27 51 o 3.240000 0.9381000 3.280000 1.366000  3.199000 1.286000  0.8071000E-01  1.876000  
1 1 1 16 27 53 o 3.634000 0.9961000 3.726000 1.422000  3.542000 1.395000  0.1841000      1.992000  
1 1 1 16 27 55 o 4.437000 0.9835000 3.571000 1.461000  5.303000 1.317000  -1.731000      1.967000  
1 1 1 16 27 57 o 4.205000 0.9783000 3.026000 1.324000  5.383000 1.440000  -2.357000      1.957000  
1 1 1 16 28 0  o 76.64000 0.7627000 76.64000 0.7627000 76.64000 0.7627000 0.000000       0.000000  
1 1 1 16 28 2  o 30.15000 0.2670000 30.01000 0.3836000 30.30000 0.3714000 -0.2942000     0.5339000 
1 1 1 16 28 4  o 70.88000 0.5025000 71.52000 0.7180000 70.24000 0.7031000 1.272000       1.005000  
1 1 1 16 28 6  o 41.79000 0.4460000 40.95000 0.5223000 42.64000 0.7231000 -1.692000      0.8920000 
1 1 1 16 28 8  o 33.76000 0.3941000 33.61000 0.4917000 33.91000 0.6161000 -0.2999000     0.7882000 
1 1 1 16 28 10 o 27.55000 0.3791000 27.77000 0.4733000 27.33000 0.5924000 0.4460000      0.7583000 
1 1 1 16 28 12 o 58.17000 0.5559000 57.36000 0.8471000 58.99000 0.7201000 -1.636000      1.112000  
1 1 1 16 28 14 o 35.65000 0.5939000 36.35000 0.9841000 34.95000 0.6651000 1.394000       1.188000  
1 1 1 16 28 16 o 40.61000 0.4354000 40.58000 0.6659000 40.64000 0.5611000 -0.5841000E-01 0.8708000 
1 1 1 16 28 18 o 55.96000 0.6949000 55.84000 1.202000  56.09000 0.6983000 -0.2550000     1.390000  
1 1 1 16 28 20 o 28.60000 0.3586000 28.66000 0.5074000 28.54000 0.5069000 0.1198000      0.7172000 
1 1 1 16 28 22 o 25.82000 0.3997000 25.39000 0.5081000 26.26000 0.6172000 -0.8703000     0.7994000 
1 1 1 16 28 24 o 49.87000 0.5582000 49.71000 0.7859000 50.03000 0.7930000 -0.3218000     1.116000  
1 1 1 16 28 26 f 33.73000 0.3817000 33.86000 0.5418000 33.60000 0.5378000 0.2566000      0.7634000 
1 1 1 16 28 28 o 41.39000 0.4203000 41.66000 0.4275000 41.12000 0.7238000 0.5443000      0.8406000 
1 1 1 16 28 30 f 18.01000 0.3589000 17.88000 0.4402000 18.14000 0.5670000 -0.2629000     0.7179000 
1 1 1 16 28 32 o 10.88000 0.4811000 10.76000 0.5523000 10.99000 0.7880000 -0.2287000     0.9623000 
1 1 1 16 28 34 o 25.12000 0.3193000 25.00000 0.3640000 25.23000 0.5247000 -0.2304000     0.6386000 
1 1 1 16 28 36 o 8.612000 0.5732000 7.809000 0.7974000 9.414000 0.8238000 -1.605000      1.146000  
1 1 1 16 28 38 o 10.43000 0.4920000 10.37000 0.6880000 10.48000 0.7035000 -0.1084000     0.9840000 
1 1 1 16 28 40 o 11.13000 0.4577000 10.82000 0.6333000 11.43000 0.6610000 -0.6071000     0.9154000 
1 1 1 16 28 42 o 16.90000 0.4364000 16.94000 0.6858000 16.87000 0.5399000 0.7006000E-01  0.8728000 
1 1 1 16 28 44 o 7.204000 0.6765000 7.776000 0.8737000 6.631000 1.033000  1.145000       1.353000  
1 1 1 16 28 46 o 3.420000 0.8948000 3.950000 1.343000  2.890000 1.182000  1.061000       1.790000  
1 1 1 16 28 48 o 7.350000 0.7113000 6.781000 1.069000  7.920000 0.9387000 -1.138000      1.423000  
1 1 1 16 28 50 o 4.312000 1.067000  3.757000 1.357000  4.866000 1.647000  -1.109000      2.134000  
1 1 1 16 28 52 o 9.468000 0.6915000 8.384000 1.180000  10.55000 0.7209000 -2.169000      1.383000  
1 1 1 16 28 54 o 3.743000 0.9849000 3.978000 1.380000  3.508000 1.406000  0.4700000      1.970000  
1 1 1 16 28 56 o 7.295000 0.8285000 7.107000 1.276000  7.483000 1.057000  -0.3761000     1.657000  
1 1 1 16 29 1  o 20.67000 0.2780000 20.60000 0.4367000 20.74000 0.3439000 -0.1421000     0.5559000 
1 1 1 16 29 3  o 39.83000 0.3332000 40.12000 0.4531000 39.55000 0.4888000 0.5610000      0.6665000 
1 1 1 16 29 5  o 14.86000 0.5584000 14.11000 0.4107000 15.61000 1.039000  -1.499000      1.117000  
1 1 1 16 29 7  o 17.02000 0.5420000 16.56000 0.3959000 17.48000 1.009000  -0.9248000     1.084000  
1 1 1 16 29 9  o 46.20000 0.5194000 45.55000 0.7069000 46.85000 0.7612000 -1.303000      1.039000  
1 1 1 16 29 11 o 17.15000 0.4108000 17.38000 0.6301000 16.91000 0.5274000 0.4683000      0.8216000 
1 1 1 16 29 13 o 39.43000 0.4308000 39.44000 0.6579000 39.41000 0.5562000 0.3253000E-01  0.8615000 
1 1 1 16 29 15 o 22.66000 0.3848000 22.72000 0.5794000 22.61000 0.5065000 0.1111000      0.7695000 
1 1 1 16 29 17 o 53.85000 0.5381000 54.03000 0.8381000 53.66000 0.6752000 0.3684000      1.076000  
1 1 1 16 29 19 o 22.97000 0.3746000 22.86000 0.5295000 23.08000 0.5300000 -0.2200000     0.7492000 
1 1 1 16 29 21 o 31.51000 0.4076000 32.42000 0.5281000 30.60000 0.6209000 1.816000       0.8151000 
1 1 1 16 29 23 o 21.38000 0.4280000 21.30000 0.6656000 21.46000 0.5382000 -0.1657000     0.8559000 
1 1 1 16 29 25 o 22.19000 0.3896000 21.46000 0.5463000 22.92000 0.5558000 -1.465000      0.7793000 
1 1 1 16 29 27 o 29.50000 0.3869000 29.34000 0.4166000 29.66000 0.6521000 -0.3252000     0.7738000 
1 1 1 16 29 29 o 18.66000 0.3466000 18.27000 0.3790000 19.06000 0.5806000 -0.7860000     0.6933000 
1 1 1 16 29 31 o 33.94000 0.3477000 34.54000 0.4387000 33.33000 0.5395000 1.213000       0.6954000 
1 1 1 16 29 33 o 31.01000 0.3439000 30.76000 0.4332000 31.27000 0.5342000 -0.5069000     0.6877000 
1 1 1 16 29 35 o 17.72000 0.3547000 17.41000 0.4334000 18.03000 0.5616000 -0.6183000     0.7094000 
1 1 1 16 29 37 o 10.80000 0.4766000 10.19000 0.6773000 11.40000 0.6707000 -1.215000      0.9532000 
1 1 1 16 29 39 o 20.60000 0.3526000 20.50000 0.4271000 20.70000 0.5610000 -0.1959000     0.7051000 
1 1 1 16 29 41 o 14.20000 0.4317000 13.97000 0.5508000 14.42000 0.6648000 -0.4504000     0.8634000 
1 1 1 16 29 43 o 7.297000 0.7334000 7.990000 1.013000  6.604000 1.061000  1.386000       1.467000  
1 1 1 16 29 45 o 9.376000 0.5294000 9.148000 0.7803000 9.604000 0.7156000 -0.4553000     1.059000  
1 1 1 16 29 47 o 8.202000 0.6299000 7.984000 0.9290000 8.421000 0.8511000 -0.4367000     1.260000  
1 1 1 16 29 49 o 11.73000 0.5359000 11.32000 0.6834000 12.14000 0.8257000 -0.8215000     1.072000  
1 1 1 16 29 51 f 12.02000 0.5297000 11.75000 0.8093000 12.28000 0.6838000 -0.5231000     1.059000  
1 1 1 16 29 53 o 3.324000 0.9648000 3.737000 1.427000  2.912000 1.299000  0.8256000      1.930000  
1 1 1 16 29 55 o 4.294000 1.056000  5.499000 1.685000  3.088000 1.274000  2.411000       2.112000  
1 1 1 16 30 0  o 13.57000 0.4282000 13.57000 0.4282000 13.57000 0.4282000 0.000000       0.000000  
1 1 1 16 30 2  o 38.86000 0.3498000 38.81000 0.4998000 38.92000 0.4896000 -0.1169000     0.6997000 
1 1 1 16 30 4  f 15.98000 0.3203000 16.54000 0.5644000 15.41000 0.3031000 1.131000       0.6406000 
1 1 1 16 30 6  o 36.92000 0.4161000 37.61000 0.4989000 36.22000 0.6661000 1.394000       0.8322000 
1 1 1 16 30 8  o 62.60000 0.5959000 62.51000 0.7372000 62.69000 0.9364000 -0.1881000     1.192000  
1 1 1 16 30 10 o 9.018000 0.6385000 8.524000 0.6423000 9.512000 1.104000  -0.9882000     1.277000  
1 1 1 16 30 12 o 40.70000 0.4354000 41.22000 0.6666000 40.18000 0.5602000 1.043000       0.8707000 
1 1 1 16 30 14 o 9.714000 0.7072000 8.636000 1.024000  10.79000 0.9755000 -2.156000      1.414000  
1 1 1 16 30 16 o 27.58000 0.3601000 27.72000 0.5044000 27.44000 0.5142000 0.2793000      0.7202000 
1 1 1 16 30 18 o 7.894000 0.8163000 8.541000 0.9480000 7.247000 1.329000  1.293000       1.633000  
1 1 1 16 30 20 o 23.32000 0.4404000 23.64000 0.6295000 23.00000 0.6161000 0.6467000      0.8808000 
1 1 1 16 30 22 o 4.821000 1.045000  4.844000 1.506000  4.799000 1.449000  0.4561000E-01  2.090000  
1 1 1 16 30 24 o 22.10000 0.3821000 22.26000 0.5248000 21.93000 0.5555000 0.3329000      0.7642000 
1 1 1 16 30 26 o 13.47000 0.4990000 13.23000 0.7075000 13.71000 0.7040000 -0.4732000     0.9981000 
1 1 1 16 30 28 o 14.81000 0.3767000 14.51000 0.3901000 15.10000 0.6445000 -0.5963000     0.7534000 
1 1 1 16 30 30 o 15.62000 0.4656000 15.27000 0.5424000 15.98000 0.7569000 -0.7054000     0.9312000 
1 1 1 16 30 32 o 13.19000 0.4097000 13.15000 0.4526000 13.22000 0.6831000 -0.7005000E-01 0.8194000 
1 1 1 16 30 34 o 11.12000 0.5076000 10.33000 0.7128000 11.91000 0.7230000 -1.582000      1.015000  
1 1 1 16 30 36 o 6.163000 0.7820000 5.283000 1.252000  7.044000 0.9374000 -1.761000      1.564000  
1 1 1 16 30 38 o 8.495000 0.5556000 7.329000 0.8167000 9.660000 0.7536000 -2.331000      1.111000  
1 1 1 16 30 40 o 14.36000 0.4147000 14.19000 0.5050000 14.53000 0.6579000 -0.3408000     0.8293000 
1 1 1 16 30 42 o 10.46000 0.4890000 9.952000 0.7160000 10.96000 0.6663000 -1.010000      0.9780000 
1 1 1 16 30 44 o 6.506000 0.8343000 7.878000 1.080000  5.134000 1.272000  2.744000       1.669000  
1 1 1 16 30 46 o 6.133000 0.8627000 5.502000 1.441000  6.763000 0.9497000 -1.260000      1.725000  
1 1 1 16 30 48 o 11.38000 0.5454000 10.95000 0.7105000 11.82000 0.8278000 -0.8770000     1.091000  
1 1 1 16 30 50 o 7.389000 0.7702000 7.228000 1.100000  7.551000 1.079000  -0.3228000     1.540000  
1 1 1 16 30 52 o 5.685000 0.9306000 6.335000 1.269000  5.035000 1.362000  1.300000       1.861000  
1 1 1 16 30 54 o 8.053000 0.6663000 7.583000 1.050000  8.524000 0.8206000 -0.9410000     1.333000  
1 1 1 16 31 1  o 18.04000 0.2939000 17.83000 0.4610000 18.25000 0.3645000 -0.4149000     0.5877000 
1 1 1 16 31 3  o 12.46000 0.2914000 12.53000 0.4608000 12.39000 0.3567000 0.1397000      0.5827000 
1 1 1 16 31 5  o 43.33000 0.5906000 43.45000 0.5490000 43.21000 1.046000  0.2449000      1.181000  
1 1 1 16 31 7  o 48.45000 0.4730000 47.76000 0.5199000 49.13000 0.7903000 -1.373000      0.9460000 
1 1 1 16 31 9  o 18.27000 0.4169000 17.89000 0.4618000 18.65000 0.6942000 -0.7549000     0.8337000 
1 1 1 16 31 11 o 23.90000 0.3974000 23.37000 0.4486000 24.43000 0.6560000 -1.060000      0.7947000 
1 1 1 16 31 13 o 15.61000 0.4968000 16.40000 0.5559000 14.82000 0.8236000 1.586000       0.9936000 
1 1 1 16 31 15 o 48.45000 0.4453000 49.46000 0.6332000 47.45000 0.6263000 2.014000       0.8906000 
1 1 1 16 31 17 o 22.99000 0.5509000 22.45000 0.9086000 23.52000 0.6231000 -1.063000      1.102000  
1 1 1 16 31 19 o 44.56000 0.4270000 45.63000 0.6038000 43.49000 0.6038000 2.135000       0.8539000 
1 1 1 16 31 21 o 24.19000 0.3753000 24.94000 0.5270000 23.44000 0.5346000 1.504000       0.7507000 
1 1 1 16 31 23 o 22.99000 0.3808000 23.41000 0.5348000 22.58000 0.5423000 0.8325000      0.7616000 
1 1 1 16 31 25 o 7.804000 0.7819000 8.156000 1.115000  7.452000 1.096000  0.7043000      1.564000  
1 1 1 16 31 27 o 14.18000 0.4679000 15.03000 0.6536000 13.32000 0.6697000 1.709000       0.9358000 
1 1 1 16 31 29 o 19.03000 0.4006000 18.37000 0.4114000 19.69000 0.6875000 -1.328000      0.8012000 
1 1 1 16 31 31 o 4.572000 0.8603000 3.324000 1.147000  5.819000 1.283000  -2.494000      1.721000  
1 1 1 16 31 33 o 12.05000 0.4362000 11.61000 0.5624000 12.50000 0.6670000 -0.8980000     0.8724000 
1 1 1 16 31 35 o 6.039000 0.8668000 5.061000 1.347000  7.016000 1.091000  -1.955000      1.734000  
1 1 1 16 31 37 o 12.70000 0.3916000 12.19000 0.5235000 13.21000 0.5824000 -1.015000      0.7831000 
1 1 1 16 31 39 o 12.49000 0.4568000 12.73000 0.5328000 12.26000 0.7422000 0.4674000      0.9136000 
1 1 1 16 31 41 f 9.723000 0.5248000 9.284000 0.7750000 10.16000 0.7077000 -0.8792000     1.050000  
1 1 1 16 31 43 o 12.42000 0.4222000 11.76000 0.5941000 13.09000 0.5999000 -1.323000      0.8443000 
1 1 1 16 31 45 o 5.824000 0.9974000 5.521000 1.475000  6.127000 1.343000  -0.6052000     1.995000  
1 1 1 16 31 47 o 11.45000 0.6329000 11.49000 0.9956000 11.41000 0.7816000 0.7257000E-01  1.266000  
1 1 1 16 31 49 o 6.996000 0.9366000 7.992000 1.185000  6.001000 1.450000  1.991000       1.873000  
1 1 1 16 31 51 o 11.15000 0.5688000 10.38000 0.9057000 11.92000 0.6882000 -1.540000      1.138000  
1 1 1 16 31 53 o 5.558000 0.9166000 6.120000 1.293000  4.996000 1.299000  1.124000       1.833000  
1 1 1 16 32 0  f 2.817000 1.200000  2.817000 1.200000  2.817000 1.200000  0.000000       0.000000  
1 1 1 16 32 2  o 13.06000 0.2974000 12.83000 0.4498000 13.29000 0.3891000 -0.4674000     0.5948000 
1 1 1 16 32 4  o 27.22000 0.2977000 26.81000 0.4732000 27.64000 0.3612000 -0.8297000     0.5953000 
1 1 1 16 32 6  o 7.983000 0.7910000 7.686000 0.8706000 8.280000 1.321000  -0.5942000     1.582000  
1 1 1 16 32 8  o 77.44000 0.7162000 77.23000 0.8905000 77.66000 1.122000  -0.4275000     1.432000  
1 1 1 16 32 10 o 37.47000 0.4124000 36.98000 0.4502000 37.95000 0.6911000 -0.9709000     0.8248000 
1 1 1 16 32 12 f 11.56000 0.5501000 11.39000 0.5716000 11.74000 0.9401000 -0.3410000     1.100000  
1 1 1 16 32 14 o 29.48000 0.4969000 29.49000 0.4280000 29.47000 0.8969000 0.1929000E-01  0.9938000 
1 1 1 16 32 16 o 18.64000 0.5774000 17.49000 0.6754000 19.80000 0.9366000 -2.316000      1.155000  
1 1 1 16 32 18 o 40.51000 0.4080000 40.44000 0.5703000 40.58000 0.5836000 -0.1395000     0.8160000 
1 1 1 16 32 20 o 17.42000 0.4261000 17.72000 0.5904000 17.13000 0.6146000 0.5986000      0.8522000 
1 1 1 16 32 22 o 22.96000 0.3797000 23.36000 0.5295000 22.56000 0.5444000 0.7929000      0.7594000 
1 1 1 16 32 24 o 14.95000 0.4574000 15.03000 0.6473000 14.87000 0.6465000 0.1627000      0.9148000 
1 1 1 16 32 26 o 7.607000 0.9098000 8.817000 0.9924000 6.397000 1.525000  2.420000       1.820000  
1 1 1 16 32 28 o 14.07000 0.5300000 13.88000 0.6808000 14.25000 0.8126000 -0.3674000     1.060000  
1 1 1 16 32 30 o 4.502000 0.8799000 4.060000 1.065000  4.943000 1.401000  -0.8827000     1.760000  
1 1 1 16 32 32 o 5.224000 0.8602000 5.093000 1.121000  5.355000 1.305000  -0.2618000     1.720000  
1 1 1 16 32 34 o 10.40000 0.4647000 9.768000 0.6035000 11.04000 0.7068000 -1.272000      0.9294000 
1 1 1 16 32 36 o 7.186000 0.6466000 6.850000 0.8523000 7.523000 0.9725000 -0.6725000     1.293000  
1 1 1 16 32 38 o 16.59000 0.4294000 16.49000 0.4420000 16.69000 0.7363000 -0.1916000     0.8588000 
1 1 1 16 32 40 o 6.030000 0.7360000 5.263000 1.088000  6.798000 0.9909000 -1.535000      1.472000  
1 1 1 16 32 42 o 4.713000 0.9303000 4.594000 1.284000  4.833000 1.346000  -0.2392000     1.861000  
1 1 1 16 32 44 o 12.10000 0.5159000 12.29000 0.7095000 11.91000 0.7493000 0.3752000      1.032000  
1 1 1 16 32 46 o 11.19000 0.5383000 11.58000 0.8274000 10.80000 0.6888000 0.7873000      1.077000  
1 1 1 16 32 48 o 8.212000 0.7115000 7.671000 1.200000  8.753000 0.7652000 -1.082000      1.423000  
1 1 1 16 32 50 o 7.585000 0.9438000 6.561000 1.645000  8.609000 0.9259000 -2.048000      1.888000  
1 1 1 16 32 52 o 4.903000 1.086000  4.204000 1.546000  5.602000 1.526000  -1.397000      2.173000  
1 1 1 16 32 54 o 5.393000 1.137000  6.564000 1.622000  4.223000 1.594000  2.341000       2.274000  
1 1 1 16 33 1  o 31.74000 0.2986000 31.92000 0.4464000 31.56000 0.3968000 0.3567000      0.5972000 
1 1 1 16 33 3  f 22.83000 0.3191000 22.73000 0.5315000 22.94000 0.3532000 -0.2179000     0.6382000 
1 1 1 16 33 5  o 14.04000 0.2988000 13.86000 0.4978000 14.22000 0.3306000 -0.3661000     0.5976000 
1 1 1 16 33 7  o 28.15000 0.3838000 28.38000 0.4065000 27.91000 0.6511000 0.4768000      0.7676000 
1 1 1 16 33 9  o 15.61000 0.6181000 15.76000 0.4639000 15.47000 1.146000  0.2956000      1.236000  
1 1 1 16 33 11 o 28.90000 0.4833000 29.02000 0.4194000 28.78000 0.8708000 0.2405000      0.9665000 
1 1 1 16 33 13 o 20.66000 0.5436000 19.92000 0.6284000 21.41000 0.8871000 -1.489000      1.087000  
1 1 1 16 33 15 o 21.57000 0.4057000 21.08000 0.4417000 22.06000 0.6807000 -0.9833000     0.8115000 
1 1 1 16 33 17 o 17.17000 0.4621000 18.54000 0.4768000 15.80000 0.7918000 2.741000       0.9243000 
1 1 1 16 33 19 o 9.049000 0.7095000 9.683000 0.9373000 8.415000 1.065000  1.268000       1.419000  
1 1 1 16 33 21 f 12.81000 0.5166000 13.67000 0.6675000 11.94000 0.7888000 1.733000       1.033000  
1 1 1 16 33 23 o 12.55000 0.5118000 11.97000 0.7400000 13.13000 0.7072000 -1.159000      1.024000  
1 1 1 16 33 25 o 10.17000 0.5947000 9.982000 0.8544000 10.36000 0.8273000 -0.3738000     1.189000  
1 1 1 16 33 27 o 17.20000 0.4757000 17.17000 0.5954000 17.22000 0.7421000 -0.4298000E-01 0.9515000 
1 1 1 16 33 29 o 9.141000 0.5675000 8.349000 0.6080000 9.932000 0.9583000 -1.583000      1.135000  
1 1 1 16 33 31 f 16.86000 0.3358000 16.27000 0.3684000 17.45000 0.5614000 -1.177000      0.6715000 
1 1 1 16 33 33 o 16.42000 0.3758000 15.84000 0.4987000 17.00000 0.5622000 -1.157000      0.7515000 
1 1 1 16 33 35 o 5.333000 0.8484000 5.078000 1.159000  5.588000 1.239000  -0.5104000     1.697000  
1 1 1 16 33 37 o 12.19000 0.3979000 11.55000 0.5391000 12.84000 0.5853000 -1.287000      0.7957000 
1 1 1 16 33 39 o 10.43000 0.4324000 9.894000 0.5849000 10.97000 0.6369000 -1.072000      0.8647000 
1 1 1 16 33 41 o 4.337000 0.9537000 3.966000 1.406000  4.708000 1.289000  -0.7418000     1.907000  
1 1 1 16 33 43 o 7.366000 0.7423000 6.775000 1.202000  7.957000 0.8718000 -1.181000      1.485000  
1 1 1 16 33 45 o 5.308000 0.9816000 4.515000 1.503000  6.101000 1.263000  -1.585000      1.963000  
1 1 1 16 33 47 f 4.586000 1.041000  4.080000 1.696000  5.091000 1.208000  -1.011000      2.082000  
1 1 1 16 33 49 o 14.69000 0.5079000 14.33000 0.8602000 15.05000 0.5404000 -0.7170000     1.016000  
1 1 1 16 33 51 o 4.018000 1.017000  3.892000 1.554000  4.144000 1.314000  -0.2521000     2.035000  
1 1 1 16 33 53 o 5.468000 1.026000  7.001000 1.472000  3.934000 1.430000  3.067000       2.052000  
1 1 1 16 34 0  o 6.190000 1.191000  6.190000 1.191000  6.190000 1.191000  0.000000       0.000000  
1 1 1 16 34 2  o 12.92000 0.3287000 12.53000 0.5048000 13.31000 0.4212000 -0.7824000     0.6574000 
1 1 1 16 34 4  o 16.91000 0.2804000 16.75000 0.4272000 17.07000 0.3633000 -0.3180000     0.5608000 
1 1 1 16 34 6  o 8.056000 0.9527000 7.569000 0.8127000 8.543000 1.723000  -0.9741000     1.905000  
1 1 1 16 34 8  o 44.63000 0.5777000 45.67000 0.5104000 43.59000 1.036000  2.084000       1.155000  
1 1 1 16 34 10 o 34.75000 0.5247000 35.05000 0.5031000 34.46000 0.9209000 0.5981000      1.049000  
1 1 1 16 34 12 o 22.81000 0.4206000 23.10000 0.4979000 22.52000 0.6781000 0.5786000      0.8413000 
1 1 1 16 34 14 o 24.32000 0.3903000 24.31000 0.4327000 24.33000 0.6497000 -0.2422000E-01 0.7806000 
1 1 1 16 34 16 o 19.64000 0.4334000 19.54000 0.5242000 19.73000 0.6903000 -0.1869000     0.8668000 
1 1 1 16 34 18 o 29.34000 0.4164000 29.74000 0.4457000 28.94000 0.7035000 0.7957000      0.8328000 
1 1 1 16 34 20 o 61.75000 0.6123000 61.01000 0.7542000 62.49000 0.9647000 -1.478000      1.225000  
1 1 1 16 34 22 o 25.45000 0.4137000 26.10000 0.5138000 24.80000 0.6486000 1.302000       0.8275000 
1 1 1 16 34 24 f 20.73000 0.3893000 20.77000 0.5515000 20.70000 0.5497000 0.7266000E-01  0.7786000 
1 1 1 16 34 26 o 18.22000 0.4608000 18.07000 0.5582000 18.38000 0.7333000 -0.3059000     0.9216000 
1 1 1 16 34 28 o 13.87000 0.5094000 14.24000 0.7774000 13.51000 0.6584000 0.7341000      1.019000  
1 1 1 16 34 30 o 8.106000 0.5356000 7.103000 0.6690000 9.109000 0.8366000 -2.006000      1.071000  
1 1 1 16 34 32 o 23.54000 0.3254000 23.57000 0.3819000 23.51000 0.5270000 0.6332000E-01  0.6508000 
1 1 1 16 34 34 o 5.234000 0.7819000 3.608000 1.126000  6.859000 1.086000  -3.251000      1.564000  
1 1 1 16 34 36 o 3.805000 0.9323000 3.436000 1.228000  4.174000 1.403000  -0.7374000     1.865000  
1 1 1 16 34 38 o 10.35000 0.4392000 9.631000 0.5992000 11.07000 0.6423000 -1.437000      0.8784000 
1 1 1 16 34 40 o 12.15000 0.5198000 12.18000 0.8563000 12.11000 0.5894000 0.6957000E-01  1.040000  
1 1 1 16 34 42 o 8.388000 0.6126000 7.721000 0.9685000 9.055000 0.7504000 -1.334000      1.225000  
1 1 1 16 34 44 o 4.055000 0.9680000 4.424000 1.440000  3.686000 1.294000  0.7377000      1.936000  
1 1 1 16 34 46 o 11.80000 0.4854000 11.93000 0.7833000 11.67000 0.5733000 0.2585000      0.9707000 
1 1 1 16 34 48 f 14.17000 0.5692000 14.41000 0.9670000 13.93000 0.6008000 0.4757000      1.138000  
1 1 1 16 34 50 f 5.211000 0.9570000 5.752000 1.452000  4.670000 1.247000  1.082000       1.914000  
1 1 1 16 34 52 o 6.167000 0.9254000 6.603000 1.462000  5.731000 1.134000  0.8722000      1.851000  
1 1 1 16 35 1  o 24.68000 0.2982000 25.50000 0.3822000 23.86000 0.4578000 1.636000       0.5963000 
1 1 1 16 35 3  o 56.62000 0.4191000 56.17000 0.5904000 57.07000 0.5949000 -0.8962000     0.8381000 
1 1 1 16 35 5  o 17.93000 0.2736000 17.99000 0.4192000 17.87000 0.3516000 0.1246000      0.5472000 
1 1 1 16 35 7  o 7.878000 0.9966000 8.188000 0.7393000 7.568000 1.851000  0.6203000      1.993000  
1 1 1 16 35 9  o 12.41000 0.5583000 12.91000 0.5436000 11.92000 0.9753000 0.9927000      1.117000  
1 1 1 16 35 11 o 31.36000 0.4004000 31.39000 0.4360000 31.33000 0.6716000 0.5704000E-01  0.8007000 
1 1 1 16 35 13 o 23.99000 0.4213000 24.20000 0.5212000 23.77000 0.6621000 0.4261000      0.8426000 
1 1 1 16 35 15 o 26.98000 0.4213000 26.31000 0.5104000 27.65000 0.6705000 -1.343000      0.8426000 
1 1 1 16 35 17 o 10.28000 0.6768000 10.79000 0.6716000 9.774000 1.175000  1.021000       1.354000  
1 1 1 16 35 19 o 28.98000 0.4107000 28.83000 0.4397000 29.14000 0.6937000 -0.3079000     0.8213000 
1 1 1 16 35 21 o 10.01000 0.6893000 9.820000 0.7438000 10.20000 1.161000  -0.3826000     1.379000  
1 1 1 16 35 23 o 32.05000 0.4064000 33.11000 0.4547000 30.99000 0.6738000 2.121000       0.8129000 
1 1 1 16 35 25 o 16.68000 0.4675000 16.91000 0.5659000 16.46000 0.7443000 0.4549000      0.9350000 
1 1 1 16 35 27 o 28.52000 0.3664000 28.57000 0.5152000 28.48000 0.5211000 0.8967000E-01  0.7328000 
1 1 1 16 35 29 o 14.98000 0.4649000 15.41000 0.6922000 14.54000 0.6207000 0.8705000      0.9297000 
1 1 1 16 35 31 o 5.658000 0.7333000 5.193000 0.8660000 6.123000 1.184000  -0.9296000     1.467000  
1 1 1 16 35 33 o 7.309000 0.5782000 6.550000 0.6853000 8.069000 0.9314000 -1.519000      1.156000  
1 1 1 16 35 35 o 10.51000 0.4533000 10.14000 0.5044000 10.89000 0.7534000 -0.7525000     0.9067000 
1 1 1 16 35 37 o 7.543000 0.6818000 6.524000 0.7940000 8.561000 1.108000  -2.037000      1.364000  
1 1 1 16 35 39 o 6.016000 0.7829000 5.120000 1.257000  6.912000 0.9337000 -1.792000      1.566000  
1 1 1 16 35 41 o 7.130000 0.6973000 7.501000 1.043000  6.759000 0.9251000 0.7421000      1.395000  
1 1 1 16 35 43 o 11.06000 0.5008000 11.45000 0.7833000 10.67000 0.6242000 0.7794000      1.002000  
1 1 1 16 35 45 o 4.179000 0.9659000 3.854000 1.401000  4.504000 1.330000  -0.6495000     1.932000  
1 1 1 16 35 47 o 4.283000 0.9988000 3.967000 1.486000  4.600000 1.335000  -0.6334000     1.998000  
1 1 1 16 35 49 f 3.080000 0.9493000 3.802000 1.566000  2.359000 1.073000  1.443000       1.899000  
1 1 1 16 35 51 o 8.757000 0.6596000 9.781000 1.034000  7.733000 0.8194000 2.048000       1.319000  
1 1 1 16 36 0  o 11.42000 0.5839000 11.42000 0.5839000 11.42000 0.5839000 0.000000       0.000000  
1 1 1 16 36 2  o 20.42000 0.3069000 20.38000 0.4888000 20.47000 0.3710000 -0.9328000E-01 0.6137000 
1 1 1 16 36 4  o 9.236000 0.4287000 9.271000 0.6662000 9.202000 0.5398000 0.6945000E-01  0.8574000 
1 1 1 16 36 6  o 29.48000 0.3333000 29.05000 0.4679000 29.91000 0.4747000 -0.8602000     0.6665000 
1 1 1 16 36 8  o 18.38000 0.4508000 18.22000 0.4551000 18.55000 0.7784000 -0.3299000     0.9017000 
1 1 1 16 36 10 o 14.14000 0.5076000 13.96000 0.5289000 14.32000 0.8664000 -0.3594000     1.015000  
1 1 1 16 36 12 o 19.27000 0.4215000 19.08000 0.4585000 19.46000 0.7074000 -0.3754000     0.8430000 
1 1 1 16 36 14 f 10.94000 0.6308000 11.13000 0.6597000 10.76000 1.075000  0.3710000      1.262000  
1 1 1 16 36 16 o 35.23000 0.4183000 35.61000 0.4597000 34.85000 0.6991000 0.7693000      0.8367000 
1 1 1 16 36 18 o 34.62000 0.4069000 34.49000 0.4561000 34.74000 0.6740000 -0.2465000     0.8138000 
1 1 1 16 36 20 o 33.40000 0.4199000 32.98000 0.4536000 33.82000 0.7068000 -0.8491000     0.8398000 
1 1 1 16 36 22 f 25.00000 0.5757000 25.16000 0.4428000 24.84000 1.063000  0.3168000      1.151000  
1 1 1 16 36 24 o 19.32000 0.4337000 20.29000 0.5344000 18.34000 0.6832000 1.958000       0.8674000 
1 1 1 16 36 26 o 21.57000 0.4008000 22.06000 0.4421000 21.08000 0.6686000 0.9833000      0.8015000 
1 1 1 16 36 28 o 10.42000 0.5550000 9.926000 0.6337000 10.92000 0.9113000 -0.9973000     1.110000  
1 1 1 16 36 30 o 5.221000 0.8792000 4.429000 1.014000  6.012000 1.437000  -1.582000      1.758000  
1 1 1 16 36 32 o 23.99000 0.3113000 23.40000 0.3608000 24.58000 0.5075000 -1.183000      0.6227000 
1 1 1 16 36 34 o 15.90000 0.3709000 15.95000 0.4472000 15.85000 0.5919000 0.9616000E-01  0.7418000 
1 1 1 16 36 36 o 13.58000 0.5956000 12.50000 0.5276000 14.65000 1.068000  -2.145000      1.191000  
1 1 1 16 36 38 o 7.259000 0.5961000 6.238000 0.8807000 8.280000 0.8035000 -2.042000      1.192000  
1 1 1 16 36 40 o 5.018000 0.8955000 4.199000 1.421000  5.837000 1.091000  -1.638000      1.791000  
1 1 1 16 36 42 o 12.84000 0.4342000 12.23000 0.6961000 13.46000 0.5191000 -1.227000      0.8684000 
1 1 1 16 36 44 o 3.147000 0.8380000 2.418000 1.156000  3.876000 1.213000  -1.458000      1.676000  
1 1 1 16 36 46 o 3.469000 0.9708000 3.919000 1.465000  3.019000 1.275000  0.8997000      1.942000  
1 1 1 16 36 48 o 6.564000 0.8593000 5.608000 1.505000  7.520000 0.8306000 -1.912000      1.719000  
1 1 1 16 36 50 o 4.476000 1.037000  4.299000 1.509000  4.653000 1.422000  -0.3537000     2.074000  
1 1 1 16 37 1  o 12.75000 0.3931000 13.01000 0.6009000 12.49000 0.5071000 0.5124000      0.7863000 
1 1 1 16 37 3  o 53.65000 0.4588000 53.79000 0.6582000 53.50000 0.6393000 0.2846000      0.9176000 
1 1 1 16 37 5  o 20.18000 0.4326000 20.70000 0.4134000 19.66000 0.7602000 1.033000       0.8653000 
1 1 1 16 37 7  o 9.798000 0.6608000 9.134000 0.6915000 10.46000 1.126000  -1.329000      1.322000  
1 1 1 16 37 9  o 18.59000 0.4465000 18.56000 0.4482000 18.61000 0.7724000 -0.5486000E-01 0.8930000 
1 1 1 16 37 11 o 8.921000 0.7869000 8.790000 0.9022000 9.053000 1.290000  -0.2630000     1.574000  
1 1 1 16 37 13 o 30.56000 0.4013000 31.17000 0.4393000 29.94000 0.6716000 1.226000       0.8025000 
1 1 1 16 37 15 o 21.12000 0.4140000 21.60000 0.4422000 20.65000 0.7000000 0.9555000      0.8280000 
1 1 1 16 37 17 o 15.39000 0.4688000 15.81000 0.5077000 14.98000 0.7882000 0.8334000      0.9376000 
1 1 1 16 37 19 o 19.58000 0.5338000 19.00000 0.4572000 20.16000 0.9648000 -1.159000      1.068000  
1 1 1 16 37 21 o 31.98000 0.5655000 31.81000 0.4498000 32.15000 1.038000  -0.3479000     1.131000  
1 1 1 16 37 23 o 16.57000 0.4689000 16.29000 0.4848000 16.84000 0.8028000 -0.5490000     0.9379000 
1 1 1 16 37 25 o 13.31000 0.4925000 13.75000 0.6039000 12.87000 0.7780000 0.8733000      0.9849000 
1 1 1 16 37 27 o 11.03000 0.5886000 11.80000 0.6442000 10.25000 0.9853000 1.546000       1.177000  
1 1 1 16 37 29 o 23.46000 0.3971000 23.46000 0.4982000 23.46000 0.6184000 0.5892000E-02  0.7942000 
1 1 1 16 37 31 o 10.90000 0.4726000 10.22000 0.4046000 11.57000 0.8542000 -1.347000      0.9452000 
1 1 1 16 37 33 o 6.121000 0.7527000 6.264000 0.6755000 5.977000 1.345000  0.2869000      1.505000  
1 1 1 16 37 35 o 14.46000 0.5678000 15.20000 0.4661000 13.72000 1.036000  1.486000       1.136000  
1 1 1 16 37 37 o 5.171000 1.064000  5.809000 1.601000  4.532000 1.400000  1.277000       2.127000  
1 1 1 16 37 39 o 5.417000 0.9035000 4.843000 1.333000  5.992000 1.220000  -1.149000      1.807000  
1 1 1 16 37 41 o 4.261000 0.9322000 4.578000 1.423000  3.945000 1.204000  0.6339000      1.864000  
1 1 1 16 37 43 o 5.399000 0.8556000 5.648000 1.346000  5.149000 1.056000  0.4984000      1.711000  
1 1 1 16 37 45 o 5.323000 0.9696000 4.829000 1.498000  5.817000 1.232000  -0.9872000     1.939000  
1 1 1 16 37 47 o 3.897000 1.035000  4.805000 1.629000  2.989000 1.276000  1.817000       2.069000  
1 1 1 16 37 49 o 6.275000 1.113000  6.111000 1.942000  6.438000 1.089000  -0.3272000     2.226000  
1 1 1 16 38 0  o 2.231000 1.031000  2.231000 1.031000  2.231000 1.031000  0.000000       0.000000  
1 1 1 16 38 2  o 23.22000 0.4043000 23.10000 0.4012000 23.35000 0.7020000 -0.2490000     0.8086000 
1 1 1 16 38 4  o 24.10000 0.2773000 24.15000 0.4091000 24.05000 0.3745000 0.1015000      0.5547000 
1 1 1 16 38 6  f 17.51000 0.2873000 17.50000 0.4465000 17.51000 0.3617000 -0.8917000E-02 0.5746000 
1 1 1 16 38 8  o 18.23000 0.4403000 17.94000 0.4438000 18.52000 0.7607000 -0.5768000     0.8807000 
1 1 1 16 38 10 o 11.55000 0.6157000 11.65000 0.6778000 11.46000 1.028000  0.1923000      1.231000  
1 1 1 16 38 12 o 35.61000 0.4193000 35.69000 0.4609000 35.53000 0.7006000 0.1534000      0.8386000 
1 1 1 16 38 14 o 22.63000 0.4350000 22.67000 0.5139000 22.59000 0.7021000 0.7350000E-01  0.8701000 
1 1 1 16 38 16 f 29.68000 0.4046000 29.36000 0.4422000 30.00000 0.6776000 -0.6427000     0.8091000 
1 1 1 16 38 18 o 4.777000 0.9848000 5.531000 1.201000  4.023000 1.561000  1.508000       1.970000  
1 1 1 16 38 20 o 31.58000 0.5397000 31.83000 0.5061000 31.33000 0.9534000 0.4993000      1.079000  
1 1 1 16 38 22 o 23.65000 0.4171000 23.85000 0.4227000 23.45000 0.7192000 0.4017000      0.8343000 
1 1 1 16 38 24 o 6.686000 0.9179000 7.120000 1.024000  6.252000 1.524000  0.8681000      1.836000  
1 1 1 16 38 26 o 12.40000 0.7145000 13.53000 0.6031000 11.27000 1.295000  2.259000       1.429000  
1 1 1 16 38 28 o 20.08000 0.4120000 20.15000 0.5034000 20.00000 0.6523000 0.1464000      0.8240000 
1 1 1 16 38 30 o 16.20000 0.4237000 16.53000 0.4658000 15.88000 0.7079000 0.6560000      0.8474000 
1 1 1 16 38 32 o 11.83000 0.4765000 11.65000 0.3914000 12.01000 0.8688000 -0.3660000     0.9529000 
1 1 1 16 38 34 o 3.878000 1.057000  3.044000 1.116000  4.712000 1.795000  -1.669000      2.114000  
1 1 1 16 38 36 o 14.91000 0.4543000 15.14000 0.5110000 14.69000 0.7512000 0.4545000      0.9085000 
1 1 1 16 38 38 o 11.82000 0.6154000 11.11000 0.8959000 12.52000 0.8440000 -1.410000      1.231000  
1 1 1 16 38 40 o 5.321000 0.8168000 5.253000 1.082000  5.389000 1.224000  -0.1365000     1.634000  
1 1 1 16 38 42 o 10.02000 0.4594000 9.526000 0.6582000 10.52000 0.6411000 -0.9922000     0.9188000 
1 1 1 16 38 44 o 5.058000 0.9499000 4.590000 1.272000  5.525000 1.411000  -0.9357000     1.900000  
1 1 1 16 38 46 o 5.746000 0.9646000 4.389000 1.528000  7.104000 1.178000  -2.715000      1.929000  
1 1 1 16 38 48 o 3.396000 0.9627000 3.135000 1.316000  3.657000 1.406000  -0.5218000     1.925000  
1 1 1 16 39 1  o 19.35000 0.4225000 19.76000 0.7451000 18.94000 0.3983000 0.8196000      0.8449000 
1 1 1 16 39 3  o 17.60000 0.3667000 17.32000 0.4332000 17.87000 0.5916000 -0.5533000     0.7333000 
1 1 1 16 39 5  o 28.64000 0.2856000 28.83000 0.4190000 28.45000 0.3881000 0.3822000      0.5712000 
1 1 1 16 39 7  o 26.72000 0.3107000 27.05000 0.4241000 26.40000 0.4543000 0.6505000      0.6214000 
1 1 1 16 39 9  f 16.88000 0.4655000 17.23000 0.4662000 16.53000 0.8058000 0.6983000      0.9309000 
1 1 1 16 39 11 o 20.56000 0.4257000 20.94000 0.4415000 20.19000 0.7279000 0.7485000      0.8513000 
1 1 1 16 39 13 o 15.48000 0.5176000 15.92000 0.6140000 15.04000 0.8333000 0.8779000      1.035000  
1 1 1 16 39 15 o 14.62000 0.4950000 14.56000 0.5021000 14.67000 0.8531000 -0.1095000     0.9899000 
1 1 1 16 39 17 o 30.38000 0.5366000 31.04000 0.4427000 29.73000 0.9776000 1.317000       1.073000  
1 1 1 16 39 19 o 30.09000 0.4171000 29.80000 0.4883000 30.37000 0.6764000 -0.5675000     0.8343000 
1 1 1 16 39 21 o 5.531000 0.9590000 5.702000 1.083000  5.360000 1.583000  0.3411000      1.918000  
1 1 1 16 39 23 o 6.566000 1.003000  5.056000 1.514000  8.076000 1.317000  -3.020000      2.007000  
1 1 1 16 39 25 o 4.207000 1.032000  4.045000 1.278000  4.368000 1.620000  -0.3233000     2.064000  
1 1 1 16 39 27 o 4.798000 1.053000  4.835000 1.296000  4.761000 1.659000  0.7359000E-01  2.106000  
1 1 1 16 39 29 o 8.410000 0.6209000 8.725000 0.6767000 8.095000 1.041000  0.6301000      1.242000  
1 1 1 16 39 31 o 7.126000 0.7846000 7.373000 0.8051000 6.878000 1.347000  0.4949000      1.569000  
1 1 1 16 39 33 o 15.75000 0.5695000 16.09000 0.4808000 15.42000 1.033000  0.6711000      1.139000  
1 1 1 16 39 35 o 6.424000 0.8609000 6.591000 0.8207000 6.257000 1.514000  0.3339000      1.722000  
1 1 1 16 39 37 o 5.305000 0.9659000 5.416000 1.388000  5.194000 1.344000  0.2214000      1.932000  
1 1 1 16 39 39 o 3.432000 0.9461000 3.132000 1.194000  3.732000 1.468000  -0.6004000     1.892000  
1 1 1 16 39 41 o 6.930000 0.6294000 7.020000 0.8478000 6.840000 0.9306000 0.1807000      1.259000  
1 1 1 16 39 43 o 3.634000 0.9226000 2.782000 1.177000  4.486000 1.421000  -1.704000      1.845000  
1 1 1 16 39 45 o 3.635000 1.105000  3.966000 1.733000  3.303000 1.371000  0.6632000      2.210000  
1 1 1 16 39 47 o 6.466000 1.013000  6.471000 1.673000  6.461000 1.142000  0.9843000E-02  2.025000  
1 1 1 16 40 0  o 41.69000 0.5751000 41.69000 0.5751000 41.69000 0.5751000 0.000000       0.000000  
1 1 1 16 40 2  o 20.52000 0.2830000 20.24000 0.4122000 20.81000 0.3879000 -0.5734000     0.5660000 
1 1 1 16 40 4  o 15.61000 0.4367000 15.71000 0.7733000 15.51000 0.4062000 0.1999000      0.8735000 
1 1 1 16 40 6  o 21.28000 0.3594000 20.98000 0.4770000 21.58000 0.5377000 -0.6067000     0.7188000 
1 1 1 16 40 8  o 32.93000 0.4106000 33.56000 0.4432000 32.30000 0.6914000 1.256000       0.8213000 
1 1 1 16 40 10 o 15.35000 0.4835000 15.68000 0.4741000 15.02000 0.8429000 0.6589000      0.9670000 
1 1 1 16 40 12 o 38.35000 0.4292000 39.46000 0.4846000 37.25000 0.7086000 2.210000       0.8585000 
1 1 1 16 40 14 o 16.00000 0.6371000 15.64000 0.4852000 16.36000 1.178000  -0.7110000     1.274000  
1 1 1 16 40 16 o 9.398000 0.9205000 8.228000 0.7829000 10.57000 1.666000  -2.339000      1.841000  
1 1 1 16 40 18 o 5.099000 1.011000  5.306000 1.179000  4.892000 1.643000  0.4135000      2.022000  
1 1 1 16 40 20 o 8.947000 0.6627000 9.247000 0.6895000 8.647000 1.132000  0.5999000      1.325000  
1 1 1 16 40 22 o 16.60000 0.4515000 16.33000 0.5759000 16.86000 0.6955000 -0.5306000     0.9030000 
1 1 1 16 40 24 o 21.27000 0.4292000 21.72000 0.4396000 20.83000 0.7374000 0.8957000      0.8585000 
1 1 1 16 40 26 o 14.22000 0.5197000 14.11000 0.5664000 14.34000 0.8716000 -0.2263000     1.039000  
1 1 1 16 40 28 o 3.898000 0.9323000 4.578000 1.198000  3.218000 1.429000  1.361000       1.865000  
1 1 1 16 40 30 o 5.310000 0.8917000 5.835000 0.9651000 4.785000 1.500000  1.050000       1.783000  
1 1 1 16 40 32 o 5.022000 0.9905000 5.904000 1.055000  4.141000 1.677000  1.763000       1.981000  
1 1 1 16 40 34 o 8.401000 0.6355000 7.622000 0.6109000 9.181000 1.114000  -1.558000      1.271000  
1 1 1 16 40 36 o 3.493000 0.9278000 3.059000 1.121000  3.927000 1.479000  -0.8680000     1.856000  
1 1 1 16 40 38 o 4.446000 0.9833000 3.141000 1.247000  5.751000 1.520000  -2.610000      1.967000  
1 1 1 16 40 40 o 14.01000 0.3798000 14.02000 0.5242000 13.99000 0.5498000 0.2941000E-01  0.7596000 
1 1 1 16 40 42 o 6.111000 0.9446000 6.023000 1.406000  6.199000 1.262000  -0.1767000     1.889000  
1 1 1 16 40 44 o 7.993000 0.7546000 7.783000 1.066000  8.203000 1.068000  -0.4195000     1.509000  
1 1 1 16 40 46 o 11.11000 0.5937000 10.44000 0.9284000 11.77000 0.7403000 -1.329000      1.187000  
1 1 1 16 41 1  o 7.231000 0.5136000 7.693000 0.7294000 6.769000 0.7233000 0.9242000      1.027000  
1 1 1 16 41 3  o 6.887000 0.6690000 7.187000 0.8382000 6.587000 1.043000  0.6002000      1.338000  
1 1 1 16 41 5  o 15.97000 0.3010000 16.06000 0.4653000 15.87000 0.3819000 0.1867000      0.6020000 
1 1 1 16 41 7  o 13.33000 0.3783000 14.25000 0.6440000 12.41000 0.3970000 1.844000       0.7565000 
1 1 1 16 41 9  o 11.89000 0.5747000 12.54000 0.7533000 11.25000 0.8683000 1.291000       1.149000  
1 1 1 16 41 11 o 15.03000 0.4949000 15.50000 0.4781000 14.57000 0.8667000 0.9261000      0.9898000 
1 1 1 16 41 13 f 30.86000 0.5404000 31.32000 0.4477000 30.40000 0.9837000 0.9127000      1.081000  
1 1 1 16 41 15 o 26.69000 0.4117000 27.06000 0.4791000 26.32000 0.6696000 0.7413000      0.8234000 
1 1 1 16 41 17 o 10.43000 0.5748000 10.27000 0.6247000 10.58000 0.9651000 -0.3147000     1.150000  
1 1 1 16 41 19 f 13.62000 0.4728000 13.45000 0.5669000 13.79000 0.7568000 -0.3390000     0.9455000 
1 1 1 16 41 21 o 8.196000 0.7371000 8.498000 0.7527000 7.895000 1.268000  0.6027000      1.474000  
1 1 1 16 41 23 o 3.687000 1.009000  3.434000 1.342000  3.941000 1.507000  -0.5067000     2.018000  
1 1 1 16 41 25 o 19.66000 0.5030000 20.02000 0.6410000 19.29000 0.7753000 0.7311000      1.006000  
1 1 1 16 41 27 o 8.823000 0.7302000 9.360000 0.6763000 8.286000 1.294000  1.074000       1.460000  
1 1 1 16 41 29 o 11.10000 0.6511000 12.42000 0.5193000 9.779000 1.194000  2.639000       1.302000  
1 1 1 16 41 31 o 5.233000 0.9582000 6.414000 0.9187000 4.052000 1.682000  2.363000       1.916000  
1 1 1 16 41 33 o 16.08000 0.4421000 16.65000 0.5038000 15.52000 0.7266000 1.130000       0.8842000 
1 1 1 16 41 35 f 6.436000 0.7851000 6.240000 0.7284000 6.632000 1.391000  -0.3917000     1.570000  
1 1 1 16 41 37 o 8.154000 0.7253000 8.461000 0.6879000 7.848000 1.277000  0.6128000      1.451000  
1 1 1 16 41 39 o 3.573000 1.003000  3.867000 1.483000  3.278000 1.351000  0.5890000      2.007000  
1 1 1 16 41 41 o 10.58000 0.5839000 10.69000 0.8452000 10.48000 0.8059000 0.2030000      1.168000  
1 1 1 16 41 43 o 6.136000 0.9311000 6.203000 1.296000  6.069000 1.337000  0.1340000      1.862000  
1 1 1 16 41 45 o 3.140000 0.9560000 3.145000 1.365000  3.135000 1.339000  0.1044000E-01  1.912000  
1 1 1 16 42 0  o 4.783000 1.089000  4.783000 1.089000  4.783000 1.089000  0.000000       0.000000  
1 1 1 16 42 2  o 6.405000 0.5721000 6.189000 0.8578000 6.621000 0.7573000 -0.4320000     1.144000  
1 1 1 16 42 4  o 15.62000 0.3382000 15.87000 0.4433000 15.36000 0.5109000 0.5056000      0.6765000 
1 1 1 16 42 6  o 19.21000 0.2778000 19.67000 0.4236000 18.75000 0.3594000 0.9142000      0.5555000 
1 1 1 16 42 8  o 29.94000 0.3183000 29.58000 0.5008000 30.31000 0.3930000 -0.7230000     0.6366000 
1 1 1 16 42 10 o 15.62000 0.6011000 15.13000 0.4852000 16.11000 1.100000  -0.9779000     1.202000  
1 1 1 16 42 12 o 16.44000 0.4529000 16.93000 0.5980000 15.95000 0.6804000 0.9807000      0.9058000 
1 1 1 16 42 14 o 17.85000 0.4134000 17.53000 0.4687000 18.18000 0.6812000 -0.6460000     0.8268000 
1 1 1 16 42 16 o 5.970000 0.8975000 6.731000 0.9637000 5.209000 1.515000  1.522000       1.795000  
1 1 1 16 42 18 o 13.54000 0.4844000 14.07000 0.5898000 13.01000 0.7686000 1.059000       0.9688000 
1 1 1 16 42 20 o 11.69000 0.5361000 12.11000 0.5634000 11.26000 0.9123000 0.8535000      1.072000  
1 1 1 16 42 22 o 5.434000 1.002000  6.144000 1.219000  4.724000 1.591000  1.421000       2.004000  
1 1 1 16 42 24 o 22.38000 0.4298000 21.77000 0.5197000 22.99000 0.6848000 -1.224000      0.8597000 
1 1 1 16 42 26 o 13.00000 0.5592000 13.42000 0.5418000 12.57000 0.9784000 0.8493000      1.118000  
1 1 1 16 42 28 o 5.516000 1.013000  6.435000 0.9186000 4.598000 1.805000  1.837000       2.026000  
1 1 1 16 42 30 o 4.855000 0.9675000 5.784000 1.018000  3.926000 1.645000  1.858000       1.935000  
1 1 1 16 42 32 o 4.953000 1.139000  4.820000 1.236000  5.086000 1.914000  -0.2662000     2.279000  
1 1 1 16 42 34 o 10.32000 0.6112000 10.83000 0.6382000 9.811000 1.043000  1.019000       1.222000  
1 1 1 16 42 36 o 5.229000 0.8647000 5.048000 0.8965000 5.411000 1.479000  -0.3623000     1.729000  
1 1 1 16 42 38 o 5.542000 1.001000  5.443000 1.407000  5.641000 1.425000  -0.1977000     2.002000  
1 1 1 16 42 40 o 5.719000 1.019000  6.299000 1.420000  5.140000 1.463000  1.159000       2.039000  
1 1 1 16 42 42 o 7.733000 0.7319000 7.408000 1.027000  8.058000 1.043000  -0.6495000     1.464000  
1 1 1 16 42 44 o 3.936000 1.125000  4.599000 1.770000  3.273000 1.388000  1.325000       2.250000  
1 1 1 16 43 1  o 38.72000 0.3562000 38.68000 0.4587000 38.77000 0.5451000 -0.8534000E-01 0.7124000 
1 1 1 16 43 3  o 23.39000 0.2807000 23.27000 0.3959000 23.51000 0.3979000 -0.2397000     0.5613000 
1 1 1 16 43 5  o 19.10000 0.3114000 19.33000 0.4135000 18.86000 0.4658000 0.4710000      0.6229000 
1 1 1 16 43 7  o 12.23000 0.3393000 12.61000 0.5123000 11.84000 0.4451000 0.7633000      0.6787000 
1 1 1 16 43 9  o 21.28000 0.6075000 19.76000 0.4204000 22.80000 1.140000  -3.042000      1.215000  
1 1 1 16 43 11 o 24.43000 0.4150000 24.27000 0.5001000 24.60000 0.6625000 -0.3219000     0.8300000 
1 1 1 16 43 13 o 3.713000 0.9708000 3.037000 1.209000  4.388000 1.519000  -1.351000      1.942000  
1 1 1 16 43 15 o 7.379000 1.020000  7.610000 1.644000  7.147000 1.209000  0.4625000      2.041000  
1 1 1 16 43 17 o 12.69000 0.5376000 13.61000 0.6438000 11.76000 0.8612000 1.854000       1.075000  
1 1 1 16 43 19 o 14.05000 0.5118000 14.74000 0.6127000 13.36000 0.8200000 1.379000       1.024000  
1 1 1 16 43 21 o 7.316000 0.8369000 7.485000 1.052000  7.147000 1.302000  0.3376000      1.674000  
1 1 1 16 43 23 o 16.83000 0.4320000 16.61000 0.4681000 17.05000 0.7261000 -0.4418000     0.8639000 
1 1 1 16 43 25 o 11.13000 0.5626000 10.52000 0.6205000 11.75000 0.9387000 -1.235000      1.125000  
1 1 1 16 43 27 o 8.851000 0.9154000 8.966000 0.7301000 8.736000 1.679000  0.2301000      1.831000  
1 1 1 16 43 29 o 17.50000 0.5033000 18.03000 0.4682000 16.98000 0.8910000 1.049000       1.007000  
1 1 1 16 43 31 o 4.909000 1.236000  4.731000 1.226000  5.086000 2.147000  -0.3549000     2.472000  
1 1 1 16 43 33 o 8.780000 0.7423000 10.04000 0.8053000 7.519000 1.247000  2.524000       1.485000  
1 1 1 16 43 35 o 13.12000 0.5954000 14.06000 0.7463000 12.19000 0.9281000 1.867000       1.191000  
1 1 1 16 43 37 o 3.986000 0.9788000 4.503000 1.370000  3.469000 1.398000  1.033000       1.958000  
1 1 1 16 43 39 o 3.132000 0.9432000 3.459000 1.406000  2.804000 1.257000  0.6544000      1.886000  
1 1 1 16 43 41 o 5.206000 0.9929000 4.336000 1.474000  6.075000 1.331000  -1.738000      1.986000  
1 1 1 16 43 43 o 3.612000 1.076000  4.535000 1.771000  2.689000 1.224000  1.846000       2.152000  
1 1 1 16 44 0  o 9.812000 0.5389000 9.812000 0.5389000 9.812000 0.5389000 0.000000       0.000000  
1 1 1 16 44 2  o 8.372000 0.5582000 9.310000 0.5964000 7.435000 0.9436000 1.876000       1.116000  
1 1 1 16 44 4  f 8.144000 0.4641000 7.865000 0.7041000 8.423000 0.6046000 -0.5585000     0.9281000 
1 1 1 16 44 6  o 4.660000 0.7601000 4.114000 1.224000  5.205000 0.9018000 -1.091000      1.520000  
1 1 1 16 44 8  o 10.18000 0.3572000 10.04000 0.5824000 10.31000 0.4137000 -0.2706000     0.7144000 
1 1 1 16 44 10 o 22.75000 0.4145000 21.80000 0.4246000 23.70000 0.7121000 -1.891000      0.8291000 
1 1 1 16 44 12 o 13.55000 0.5142000 13.66000 0.5432000 13.44000 0.8731000 0.2176000      1.028000  
1 1 1 16 44 14 f 15.14000 0.5268000 15.35000 0.6612000 14.93000 0.8204000 0.4236000      1.054000  
1 1 1 16 44 16 o 19.70000 0.4399000 20.75000 0.5242000 18.65000 0.7065000 2.105000       0.8798000 
1 1 1 16 44 18 o 3.761000 1.007000  3.428000 1.425000  4.095000 1.423000  -0.6665000     2.014000  
1 1 1 16 44 20 o 14.18000 0.5511000 14.42000 0.7523000 13.95000 0.8056000 0.4670000      1.102000  
1 1 1 16 44 22 o 3.899000 0.9661000 3.160000 1.190000  4.638000 1.522000  -1.477000      1.932000  
1 1 1 16 44 24 o 8.808000 0.6430000 8.380000 0.6977000 9.236000 1.080000  -0.8559000     1.286000  
1 1 1 16 44 26 o 7.674000 1.040000  8.428000 0.7493000 6.921000 1.940000  1.507000       2.079000  
1 1 1 16 44 28 o 10.84000 0.6838000 11.26000 0.6310000 10.42000 1.213000  0.8472000      1.368000  
1 1 1 16 44 30 o 6.225000 1.144000  7.326000 0.8881000 5.125000 2.108000  2.201000       2.287000  
1 1 1 16 44 32 o 2.765000 0.8999000 2.683000 1.192000  2.846000 1.349000  -0.1634000     1.800000  
1 1 1 16 44 34 o 3.050000 0.9212000 3.132000 1.272000  2.968000 1.333000  0.1643000      1.842000  
1 1 1 16 44 36 o 7.511000 0.8397000 9.055000 0.8092000 5.968000 1.471000  3.087000       1.679000  
1 1 1 16 44 38 o 5.948000 0.9527000 5.438000 1.459000  6.459000 1.226000  -1.021000      1.905000  
1 1 1 16 44 40 o 8.891000 0.7008000 8.546000 1.007000  9.236000 0.9744000 -0.6902000     1.402000  
1 1 1 16 44 42 o 11.19000 0.5665000 11.04000 0.8611000 11.34000 0.7364000 -0.2932000     1.133000  
1 1 1 16 45 1  o 13.51000 0.3450000 13.88000 0.4842000 13.13000 0.4915000 0.7530000      0.6899000 
1 1 1 16 45 3  o 9.527000 0.4350000 10.15000 0.6487000 8.906000 0.5797000 1.242000       0.8700000 
1 1 1 16 45 5  o 7.446000 0.6032000 6.819000 0.9279000 8.073000 0.7710000 -1.254000      1.206000  
1 1 1 16 45 7  o 6.866000 0.6477000 7.634000 1.087000  6.099000 0.7050000 1.535000       1.295000  
1 1 1 16 45 9  o 15.62000 0.3350000 15.18000 0.5772000 16.05000 0.3401000 -0.8666000     0.6699000 
1 1 1 16 45 11 o 4.755000 1.077000  4.209000 1.395000  5.300000 1.640000  -1.091000      2.153000  
1 1 1 16 45 13 o 12.21000 0.5427000 11.83000 0.6230000 12.59000 0.8889000 -0.7583000     1.085000  
1 1 1 16 45 15 o 9.132000 0.6303000 9.468000 0.6432000 8.796000 1.084000  0.6728000      1.261000  
1 1 1 16 45 17 o 3.223000 0.9407000 3.319000 1.258000  3.127000 1.399000  0.1923000      1.881000  
1 1 1 16 45 19 o 3.205000 0.9389000 2.715000 1.168000  3.695000 1.470000  -0.9806000     1.878000  
1 1 1 16 45 21 o 7.082000 0.7827000 7.700000 0.9306000 6.464000 1.259000  1.236000       1.565000  
1 1 1 16 45 23 o 6.560000 1.015000  5.483000 1.239000  7.636000 1.609000  -2.153000      2.030000  
1 1 1 16 45 25 o 9.837000 0.7027000 10.43000 0.8680000 9.240000 1.105000  1.194000       1.405000  
1 1 1 16 45 27 o 8.018000 0.7904000 7.550000 0.9823000 8.486000 1.239000  -0.9362000     1.581000  
1 1 1 16 45 29 o 12.27000 0.9860000 12.66000 0.5834000 11.87000 1.884000  0.7890000      1.972000  
1 1 1 16 45 31 o 7.149000 0.8769000 7.137000 0.8347000 7.160000 1.542000  -0.2305000E-01 1.754000  
1 1 1 16 45 33 o 4.897000 1.045000  5.137000 1.249000  4.658000 1.674000  0.4790000      2.089000  
1 1 1 16 45 35 o 4.393000 1.043000  4.875000 1.388000  3.911000 1.557000  0.9646000      2.086000  
1 1 1 16 45 37 o 3.542000 0.9708000 3.509000 1.365000  3.575000 1.381000  -0.6544000E-01 1.942000  
1 1 1 16 45 39 o 4.230000 1.063000  4.515000 1.561000  3.944000 1.443000  0.5716000      2.126000  
1 1 1 16 45 41 o 6.507000 0.8983000 5.919000 1.394000  7.095000 1.133000  -1.176000      1.797000  
1 1 1 16 46 0  o 25.34000 0.3889000 25.34000 0.3889000 25.34000 0.3889000 0.000000       0.000000  
1 1 1 16 46 2  o 15.88000 0.2903000 15.70000 0.4130000 16.06000 0.4082000 -0.3585000     0.5807000 
1 1 1 16 46 4  o 4.680000 0.7141000 4.315000 1.144000  5.045000 0.8551000 -0.7299000     1.428000  
1 1 1 16 46 6  o 7.392000 0.6439000 6.762000 1.033000  8.022000 0.7693000 -1.260000      1.288000  
1 1 1 16 46 8  o 8.287000 0.4421000 8.521000 0.7258000 8.053000 0.5050000 0.4673000      0.8843000 
1 1 1 16 46 10 o 19.11000 0.3475000 19.91000 0.6082000 18.31000 0.3365000 1.605000       0.6951000 
1 1 1 16 46 12 o 16.56000 0.4354000 16.97000 0.4394000 16.16000 0.7517000 0.8115000      0.8707000 
1 1 1 16 46 14 o 3.325000 0.9476000 3.330000 1.224000  3.320000 1.447000  0.9815000E-02  1.895000  
1 1 1 16 46 16 o 13.73000 0.4937000 14.22000 0.4762000 13.25000 0.8649000 0.9687000      0.9874000 
1 1 1 16 46 18 o 8.393000 0.7420000 9.067000 0.7075000 7.719000 1.304000  1.348000       1.484000  
1 1 1 16 46 20 o 5.362000 1.066000  4.375000 1.315000  6.350000 1.677000  -1.974000      2.131000  
1 1 1 16 46 22 o 4.679000 1.073000  5.162000 1.328000  4.197000 1.686000  0.9648000      2.147000  
1 1 1 16 46 24 o 4.422000 1.077000  4.131000 1.392000  4.713000 1.643000  -0.5819000     2.154000  
1 1 1 16 46 26 o 4.572000 0.9808000 4.128000 1.264000  5.017000 1.500000  -0.8895000     1.962000  
1 1 1 16 46 28 o 8.782000 0.8512000 10.77000 0.6460000 6.797000 1.575000  3.970000       1.702000  
1 1 1 16 46 30 o 3.864000 1.069000  4.698000 1.609000  3.029000 1.409000  1.669000       2.139000  
1 1 1 16 46 32 o 8.220000 0.8235000 8.001000 0.9552000 8.440000 1.342000  -0.4386000     1.647000  
1 1 1 16 46 34 o 4.754000 1.028000  5.600000 1.335000  3.909000 1.564000  1.691000       2.057000  
1 1 1 16 46 36 o 5.989000 1.076000  6.275000 1.376000  5.704000 1.654000  0.5711000      2.152000  
1 1 1 16 46 38 o 15.73000 0.5041000 15.72000 0.6519000 15.75000 0.7692000 -0.3385000E-01 1.008000  
1 1 1 16 46 40 o 10.35000 0.6928000 10.13000 1.080000  10.56000 0.8684000 -0.4356000     1.386000  
1 1 1 16 47 1  o 28.88000 0.3038000 28.53000 0.4489000 29.22000 0.4095000 -0.6873000     0.6076000 
1 1 1 16 47 3  o 18.68000 0.4295000 18.49000 0.4386000 18.87000 0.7385000 -0.3824000     0.8589000 
1 1 1 16 47 5  o 15.81000 0.3076000 15.95000 0.4700000 15.67000 0.3968000 0.2740000      0.6151000 
1 1 1 16 47 7  o 5.232000 0.7550000 5.981000 0.8951000 4.483000 1.216000  1.498000       1.510000  
1 1 1 16 47 9  o 10.45000 0.4024000 10.70000 0.6989000 10.19000 0.3992000 0.5024000      0.8048000 
1 1 1 16 47 11 o 9.475000 0.7174000 10.33000 0.5877000 8.623000 1.309000  1.705000       1.435000  
1 1 1 16 47 13 o 7.192000 0.7397000 6.898000 0.7853000 7.486000 1.254000  -0.5878000     1.479000  
1 1 1 16 47 15 o 5.281000 0.9482000 5.579000 1.053000  4.982000 1.577000  0.5969000      1.896000  
1 1 1 16 47 17 o 5.460000 0.9424000 5.033000 1.135000  5.887000 1.505000  -0.8533000     1.885000  
1 1 1 16 47 19 o 6.696000 1.053000  5.965000 1.129000  7.428000 1.779000  -1.464000      2.107000  
1 1 1 16 47 21 f 4.293000 0.9985000 4.778000 1.265000  3.809000 1.545000  0.9694000      1.997000  
1 1 1 16 47 23 o 3.677000 0.9843000 3.766000 1.273000  3.587000 1.501000  0.1787000      1.969000  
1 1 1 16 47 25 o 4.019000 1.139000  3.516000 1.294000  4.522000 1.874000  -1.007000      2.278000  
1 1 1 16 47 27 o 3.913000 1.000000  3.266000 1.331000  4.559000 1.493000  -1.293000      2.000000  
1 1 1 16 47 29 o 11.85000 0.6322000 12.41000 0.6981000 11.29000 1.054000  1.120000       1.264000  
1 1 1 16 47 31 o 8.980000 0.7713000 9.822000 0.7530000 8.139000 1.346000  1.683000       1.543000  
1 1 1 16 47 33 f 4.175000 1.033000  2.674000 1.209000  5.675000 1.676000  -3.001000      2.066000  
1 1 1 16 47 35 o 3.891000 1.062000  4.118000 1.458000  3.664000 1.545000  0.4537000      2.124000  
1 1 1 16 47 37 o 6.320000 1.049000  5.502000 1.754000  7.138000 1.151000  -1.636000      2.098000  
1 1 1 16 47 39 o 5.508000 1.141000  6.983000 1.800000  4.033000 1.401000  2.951000       2.281000  
1 1 1 16 48 0  o 6.530000 0.8396000 6.530000 0.8396000 6.530000 0.8396000 0.000000       0.000000  
1 1 1 16 48 2  o 5.067000 0.7386000 5.105000 0.9713000 5.030000 1.113000  0.7509000E-01  1.477000  
1 1 1 16 48 4  o 10.21000 0.4311000 10.98000 0.5281000 9.438000 0.6816000 1.541000       0.8622000 
1 1 1 16 48 6  o 12.89000 0.3229000 12.88000 0.4757000 12.91000 0.4367000 -0.2524000E-01 0.6458000 
1 1 1 16 48 8  o 4.580000 0.7151000 5.090000 1.005000  4.070000 1.018000  1.020000       1.430000  
1 1 1 16 48 10 o 4.515000 0.8102000 4.033000 1.212000  4.997000 1.075000  -0.9633000     1.620000  
1 1 1 16 48 12 o 19.29000 0.5259000 18.64000 0.4315000 19.95000 0.9591000 -1.311000      1.052000  
1 1 1 16 48 14 o 13.10000 0.5846000 12.62000 0.5275000 13.58000 1.043000  -0.9659000     1.169000  
1 1 1 16 48 16 o 5.640000 1.079000  5.606000 1.060000  5.675000 1.879000  -0.6952000E-01 2.158000  
1 1 1 16 48 18 o 6.975000 0.9402000 8.053000 0.8985000 5.897000 1.652000  2.157000       1.880000  
1 1 1 16 48 20 o 6.431000 0.8042000 6.331000 0.9234000 6.531000 1.317000  -0.1999000     1.608000  
1 1 1 16 48 22 o 6.087000 0.9246000 5.818000 1.046000  6.356000 1.525000  -0.5379000     1.849000  
1 1 1 16 48 24 o 3.021000 0.9955000 2.426000 1.096000  3.617000 1.662000  -1.191000      1.991000  
1 1 1 16 48 26 o 5.299000 1.020000  5.136000 1.237000  5.461000 1.622000  -0.3253000     2.039000  
1 1 1 16 48 28 o 13.18000 0.5513000 13.19000 0.6439000 13.17000 0.8951000 0.2417000E-01  1.103000  
1 1 1 16 48 30 o 3.146000 0.9919000 3.008000 1.381000  3.285000 1.424000  -0.2776000     1.984000  
1 1 1 16 48 32 o 3.225000 0.9589000 3.391000 1.295000  3.059000 1.415000  0.3317000      1.918000  
1 1 1 16 48 34 o 8.158000 0.8682000 9.491000 0.7290000 6.826000 1.576000  2.665000       1.736000  
1 1 1 16 48 36 o 7.238000 0.9943000 8.858000 0.9144000 5.618000 1.766000  3.241000       1.989000  
1 1 1 16 48 38 o 4.966000 2.048000  ?        ?         4.966000 2.048000  ?              ?         
1 1 1 16 49 1  o 4.427000 0.7636000 4.251000 1.085000  4.604000 1.074000  -0.3524000     1.527000  
1 1 1 16 49 3  o 14.02000 0.3097000 14.30000 0.4338000 13.75000 0.4422000 0.5594000      0.6195000 
1 1 1 16 49 5  o 7.770000 0.5117000 8.799000 0.8186000 6.740000 0.6142000 2.060000       1.023000  
1 1 1 16 49 7  o 3.133000 0.8469000 3.486000 1.208000  2.779000 1.187000  0.7078000      1.694000  
1 1 1 16 49 9  o 9.726000 0.4817000 10.64000 0.5751000 8.812000 0.7728000 1.828000       0.9633000 
1 1 1 16 49 11 o 5.579000 0.5823000 6.562000 0.8013000 4.596000 0.8452000 1.966000       1.165000  
1 1 1 16 49 13 o 3.111000 0.9219000 3.307000 1.224000  2.914000 1.379000  0.3938000      1.844000  
1 1 1 16 49 15 o 3.339000 0.9907000 2.850000 1.186000  3.827000 1.587000  -0.9766000     1.981000  
1 1 1 16 49 17 o 5.562000 0.9591000 5.294000 1.290000  5.829000 1.420000  -0.5353000     1.918000  
1 1 1 16 49 19 o 8.009000 0.7350000 8.124000 0.7731000 7.894000 1.250000  0.2300000      1.470000  
1 1 1 16 49 21 o 3.859000 0.9276000 5.036000 1.344000  2.682000 1.279000  2.353000       1.855000  
1 1 1 16 49 23 o 6.335000 1.083000  6.841000 0.9067000 5.829000 1.967000  1.012000       2.166000  
1 1 1 16 49 25 o 9.777000 0.6429000 9.953000 0.6683000 9.602000 1.098000  0.3516000      1.286000  
1 1 1 16 49 27 o 9.384000 0.6844000 9.422000 0.7388000 9.345000 1.152000  0.7711000E-01  1.369000  
1 1 1 16 49 29 o 4.894000 0.9862000 6.177000 1.208000  3.611000 1.559000  2.567000       1.972000  
1 1 1 16 49 31 o 6.717000 0.9585000 7.558000 0.9174000 5.876000 1.683000  1.682000       1.917000  
1 1 1 16 49 33 o 9.722000 0.7018000 11.55000 0.7872000 7.897000 1.162000  3.651000       1.404000  
1 1 1 16 49 35 o 4.332000 0.9704000 4.933000 1.150000  3.731000 1.564000  1.202000       1.941000  
1 1 1 16 50 0  o 7.689000 0.6866000 7.689000 0.6866000 7.689000 0.6866000 0.000000       0.000000  
1 1 1 16 50 2  o 10.13000 0.3898000 10.65000 0.5093000 9.607000 0.5904000 1.045000       0.7797000 
1 1 1 16 50 4  o 22.99000 0.3070000 23.32000 0.4769000 22.67000 0.3868000 0.6546000      0.6141000 
1 1 1 16 50 6  o 20.95000 0.2928000 21.27000 0.4170000 20.63000 0.4111000 0.6375000      0.5856000 
1 1 1 16 50 8  o 18.26000 0.4697000 18.34000 0.5261000 18.18000 0.7782000 0.1566000      0.9393000 
1 1 1 16 50 10 o 9.748000 0.5896000 9.496000 0.6336000 10.00000 0.9946000 -0.5046000     1.179000  
1 1 1 16 50 12 o 5.770000 0.9334000 6.432000 0.8857000 5.108000 1.643000  1.325000       1.867000  
1 1 1 16 50 14 o 3.419000 0.9972000 2.988000 1.218000  3.851000 1.579000  -0.8628000     1.994000  
1 1 1 16 50 16 o 3.014000 0.8862000 3.245000 1.222000  2.784000 1.284000  0.4606000      1.772000  
1 1 1 16 50 18 o 3.294000 0.9192000 3.448000 1.199000  3.139000 1.394000  0.3093000      1.838000  
1 1 1 16 50 20 o 12.01000 0.7924000 12.30000 0.6716000 11.72000 1.435000  0.5859000      1.585000  
1 1 1 16 50 22 o 9.699000 0.6846000 9.711000 0.6874000 9.687000 1.184000  0.2392000E-01  1.369000  
1 1 1 16 50 24 o 7.019000 0.8023000 7.469000 0.9947000 6.570000 1.259000  0.8990000      1.605000  
1 1 1 16 50 26 o 10.03000 0.6133000 9.123000 0.7053000 10.94000 1.004000  -1.818000      1.227000  
1 1 1 16 50 28 o 3.288000 0.9814000 2.834000 1.218000  3.741000 1.540000  -0.9064000     1.963000  
1 1 1 16 50 30 f 6.714000 0.9558000 5.827000 1.088000  7.600000 1.572000  -1.773000      1.912000  
1 1 1 16 50 32 o 6.163000 1.042000  6.618000 1.022000  5.707000 1.815000  0.9112000      2.083000  
1 1 1 16 50 34 o 3.236000 0.9677000 3.613000 1.391000  2.858000 1.346000  0.7549000      1.935000  
1 1 1 16 51 1  o 3.265000 0.8253000 2.712000 1.121000  3.817000 1.211000  -1.105000      1.651000  
1 1 1 16 51 3  o 15.10000 0.3041000 15.20000 0.4450000 15.00000 0.4145000 0.1987000      0.6081000 
1 1 1 16 51 5  o 9.327000 0.4134000 9.633000 0.6176000 9.022000 0.5498000 0.6107000      0.8269000 
1 1 1 16 51 7  o 6.937000 0.6970000 7.747000 0.8819000 6.128000 1.080000  1.619000       1.394000  
1 1 1 16 51 9  o 6.365000 0.6279000 7.178000 0.7601000 5.551000 0.9997000 1.628000       1.256000  
1 1 1 16 51 11 o 3.678000 0.7961000 4.301000 1.162000  3.055000 1.089000  1.245000       1.592000  
1 1 1 16 51 13 o 3.607000 0.9632000 3.443000 1.260000  3.771000 1.457000  -0.3275000     1.926000  
1 1 1 16 51 15 o 10.90000 0.6351000 11.15000 0.6428000 10.66000 1.095000  0.4907000      1.270000  
1 1 1 16 51 17 o 3.206000 0.9425000 3.278000 1.245000  3.134000 1.416000  0.1441000      1.885000  
1 1 1 16 51 19 o 3.299000 1.048000  2.397000 1.086000  4.201000 1.793000  -1.805000      2.097000  
1 1 1 16 51 21 o 2.957000 0.9127000 2.830000 1.171000  3.084000 1.401000  -0.2539000     1.825000  
1 1 1 16 51 23 o 2.693000 0.8591000 3.003000 1.266000  2.384000 1.161000  0.6189000      1.718000  
1 1 1 16 51 25 o 3.547000 0.9465000 3.737000 1.270000  3.356000 1.404000  0.3808000      1.893000  
1 1 1 16 51 27 o 6.064000 1.014000  5.640000 1.107000  6.487000 1.700000  -0.8468000     2.029000  
1 1 1 16 51 29 o 3.251000 0.9680000 3.472000 1.338000  3.031000 1.399000  0.4414000      1.936000  
1 1 1 16 51 31 o 5.646000 1.101000  4.698000 1.332000  6.595000 1.754000  -1.897000      2.203000  
1 1 1 16 51 33 o 4.701000 1.861000  4.701000 1.861000  ?        ?         ?              ?         
1 1 1 16 52 0  o 4.646000 1.122000  4.646000 1.122000  4.646000 1.122000  0.000000       0.000000  
1 1 1 16 52 2  o 12.64000 0.3589000 13.11000 0.5057000 12.16000 0.5093000 0.9540000      0.7177000 
1 1 1 16 52 4  o 20.69000 0.2902000 20.80000 0.4161000 20.57000 0.4046000 0.2340000      0.5804000 
1 1 1 16 52 6  f 8.988000 0.6882000 8.734000 0.7460000 9.242000 1.157000  -0.5081000     1.376000  
1 1 1 16 52 8  f 6.491000 0.6461000 6.300000 0.8549000 6.683000 0.9690000 -0.3827000     1.292000  
1 1 1 16 52 10 o 11.26000 0.5734000 11.89000 0.5396000 10.64000 1.012000  1.248000       1.147000  
1 1 1 16 52 12 o 7.676000 0.7947000 7.603000 0.8394000 7.748000 1.350000  -0.1452000     1.589000  
1 1 1 16 52 14 o 11.22000 0.5790000 10.87000 0.6071000 11.57000 0.9860000 -0.6951000     1.158000  
1 1 1 16 52 16 o 6.302000 1.219000  6.861000 1.161000  5.742000 2.145000  1.119000       2.439000  
1 1 1 16 52 18 o 6.258000 0.9385000 6.075000 0.9887000 6.441000 1.596000  -0.3664000     1.877000  
1 1 1 16 52 20 o 3.940000 1.007000  3.443000 1.316000  4.438000 1.525000  -0.9951000     2.014000  
1 1 1 16 52 22 o 6.518000 0.9240000 6.533000 0.9374000 6.503000 1.593000  0.2991000E-01  1.848000  
1 1 1 16 52 24 o 4.692000 1.037000  4.902000 1.314000  4.482000 1.604000  0.4203000      2.074000  
1 1 1 16 52 26 o 5.313000 0.9912000 6.077000 1.028000  4.549000 1.695000  1.528000       1.982000  
1 1 1 16 52 28 o 2.660000 0.8950000 1.957000 0.9431000 3.363000 1.521000  -1.405000      1.790000  
1 1 1 16 52 30 o 4.891000 1.138000  4.335000 1.409000  5.448000 1.787000  -1.113000      2.276000  
1 1 1 16 53 1  o 7.017000 0.5516000 6.916000 0.8159000 7.118000 0.7424000 -0.2024000     1.103000  
1 1 1 16 53 3  o 6.093000 0.7652000 5.570000 1.339000  6.615000 0.7413000 -1.045000      1.530000  
1 1 1 16 53 5  o 3.192000 0.8873000 2.824000 1.157000  3.561000 1.346000  -0.7369000     1.775000  
1 1 1 16 53 7  o 6.637000 0.6481000 8.236000 0.6902000 5.038000 1.097000  3.197000       1.296000  
1 1 1 16 53 9  o 10.62000 0.5942000 10.24000 0.5695000 11.01000 1.043000  -0.7742000     1.188000  
1 1 1 16 53 11 o 5.448000 0.9908000 5.331000 1.150000  5.565000 1.614000  -0.2340000     1.982000  
1 1 1 16 53 13 o 3.755000 1.077000  3.550000 1.267000  3.959000 1.743000  -0.4093000     2.154000  
1 1 1 16 53 15 o 4.351000 1.197000  3.581000 1.374000  5.120000 1.961000  -1.539000      2.395000  
1 1 1 16 53 17 f 5.099000 0.9956000 5.479000 1.083000  4.720000 1.671000  0.7598000      1.991000  
1 1 1 16 53 19 o 7.283000 0.8231000 7.454000 0.9429000 7.113000 1.349000  0.3407000      1.646000  
1 1 1 16 53 21 o 9.689000 0.6667000 8.519000 0.8402000 10.86000 1.035000  -2.340000      1.333000  
1 1 1 16 53 23 o 4.034000 1.020000  2.944000 1.205000  5.123000 1.647000  -2.180000      2.040000  
1 1 1 16 53 25 o 3.446000 1.017000  2.920000 1.242000  3.972000 1.612000  -1.051000      2.035000  
1 1 1 16 53 27 o 9.526000 0.7870000 9.553000 0.8013000 9.500000 1.355000  0.5280000E-01  1.574000  
1 1 1 16 53 29 o 3.781000 1.643000  3.781000 1.643000  ?        ?         ?              ?         
1 1 1 16 54 0  o 9.569000 0.6268000 9.569000 0.6268000 9.569000 0.6268000 0.000000       0.000000  
1 1 1 16 54 2  o 15.10000 0.3528000 15.35000 0.5621000 14.85000 0.4266000 0.5048000      0.7056000 
1 1 1 16 54 4  o 8.920000 0.4056000 9.401000 0.5846000 8.439000 0.5624000 0.9613000      0.8112000 
1 1 1 16 54 6  o 7.821000 0.5422000 7.291000 0.7602000 8.351000 0.7732000 -1.060000      1.084000  
1 1 1 16 54 8  o 4.642000 1.045000  3.564000 1.236000  5.721000 1.685000  -2.157000      2.089000  
1 1 1 16 54 10 o 5.025000 0.9591000 4.863000 1.135000  5.187000 1.546000  -0.3243000     1.918000  
1 1 1 16 54 12 o 5.710000 1.029000  6.506000 0.9275000 4.914000 1.837000  1.592000       2.058000  
1 1 1 16 54 14 f 4.710000 1.010000  5.746000 1.315000  3.673000 1.532000  2.072000       2.019000  
1 1 1 16 54 16 o 4.386000 1.064000  4.159000 1.313000  4.614000 1.674000  -0.4541000     2.127000  
1 1 1 16 54 18 o 6.173000 1.012000  6.150000 1.189000  6.197000 1.639000  -0.4711000E-01 2.025000  
1 1 1 16 54 20 o 3.239000 0.9828000 2.122000 1.005000  4.357000 1.689000  -2.235000      1.966000  
1 1 1 16 54 22 o 4.105000 1.039000  3.318000 1.304000  4.892000 1.618000  -1.574000      2.078000  
1 1 1 16 54 24 f 2.755000 0.8862000 2.217000 1.020000  3.293000 1.449000  -1.076000      1.772000  
1 1 1 16 54 26 o 4.594000 1.101000  4.766000 1.418000  4.422000 1.684000  0.3446000      2.202000  
1 1 1 16 55 1  o 4.404000 0.9724000 4.533000 1.353000  4.274000 1.397000  0.2590000      1.945000  
1 1 1 16 55 3  o 7.787000 0.6162000 8.500000 0.7035000 7.073000 1.012000  1.428000       1.232000  
1 1 1 16 55 5  o 7.338000 0.9756000 9.142000 0.7977000 5.533000 1.781000  3.609000       1.951000  
1 1 1 16 55 7  o 3.963000 0.9713000 3.795000 1.264000  4.131000 1.475000  -0.3358000     1.943000  
1 1 1 16 55 9  o 4.787000 1.167000  4.606000 1.126000  4.969000 2.044000  -0.3632000     2.334000  
1 1 1 16 55 11 o 4.963000 1.024000  4.435000 1.221000  5.491000 1.643000  -1.056000      2.048000  
1 1 1 16 55 13 o 3.586000 0.9905000 3.326000 1.250000  3.847000 1.537000  -0.5216000     1.981000  
1 1 1 16 55 15 o 3.430000 0.9814000 3.372000 1.287000  3.487000 1.482000  -0.1148000     1.963000  
1 1 1 16 55 17 o 4.040000 1.075000  3.023000 1.303000  5.056000 1.710000  -2.032000      2.150000  
1 1 1 16 55 19 o 6.979000 0.8904000 7.260000 0.9024000 6.698000 1.535000  0.5622000      1.781000  
1 1 1 16 55 21 o 6.119000 1.010000  6.661000 0.9099000 5.576000 1.804000  1.085000       2.021000  
1 1 1 16 55 23 o 5.291000 0.9771000 5.624000 1.136000  4.958000 1.590000  0.6662000      1.954000  
1 1 1 16 56 0  o 3.598000 1.399000  3.598000 1.399000  3.598000 1.399000  0.000000       0.000000  
1 1 1 16 56 2  o 4.536000 0.8715000 5.031000 1.107000  4.040000 1.346000  0.9909000      1.743000  
1 1 1 16 56 4  o 4.478000 1.104000  4.948000 1.327000  4.007000 1.765000  0.9403000      2.208000  
1 1 1 16 56 6  o 4.155000 1.194000  2.681000 1.146000  5.630000 2.094000  -2.949000      2.387000  
1 1 1 16 56 8  o 4.099000 0.9443000 4.657000 1.169000  3.541000 1.483000  1.116000       1.889000  
1 1 1 16 56 10 o 4.608000 1.038000  3.751000 1.236000  5.465000 1.667000  -1.714000      2.075000  
1 1 1 16 56 12 o 9.440000 0.7617000 9.834000 0.6891000 9.046000 1.359000  0.7876000      1.523000  
1 1 1 16 56 14 o 8.577000 0.7124000 8.298000 0.7711000 8.857000 1.198000  -0.5590000     1.425000  
1 1 1 16 56 16 o 4.053000 1.086000  3.588000 1.327000  4.517000 1.720000  -0.9287000     2.173000  
1 1 1 16 56 18 o 4.175000 1.040000  3.341000 1.251000  5.010000 1.662000  -1.668000      2.081000  
1 1 1 16 56 20 o 4.207000 1.095000  3.617000 1.281000  4.798000 1.775000  -1.181000      2.189000  
1 1 1 16 57 1  o 4.289000 1.231000  3.805000 1.427000  4.773000 2.005000  -0.9682000     2.461000  
1 1 1 16 57 3  o 4.478000 1.227000  4.101000 1.358000  4.856000 2.045000  -0.7550000     2.455000  
1 1 1 16 57 5  o 4.755000 0.9777000 3.655000 1.275000  5.855000 1.482000  -2.200000      1.955000  
1 1 1 16 57 7  o 4.739000 1.042000  4.273000 1.166000  5.205000 1.727000  -0.9316000     2.084000  
1 1 1 16 57 9  o 5.376000 0.9967000 6.271000 1.031000  4.481000 1.706000  1.790000       1.993000  
1 1 1 16 57 11 o 7.562000 0.7327000 6.162000 0.9548000 8.963000 1.112000  -2.802000      1.465000  
1 1 1 16 57 13 o 6.337000 0.9367000 4.859000 1.081000  7.815000 1.530000  -2.956000      1.873000  
1 1 1 16 57 15 o 3.796000 1.004000  3.903000 1.240000  3.689000 1.580000  0.2144000      2.008000  
1 1 1 16 57 17 o 4.406000 1.058000  4.516000 1.294000  4.295000 1.673000  0.2206000      2.115000  
1 1 1 16 58 0  o 3.446000 1.473000  3.446000 1.473000  3.446000 1.473000  0.000000       0.000000  
1 1 1 16 58 2  o 3.724000 1.048000  3.704000 1.390000  3.743000 1.569000  -0.3905000E-01 2.096000  
1 1 1 16 58 4  o 5.624000 1.055000  4.354000 1.330000  6.893000 1.639000  -2.540000      2.111000  
1 1 1 16 58 6  o 3.093000 0.9700000 3.077000 1.306000  3.110000 1.434000  -0.3216000E-01 1.940000  
1 1 1 16 58 8  o 6.559000 0.9109000 5.399000 1.234000  7.720000 1.340000  -2.321000      1.822000  
1 1 1 16 58 10 o 6.632000 0.9610000 5.335000 1.327000  7.929000 1.391000  -2.594000      1.922000  
1 1 1 16 58 12 o 4.795000 1.017000  2.988000 1.310000  6.603000 1.557000  -3.615000      2.034000  
1 1 1 16 59 1  o 3.598000 1.153000  4.118000 1.802000  3.079000 1.437000  1.039000       2.305000  
1 1 1 16 59 3  o 7.166000 1.264000  8.035000 1.935000  6.297000 1.627000  1.738000       2.529000  
1 1 1 16 59 5  o 3.627000 1.096000  3.691000 1.556000  3.563000 1.544000  0.1284000      2.191000  
1 1 1 16 59 7  o 6.928000 1.384000  7.650000 2.003000  6.205000 1.910000  1.446000       2.768000  
1 1 1 17 0  1  o 28.56000 0.3593000 28.56000 0.3593000 28.56000 0.3593000 0.000000       0.000000  
1 1 1 17 0  3  f 27.57000 0.5034000 27.57000 0.5034000 27.57000 0.5034000 0.000000       0.000000  
1 1 1 17 0  5  o 23.10000 0.3429000 23.10000 0.3429000 23.10000 0.3429000 0.000000       0.000000  
1 1 1 17 0  7  o 24.14000 0.3506000 24.14000 0.3506000 24.14000 0.3506000 0.000000       0.000000  
1 1 1 17 0  9  o 72.67000 0.7227000 72.67000 0.7227000 72.67000 0.7227000 0.000000       0.000000  
1 1 1 17 0  11 o 21.78000 0.4220000 21.78000 0.4220000 21.78000 0.4220000 0.000000       0.000000  
1 1 1 17 0  13 o 68.84000 0.6885000 68.84000 0.6885000 68.84000 0.6885000 0.000000       0.000000  
1 1 1 17 0  15 o 37.83000 0.4377000 37.83000 0.4377000 37.83000 0.4377000 0.000000       0.000000  
1 1 1 17 0  17 o 47.68000 0.5111000 47.68000 0.5111000 47.68000 0.5111000 0.000000       0.000000  
1 1 1 17 0  19 o 77.02000 0.8843000 77.02000 0.8843000 77.02000 0.8843000 0.000000       0.000000  
1 1 1 17 0  21 o 16.41000 0.4469000 16.41000 0.4469000 16.41000 0.4469000 0.000000       0.000000  
1 1 1 17 0  23 o 111.3000 1.086000  111.3000 1.086000  111.3000 1.086000  0.000000       0.000000  
1 1 1 17 0  25 o 27.49000 0.4783000 27.49000 0.4783000 27.49000 0.4783000 0.000000       0.000000  
1 1 1 17 0  27 o 7.781000 0.8494000 7.781000 0.8494000 7.781000 0.8494000 0.000000       0.000000  
1 1 1 17 0  29 o 10.72000 0.7783000 10.72000 0.7783000 10.72000 0.7783000 0.000000       0.000000  
1 1 1 17 0  31 o 100.8000 1.148000  100.8000 1.148000  100.8000 1.148000  0.000000       0.000000  
1 1 1 17 0  33 o 3.326000 1.301000  3.326000 1.301000  3.326000 1.301000  0.000000       0.000000  
1 1 1 17 0  35 o 6.869000 1.122000  6.869000 1.122000  6.869000 1.122000  0.000000       0.000000  
1 1 1 17 0  37 o 71.32000 0.7317000 71.32000 0.7317000 71.32000 0.7317000 0.000000       0.000000  
1 1 1 17 0  39 o 35.02000 0.4733000 35.02000 0.4733000 35.02000 0.4733000 0.000000       0.000000  
1 1 1 17 0  41 o 3.536000 1.503000  3.536000 1.503000  3.536000 1.503000  0.000000       0.000000  
1 1 1 17 0  43 o 7.355000 1.207000  7.355000 1.207000  7.355000 1.207000  0.000000       0.000000  
1 1 1 17 0  45 o 3.688000 1.412000  3.688000 1.412000  3.688000 1.412000  0.000000       0.000000  
1 1 1 17 0  47 o 46.41000 0.6173000 46.41000 0.6173000 46.41000 0.6173000 0.000000       0.000000  
1 1 1 17 0  49 o 24.71000 0.4600000 24.71000 0.4600000 24.71000 0.4600000 0.000000       0.000000  
1 1 1 17 0  51 o 6.233000 1.151000  6.233000 1.151000  6.233000 1.151000  0.000000       0.000000  
1 1 1 17 0  53 o 3.157000 1.323000  3.157000 1.323000  3.157000 1.323000  0.000000       0.000000  
1 1 1 17 0  55 o 8.437000 1.026000  8.437000 1.026000  8.437000 1.026000  0.000000       0.000000  
1 1 1 17 0  57 o 3.860000 1.466000  3.860000 1.466000  3.860000 1.466000  0.000000       0.000000  
1 1 1 17 0  59 o 9.191000 0.9109000 9.191000 0.9109000 9.191000 0.9109000 0.000000       0.000000  
1 1 1 17 0  61 o 2.958000 1.289000  2.958000 1.289000  2.958000 1.289000  0.000000       0.000000  
1 1 1 17 0  63 o 8.082000 1.049000  8.082000 1.049000  8.082000 1.049000  0.000000       0.000000  
1 1 1 17 1  0  o 74.13000 1.039000  74.13000 1.039000  74.13000 1.039000  0.000000       0.000000  
1 1 1 17 1  2  o 53.48000 0.3870000 53.14000 0.5436000 53.81000 0.5509000 -0.6692000     0.7739000 
1 1 1 17 1  4  o 140.1000 0.9562000 140.0000 1.352000  140.1000 1.353000  -0.6950000E-01 1.912000  
1 1 1 17 1  6  o 29.51000 0.2810000 29.92000 0.4270000 29.11000 0.3652000 0.8107000      0.5619000 
1 1 1 17 1  8  f 43.12000 0.3281000 42.97000 0.4625000 43.26000 0.4655000 -0.2926000     0.6562000 
1 1 1 17 1  10 o 62.89000 0.4479000 62.88000 0.6335000 62.90000 0.6335000 -0.1885000E-01 0.8959000 
1 1 1 17 1  12 o 60.01000 0.4317000 60.04000 0.6099000 59.97000 0.6112000 0.6705000E-01  0.8635000 
1 1 1 17 1  14 o 34.13000 0.3346000 33.66000 0.4665000 34.60000 0.4799000 -0.9339000     0.6693000 
1 1 1 17 1  16 o 62.71000 0.4501000 62.16000 0.6308000 63.26000 0.6421000 -1.107000      0.9001000 
1 1 1 17 1  18 o 48.78000 0.3963000 48.66000 0.5198000 48.90000 0.5984000 -0.2396000     0.7927000 
1 1 1 17 1  20 o 81.54000 0.5720000 81.38000 0.8073000 81.70000 0.8105000 -0.3150000     1.144000  
1 1 1 17 1  22 o 23.71000 0.2777000 23.77000 0.3921000 23.65000 0.3934000 0.1212000      0.5554000 
1 1 1 17 1  24 o 14.71000 0.3752000 15.12000 0.4769000 14.30000 0.5794000 0.8138000      0.7504000 
1 1 1 17 1  26 o 18.01000 0.3325000 17.92000 0.4413000 18.10000 0.4975000 -0.1821000     0.6650000 
1 1 1 17 1  28 o 12.74000 0.4136000 12.78000 0.5417000 12.70000 0.6250000 0.8480000E-01  0.8271000 
1 1 1 17 1  30 o 59.02000 0.5372000 59.49000 0.8797000 58.56000 0.6169000 0.9349000      1.074000  
1 1 1 17 1  32 o 20.03000 0.3250000 20.24000 0.4539000 19.81000 0.4653000 0.4277000      0.6500000 
1 1 1 17 1  34 o 33.33000 0.3638000 32.92000 0.5133000 33.75000 0.5157000 -0.8302000     0.7276000 
1 1 1 17 1  36 o 35.98000 0.3354000 36.30000 0.4745000 35.66000 0.4741000 0.6393000      0.6708000 
1 1 1 17 1  38 o 16.74000 0.3963000 16.83000 0.5665000 16.65000 0.5542000 0.1799000      0.7926000 
1 1 1 17 1  40 o 6.647000 0.9680000 7.107000 1.225000  6.186000 1.499000  0.9218000      1.936000  
1 1 1 17 1  42 o 12.00000 0.5579000 11.09000 0.8684000 12.90000 0.7007000 -1.806000      1.116000  
1 1 1 17 1  44 o 17.49000 0.5033000 17.28000 0.6293000 17.70000 0.7857000 -0.4160000     1.007000  
1 1 1 17 1  46 o 8.609000 0.6333000 8.101000 0.9477000 9.117000 0.8404000 -1.016000      1.267000  
1 1 1 17 1  48 o 5.427000 0.8780000 6.806000 1.019000  4.048000 1.431000  2.758000       1.756000  
1 1 1 17 1  50 o 7.571000 0.6631000 7.752000 0.9159000 7.390000 0.9592000 0.3623000      1.326000  
1 1 1 17 1  52 o 3.771000 0.9451000 4.220000 1.381000  3.322000 1.290000  0.8973000      1.890000  
1 1 1 17 1  54 o 3.040000 0.9384000 3.010000 1.341000  3.069000 1.313000  -0.5955000E-01 1.877000  
1 1 1 17 1  56 o 7.880000 0.8201000 6.884000 1.157000  8.877000 1.162000  -1.993000      1.640000  
1 1 1 17 1  58 o 5.279000 1.020000  4.915000 1.446000  5.643000 1.440000  -0.7279000     2.041000  
1 1 1 17 1  60 o 5.239000 1.010000  6.077000 1.344000  4.401000 1.509000  1.676000       2.020000  
1 1 1 17 1  62 o 2.896000 0.9112000 3.059000 1.345000  2.733000 1.229000  0.3260000      1.822000  
1 1 1 17 2  1  o 64.26000 0.4912000 64.01000 0.7404000 64.51000 0.6455000 -0.4983000     0.9823000 
1 1 1 17 2  3  o 41.43000 0.3423000 41.07000 0.4451000 41.80000 0.5203000 -0.7347000     0.6847000 
1 1 1 17 2  5  o 101.1000 0.6965000 100.9000 0.9825000 101.3000 0.9875000 -0.4175000     1.393000  
1 1 1 17 2  7  o 82.25000 0.6188000 81.56000 0.8041000 82.94000 0.9406000 -1.384000      1.238000  
1 1 1 17 2  9  o 86.75000 0.6022000 86.47000 0.8492000 87.02000 0.8540000 -0.5453000     1.204000  
1 1 1 17 2  11 o 68.09000 0.4822000 67.42000 0.6757000 68.76000 0.6880000 -1.340000      0.9644000 
1 1 1 17 2  13 o 38.10000 0.3308000 37.73000 0.4956000 38.46000 0.4382000 -0.7249000     0.6616000 
1 1 1 17 2  15 o 27.76000 0.2929000 28.03000 0.3877000 27.48000 0.4391000 0.5499000      0.5858000 
1 1 1 17 2  17 o 17.40000 0.3101000 16.95000 0.4164000 17.86000 0.4597000 -0.9096000     0.6202000 
1 1 1 17 2  19 o 18.87000 0.3073000 19.25000 0.4558000 18.48000 0.4122000 0.7695000      0.6145000 
1 1 1 17 2  21 o 12.03000 0.3724000 12.09000 0.5220000 11.97000 0.5313000 0.1114000      0.7448000 
1 1 1 17 2  23 o 74.54000 0.5701000 74.45000 0.7457000 74.63000 0.8625000 -0.1713000     1.140000  
1 1 1 17 2  25 o 21.79000 0.3096000 21.70000 0.3750000 21.88000 0.4927000 -0.1833000     0.6192000 
1 1 1 17 2  27 o 61.39000 0.5189000 61.92000 0.7400000 60.86000 0.7275000 1.053000       1.038000  
1 1 1 17 2  29 o 39.66000 0.3329000 39.94000 0.4731000 39.37000 0.4684000 0.5633000      0.6657000 
1 1 1 17 2  31 f 24.38000 0.3960000 25.15000 0.6154000 23.61000 0.4987000 1.537000       0.7921000 
1 1 1 17 2  33 o 28.17000 0.3101000 28.31000 0.4388000 28.04000 0.4382000 0.2703000      0.6202000 
1 1 1 17 2  35 o 31.78000 0.3431000 31.10000 0.4531000 32.45000 0.5153000 -1.358000      0.6861000 
1 1 1 17 2  37 o 52.70000 0.4102000 52.87000 0.5791000 52.53000 0.5812000 0.3430000      0.8204000 
1 1 1 17 2  39 o 22.53000 0.3584000 23.08000 0.4839000 21.98000 0.5288000 1.105000       0.7168000 
1 1 1 17 2  41 o 12.25000 0.4988000 12.19000 0.7171000 12.32000 0.6936000 -0.1281000     0.9976000 
1 1 1 17 2  43 o 32.35000 0.3923000 32.38000 0.5446000 32.31000 0.5648000 0.7008000E-01  0.7846000 
1 1 1 17 2  45 o 23.87000 0.3661000 23.37000 0.5583000 24.37000 0.4736000 -1.002000      0.7321000 
1 1 1 17 2  47 o 11.85000 0.4724000 11.98000 0.6672000 11.72000 0.6689000 0.2582000      0.9448000 
1 1 1 17 2  49 o 6.307000 0.7916000 5.601000 1.268000  7.012000 0.9481000 -1.411000      1.583000  
1 1 1 17 2  51 o 12.56000 0.4400000 13.01000 0.6089000 12.12000 0.6352000 0.8887000      0.8799000 
1 1 1 17 2  53 o 7.848000 0.7339000 8.331000 0.8881000 7.365000 1.169000  0.9668000      1.468000  
1 1 1 17 2  55 o 15.87000 0.5483000 15.60000 0.7924000 16.15000 0.7580000 -0.5544000     1.097000  
1 1 1 17 2  57 o 10.49000 0.6939000 9.925000 1.106000  11.06000 0.8378000 -1.135000      1.388000  
1 1 1 17 2  59 o 6.728000 0.8385000 7.068000 1.152000  6.388000 1.218000  0.6799000      1.677000  
1 1 1 17 2  61 o 4.189000 0.9980000 3.683000 1.418000  4.695000 1.405000  -1.012000      1.996000  
1 1 1 17 2  63 o 4.055000 1.030000  3.468000 1.375000  4.643000 1.535000  -1.175000      2.061000  
1 1 1 17 3  0  o 68.99000 0.6864000 68.99000 0.6864000 68.99000 0.6864000 0.000000       0.000000  
1 1 1 17 3  2  o 52.52000 0.3816000 52.59000 0.5409000 52.45000 0.5383000 0.1412000      0.7631000 
1 1 1 17 3  4  o 55.12000 0.4596000 55.31000 0.6514000 54.94000 0.6485000 0.3756000      0.9192000 
1 1 1 17 3  6  o 39.44000 0.3057000 39.54000 0.4354000 39.34000 0.4292000 0.2069000      0.6114000 
1 1 1 17 3  8  o 52.51000 0.3833000 52.16000 0.5387000 52.86000 0.5456000 -0.7065000     0.7667000 
1 1 1 17 3  10 o 90.84000 0.8134000 91.09000 1.264000  90.60000 1.024000  0.4930000      1.627000  
1 1 1 17 3  12 o 60.84000 0.4713000 60.83000 0.7121000 60.85000 0.6175000 -0.2343000E-01 0.9426000 
1 1 1 17 3  14 o 58.33000 0.4227000 58.24000 0.5966000 58.42000 0.5989000 -0.1817000     0.8453000 
1 1 1 17 3  16 o 7.512000 0.5202000 7.964000 0.7115000 7.060000 0.7589000 0.9047000      1.040000  
1 1 1 17 3  18 o 84.02000 0.6327000 84.28000 0.8318000 83.75000 0.9535000 0.5331000      1.265000  
1 1 1 17 3  20 o 27.57000 0.2991000 27.31000 0.4455000 27.82000 0.3991000 -0.5033000     0.5982000 
1 1 1 17 3  22 o 62.93000 0.4919000 63.00000 0.6440000 62.86000 0.7436000 0.1370000      0.9837000 
1 1 1 17 3  24 o 38.18000 0.3331000 37.95000 0.4033000 38.41000 0.5303000 -0.4558000     0.6662000 
1 1 1 17 3  26 o 70.10000 0.5425000 69.71000 0.7052000 70.49000 0.8245000 -0.7800000     1.085000  
1 1 1 17 3  28 o 35.81000 0.3438000 36.02000 0.5167000 35.60000 0.4536000 0.4213000      0.6876000 
1 1 1 17 3  30 o 20.33000 0.3899000 20.32000 0.5808000 20.34000 0.5204000 -0.2532000E-01 0.7799000 
1 1 1 17 3  32 f 20.39000 0.3602000 20.37000 0.5471000 20.42000 0.4687000 -0.4967000E-01 0.7205000 
1 1 1 17 3  34 o 20.52000 0.3741000 19.81000 0.5241000 21.22000 0.5340000 -1.412000      0.7482000 
1 1 1 17 3  36 o 13.98000 0.4385000 13.77000 0.6401000 14.20000 0.5995000 -0.4293000     0.8770000 
1 1 1 17 3  38 f 31.50000 0.3286000 31.28000 0.4704000 31.72000 0.4591000 -0.4395000     0.6573000 
1 1 1 17 3  40 o 27.13000 0.3332000 27.67000 0.4745000 26.59000 0.4679000 1.082000       0.6664000 
1 1 1 17 3  42 f 11.63000 0.5567000 12.11000 0.7224000 11.16000 0.8471000 0.9525000      1.113000  
1 1 1 17 3  44 o 14.47000 0.4975000 13.99000 0.6845000 14.95000 0.7220000 -0.9569000     0.9949000 
1 1 1 17 3  46 o 17.45000 0.4621000 17.50000 0.7200000 17.39000 0.5794000 0.1082000      0.9242000 
1 1 1 17 3  48 o 13.57000 0.4232000 13.50000 0.6111000 13.65000 0.5857000 -0.1554000     0.8465000 
1 1 1 17 3  50 o 13.43000 0.4114000 13.87000 0.5731000 12.99000 0.5905000 0.8749000      0.8229000 
1 1 1 17 3  52 o 17.08000 0.3956000 17.23000 0.5168000 16.93000 0.5992000 0.3006000      0.7913000 
1 1 1 17 3  54 o 12.94000 0.4632000 12.84000 0.6503000 13.03000 0.6597000 -0.1942000     0.9264000 
1 1 1 17 3  56 o 12.72000 0.4793000 12.25000 0.6937000 13.18000 0.6617000 -0.9394000     0.9587000 
1 1 1 17 3  58 o 5.079000 1.031000  5.762000 1.481000  4.397000 1.436000  1.364000       2.063000  
1 1 1 17 3  60 o 9.027000 0.6235000 8.665000 0.9451000 9.389000 0.8135000 -0.7233000     1.247000  
1 1 1 17 3  62 o 4.546000 0.9882000 3.714000 1.460000  5.377000 1.332000  -1.663000      1.976000  
1 1 1 17 4  1  f 83.20000 0.5780000 82.51000 0.8112000 83.88000 0.8234000 -1.373000      1.156000  
1 1 1 17 4  3  o 111.3000 0.8257000 111.4000 1.081000  111.3000 1.248000  0.3221000E-01  1.651000  
1 1 1 17 4  5  o 85.25000 0.6391000 85.69000 0.8418000 84.82000 0.9618000 0.8770000      1.278000  
1 1 1 17 4  7  o 57.74000 0.5373000 58.10000 0.6819000 57.38000 0.8304000 0.7129000      1.075000  
1 1 1 17 4  9  o 56.02000 0.4388000 56.18000 0.5744000 55.85000 0.6636000 0.3265000      0.8777000 
1 1 1 17 4  11 f 142.2000 1.121000  142.5000 1.589000  141.8000 1.582000  0.7075000      2.242000  
1 1 1 17 4  13 o 88.51000 0.6644000 88.47000 1.004000  88.56000 0.8710000 -0.8564000E-01 1.329000  
1 1 1 17 4  15 o 49.08000 0.3988000 48.77000 0.5178000 49.38000 0.6067000 -0.6155000     0.7976000 
1 1 1 17 4  17 o 34.45000 0.3192000 33.99000 0.4192000 34.90000 0.4816000 -0.9126000     0.6385000 
1 1 1 17 4  19 o 35.53000 0.3491000 35.81000 0.4944000 35.24000 0.4931000 0.5725000      0.6982000 
1 1 1 17 4  21 o 43.89000 0.3714000 43.76000 0.4849000 44.01000 0.5627000 -0.2498000     0.7429000 
1 1 1 17 4  23 o 7.493000 0.5917000 6.581000 0.7700000 8.404000 0.8987000 -1.823000      1.183000  
1 1 1 17 4  25 o 38.57000 0.3497000 38.25000 0.4528000 38.90000 0.5330000 -0.6425000     0.6994000 
1 1 1 17 4  27 o 18.42000 0.3225000 18.67000 0.3940000 18.16000 0.5107000 0.5056000      0.6450000 
1 1 1 17 4  29 o 59.71000 0.4764000 59.41000 0.7163000 60.01000 0.6284000 -0.6057000     0.9528000 
1 1 1 17 4  31 o 10.93000 0.4967000 10.31000 0.6872000 11.55000 0.7173000 -1.240000      0.9934000 
1 1 1 17 4  33 o 63.15000 0.5369000 63.58000 0.7634000 62.72000 0.7552000 0.8531000      1.074000  
1 1 1 17 4  35 o 27.41000 0.3123000 27.39000 0.4451000 27.42000 0.4382000 -0.3045000E-01 0.6247000 
1 1 1 17 4  37 o 22.16000 0.3449000 21.78000 0.4901000 22.55000 0.4854000 -0.7609000     0.6898000 
1 1 1 17 4  39 o 15.10000 0.4138000 14.60000 0.6149000 15.59000 0.5539000 -0.9857000     0.8276000 
1 1 1 17 4  41 o 21.14000 0.3839000 21.32000 0.5189000 20.96000 0.5658000 0.3614000      0.7677000 
1 1 1 17 4  43 o 20.01000 0.3949000 19.73000 0.6008000 20.30000 0.5127000 -0.5744000     0.7898000 
1 1 1 17 4  45 o 16.38000 0.4296000 15.75000 0.6710000 17.02000 0.5366000 -1.273000      0.8592000 
1 1 1 17 4  47 o 7.890000 0.7610000 6.641000 1.297000  9.139000 0.7973000 -2.497000      1.522000  
1 1 1 17 4  49 o 6.759000 0.7552000 6.327000 1.145000  7.191000 0.9852000 -0.8636000     1.510000  
1 1 1 17 4  51 o 4.332000 0.9418000 4.971000 1.330000  3.694000 1.333000  1.277000       1.884000  
1 1 1 17 4  53 o 8.262000 0.6200000 7.895000 0.8989000 8.628000 0.8541000 -0.7326000     1.240000  
1 1 1 17 4  55 o 4.926000 1.078000  5.492000 1.521000  4.361000 1.528000  1.132000       2.156000  
1 1 1 17 4  57 o 7.068000 0.9059000 7.017000 1.277000  7.120000 1.285000  -0.1035000     1.812000  
1 1 1 17 4  59 o 3.461000 0.9961000 3.512000 1.409000  3.410000 1.409000  0.1018000      1.992000  
1 1 1 17 4  61 o 5.373000 1.018000  5.498000 1.417000  5.247000 1.463000  0.2514000      2.036000  
1 1 1 17 4  63 o 4.332000 0.9770000 5.626000 1.436000  3.038000 1.325000  2.588000       1.954000  
1 1 1 17 5  0  o 104.7000 1.176000  104.7000 1.176000  104.7000 1.176000  0.000000       0.000000  
1 1 1 17 5  2  o 8.077000 0.4204000 8.230000 0.5241000 7.924000 0.6574000 0.3058000      0.8407000 
1 1 1 17 5  4  f 33.05000 0.2928000 33.36000 0.3900000 32.74000 0.4367000 0.6234000      0.5855000 
1 1 1 17 5  6  o 88.70000 0.6143000 88.74000 0.8690000 88.66000 0.8685000 0.7813000E-01  1.229000  
1 1 1 17 5  8  o 25.87000 0.2518000 26.07000 0.3541000 25.67000 0.3580000 0.3991000      0.5035000 
1 1 1 17 5  10 o 35.05000 0.3691000 35.13000 0.5677000 34.97000 0.4718000 0.1558000      0.7381000 
1 1 1 17 5  12 o 97.94000 0.7313000 97.84000 0.9558000 98.04000 1.107000  -0.1961000     1.463000  
1 1 1 17 5  14 o 52.19000 0.5004000 51.96000 0.6245000 52.43000 0.7820000 -0.4676000     1.001000  
1 1 1 17 5  16 o 21.43000 0.3302000 21.12000 0.3891000 21.74000 0.5336000 -0.6142000     0.6604000 
1 1 1 17 5  18 o 45.92000 0.3828000 45.46000 0.4973000 46.38000 0.5820000 -0.9206000     0.7655000 
1 1 1 17 5  20 f 28.16000 0.3006000 27.80000 0.4529000 28.52000 0.3954000 -0.7205000     0.6012000 
1 1 1 17 5  22 o 45.71000 0.3559000 45.08000 0.4953000 46.34000 0.5113000 -1.265000      0.7119000 
1 1 1 17 5  24 o 19.23000 0.3269000 18.93000 0.4217000 19.52000 0.4996000 -0.5869000     0.6538000 
1 1 1 17 5  26 o 31.15000 0.3719000 30.75000 0.4143000 31.56000 0.6177000 -0.8102000     0.7438000 
1 1 1 17 5  28 o 42.42000 0.3564000 42.23000 0.4311000 42.60000 0.5676000 -0.3653000     0.7128000 
1 1 1 17 5  30 o 52.04000 0.4878000 52.74000 0.7986000 51.34000 0.5604000 1.399000       0.9756000 
1 1 1 17 5  32 f 19.79000 0.3287000 20.33000 0.4611000 19.24000 0.4686000 1.089000       0.6575000 
1 1 1 17 5  34 o 12.18000 0.4673000 11.50000 0.7020000 12.86000 0.6169000 -1.355000      0.9345000 
1 1 1 17 5  36 o 17.54000 0.3668000 17.69000 0.5346000 17.40000 0.5024000 0.2821000      0.7336000 
1 1 1 17 5  38 o 45.03000 0.3995000 44.84000 0.5229000 45.21000 0.6040000 -0.3742000     0.7989000 
1 1 1 17 5  40 o 21.03000 0.3616000 21.36000 0.4956000 20.70000 0.5267000 0.6653000      0.7232000 
1 1 1 17 5  42 o 20.54000 0.3674000 20.29000 0.5284000 20.80000 0.5106000 -0.5107000     0.7348000 
1 1 1 17 5  44 o 17.52000 0.4976000 17.64000 0.7677000 17.39000 0.6334000 0.2463000      0.9952000 
1 1 1 17 5  46 o 32.85000 0.3718000 32.34000 0.5257000 33.36000 0.5261000 -1.020000      0.7437000 
1 1 1 17 5  48 o 6.535000 0.8145000 7.621000 0.9609000 5.449000 1.315000  2.171000       1.629000  
1 1 1 17 5  50 o 10.27000 0.5063000 10.62000 0.6629000 9.916000 0.7656000 0.7064000      1.013000  
1 1 1 17 5  52 o 6.704000 0.8086000 8.424000 0.8542000 4.983000 1.373000  3.442000       1.617000  
1 1 1 17 5  54 o 19.59000 0.3609000 19.93000 0.5002000 19.26000 0.5204000 0.6709000      0.7218000 
1 1 1 17 5  56 o 12.05000 0.5285000 12.21000 0.8108000 11.89000 0.6783000 0.3198000      1.057000  
1 1 1 17 5  58 o 9.290000 0.5693000 9.241000 0.8246000 9.340000 0.7852000 -0.9890000E-01 1.139000  
1 1 1 17 5  60 o 3.333000 0.9375000 2.807000 1.241000  3.860000 1.406000  -1.053000      1.875000  
1 1 1 17 5  62 o 5.234000 1.004000  4.786000 1.397000  5.682000 1.442000  -0.8963000     2.008000  
1 1 1 17 6  1  o 56.08000 0.4666000 55.94000 0.6577000 56.23000 0.6621000 -0.2940000     0.9333000 
1 1 1 17 6  3  o 86.02000 0.5965000 85.32000 0.8366000 86.71000 0.8505000 -1.383000      1.193000  
1 1 1 17 6  5  o 37.76000 0.2967000 37.24000 0.4149000 38.28000 0.4242000 -1.040000      0.5933000 
1 1 1 17 6  7  o 96.56000 0.6662000 96.43000 0.9409000 96.70000 0.9433000 -0.2730000     1.332000  
1 1 1 17 6  9  o 43.47000 0.3583000 43.51000 0.5411000 43.43000 0.4698000 0.7534000E-01  0.7166000 
1 1 1 17 6  11 o 59.41000 0.4627000 59.04000 0.6972000 59.78000 0.6084000 -0.7357000     0.9253000 
1 1 1 17 6  13 o 54.23000 0.4310000 53.96000 0.5612000 54.50000 0.6542000 -0.5388000     0.8619000 
1 1 1 17 6  15 o 37.07000 0.3799000 36.58000 0.4294000 37.56000 0.6268000 -0.9836000     0.7598000 
1 1 1 17 6  17 o 46.00000 0.4056000 46.13000 0.5718000 45.88000 0.5754000 0.2587000      0.8112000 
1 1 1 17 6  19 o 17.53000 0.2951000 17.78000 0.4192000 17.28000 0.4153000 0.5016000      0.5901000 
1 1 1 17 6  21 f 65.96000 0.4732000 65.47000 0.6653000 66.44000 0.6731000 -0.9688000     0.9465000 
1 1 1 17 6  23 o 82.44000 0.6247000 82.61000 0.8174000 82.26000 0.9450000 0.3547000      1.249000  
1 1 1 17 6  25 o 75.61000 0.5526000 76.06000 0.6809000 75.16000 0.8705000 0.8966000      1.105000  
1 1 1 17 6  27 o 17.79000 0.3333000 17.54000 0.3931000 18.04000 0.5384000 -0.5021000     0.6666000 
1 1 1 17 6  29 o 26.63000 0.3422000 26.99000 0.4812000 26.27000 0.4865000 0.7264000      0.6843000 
1 1 1 17 6  31 o 14.66000 0.3994000 14.00000 0.5309000 15.32000 0.5969000 -1.316000      0.7988000 
1 1 1 17 6  33 o 34.25000 0.3480000 34.62000 0.4541000 33.88000 0.5276000 0.7409000      0.6961000 
1 1 1 17 6  35 o 42.44000 0.3547000 42.71000 0.5021000 42.17000 0.5011000 0.5337000      0.7094000 
1 1 1 17 6  37 o 27.29000 0.3563000 27.66000 0.4687000 26.93000 0.5368000 0.7229000      0.7126000 
1 1 1 17 6  39 o 21.42000 0.3554000 21.67000 0.5015000 21.16000 0.5037000 0.5121000      0.7108000 
1 1 1 17 6  41 o 25.15000 0.3368000 24.42000 0.4764000 25.87000 0.4763000 -1.443000      0.6736000 
1 1 1 17 6  43 o 8.113000 0.7608000 7.594000 1.187000  8.632000 0.9527000 -1.038000      1.522000  
1 1 1 17 6  45 o 4.014000 1.065000  4.506000 1.625000  3.523000 1.378000  0.9832000      2.130000  
1 1 1 17 6  47 o 6.963000 0.7675000 5.708000 1.286000  8.219000 0.8376000 -2.511000      1.535000  
1 1 1 17 6  49 o 5.369000 0.9198000 5.145000 1.300000  5.593000 1.302000  -0.4482000     1.840000  
1 1 1 17 6  51 o 5.978000 0.8314000 5.967000 1.173000  5.990000 1.178000  -0.2263000E-01 1.663000  
1 1 1 17 6  53 o 4.582000 0.9695000 5.177000 1.291000  3.987000 1.447000  1.190000       1.939000  
1 1 1 17 6  55 o 8.878000 0.6913000 8.249000 1.074000  9.506000 0.8712000 -1.258000      1.383000  
1 1 1 17 6  57 o 6.846000 0.9255000 6.339000 1.395000  7.352000 1.217000  -1.013000      1.851000  
1 1 1 17 6  59 o 8.860000 0.7575000 8.816000 1.207000  8.905000 0.9150000 -0.8875000E-01 1.515000  
1 1 1 17 6  61 o 5.841000 1.053000  5.950000 1.389000  5.733000 1.583000  0.2165000      2.106000  
1 1 1 17 6  63 o 3.511000 1.006000  3.709000 1.441000  3.314000 1.405000  0.3957000      2.013000  
1 1 1 17 7  0  o 47.34000 0.4946000 47.34000 0.4946000 47.34000 0.4946000 0.000000       0.000000  
1 1 1 17 7  2  o 21.10000 0.2572000 21.12000 0.3877000 21.08000 0.3380000 0.3153000E-01  0.5143000 
1 1 1 17 7  4  f 24.77000 0.2439000 24.53000 0.3419000 25.00000 0.3480000 -0.4735000     0.4879000 
1 1 1 17 7  6  o 28.45000 0.3442000 28.30000 0.5404000 28.59000 0.4264000 -0.2879000     0.6883000 
1 1 1 17 7  8  o 29.71000 0.2830000 29.66000 0.4239000 29.76000 0.3752000 -0.9637000E-01 0.5661000 
1 1 1 17 7  10 o 66.76000 0.4735000 66.46000 0.6677000 67.07000 0.6716000 -0.6059000     0.9470000 
1 1 1 17 7  12 o 38.36000 0.3078000 38.05000 0.4331000 38.66000 0.4373000 -0.6119000     0.6155000 
1 1 1 17 7  14 o 96.46000 0.8645000 94.97000 1.073000  97.95000 1.355000  -2.981000      1.729000  
1 1 1 17 7  16 o 42.96000 0.4727000 42.96000 0.4727000 ?        ?         ?              ?         
1 1 1 17 7  18 o 49.44000 0.3996000 49.20000 0.5226000 49.68000 0.6046000 -0.4814000     0.7991000 
1 1 1 17 7  20 o 55.96000 0.4444000 56.14000 0.6730000 55.78000 0.5805000 0.3624000      0.8888000 
1 1 1 17 7  22 o 12.87000 0.3938000 12.44000 0.4783000 13.30000 0.6257000 -0.8567000     0.7876000 
1 1 1 17 7  24 o 12.01000 0.4159000 12.20000 0.4669000 11.83000 0.6885000 0.3725000      0.8319000 
1 1 1 17 7  26 f 31.70000 0.3091000 31.49000 0.3722000 31.92000 0.4938000 -0.4289000     0.6183000 
1 1 1 17 7  28 o 4.353000 0.9029000 4.689000 1.119000  4.017000 1.417000  0.6722000      1.806000  
1 1 1 17 7  30 o 46.81000 0.3678000 45.95000 0.5087000 47.66000 0.5315000 -1.715000      0.7357000 
1 1 1 17 7  32 o 25.20000 0.3116000 24.98000 0.4360000 25.42000 0.4454000 -0.4403000     0.6233000 
1 1 1 17 7  34 o 24.94000 0.3309000 24.54000 0.4897000 25.33000 0.4454000 -0.7889000     0.6619000 
1 1 1 17 7  36 o 20.81000 0.3694000 20.83000 0.4702000 20.79000 0.5698000 0.3546000E-01  0.7388000 
1 1 1 17 7  38 o 31.73000 0.3327000 31.69000 0.4645000 31.76000 0.4766000 -0.6919000E-01 0.6655000 
1 1 1 17 7  40 o 16.85000 0.4402000 16.86000 0.5579000 16.83000 0.6811000 0.2880000E-01  0.8804000 
1 1 1 17 7  42 o 7.056000 0.8497000 7.494000 1.086000  6.618000 1.307000  0.8766000      1.699000  
1 1 1 17 7  44 o 17.46000 0.4094000 17.00000 0.5355000 17.91000 0.6194000 -0.9108000     0.8188000 
1 1 1 17 7  46 o 3.450000 0.9600000 2.462000 1.165000  4.438000 1.526000  -1.976000      1.920000  
1 1 1 17 7  48 o 3.109000 0.9382000 3.517000 1.436000  2.702000 1.208000  0.8149000      1.876000  
1 1 1 17 7  50 o 9.444000 0.5770000 8.893000 0.8034000 9.995000 0.8284000 -1.102000      1.154000  
1 1 1 17 7  52 o 8.368000 0.6627000 7.265000 1.000000  9.470000 0.8698000 -2.205000      1.325000  
1 1 1 17 7  54 o 7.374000 0.7190000 7.628000 0.9842000 7.120000 1.048000  0.5075000      1.438000  
1 1 1 17 7  56 o 5.260000 0.9459000 5.345000 1.335000  5.174000 1.340000  0.1706000      1.892000  
1 1 1 17 7  58 o 14.67000 0.4473000 14.85000 0.6453000 14.49000 0.6195000 0.3559000      0.8945000 
1 1 1 17 7  60 o 5.233000 0.9623000 4.579000 1.434000  5.887000 1.283000  -1.308000      1.925000  
1 1 1 17 7  62 o 6.853000 0.8439000 7.148000 1.150000  6.558000 1.235000  0.5905000      1.688000  
1 1 1 17 8  1  o 38.71000 0.3225000 38.28000 0.4814000 39.14000 0.4293000 -0.8608000     0.6451000 
1 1 1 17 8  3  f 27.65000 0.2738000 27.18000 0.4124000 28.12000 0.3604000 -0.9426000     0.5477000 
1 1 1 17 8  5  o 15.05000 0.2932000 15.20000 0.4489000 14.89000 0.3774000 0.3064000      0.5864000 
1 1 1 17 8  7  o 76.71000 0.6557000 75.79000 1.064000  77.63000 0.7672000 -1.848000      1.311000  
1 1 1 17 8  9  o 22.57000 0.2836000 22.79000 0.4406000 22.36000 0.3572000 0.4318000      0.5672000 
1 1 1 17 8  11 o 71.54000 0.5449000 71.06000 0.8202000 72.02000 0.7175000 -0.9584000     1.090000  
1 1 1 17 8  13 o 63.44000 0.4884000 63.65000 0.6427000 63.23000 0.7357000 0.4169000      0.9769000 
1 1 1 17 8  15 o 35.31000 0.3214000 34.79000 0.4199000 35.83000 0.4868000 -1.045000      0.6429000 
1 1 1 17 8  17 o 27.97000 0.3606000 27.68000 0.4369000 28.26000 0.5739000 -0.5823000     0.7213000 
1 1 1 17 8  19 o 16.79000 0.2995000 17.15000 0.4115000 16.43000 0.4353000 0.7228000      0.5991000 
1 1 1 17 8  21 o 30.98000 0.3578000 30.32000 0.3964000 31.63000 0.5959000 -1.309000      0.7157000 
1 1 1 17 8  23 o 21.96000 0.2990000 22.09000 0.3422000 21.83000 0.4905000 0.2613000      0.5980000 
1 1 1 17 8  25 o 41.62000 0.3501000 41.48000 0.4220000 41.77000 0.5587000 -0.2960000     0.7001000 
1 1 1 17 8  27 o 38.89000 0.3378000 38.84000 0.4081000 38.93000 0.5385000 -0.9464000E-01 0.6757000 
1 1 1 17 8  29 o 33.77000 0.3351000 33.79000 0.4303000 33.74000 0.5138000 0.5740000E-01  0.6702000 
1 1 1 17 8  31 o 29.18000 0.3318000 28.89000 0.4227000 29.46000 0.5116000 -0.5695000     0.6637000 
1 1 1 17 8  33 o 13.65000 0.4395000 13.41000 0.5815000 13.89000 0.6591000 -0.4779000     0.8790000 
1 1 1 17 8  35 o 26.68000 0.3793000 26.34000 0.5377000 27.01000 0.5350000 -0.6722000     0.7585000 
1 1 1 17 8  37 o 26.65000 0.3295000 27.07000 0.4487000 26.23000 0.4827000 0.8384000      0.6590000 
1 1 1 17 8  39 o 15.25000 0.4649000 15.83000 0.5922000 14.67000 0.7168000 1.157000       0.9298000 
1 1 1 17 8  41 o 19.95000 0.3586000 19.17000 0.5141000 20.73000 0.5000000 -1.565000      0.7171000 
1 1 1 17 8  43 o 14.63000 0.4457000 15.14000 0.6439000 14.12000 0.6164000 1.025000       0.8914000 
1 1 1 17 8  45 o 24.76000 0.3253000 24.46000 0.4544000 25.06000 0.4657000 -0.6027000     0.6506000 
1 1 1 17 8  47 o 13.08000 0.4403000 13.33000 0.6015000 12.83000 0.6431000 0.5003000      0.8805000 
1 1 1 17 8  49 o 7.106000 0.8321000 7.486000 1.144000  6.725000 1.208000  0.7609000      1.664000  
1 1 1 17 8  51 o 14.95000 0.3749000 14.69000 0.5513000 15.21000 0.5082000 -0.5154000     0.7498000 
1 1 1 17 8  53 o 9.546000 0.5575000 9.287000 0.7785000 9.805000 0.7983000 -0.5182000     1.115000  
1 1 1 17 8  55 o 6.970000 0.8034000 8.277000 0.9995000 5.664000 1.258000  2.613000       1.607000  
1 1 1 17 8  57 o 4.950000 1.088000  5.114000 1.516000  4.786000 1.562000  0.3285000      2.176000  
1 1 1 17 8  59 o 4.440000 1.007000  3.708000 1.428000  5.172000 1.420000  -1.464000      2.013000  
1 1 1 17 8  61 o 3.386000 0.9561000 3.239000 1.365000  3.532000 1.339000  -0.2938000     1.912000  
1 1 1 17 8  63 o 5.479000 1.071000  5.631000 1.612000  5.327000 1.410000  0.3043000      2.142000  
1 1 1 17 9  0  o 26.29000 0.3549000 26.29000 0.3549000 26.29000 0.3549000 0.000000       0.000000  
1 1 1 17 9  2  o 71.02000 0.5393000 70.95000 0.8157000 71.09000 0.7058000 -0.1421000     1.079000  
1 1 1 17 9  4  o 68.95000 0.5964000 68.82000 0.9742000 69.08000 0.6883000 -0.2589000     1.193000  
1 1 1 17 9  6  o 134.1000 1.124000  134.4000 1.840000  133.9000 1.294000  0.5436000      2.249000  
1 1 1 17 9  8  o 25.20000 0.2836000 25.03000 0.4382000 25.37000 0.3602000 -0.3381000     0.5672000 
1 1 1 17 9  10 o 32.56000 0.3244000 32.47000 0.4689000 32.64000 0.4483000 -0.1659000     0.6487000 
1 1 1 17 9  12 o 34.08000 0.3340000 34.03000 0.4788000 34.14000 0.4659000 -0.1159000     0.6680000 
1 1 1 17 9  14 o 38.94000 0.3350000 38.94000 0.4425000 38.95000 0.5030000 -0.1181000E-01 0.6699000 
1 1 1 17 9  16 o 24.52000 0.2841000 24.74000 0.3759000 24.30000 0.4261000 0.4472000      0.5682000 
1 1 1 17 9  18 o 60.04000 0.4679000 60.07000 0.7057000 60.01000 0.6145000 0.6126000E-01  0.9357000 
1 1 1 17 9  20 f 44.33000 0.4896000 43.27000 0.6586000 45.39000 0.7245000 -2.122000      0.9791000 
1 1 1 17 9  22 o 56.84000 0.4313000 57.58000 0.5329000 56.09000 0.6784000 1.488000       0.8627000 
1 1 1 17 9  24 o 12.59000 0.3833000 12.40000 0.4393000 12.78000 0.6283000 -0.3804000     0.7666000 
1 1 1 17 9  26 o 51.60000 0.4020000 51.84000 0.4925000 51.35000 0.6355000 0.4914000      0.8040000 
1 1 1 17 9  28 o 14.41000 0.3761000 13.92000 0.4704000 14.90000 0.5871000 -0.9792000     0.7523000 
1 1 1 17 9  30 o 47.77000 0.3857000 48.08000 0.4716000 47.46000 0.6104000 0.6167000      0.7714000 
1 1 1 17 9  32 o 11.16000 0.5317000 10.86000 0.7731000 11.46000 0.7303000 -0.6097000     1.063000  
1 1 1 17 9  34 o 29.79000 0.3631000 29.55000 0.4950000 30.02000 0.5313000 -0.4656000     0.7261000 
1 1 1 17 9  36 o 41.96000 0.3889000 42.01000 0.5850000 41.92000 0.5124000 0.8813000E-01  0.7777000 
1 1 1 17 9  38 o 10.13000 0.6415000 9.827000 0.8102000 10.42000 0.9948000 -0.5976000     1.283000  
1 1 1 17 9  40 o 22.15000 0.3555000 22.35000 0.4943000 21.94000 0.5109000 0.4032000      0.7109000 
1 1 1 17 9  42 o 19.82000 0.3600000 19.85000 0.4946000 19.80000 0.5233000 0.5521000E-01  0.7201000 
1 1 1 17 9  44 o 12.84000 0.4947000 12.27000 0.6498000 13.41000 0.7460000 -1.142000      0.9893000 
1 1 1 17 9  46 o 17.66000 0.4555000 17.13000 0.7163000 18.18000 0.5629000 -1.046000      0.9110000 
1 1 1 17 9  48 o 13.13000 0.4601000 13.40000 0.5847000 12.85000 0.7107000 0.5528000      0.9203000 
1 1 1 17 9  50 o 16.94000 0.3691000 16.61000 0.5326000 17.27000 0.5110000 -0.6619000     0.7381000 
1 1 1 17 9  52 o 11.46000 0.4619000 11.17000 0.6617000 11.75000 0.6446000 -0.5852000     0.9238000 
1 1 1 17 9  54 o 4.462000 1.036000  4.256000 1.389000  4.668000 1.537000  -0.4123000     2.072000  
1 1 1 17 9  56 o 4.760000 1.112000  4.103000 1.856000  5.417000 1.227000  -1.314000      2.225000  
1 1 1 17 9  58 o 4.690000 1.094000  5.027000 1.612000  4.353000 1.478000  0.6740000      2.187000  
1 1 1 17 9  60 o 3.967000 1.059000  3.652000 1.533000  4.281000 1.461000  -0.6287000     2.118000  
1 1 1 17 9  62 o 4.133000 1.046000  4.409000 1.467000  3.857000 1.491000  0.5521000      2.092000  
1 1 1 17 10 1  o 125.7000 0.9925000 125.6000 1.402000  125.9000 1.405000  -0.2786000     1.985000  
1 1 1 17 10 3  o 61.29000 0.7207000 61.27000 1.254000  61.31000 0.7101000 -0.4313000E-01 1.441000  
1 1 1 17 10 5  o 94.14000 0.7492000 94.33000 1.062000  93.95000 1.057000  0.3739000      1.498000  
1 1 1 17 10 7  o 88.69000 0.6632000 88.14000 0.8642000 89.25000 1.006000  -1.112000      1.326000  
1 1 1 17 10 9  o 50.42000 0.4008000 50.08000 0.5229000 50.75000 0.6074000 -0.6699000     0.8015000 
1 1 1 17 10 11 o 49.92000 0.3698000 49.91000 0.5222000 49.92000 0.5237000 -0.1172000E-01 0.7395000 
1 1 1 17 10 13 o 84.92000 0.6832000 83.82000 0.9574000 86.01000 0.9748000 -2.187000      1.366000  
1 1 1 17 10 15 o 23.73000 0.2921000 23.57000 0.4531000 23.88000 0.3688000 -0.3111000     0.5843000 
1 1 1 17 10 17 o 30.42000 0.3175000 30.47000 0.4462000 30.37000 0.4519000 0.9784000E-01  0.6351000 
1 1 1 17 10 19 o 38.65000 0.3300000 38.23000 0.3936000 39.07000 0.5297000 -0.8411000     0.6599000 
1 1 1 17 10 21 o 20.06000 0.3171000 20.18000 0.3851000 19.93000 0.5039000 0.2502000      0.6342000 
1 1 1 17 10 23 o 7.790000 0.6271000 7.249000 0.6869000 8.332000 1.049000  -1.083000      1.254000  
1 1 1 17 10 25 o 42.67000 0.4177000 42.55000 0.4721000 42.79000 0.6893000 -0.2374000     0.8355000 
1 1 1 17 10 27 o 30.27000 0.3070000 30.56000 0.3691000 29.98000 0.4906000 0.5760000      0.6139000 
1 1 1 17 10 29 o 20.04000 0.3174000 19.51000 0.3797000 20.57000 0.5088000 -1.064000      0.6348000 
1 1 1 17 10 31 o 21.81000 0.3816000 22.07000 0.4213000 21.55000 0.6364000 0.5198000      0.7632000 
1 1 1 17 10 33 o 17.16000 0.4234000 17.01000 0.5870000 17.31000 0.6103000 -0.2946000     0.8468000 
1 1 1 17 10 35 o 20.36000 0.3400000 20.34000 0.4603000 20.38000 0.5004000 -0.4435000E-01 0.6799000 
1 1 1 17 10 37 o 27.04000 0.3818000 26.50000 0.5376000 27.59000 0.5422000 -1.096000      0.7635000 
1 1 1 17 10 39 o 19.32000 0.4457000 19.68000 0.6100000 18.95000 0.6500000 0.7310000      0.8914000 
1 1 1 17 10 41 o 2.917000 0.8994000 2.302000 1.103000  3.532000 1.421000  -1.230000      1.799000  
1 1 1 17 10 43 o 8.385000 0.8064000 9.029000 0.9862000 7.741000 1.276000  1.288000       1.613000  
1 1 1 17 10 45 o 8.520000 0.6443000 8.505000 0.9121000 8.534000 0.9102000 -0.2869000E-01 1.289000  
1 1 1 17 10 47 o 15.78000 0.4200000 15.37000 0.6330000 16.19000 0.5522000 -0.8240000     0.8400000 
1 1 1 17 10 49 o 13.98000 0.4115000 13.15000 0.6230000 14.80000 0.5377000 -1.646000      0.8229000 
1 1 1 17 10 51 o 13.48000 0.4780000 13.30000 0.6371000 13.66000 0.7128000 -0.3669000     0.9561000 
1 1 1 17 10 53 o 3.534000 0.9611000 3.696000 1.412000  3.371000 1.304000  0.3247000      1.922000  
1 1 1 17 10 55 o 4.254000 1.244000  4.952000 2.076000  3.556000 1.372000  1.397000       2.488000  
1 1 1 17 10 57 o 5.752000 0.9988000 5.401000 1.438000  6.102000 1.386000  -0.7013000     1.998000  
1 1 1 17 10 59 o 8.054000 0.7411000 7.836000 0.9502000 8.272000 1.138000  -0.4360000     1.482000  
1 1 1 17 10 61 o 14.02000 0.5723000 14.09000 0.8266000 13.96000 0.7918000 0.1245000      1.145000  
1 1 1 17 11 0  o 239.7000 2.657000  239.7000 2.657000  239.7000 2.657000  0.000000       0.000000  
1 1 1 17 11 2  o 106.1000 0.9411000 105.6000 1.453000  106.6000 1.196000  -1.048000      1.882000  
1 1 1 17 11 4  o 85.09000 0.6827000 85.09000 0.9664000 85.08000 0.9646000 0.1334000E-01  1.365000  
1 1 1 17 11 6  o 96.34000 0.7166000 97.22000 0.9495000 95.47000 1.074000  1.747000       1.433000  
1 1 1 17 11 8  o 71.19000 0.5010000 70.83000 0.7056000 71.56000 0.7114000 -0.7331000     1.002000  
1 1 1 17 11 10 o 63.87000 0.4890000 63.98000 0.6443000 63.76000 0.7357000 0.2129000      0.9779000 
1 1 1 17 11 12 o 55.48000 0.4341000 55.01000 0.5661000 55.94000 0.6583000 -0.9262000     0.8683000 
1 1 1 17 11 14 o 45.34000 0.3449000 45.41000 0.4892000 45.26000 0.4864000 0.1516000      0.6898000 
1 1 1 17 11 16 o 22.40000 0.3532000 22.97000 0.5672000 21.82000 0.4210000 1.159000       0.7064000 
1 1 1 17 11 18 o 64.39000 0.4789000 64.05000 0.5801000 64.73000 0.7620000 -0.6789000     0.9577000 
1 1 1 17 11 20 o 55.23000 0.4413000 54.84000 0.5660000 55.63000 0.6773000 -0.7866000     0.8826000 
1 1 1 17 11 22 o 12.05000 0.4019000 11.88000 0.5156000 12.21000 0.6167000 -0.3390000     0.8038000 
1 1 1 17 11 24 o 42.55000 0.3507000 42.36000 0.4224000 42.74000 0.5600000 -0.3782000     0.7014000 
1 1 1 17 11 26 o 30.13000 0.3659000 30.19000 0.3993000 30.07000 0.6134000 0.1140000      0.7319000 
1 1 1 17 11 28 o 40.79000 0.3644000 40.28000 0.4639000 41.30000 0.5621000 -1.023000      0.7288000 
1 1 1 17 11 30 o 24.42000 0.3114000 24.42000 0.3692000 24.42000 0.5016000 -0.4692000E-03 0.6229000 
1 1 1 17 11 32 o 13.73000 0.4995000 13.28000 0.5497000 14.18000 0.8341000 -0.8944000     0.9990000 
1 1 1 17 11 34 o 43.28000 0.4342000 42.92000 0.6951000 43.64000 0.5204000 -0.7149000     0.8683000 
1 1 1 17 11 36 o 52.00000 0.4384000 51.41000 0.5625000 52.59000 0.6726000 -1.174000      0.8768000 
1 1 1 17 11 38 o 57.22000 0.4726000 56.98000 0.7096000 57.47000 0.6243000 -0.4825000     0.9451000 
1 1 1 17 11 40 o 10.22000 0.5700000 10.34000 0.7654000 10.10000 0.8447000 0.2367000      1.140000  
1 1 1 17 11 42 o 17.09000 0.3792000 16.84000 0.5324000 17.35000 0.5400000 -0.5163000     0.7583000 
1 1 1 17 11 44 o 5.824000 0.8878000 7.015000 1.091000  4.632000 1.401000  2.383000       1.776000  
1 1 1 17 11 46 o 6.338000 0.9192000 6.007000 1.297000  6.669000 1.303000  -0.6624000     1.838000  
1 1 1 17 11 48 o 21.01000 0.3404000 20.72000 0.4693000 21.29000 0.4930000 -0.5728000     0.6807000 
1 1 1 17 11 50 o 16.72000 0.4523000 17.27000 0.6336000 16.17000 0.6456000 1.095000       0.9046000 
1 1 1 17 11 52 o 9.685000 0.5446000 9.739000 0.7918000 9.631000 0.7480000 0.1080000      1.089000  
1 1 1 17 11 54 o 8.022000 0.7169000 8.076000 0.9226000 7.968000 1.098000  0.1074000      1.434000  
1 1 1 17 11 56 o 3.846000 1.023000  4.348000 1.576000  3.344000 1.304000  1.004000       2.046000  
1 1 1 17 11 58 o 6.635000 0.8719000 6.536000 1.303000  6.734000 1.159000  -0.1979000     1.744000  
1 1 1 17 11 60 o 4.374000 0.9854000 3.391000 1.394000  5.357000 1.394000  -1.966000      1.971000  
1 1 1 17 11 62 o 4.216000 1.016000  4.588000 1.461000  3.845000 1.412000  0.7436000      2.031000  
1 1 1 17 12 1  o 63.06000 0.4867000 63.66000 0.7426000 62.46000 0.6292000 1.197000       0.9733000 
1 1 1 17 12 3  o 33.04000 0.2751000 33.12000 0.3890000 32.97000 0.3892000 0.1478000      0.5503000 
1 1 1 17 12 5  o 46.05000 0.3960000 46.05000 0.5642000 46.04000 0.5556000 0.7889000E-02  0.7919000 
1 1 1 17 12 7  o 60.89000 0.4723000 59.93000 0.6071000 61.86000 0.7236000 -1.932000      0.9446000 
1 1 1 17 12 9  o 74.58000 0.5638000 74.45000 0.7388000 74.71000 0.8518000 -0.2639000     1.128000  
1 1 1 17 12 11 o 23.60000 0.2670000 22.88000 0.3517000 24.33000 0.4019000 -1.450000      0.5341000 
1 1 1 17 12 13 o 55.05000 0.4327000 55.51000 0.6562000 54.59000 0.5642000 0.9214000      0.8655000 
1 1 1 17 12 15 o 40.10000 0.3392000 40.04000 0.5096000 40.16000 0.4480000 -0.1254000     0.6785000 
1 1 1 17 12 17 o 57.48000 0.5206000 57.09000 0.5900000 57.87000 0.8578000 -0.7776000     1.041000  
1 1 1 17 12 19 o 32.02000 0.2992000 32.14000 0.3564000 31.90000 0.4806000 0.2457000      0.5983000 
1 1 1 17 12 21 o 29.82000 0.2923000 29.56000 0.3459000 30.08000 0.4713000 -0.5214000     0.5846000 
1 1 1 17 12 23 o 21.66000 0.3015000 21.56000 0.3883000 21.76000 0.4613000 -0.1957000     0.6030000 
1 1 1 17 12 25 o 44.65000 0.3646000 45.17000 0.4451000 44.13000 0.5775000 1.042000       0.7291000 
1 1 1 17 12 27 o 33.65000 0.3268000 33.89000 0.4205000 33.41000 0.5004000 0.4817000      0.6536000 
1 1 1 17 12 29 o 7.550000 1.001000  7.058000 0.9334000 8.043000 1.771000  -0.9853000     2.002000  
1 1 1 17 12 31 f 15.98000 0.4298000 15.98000 0.4298000 ?        ?         ?              ?         
1 1 1 17 12 33 o 22.99000 0.3264000 23.23000 0.4468000 22.75000 0.4759000 0.4715000      0.6528000 
1 1 1 17 12 35 o 50.53000 0.4603000 50.62000 0.6435000 50.44000 0.6582000 0.1724000      0.9205000 
1 1 1 17 12 37 o 23.90000 0.3400000 24.23000 0.4563000 23.57000 0.5042000 0.6568000      0.6801000 
1 1 1 17 12 39 o 35.97000 0.3438000 35.50000 0.4709000 36.44000 0.5010000 -0.9367000     0.6875000 
1 1 1 17 12 41 f 25.35000 0.3276000 25.35000 0.4512000 25.35000 0.4752000 0.2220000E-02  0.6553000 
1 1 1 17 12 43 o 3.977000 1.063000  4.186000 1.481000  3.767000 1.525000  0.4195000      2.126000  
1 1 1 17 12 45 o 7.843000 0.7098000 7.466000 0.9662000 8.220000 1.040000  -0.7544000     1.420000  
1 1 1 17 12 47 o 19.63000 0.3437000 19.49000 0.4804000 19.78000 0.4915000 -0.2960000     0.6873000 
1 1 1 17 12 49 o 5.748000 0.9321000 5.185000 1.293000  6.310000 1.343000  -1.125000      1.864000  
1 1 1 17 12 51 o 9.131000 0.6861000 9.015000 1.059000  9.246000 0.8732000 -0.2302000     1.372000  
1 1 1 17 12 53 o 6.473000 0.8366000 4.205000 1.463000  8.740000 0.8111000 -4.535000      1.673000  
1 1 1 17 12 55 o 5.559000 0.9565000 6.761000 1.221000  4.357000 1.473000  2.404000       1.913000  
1 1 1 17 12 57 o 5.936000 0.9324000 6.577000 1.305000  5.295000 1.332000  1.282000       1.865000  
1 1 1 17 12 59 o 4.665000 1.086000  5.148000 1.529000  4.181000 1.543000  0.9666000      2.172000  
1 1 1 17 12 61 o 9.007000 0.6360000 9.944000 0.8865000 8.070000 0.9123000 1.874000       1.272000  
1 1 1 17 13 0  o 104.4000 1.176000  104.4000 1.176000  104.4000 1.176000  0.000000       0.000000  
1 1 1 17 13 2  o 111.8000 0.7675000 111.7000 1.084000  111.9000 1.087000  -0.2142000     1.535000  
1 1 1 17 13 4  o 61.18000 0.4732000 61.10000 0.7154000 61.27000 0.6196000 -0.1614000     0.9464000 
1 1 1 17 13 6  o 101.1000 0.7513000 101.8000 0.9918000 100.4000 1.129000  1.388000       1.503000  
1 1 1 17 13 8  o 72.69000 0.5494000 73.09000 0.7254000 72.28000 0.8254000 0.8122000      1.099000  
1 1 1 17 13 10 o 16.06000 0.2748000 15.72000 0.3944000 16.40000 0.3828000 -0.6745000     0.5497000 
1 1 1 17 13 12 o 31.33000 0.2908000 30.91000 0.4306000 31.74000 0.3909000 -0.8379000     0.5815000 
1 1 1 17 13 14 o 39.14000 0.3107000 39.18000 0.4404000 39.09000 0.4384000 0.9092000E-01  0.6214000 
1 1 1 17 13 16 o 24.98000 0.3320000 25.05000 0.3213000 24.91000 0.5811000 0.1401000      0.6640000 
1 1 1 17 13 18 o 45.03000 0.3769000 44.72000 0.4880000 45.34000 0.5746000 -0.6234000     0.7538000 
1 1 1 17 13 20 o 55.18000 0.4394000 55.11000 0.5695000 55.24000 0.6692000 -0.1280000     0.8787000 
1 1 1 17 13 22 o 32.63000 0.3018000 32.35000 0.3571000 32.90000 0.4867000 -0.5464000     0.6036000 
1 1 1 17 13 24 o 61.12000 0.4817000 60.98000 0.6279000 61.25000 0.7307000 -0.2634000     0.9634000 
1 1 1 17 13 26 o 34.22000 0.3149000 34.42000 0.3795000 34.02000 0.5026000 0.3964000      0.6298000 
1 1 1 17 13 28 o 12.63000 0.3813000 12.42000 0.4506000 12.85000 0.6152000 -0.4371000     0.7626000 
1 1 1 17 13 30 o 8.002000 0.6672000 7.150000 0.8348000 8.855000 1.041000  -1.705000      1.334000  
1 1 1 17 13 32 o 35.45000 0.4043000 35.99000 0.4497000 34.92000 0.6721000 1.075000       0.8087000 
1 1 1 17 13 34 o 31.32000 0.3630000 31.84000 0.4991000 30.80000 0.5273000 1.036000       0.7260000 
1 1 1 17 13 36 o 7.848000 0.7159000 7.371000 1.040000  8.325000 0.9842000 -0.9535000     1.432000  
1 1 1 17 13 38 o 23.80000 0.3797000 23.20000 0.5792000 24.40000 0.4910000 -1.207000      0.7593000 
1 1 1 17 13 40 o 9.417000 0.6044000 9.837000 0.8187000 8.998000 0.8894000 0.8393000      1.209000  
1 1 1 17 13 42 o 28.16000 0.3428000 28.15000 0.5083000 28.16000 0.4601000 -0.8402000E-02 0.6856000 
1 1 1 17 13 44 o 19.14000 0.3455000 18.96000 0.4817000 19.33000 0.4953000 -0.3732000     0.6909000 
1 1 1 17 13 46 o 20.89000 0.3804000 20.57000 0.4763000 21.21000 0.5932000 -0.6445000     0.7607000 
1 1 1 17 13 48 o 15.72000 0.5223000 16.53000 0.5947000 14.90000 0.8587000 1.633000       1.045000  
1 1 1 17 13 50 o 10.67000 0.5791000 10.16000 0.9418000 11.17000 0.6741000 -1.010000      1.158000  
1 1 1 17 13 52 f 8.011000 0.6937000 7.439000 1.040000  8.583000 0.9186000 -1.144000      1.387000  
1 1 1 17 13 54 o 3.419000 0.9970000 3.084000 1.363000  3.755000 1.456000  -0.6708000     1.994000  
1 1 1 17 13 56 o 5.785000 0.9567000 5.728000 1.314000  5.843000 1.391000  -0.1153000     1.913000  
1 1 1 17 13 58 o 4.082000 1.074000  3.754000 1.525000  4.409000 1.513000  -0.6547000     2.148000  
1 1 1 17 13 60 o 8.345000 0.8021000 10.06000 1.037000  6.630000 1.224000  3.430000       1.604000  
1 1 1 17 13 62 f 5.143000 1.104000  5.709000 1.675000  4.578000 1.439000  1.132000       2.208000  
1 1 1 17 14 1  o 47.97000 0.3860000 47.82000 0.5006000 48.11000 0.5877000 -0.2904000     0.7720000 
1 1 1 17 14 3  o 98.10000 0.7305000 97.48000 0.9521000 98.71000 1.108000  -1.235000      1.461000  
1 1 1 17 14 5  o 23.62000 0.3831000 22.56000 0.5991000 24.68000 0.4778000 -2.122000      0.7663000 
1 1 1 17 14 7  o 45.81000 0.3919000 45.47000 0.5517000 46.15000 0.5567000 -0.6802000     0.7837000 
1 1 1 17 14 9  o 18.16000 0.3478000 18.14000 0.4166000 18.19000 0.5570000 -0.5158000E-01 0.6956000 
1 1 1 17 14 11 o 54.94000 0.4298000 54.74000 0.6444000 55.13000 0.5688000 -0.3918000     0.8595000 
1 1 1 17 14 13 o 61.11000 0.4389000 61.56000 0.6249000 60.66000 0.6165000 0.9052000      0.8778000 
1 1 1 17 14 15 o 48.98000 0.3817000 48.92000 0.4595000 49.05000 0.6097000 -0.1329000     0.7635000 
1 1 1 17 14 17 o 58.28000 0.5059000 58.74000 0.5352000 57.82000 0.8586000 0.9208000      1.012000  
1 1 1 17 14 19 o 35.99000 0.3125000 35.71000 0.3716000 36.26000 0.5026000 -0.5454000     0.6250000 
1 1 1 17 14 21 o 34.65000 0.3268000 34.20000 0.4208000 35.09000 0.5001000 -0.8987000     0.6536000 
1 1 1 17 14 23 o 51.70000 0.4013000 51.20000 0.4813000 52.20000 0.6423000 -0.9987000     0.8027000 
1 1 1 17 14 25 o 27.55000 0.3111000 27.21000 0.3993000 27.88000 0.4773000 -0.6698000     0.6222000 
1 1 1 17 14 27 f 44.79000 0.3810000 44.65000 0.4905000 44.92000 0.5830000 -0.2626000     0.7619000 
1 1 1 17 14 29 o 11.85000 0.4753000 11.87000 0.4857000 11.82000 0.8172000 0.5030000E-01  0.9506000 
1 1 1 17 14 31 o 38.24000 0.5353000 38.32000 0.4175000 38.16000 0.9858000 0.1592000      1.071000  
1 1 1 17 14 33 o 13.60000 0.5212000 12.68000 0.5680000 14.51000 0.8740000 -1.829000      1.042000  
1 1 1 17 14 35 o 36.83000 0.3905000 36.79000 0.5283000 36.87000 0.5753000 -0.7190000E-01 0.7811000 
1 1 1 17 14 37 o 33.42000 0.3332000 33.34000 0.4581000 33.51000 0.4840000 -0.1671000     0.6664000 
1 1 1 17 14 39 o 30.93000 0.3671000 30.65000 0.5545000 31.20000 0.4811000 -0.5548000     0.7341000 
1 1 1 17 14 41 o 14.09000 0.4320000 13.61000 0.6036000 14.56000 0.6181000 -0.9560000     0.8639000 
1 1 1 17 14 43 o 18.94000 0.3942000 19.74000 0.4894000 18.14000 0.6182000 1.600000       0.7885000 
1 1 1 17 14 45 o 15.31000 0.4932000 14.38000 0.6313000 16.24000 0.7580000 -1.856000      0.9865000 
1 1 1 17 14 47 f 2.827000 0.8747000 3.064000 1.292000  2.590000 1.179000  0.4737000      1.749000  
1 1 1 17 14 49 f 5.947000 1.089000  6.265000 1.770000  5.630000 1.269000  0.6351000      2.178000  
1 1 1 17 14 51 o 3.851000 1.004000  3.900000 1.410000  3.803000 1.428000  0.9733000E-01  2.007000  
1 1 1 17 14 53 o 6.786000 0.7417000 6.917000 1.071000  6.655000 1.027000  0.2615000      1.483000  
1 1 1 17 14 55 o 5.190000 1.077000  4.961000 1.522000  5.420000 1.523000  -0.4592000     2.153000  
1 1 1 17 14 57 o 2.668000 0.8677000 2.641000 1.224000  2.695000 1.230000  -0.5407000E-01 1.735000  
1 1 1 17 14 59 o 4.526000 1.071000  4.122000 1.463000  4.931000 1.563000  -0.8093000     2.141000  
1 1 1 17 14 61 o 5.678000 0.9364000 6.824000 1.189000  4.532000 1.447000  2.292000       1.873000  
1 1 1 17 15 0  o 44.91000 0.5413000 44.91000 0.5413000 44.91000 0.5413000 0.000000       0.000000  
1 1 1 17 15 2  o 80.48000 0.6451000 80.12000 0.9087000 80.84000 0.9159000 -0.7216000     1.290000  
1 1 1 17 15 4  o 26.91000 0.2788000 27.03000 0.3973000 26.80000 0.3911000 0.2291000      0.5575000 
1 1 1 17 15 6  o 98.22000 0.7319000 97.81000 1.100000  98.64000 0.9662000 -0.8389000     1.464000  
1 1 1 17 15 8  o 68.22000 0.5179000 67.66000 0.7750000 68.79000 0.6871000 -1.139000      1.036000  
1 1 1 17 15 10 o 59.47000 0.4632000 59.64000 0.6055000 59.31000 0.7012000 0.3325000      0.9264000 
1 1 1 17 15 12 o 60.44000 0.4338000 60.55000 0.6134000 60.33000 0.6134000 0.2253000      0.8675000 
1 1 1 17 15 14 o 31.96000 0.2938000 31.50000 0.3369000 32.42000 0.4814000 -0.9130000     0.5875000 
1 1 1 17 15 16 o 37.94000 0.3915000 37.66000 0.4349000 38.22000 0.6511000 -0.5672000     0.7830000 
1 1 1 17 15 18 o 25.59000 0.2757000 24.96000 0.3146000 26.22000 0.4529000 -1.264000      0.5514000 
1 1 1 17 15 20 o 44.22000 0.3707000 43.69000 0.4702000 44.75000 0.5732000 -1.060000      0.7414000 
1 1 1 17 15 22 o 7.933000 0.5209000 7.790000 0.6463000 8.075000 0.8170000 -0.2858000     1.042000  
1 1 1 17 15 24 f 12.44000 0.3495000 12.13000 0.3988000 12.75000 0.5741000 -0.6188000     0.6990000 
1 1 1 17 15 26 o 45.44000 0.4135000 45.55000 0.5839000 45.33000 0.5856000 0.2177000      0.8270000 
1 1 1 17 15 28 o 28.60000 0.3507000 28.22000 0.3588000 28.99000 0.6028000 -0.7728000     0.7014000 
1 1 1 17 15 30 o 4.835000 1.139000  4.377000 1.195000  5.294000 1.940000  -0.9172000     2.279000  
1 1 1 17 15 32 o 47.70000 0.4082000 48.03000 0.5246000 47.36000 0.6255000 0.6619000      0.8164000 
1 1 1 17 15 34 o 13.14000 0.4214000 12.20000 0.5826000 14.08000 0.6091000 -1.888000      0.8429000 
1 1 1 17 15 36 o 27.87000 0.3508000 27.70000 0.5205000 28.04000 0.4705000 -0.3443000     0.7017000 
1 1 1 17 15 38 o 27.57000 0.3723000 27.89000 0.5058000 27.24000 0.5465000 0.6504000      0.7446000 
1 1 1 17 15 40 o 10.75000 0.5885000 11.22000 0.8903000 10.27000 0.7699000 0.9484000      1.177000  
1 1 1 17 15 42 o 27.53000 0.3457000 27.59000 0.5085000 27.46000 0.4685000 0.1312000      0.6914000 
1 1 1 17 15 44 o 3.189000 0.9547000 2.925000 1.268000  3.453000 1.427000  -0.5282000     1.909000  
1 1 1 17 15 46 o 9.140000 0.5869000 9.608000 0.7901000 8.671000 0.8680000 0.9368000      1.174000  
1 1 1 17 15 48 o 11.97000 0.4587000 12.10000 0.6441000 11.83000 0.6533000 0.2651000      0.9174000 
1 1 1 17 15 50 o 6.150000 0.8160000 5.057000 1.338000  7.244000 0.9337000 -2.187000      1.632000  
1 1 1 17 15 52 o 15.00000 0.4684000 15.05000 0.7286000 14.94000 0.5890000 0.1166000      0.9369000 
1 1 1 17 15 54 o 9.473000 0.6523000 8.905000 1.028000  10.04000 0.8036000 -1.135000      1.305000  
1 1 1 17 15 56 o 3.976000 1.078000  4.146000 1.496000  3.806000 1.553000  0.3401000      2.156000  
1 1 1 17 15 58 o 3.742000 0.9829000 2.794000 1.266000  4.690000 1.504000  -1.896000      1.966000  
1 1 1 17 15 60 o 7.466000 0.7391000 7.820000 1.110000  7.112000 0.9758000 0.7078000      1.478000  
1 1 1 17 16 1  o 59.48000 0.4917000 59.19000 0.6850000 59.77000 0.7055000 -0.5758000     0.9833000 
1 1 1 17 16 3  o 52.06000 0.3802000 51.96000 0.5364000 52.16000 0.5390000 -0.2013000     0.7604000 
1 1 1 17 16 5  o 30.38000 0.2867000 30.23000 0.4354000 30.53000 0.3730000 -0.2985000     0.5734000 
1 1 1 17 16 7  o 13.58000 0.2804000 13.81000 0.3831000 13.34000 0.4097000 0.4713000      0.5609000 
1 1 1 17 16 9  o 41.94000 0.3226000 41.59000 0.4529000 42.28000 0.4595000 -0.6928000     0.6452000 
1 1 1 17 16 11 o 53.55000 0.3906000 53.54000 0.5521000 53.57000 0.5528000 -0.3724000E-01 0.7812000 
1 1 1 17 16 13 o 38.63000 0.3235000 37.93000 0.3756000 39.33000 0.5269000 -1.396000      0.6471000 
1 1 1 17 16 15 o 52.95000 0.4077000 52.06000 0.4799000 53.85000 0.6591000 -1.796000      0.8153000 
1 1 1 17 16 17 o 45.30000 0.4368000 45.04000 0.4889000 45.55000 0.7239000 -0.5069000     0.8735000 
1 1 1 17 16 19 o 40.26000 0.3340000 40.21000 0.3975000 40.30000 0.5368000 -0.8936000E-01 0.6679000 
1 1 1 17 16 21 o 27.30000 0.2862000 26.99000 0.3264000 27.61000 0.4701000 -0.6255000     0.5723000 
1 1 1 17 16 23 o 20.33000 0.3014000 19.92000 0.3831000 20.74000 0.4655000 -0.8198000     0.6029000 
1 1 1 17 16 25 o 2.685000 0.8012000 2.752000 1.092000  2.619000 1.173000  0.1333000      1.602000  
1 1 1 17 16 27 o 20.79000 0.3718000 20.90000 0.4147000 20.68000 0.6172000 0.2144000      0.7436000 
1 1 1 17 16 29 o 43.27000 0.4127000 43.80000 0.4399000 42.74000 0.6984000 1.062000       0.8254000 
1 1 1 17 16 31 o 19.37000 0.3537000 19.23000 0.4389000 19.51000 0.5547000 -0.2808000     0.7073000 
1 1 1 17 16 33 o 29.90000 0.3365000 30.16000 0.4210000 29.64000 0.5251000 0.5228000      0.6731000 
1 1 1 17 16 35 o 16.32000 0.3777000 16.01000 0.5113000 16.63000 0.5561000 -0.6237000     0.7554000 
1 1 1 17 16 37 o 17.39000 0.4814000 17.21000 0.6054000 17.57000 0.7487000 -0.3632000     0.9628000 
1 1 1 17 16 39 o 11.00000 0.5319000 11.53000 0.7068000 10.46000 0.7952000 1.065000       1.064000  
1 1 1 17 16 41 o 14.40000 0.5335000 14.33000 0.7995000 14.47000 0.7066000 -0.1398000     1.067000  
1 1 1 17 16 43 o 7.048000 0.8585000 7.389000 0.9999000 6.707000 1.396000  0.6829000      1.717000  
1 1 1 17 16 45 o 22.82000 0.3533000 23.61000 0.5275000 22.03000 0.4701000 1.580000       0.7066000 
1 1 1 17 16 47 o 12.30000 0.4510000 13.00000 0.6342000 11.60000 0.6413000 1.403000       0.9019000 
1 1 1 17 16 49 o 9.781000 0.5376000 9.616000 0.7794000 9.946000 0.7408000 -0.3302000     1.075000  
1 1 1 17 16 51 o 4.444000 0.9951000 5.154000 1.378000  3.734000 1.436000  1.421000       1.990000  
1 1 1 17 16 53 o 3.334000 0.9761000 3.513000 1.411000  3.156000 1.349000  0.3563000      1.952000  
1 1 1 17 16 55 o 6.840000 0.8914000 7.280000 1.304000  6.400000 1.216000  0.8804000      1.783000  
1 1 1 17 16 57 o 7.214000 0.7886000 8.260000 1.016000  6.169000 1.207000  2.091000       1.577000  
1 1 1 17 16 59 o 4.729000 1.038000  4.339000 1.542000  5.120000 1.391000  -0.7808000     2.076000  
1 1 1 17 16 61 o 4.692000 1.015000  6.150000 1.569000  3.234000 1.286000  2.916000       2.029000  
1 1 1 17 17 0  o 38.39000 0.5072000 38.39000 0.5072000 38.39000 0.5072000 0.000000       0.000000  
1 1 1 17 17 2  o 58.34000 0.4547000 58.69000 0.5963000 57.99000 0.6866000 0.6942000      0.9094000 
1 1 1 17 17 4  o 28.75000 0.2608000 28.57000 0.3648000 28.93000 0.3727000 -0.3628000     0.5215000 
1 1 1 17 17 6  o 57.81000 0.4501000 57.78000 0.6813000 57.84000 0.5884000 -0.6278000E-01 0.9003000 
1 1 1 17 17 8  o 6.799000 0.3967000 6.557000 0.5989000 7.041000 0.5205000 -0.4835000     0.7934000 
1 1 1 17 17 10 o 57.72000 0.4171000 57.92000 0.5924000 57.53000 0.5872000 0.3992000      0.8342000 
1 1 1 17 17 12 o 36.07000 0.3266000 36.44000 0.4211000 35.70000 0.4995000 0.7443000      0.6533000 
1 1 1 17 17 14 o 26.68000 0.2753000 26.60000 0.3054000 26.76000 0.4581000 -0.1590000     0.5506000 
1 1 1 17 17 16 o 24.09000 0.3334000 23.56000 0.2951000 24.62000 0.5979000 -1.056000      0.6668000 
1 1 1 17 17 18 o 12.54000 0.3552000 12.37000 0.4185000 12.72000 0.5741000 -0.3560000     0.7104000 
1 1 1 17 17 20 o 35.44000 0.3239000 35.19000 0.4067000 35.69000 0.5043000 -0.4942000     0.6478000 
1 1 1 17 17 22 o 60.70000 0.4574000 60.88000 0.5546000 60.52000 0.7274000 0.3565000      0.9147000 
1 1 1 17 17 24 o 30.06000 0.3063000 29.58000 0.3777000 30.54000 0.4824000 -0.9561000     0.6127000 
1 1 1 17 17 26 o 37.81000 0.3784000 37.88000 0.3953000 37.73000 0.6454000 0.1528000      0.7568000 
1 1 1 17 17 28 o 23.48000 0.3197000 23.59000 0.3967000 23.37000 0.5014000 0.2138000      0.6393000 
1 1 1 17 17 30 o 13.19000 0.4964000 13.82000 0.4916000 12.55000 0.8624000 1.278000       0.9927000 
1 1 1 17 17 32 o 26.44000 0.3233000 25.96000 0.3812000 26.92000 0.5222000 -0.9514000     0.6466000 
1 1 1 17 17 34 o 34.82000 0.3275000 35.01000 0.4550000 34.64000 0.4710000 0.3672000      0.6549000 
1 1 1 17 17 36 o 18.99000 0.3568000 18.71000 0.4869000 19.27000 0.5217000 -0.5650000     0.7136000 
1 1 1 17 17 38 f 30.17000 0.3711000 30.23000 0.5167000 30.12000 0.5328000 0.1069000      0.7422000 
1 1 1 17 17 40 o 20.73000 0.3464000 20.73000 0.4833000 20.73000 0.4964000 -0.3613000E-02 0.6928000 
1 1 1 17 17 42 o 10.54000 0.6443000 10.26000 0.7813000 10.83000 1.025000  -0.5738000     1.289000  
1 1 1 17 17 44 o 11.31000 0.6524000 10.67000 0.9656000 11.95000 0.8776000 -1.275000      1.305000  
1 1 1 17 17 46 o 13.46000 0.4704000 13.28000 0.6515000 13.63000 0.6787000 -0.3465000     0.9408000 
1 1 1 17 17 48 o 3.683000 0.9401000 4.832000 1.486000  2.534000 1.151000  2.298000       1.880000  
1 1 1 17 17 50 o 12.10000 0.5101000 12.64000 0.8030000 11.56000 0.6292000 1.087000       1.020000  
1 1 1 17 17 52 o 4.682000 1.022000  5.111000 1.449000  4.253000 1.440000  0.8583000      2.043000  
1 1 1 17 17 54 o 9.269000 0.6537000 9.587000 0.9976000 8.952000 0.8451000 0.6356000      1.307000  
1 1 1 17 17 56 o 2.574000 0.8380000 2.348000 1.125000  2.800000 1.243000  -0.4524000     1.676000  
1 1 1 17 17 58 o 3.655000 0.9812000 3.112000 1.359000  4.199000 1.416000  -1.087000      1.962000  
1 1 1 17 17 60 f 4.888000 0.9727000 5.988000 1.416000  3.789000 1.334000  2.199000       1.945000  
1 1 1 17 18 1  o 79.39000 0.5545000 79.78000 0.7878000 79.00000 0.7807000 0.7746000      1.109000  
1 1 1 17 18 3  o 44.91000 0.3382000 44.46000 0.4727000 45.36000 0.4838000 -0.8981000     0.6763000 
1 1 1 17 18 5  o 24.68000 0.2616000 24.72000 0.3965000 24.63000 0.3413000 0.9147000E-01  0.5231000 
1 1 1 17 18 7  o 7.180000 0.3659000 7.490000 0.4780000 6.870000 0.5542000 0.6199000      0.7319000 
1 1 1 17 18 9  f 11.14000 0.4590000 10.57000 0.6948000 11.72000 0.6000000 -1.147000      0.9180000 
1 1 1 17 18 11 o 48.74000 0.4293000 48.86000 0.6088000 48.63000 0.6053000 0.2245000      0.8585000 
1 1 1 17 18 13 o 19.61000 0.3784000 19.78000 0.6018000 19.45000 0.4591000 0.3320000      0.7569000 
1 1 1 17 18 15 o 37.85000 0.3917000 37.44000 0.4233000 38.26000 0.6593000 -0.8266000     0.7835000 
1 1 1 17 18 17 o 81.82000 0.6833000 81.99000 0.7237000 81.64000 1.159000  0.3434000      1.367000  
1 1 1 17 18 19 o 87.36000 0.6301000 87.80000 0.7718000 86.93000 0.9961000 0.8703000      1.260000  
1 1 1 17 18 21 o 17.84000 0.2919000 18.12000 0.3117000 17.57000 0.4937000 0.5516000      0.5839000 
1 1 1 17 18 23 o 42.75000 0.3667000 43.02000 0.4685000 42.49000 0.5642000 0.5224000      0.7334000 
1 1 1 17 18 25 o 24.45000 0.3309000 23.87000 0.3299000 25.03000 0.5738000 -1.163000      0.6619000 
1 1 1 17 18 27 o 13.73000 0.3968000 13.27000 0.5165000 14.19000 0.6026000 -0.9136000     0.7937000 
1 1 1 17 18 29 o 54.78000 0.5016000 55.63000 0.5805000 53.94000 0.8182000 1.681000       1.003000  
1 1 1 17 18 31 o 25.65000 0.3195000 25.60000 0.3726000 25.70000 0.5191000 -0.1013000     0.6390000 
1 1 1 17 18 33 o 21.07000 0.3503000 20.96000 0.4367000 21.19000 0.5477000 -0.2269000     0.7005000 
1 1 1 17 18 35 o 44.05000 0.3646000 43.77000 0.5028000 44.32000 0.5282000 -0.5446000     0.7292000 
1 1 1 17 18 37 o 40.51000 0.3540000 40.88000 0.4916000 40.14000 0.5094000 0.7418000      0.7079000 
1 1 1 17 18 39 o 4.939000 0.9674000 4.794000 1.422000  5.083000 1.312000  -0.2889000     1.935000  
1 1 1 17 18 41 o 6.745000 1.132000  6.077000 1.711000  7.413000 1.484000  -1.336000      2.265000  
1 1 1 17 18 43 o 7.030000 0.9906000 6.472000 1.718000  7.587000 0.9858000 -1.115000      1.981000  
1 1 1 17 18 45 o 6.150000 0.8830000 5.960000 1.203000  6.339000 1.293000  -0.3787000     1.766000  
1 1 1 17 18 47 o 4.719000 1.067000  4.337000 1.471000  5.101000 1.546000  -0.7642000     2.134000  
1 1 1 17 18 49 o 12.95000 0.5345000 13.51000 0.8455000 12.39000 0.6542000 1.123000       1.069000  
1 1 1 17 18 51 o 4.386000 1.035000  4.422000 1.553000  4.349000 1.368000  0.7273000E-01  2.070000  
1 1 1 17 18 53 o 14.59000 0.5607000 14.29000 0.9196000 14.89000 0.6418000 -0.6058000     1.121000  
1 1 1 17 18 55 o 12.62000 0.4741000 13.16000 0.6607000 12.09000 0.6801000 1.074000       0.9482000 
1 1 1 17 18 57 o 3.781000 1.003000  3.804000 1.486000  3.758000 1.347000  0.4561000E-01  2.006000  
1 1 1 17 18 59 o 4.475000 1.013000  5.271000 1.484000  3.678000 1.379000  1.594000       2.026000  
1 1 1 17 19 0  o 100.8000 0.9824000 100.8000 0.9824000 100.8000 0.9824000 0.000000       0.000000  
1 1 1 17 19 2  o 47.80000 0.3869000 47.50000 0.4976000 48.09000 0.5927000 -0.5867000     0.7739000 
1 1 1 17 19 4  o 19.91000 0.3789000 20.53000 0.4458000 19.29000 0.6128000 1.232000       0.7578000 
1 1 1 17 19 6  o 38.33000 0.3279000 38.28000 0.4978000 38.37000 0.4268000 -0.9471000E-01 0.6558000 
1 1 1 17 19 8  o 81.33000 0.6605000 81.70000 0.9383000 80.97000 0.9300000 0.7246000      1.321000  
1 1 1 17 19 10 o 34.20000 0.3444000 33.64000 0.4875000 34.76000 0.4865000 -1.120000      0.6888000 
1 1 1 17 19 12 o 32.37000 0.3399000 32.40000 0.4827000 32.34000 0.4786000 0.5675000E-01  0.6798000 
1 1 1 17 19 14 o 21.91000 0.3288000 21.49000 0.4764000 22.33000 0.4533000 -0.8399000     0.6576000 
1 1 1 17 19 16 o 40.79000 0.4383000 40.40000 0.5463000 41.18000 0.6855000 -0.7813000     0.8765000 
1 1 1 17 19 18 o 15.54000 0.2924000 15.06000 0.2845000 16.01000 0.5110000 -0.9515000     0.5848000 
1 1 1 17 19 20 o 15.11000 0.3302000 14.11000 0.4092000 16.12000 0.5183000 -2.010000      0.6603000 
1 1 1 17 19 22 o 29.16000 0.3013000 28.86000 0.3640000 29.47000 0.4802000 -0.6097000     0.6026000 
1 1 1 17 19 24 o 35.69000 0.3651000 35.36000 0.3729000 36.02000 0.6279000 -0.6575000     0.7302000 
1 1 1 17 19 26 o 26.45000 0.3015000 26.58000 0.3473000 26.31000 0.4929000 0.2747000      0.6030000 
1 1 1 17 19 28 o 37.12000 0.4629000 36.97000 0.6582000 37.28000 0.6510000 -0.3082000     0.9257000 
1 1 1 17 19 30 o 51.38000 0.4750000 51.20000 0.4940000 51.56000 0.8114000 -0.3545000     0.9500000 
1 1 1 17 19 32 o 34.42000 0.3339000 34.77000 0.4004000 34.07000 0.5344000 0.6984000      0.6678000 
1 1 1 17 19 34 o 6.346000 0.8580000 6.228000 0.9925000 6.464000 1.400000  -0.2359000     1.716000  
1 1 1 17 19 36 o 35.53000 0.3348000 36.08000 0.4619000 34.99000 0.4848000 1.094000       0.6697000 
1 1 1 17 19 38 o 15.31000 0.3981000 15.38000 0.5468000 15.23000 0.5788000 0.1470000      0.7962000 
1 1 1 17 19 40 o 10.94000 0.5206000 10.75000 0.7792000 11.14000 0.6905000 -0.3940000     1.041000  
1 1 1 17 19 42 o 11.75000 0.8245000 10.79000 0.8714000 12.71000 1.400000  -1.925000      1.649000  
1 1 1 17 19 44 o 10.91000 0.6261000 10.38000 0.8100000 11.43000 0.9550000 -1.042000      1.252000  
1 1 1 17 19 46 f 5.028000 0.9607000 4.125000 1.448000  5.931000 1.262000  -1.805000      1.921000  
1 1 1 17 19 48 o 5.542000 0.9168000 6.340000 1.207000  4.744000 1.380000  1.596000       1.834000  
1 1 1 17 19 50 o 4.492000 0.9707000 3.463000 1.459000  5.521000 1.280000  -2.059000      1.941000  
1 1 1 17 19 52 o 3.601000 1.015000  3.587000 1.478000  3.615000 1.391000  -0.2745000E-01 2.029000  
1 1 1 17 19 54 o 7.849000 1.027000  7.674000 1.706000  8.025000 1.142000  -0.3514000     2.053000  
1 1 1 17 19 56 o 3.947000 1.062000  4.226000 1.494000  3.668000 1.511000  0.5581000      2.124000  
1 1 1 17 19 58 f 3.466000 0.9824000 3.705000 1.465000  3.226000 1.309000  0.4788000      1.965000  
1 1 1 17 19 60 o 5.810000 0.9332000 6.344000 1.406000  5.276000 1.227000  1.067000       1.866000  
1 1 1 17 20 1  o 43.75000 0.3559000 43.49000 0.4698000 44.02000 0.5348000 -0.5371000     0.7118000 
1 1 1 17 20 3  o 48.36000 0.3606000 48.94000 0.5149000 47.79000 0.5049000 1.153000       0.7212000 
1 1 1 17 20 5  o 11.55000 0.4640000 11.36000 0.8485000 11.74000 0.3758000 -0.3754000     0.9280000 
1 1 1 17 20 7  o 65.74000 0.5458000 65.79000 0.7739000 65.69000 0.7700000 0.1071000      1.092000  
1 1 1 17 20 9  o 37.15000 0.3610000 37.51000 0.5147000 36.79000 0.5065000 0.7120000      0.7221000 
1 1 1 17 20 11 o 39.57000 0.3719000 39.36000 0.5250000 39.77000 0.5269000 -0.4157000     0.7438000 
1 1 1 17 20 13 o 22.25000 0.3204000 22.10000 0.4608000 22.41000 0.4453000 -0.3029000     0.6408000 
1 1 1 17 20 15 o 12.82000 0.4143000 12.74000 0.6227000 12.91000 0.5465000 -0.1649000     0.8285000 
1 1 1 17 20 17 o 37.02000 0.3679000 37.35000 0.5242000 36.68000 0.5165000 0.6763000      0.7359000 
1 1 1 17 20 19 o 23.86000 0.2798000 23.58000 0.3199000 24.13000 0.4591000 -0.5509000     0.5596000 
1 1 1 17 20 21 o 18.86000 0.3343000 18.71000 0.2953000 19.01000 0.5998000 -0.2991000     0.6685000 
1 1 1 17 20 23 o 29.19000 0.3446000 28.88000 0.3714000 29.50000 0.5806000 -0.6233000     0.6892000 
1 1 1 17 20 25 o 14.15000 0.3418000 13.40000 0.3843000 14.90000 0.5652000 -1.495000      0.6835000 
1 1 1 17 20 27 o 23.23000 0.3545000 22.81000 0.3744000 23.64000 0.6020000 -0.8369000     0.7089000 
1 1 1 17 20 29 o 14.51000 0.4739000 14.57000 0.5436000 14.46000 0.7764000 0.1068000      0.9478000 
1 1 1 17 20 31 o 18.02000 0.3557000 17.72000 0.4166000 18.32000 0.5766000 -0.6061000     0.7114000 
1 1 1 17 20 33 o 12.54000 0.4379000 11.29000 0.5233000 13.79000 0.7023000 -2.499000      0.8758000 
1 1 1 17 20 35 o 9.969000 0.5464000 9.586000 0.7713000 10.35000 0.7742000 -0.7665000     1.093000  
1 1 1 17 20 37 o 23.49000 0.3175000 23.80000 0.4330000 23.18000 0.4645000 0.6201000      0.6350000 
1 1 1 17 20 39 o 13.51000 0.5708000 13.65000 0.9778000 13.37000 0.5892000 0.2731000      1.142000  
1 1 1 17 20 41 o 9.365000 0.5605000 8.969000 0.8336000 9.761000 0.7495000 -0.7926000     1.121000  
1 1 1 17 20 43 o 6.730000 0.9254000 4.618000 1.400000  8.841000 1.210000  -4.223000      1.851000  
1 1 1 17 20 45 o 6.955000 0.7530000 6.956000 1.123000  6.954000 1.004000  0.1760000E-02  1.506000  
1 1 1 17 20 47 o 9.651000 0.5375000 9.644000 0.7970000 9.657000 0.7214000 -0.1298000E-01 1.075000  
1 1 1 17 20 49 o 4.177000 0.9715000 4.623000 1.397000  3.731000 1.350000  0.8926000      1.943000  
1 1 1 17 20 51 o 5.637000 0.9585000 5.538000 1.453000  5.735000 1.251000  -0.1976000     1.917000  
1 1 1 17 20 53 o 25.42000 0.4135000 25.57000 0.5847000 25.27000 0.5848000 0.2998000      0.8269000 
1 1 1 17 20 55 o 10.31000 0.8637000 9.192000 1.118000  11.44000 1.316000  -2.243000      1.727000  
1 1 1 17 20 57 o 3.143000 0.9609000 3.361000 1.428000  2.925000 1.286000  0.4364000      1.922000  
1 1 1 17 20 59 o 3.401000 0.9725000 4.038000 1.523000  2.764000 1.210000  1.275000       1.945000  
1 1 1 17 21 0  o 30.67000 0.6207000 30.67000 0.6207000 30.67000 0.6207000 0.000000       0.000000  
1 1 1 17 21 2  o 47.94000 0.3895000 48.17000 0.5090000 47.72000 0.5898000 0.4564000      0.7791000 
1 1 1 17 21 4  f 32.54000 0.2742000 32.21000 0.3879000 32.87000 0.3876000 -0.6545000     0.5483000 
1 1 1 17 21 6  o 87.11000 0.7891000 86.76000 1.222000  87.46000 0.9983000 -0.6964000     1.578000  
1 1 1 17 21 8  o 46.87000 0.4168000 46.21000 0.5836000 47.53000 0.5954000 -1.317000      0.8337000 
1 1 1 17 21 10 o 29.63000 0.3793000 29.74000 0.6027000 29.52000 0.4607000 0.2144000      0.7586000 
1 1 1 17 21 12 o 18.64000 0.3423000 18.49000 0.5043000 18.80000 0.4629000 -0.3099000     0.6845000 
1 1 1 17 21 14 o 29.00000 0.3332000 28.99000 0.4713000 29.01000 0.4711000 -0.2171000E-01 0.6664000 
1 1 1 17 21 16 o 8.727000 0.6942000 9.722000 0.7741000 7.733000 1.153000  1.989000       1.388000  
1 1 1 17 21 18 o 36.27000 0.3646000 36.33000 0.5175000 36.21000 0.5136000 0.1199000      0.7291000 
1 1 1 17 21 20 o 21.36000 0.3992000 21.39000 0.5617000 21.33000 0.5675000 0.6124000E-01  0.7985000 
1 1 1 17 21 22 o 21.77000 0.3166000 21.68000 0.4188000 21.87000 0.4749000 -0.1849000     0.6332000 
1 1 1 17 21 24 o 10.08000 0.4458000 9.784000 0.4734000 10.38000 0.7556000 -0.5959000     0.8917000 
1 1 1 17 21 26 o 34.71000 0.3969000 34.54000 0.4807000 34.89000 0.6317000 -0.3513000     0.7938000 
1 1 1 17 21 28 o 27.38000 0.3107000 27.26000 0.3613000 27.51000 0.5055000 -0.2542000     0.6214000 
1 1 1 17 21 30 o 48.53000 0.4169000 48.40000 0.5390000 48.65000 0.6361000 -0.2461000     0.8337000 
1 1 1 17 21 32 o 25.29000 0.3349000 24.81000 0.4211000 25.77000 0.5207000 -0.9584000     0.6697000 
1 1 1 17 21 34 o 50.53000 0.4117000 50.85000 0.4988000 50.21000 0.6551000 0.6443000      0.8234000 
1 1 1 17 21 36 o 14.77000 0.4120000 14.22000 0.5724000 15.32000 0.5926000 -1.104000      0.8240000 
1 1 1 17 21 38 o 10.57000 0.7189000 10.29000 1.234000  10.84000 0.7382000 -0.5447000     1.438000  
1 1 1 17 21 40 o 11.11000 0.5753000 11.47000 0.8903000 10.74000 0.7289000 0.7288000      1.151000  
1 1 1 17 21 42 o 11.60000 0.5044000 11.25000 0.7152000 11.94000 0.7113000 -0.6916000     1.009000  
1 1 1 17 21 44 o 6.446000 0.8900000 5.946000 1.398000  6.947000 1.102000  -1.000000      1.780000  
1 1 1 17 21 46 o 5.151000 1.062000  5.289000 1.291000  5.013000 1.687000  0.2759000      2.125000  
1 1 1 17 21 48 o 5.165000 0.9086000 4.455000 1.444000  5.874000 1.103000  -1.419000      1.817000  
1 1 1 17 21 50 o 5.216000 0.9818000 4.760000 1.456000  5.672000 1.317000  -0.9123000     1.964000  
1 1 1 17 21 52 o 6.677000 0.9859000 5.944000 1.413000  7.410000 1.375000  -1.466000      1.972000  
1 1 1 17 21 54 o 7.059000 0.9694000 6.117000 1.480000  8.001000 1.252000  -1.884000      1.939000  
1 1 1 17 21 56 o 7.631000 0.7688000 7.843000 1.151000  7.419000 1.020000  0.4241000      1.538000  
1 1 1 17 21 58 o 5.452000 1.089000  5.498000 1.633000  5.406000 1.442000  0.9219000E-01  2.179000  
1 1 1 17 22 1  o 26.14000 0.2802000 26.58000 0.4367000 25.69000 0.3510000 0.8943000      0.5603000 
1 1 1 17 22 3  o 37.43000 0.2994000 37.18000 0.4227000 37.68000 0.4241000 -0.5042000     0.5988000 
1 1 1 17 22 5  o 40.37000 0.4009000 40.71000 0.6815000 40.03000 0.4224000 0.6806000      0.8018000 
1 1 1 17 22 7  o 17.84000 0.3370000 18.03000 0.4926000 17.65000 0.4601000 0.3842000      0.6741000 
1 1 1 17 22 9  o 16.23000 0.3446000 16.13000 0.5007000 16.34000 0.4735000 -0.2129000     0.6891000 
1 1 1 17 22 11 o 21.11000 0.3229000 20.72000 0.4572000 21.49000 0.4562000 -0.7643000     0.6459000 
1 1 1 17 22 13 o 28.94000 0.3340000 29.10000 0.4761000 28.77000 0.4686000 0.3312000      0.6680000 
1 1 1 17 22 15 o 30.69000 0.3399000 30.53000 0.4859000 30.86000 0.4754000 -0.3361000     0.6797000 
1 1 1 17 22 17 o 32.94000 0.3520000 32.60000 0.4953000 33.28000 0.5003000 -0.6756000     0.7041000 
1 1 1 17 22 19 o 29.46000 0.5344000 29.23000 0.8910000 29.69000 0.5903000 -0.4661000     1.069000  
1 1 1 17 22 21 o 16.17000 0.5061000 14.83000 0.3069000 17.51000 0.9645000 -2.676000      1.012000  
1 1 1 17 22 23 o 9.021000 0.5010000 9.106000 0.4769000 8.936000 0.8813000 0.1705000      1.002000  
1 1 1 17 22 25 o 26.42000 0.3456000 26.39000 0.3650000 26.45000 0.5869000 -0.5910000E-01 0.6911000 
1 1 1 17 22 27 o 41.52000 0.3729000 41.43000 0.4772000 41.62000 0.5732000 -0.1857000     0.7458000 
1 1 1 17 22 29 o 42.36000 0.4238000 41.68000 0.4250000 43.04000 0.7334000 -1.356000      0.8476000 
1 1 1 17 22 31 o 37.63000 0.3480000 37.71000 0.4091000 37.55000 0.5630000 0.1527000      0.6960000 
1 1 1 17 22 33 o 13.40000 0.4443000 12.93000 0.5236000 13.87000 0.7180000 -0.9411000     0.8886000 
1 1 1 17 22 35 o 26.28000 0.3505000 26.84000 0.4420000 25.72000 0.5442000 1.121000       0.7011000 
1 1 1 17 22 37 o 26.74000 0.3273000 26.42000 0.4432000 27.06000 0.4816000 -0.6407000     0.6545000 
1 1 1 17 22 39 o 15.18000 0.4441000 14.90000 0.6076000 15.46000 0.6478000 -0.5547000     0.8882000 
1 1 1 17 22 41 o 10.47000 0.6380000 10.30000 0.8223000 10.64000 0.9758000 -0.3369000     1.276000  
1 1 1 17 22 43 o 11.56000 0.5495000 11.31000 0.8241000 11.81000 0.7271000 -0.5022000     1.099000  
1 1 1 17 22 45 o 7.327000 0.6971000 6.647000 1.107000  8.008000 0.8482000 -1.361000      1.394000  
1 1 1 17 22 47 o 9.697000 0.5413000 9.706000 0.7722000 9.689000 0.7587000 0.1767000E-01  1.083000  
1 1 1 17 22 49 o 5.150000 0.9485000 5.536000 1.320000  4.765000 1.363000  0.7710000      1.897000  
1 1 1 17 22 51 o 6.813000 0.8918000 6.192000 1.329000  7.434000 1.189000  -1.241000      1.784000  
1 1 1 17 22 53 o 11.29000 0.5856000 11.69000 0.8953000 10.88000 0.7552000 0.8036000      1.171000  
1 1 1 17 22 55 o 3.956000 0.9897000 3.270000 1.441000  4.643000 1.357000  -1.373000      1.979000  
1 1 1 17 22 57 o 3.854000 1.049000  3.892000 1.510000  3.816000 1.456000  0.7591000E-01  2.098000  
1 1 1 17 22 59 o 6.304000 0.9601000 7.970000 1.383000  4.638000 1.332000  3.332000       1.920000  
1 1 1 17 23 0  o 47.07000 0.5011000 47.07000 0.5011000 47.07000 0.5011000 0.000000       0.000000  
1 1 1 17 23 2  o 59.69000 0.5012000 61.12000 0.7239000 58.25000 0.6932000 2.878000       1.002000  
1 1 1 17 23 4  o 28.82000 0.2745000 29.01000 0.4531000 28.64000 0.3102000 0.3689000      0.5491000 
1 1 1 17 23 6  o 49.08000 0.4910000 49.00000 0.7681000 49.17000 0.6119000 -0.1727000     0.9821000 
1 1 1 17 23 8  f 10.74000 0.4658000 11.02000 0.6637000 10.47000 0.6537000 0.5488000      0.9316000 
1 1 1 17 23 10 o 43.94000 0.4027000 44.44000 0.5735000 43.45000 0.5654000 0.9828000      0.8053000 
1 1 1 17 23 12 o 20.65000 0.3338000 20.90000 0.4838000 20.41000 0.4600000 0.4933000      0.6676000 
1 1 1 17 23 14 o 23.83000 0.3354000 24.35000 0.4751000 23.32000 0.4736000 1.033000       0.6709000 
1 1 1 17 23 16 o 30.46000 0.5027000 31.20000 0.4942000 29.73000 0.8755000 1.470000       1.005000  
1 1 1 17 23 18 o 8.286000 0.7695000 8.706000 1.060000  7.867000 1.115000  0.8389000      1.539000  
1 1 1 17 23 20 o 45.85000 0.4705000 44.81000 0.7170000 46.90000 0.6095000 -2.089000      0.9410000 
1 1 1 17 23 22 o 14.07000 0.4491000 13.72000 0.6565000 14.41000 0.6128000 -0.6924000     0.8981000 
1 1 1 17 23 24 o 46.23000 0.4463000 44.75000 0.4794000 47.72000 0.7530000 -2.968000      0.8927000 
1 1 1 17 23 26 o 12.71000 0.3950000 12.29000 0.4316000 13.14000 0.6617000 -0.8519000     0.7901000 
1 1 1 17 23 28 o 32.57000 0.3410000 31.76000 0.4259000 33.37000 0.5325000 -1.611000      0.6819000 
1 1 1 17 23 30 o 16.44000 0.3821000 15.91000 0.4343000 16.97000 0.6287000 -1.057000      0.7641000 
1 1 1 17 23 32 o 9.898000 0.5484000 9.336000 0.7038000 10.46000 0.8413000 -1.126000      1.097000  
1 1 1 17 23 34 o 23.51000 0.3833000 24.01000 0.5350000 23.01000 0.5490000 0.9995000      0.7665000 
1 1 1 17 23 36 o 44.19000 0.3693000 44.63000 0.5110000 43.75000 0.5333000 0.8787000      0.7386000 
1 1 1 17 23 38 o 6.113000 0.8827000 5.980000 1.300000  6.245000 1.195000  -0.2654000     1.765000  
1 1 1 17 23 40 o 8.586000 0.6811000 7.131000 1.068000  10.04000 0.8451000 -2.911000      1.362000  
1 1 1 17 23 42 o 7.793000 0.7153000 8.426000 0.8458000 7.160000 1.154000  1.265000       1.431000  
1 1 1 17 23 44 o 10.97000 0.5390000 10.68000 0.8675000 11.26000 0.6398000 -0.5744000     1.078000  
1 1 1 17 23 46 o 12.92000 0.4363000 12.29000 0.6391000 13.54000 0.5941000 -1.251000      0.8726000 
1 1 1 17 23 48 o 3.734000 0.9826000 3.982000 1.459000  3.485000 1.317000  0.4971000      1.965000  
1 1 1 17 23 50 o 7.203000 0.9649000 7.130000 1.085000  7.276000 1.596000  -0.1465000     1.930000  
1 1 1 17 23 52 o 3.648000 0.9877000 3.921000 1.470000  3.374000 1.320000  0.5468000      1.975000  
1 1 1 17 23 54 o 8.441000 0.7380000 8.725000 1.049000  8.157000 1.038000  0.5675000      1.476000  
1 1 1 17 23 56 o 4.416000 1.033000  4.358000 1.498000  4.473000 1.424000  -0.1148000     2.066000  
1 1 1 17 23 58 o 3.632000 0.9737000 3.339000 1.404000  3.926000 1.349000  -0.5874000     1.947000  
1 1 1 17 24 1  o 5.636000 0.5474000 5.950000 0.7423000 5.322000 0.8047000 0.6277000      1.095000  
1 1 1 17 24 3  o 34.69000 0.3016000 34.37000 0.4879000 35.02000 0.3548000 -0.6558000     0.6033000 
1 1 1 17 24 5  f 36.65000 0.4608000 36.56000 0.6476000 36.74000 0.6558000 -0.1831000     0.9217000 
1 1 1 17 24 7  o 56.30000 0.4821000 56.63000 0.6825000 55.96000 0.6811000 0.6655000      0.9642000 
1 1 1 17 24 9  o 6.178000 0.7740000 5.875000 1.206000  6.482000 0.9705000 -0.6070000     1.548000  
1 1 1 17 24 11 o 66.36000 0.5533000 66.67000 0.7850000 66.05000 0.7799000 0.6206000      1.107000  
1 1 1 17 24 13 o 14.41000 0.3812000 13.87000 0.5754000 14.95000 0.5001000 -1.080000      0.7624000 
1 1 1 17 24 15 o 50.34000 0.6815000 50.28000 0.7857000 50.41000 1.114000  -0.1309000     1.363000  
1 1 1 17 24 17 o 46.52000 0.4741000 46.22000 0.7278000 46.82000 0.6077000 -0.6040000     0.9482000 
1 1 1 17 24 19 o 22.08000 0.3932000 21.72000 0.6194000 22.45000 0.4846000 -0.7320000     0.7864000 
1 1 1 17 24 21 o 15.77000 0.4592000 15.83000 0.7092000 15.71000 0.5835000 0.1207000      0.9184000 
1 1 1 17 24 23 f 40.49000 0.3964000 40.14000 0.4023000 40.83000 0.6832000 -0.6901000     0.7929000 
1 1 1 17 24 25 o 14.18000 0.3569000 14.13000 0.3758000 14.22000 0.6069000 -0.9061000E-01 0.7138000 
1 1 1 17 24 27 o 15.05000 0.3716000 14.76000 0.4199000 15.34000 0.6131000 -0.5856000     0.7431000 
1 1 1 17 24 29 o 7.770000 0.8654000 8.340000 0.8005000 7.201000 1.534000  1.138000       1.731000  
1 1 1 17 24 31 o 8.385000 0.6171000 8.003000 0.7651000 8.766000 0.9683000 -0.7626000     1.234000  
1 1 1 17 24 33 o 16.66000 0.3828000 16.72000 0.4584000 16.61000 0.6132000 0.1101000      0.7656000 
1 1 1 17 24 35 o 21.02000 0.3951000 21.10000 0.4115000 20.95000 0.6747000 0.1448000      0.7903000 
1 1 1 17 24 37 o 20.63000 0.3373000 20.55000 0.4599000 20.71000 0.4935000 -0.1578000     0.6746000 
1 1 1 17 24 39 o 5.896000 0.8910000 4.527000 1.388000  7.266000 1.118000  -2.740000      1.782000  
1 1 1 17 24 41 o 9.401000 0.5949000 9.088000 0.9429000 9.714000 0.7255000 -0.6266000     1.190000  
1 1 1 17 24 43 o 12.60000 0.4838000 12.50000 0.7148000 12.71000 0.6521000 -0.2104000     0.9676000 
1 1 1 17 24 45 o 12.25000 0.4542000 11.75000 0.6875000 12.75000 0.5938000 -0.9946000     0.9084000 
1 1 1 17 24 47 o 10.24000 0.5071000 9.739000 0.7954000 10.74000 0.6293000 -1.000000      1.014000  
1 1 1 17 24 49 f 9.224000 0.5656000 9.214000 0.7913000 9.234000 0.8084000 -0.1985000E-01 1.131000  
1 1 1 17 24 51 o 5.531000 1.213000  5.105000 1.446000  5.956000 1.948000  -0.8511000     2.426000  
1 1 1 17 24 53 o 12.99000 0.6017000 12.73000 1.022000  13.24000 0.6350000 -0.5057000     1.203000  
1 1 1 17 24 55 o 5.287000 0.9500000 6.508000 1.252000  4.066000 1.429000  2.442000       1.900000  
1 1 1 17 24 57 o 4.856000 1.000000  5.831000 1.478000  3.880000 1.348000  1.951000       2.000000  
1 1 1 17 25 0  o 15.38000 0.4756000 15.38000 0.4756000 15.38000 0.4756000 0.000000       0.000000  
1 1 1 17 25 2  o 53.25000 0.4249000 53.17000 0.6475000 53.32000 0.5504000 -0.1500000     0.8498000 
1 1 1 17 25 4  o 58.38000 0.4397000 59.17000 0.7056000 57.60000 0.5248000 1.567000       0.8794000 
1 1 1 17 25 6  o 28.61000 0.3846000 29.14000 0.6164000 28.07000 0.4600000 1.069000       0.7691000 
1 1 1 17 25 8  o 8.555000 0.5870000 9.397000 0.7921000 7.713000 0.8664000 1.684000       1.174000  
1 1 1 17 25 10 o 43.53000 0.4507000 42.99000 0.5622000 44.07000 0.7046000 -1.087000      0.9014000 
1 1 1 17 25 12 o 27.78000 0.3698000 27.81000 0.4730000 27.75000 0.5686000 0.5960000E-01  0.7396000 
1 1 1 17 25 14 o 8.091000 0.6987000 7.194000 1.012000  8.989000 0.9633000 -1.795000      1.397000  
1 1 1 17 25 16 f 54.65000 0.5328000 55.10000 0.8272000 54.20000 0.6718000 0.8990000      1.066000  
1 1 1 17 25 18 o 43.92000 0.4682000 43.81000 0.7255000 44.02000 0.5920000 -0.2132000     0.9364000 
1 1 1 17 25 20 o 35.59000 0.4142000 35.05000 0.6337000 36.14000 0.5334000 -1.093000      0.8283000 
1 1 1 17 25 22 o 18.02000 0.4245000 17.66000 0.5695000 18.38000 0.6296000 -0.7164000     0.8490000 
1 1 1 17 25 24 o 24.72000 0.3140000 24.81000 0.3862000 24.64000 0.4952000 0.1732000      0.6280000 
1 1 1 17 25 26 o 21.28000 0.3121000 21.37000 0.3397000 21.20000 0.5236000 0.1698000      0.6241000 
1 1 1 17 25 28 o 17.65000 0.4042000 17.36000 0.3851000 17.95000 0.7107000 -0.5905000     0.8083000 
1 1 1 17 25 30 o 6.087000 1.017000  6.471000 1.439000  5.703000 1.438000  0.7683000      2.035000  
1 1 1 17 25 32 o 27.57000 0.3854000 27.72000 0.4493000 27.43000 0.6263000 0.2896000      0.7708000 
1 1 1 17 25 34 o 16.41000 0.3932000 15.96000 0.4894000 16.86000 0.6156000 -0.9035000     0.7864000 
1 1 1 17 25 36 o 19.98000 0.3347000 20.11000 0.4479000 19.85000 0.4974000 0.2613000      0.6694000 
1 1 1 17 25 38 o 14.51000 0.4358000 14.01000 0.5823000 15.00000 0.6487000 -0.9893000     0.8717000 
1 1 1 17 25 40 o 6.105000 0.9147000 6.400000 1.089000  5.810000 1.470000  0.5903000      1.829000  
1 1 1 17 25 42 o 11.76000 0.5150000 11.66000 0.7883000 11.86000 0.6629000 -0.2001000     1.030000  
1 1 1 17 25 44 o 5.482000 0.9361000 5.851000 1.376000  5.113000 1.269000  0.7377000      1.872000  
1 1 1 17 25 46 o 5.122000 0.9286000 4.805000 1.388000  5.438000 1.234000  -0.6325000     1.857000  
1 1 1 17 25 48 o 4.138000 0.9227000 5.421000 1.390000  2.856000 1.214000  2.565000       1.845000  
1 1 1 17 25 50 o 3.823000 1.000000  3.764000 1.455000  3.881000 1.372000  -0.1167000     2.000000  
1 1 1 17 25 52 o 3.025000 0.9241000 3.058000 1.340000  2.993000 1.273000  0.6503000E-01  1.848000  
1 1 1 17 25 54 o 9.508000 0.7117000 9.159000 1.127000  9.858000 0.8700000 -0.6991000     1.423000  
1 1 1 17 25 56 o 3.996000 1.010000  5.059000 1.593000  2.934000 1.243000  2.125000       2.020000  
1 1 1 17 26 1  o 42.77000 0.3505000 42.82000 0.4668000 42.72000 0.5229000 0.1000000      0.7010000 
1 1 1 17 26 3  o 46.33000 0.3641000 45.86000 0.5796000 46.79000 0.4407000 -0.9324000     0.7281000 
1 1 1 17 26 5  o 49.62000 0.4992000 49.97000 0.7846000 49.27000 0.6176000 0.6995000      0.9985000 
1 1 1 17 26 7  o 51.96000 0.4549000 52.59000 0.6468000 51.33000 0.6400000 1.256000       0.9099000 
1 1 1 17 26 9  o 77.53000 0.7102000 77.35000 0.8956000 77.70000 1.102000  -0.3545000     1.420000  
1 1 1 17 26 11 o 39.38000 0.4221000 40.15000 0.5425000 38.62000 0.6468000 1.529000       0.8442000 
1 1 1 17 26 13 o 52.20000 0.5107000 51.89000 0.7837000 52.51000 0.6551000 -0.6235000     1.021000  
1 1 1 17 26 15 o 56.04000 0.6003000 57.14000 0.8510000 54.94000 0.8468000 2.199000       1.201000  
1 1 1 17 26 17 o 24.17000 0.3518000 23.85000 0.5017000 24.48000 0.4933000 -0.6294000     0.7036000 
1 1 1 17 26 19 o 53.31000 0.5224000 53.00000 0.7987000 53.62000 0.6735000 -0.6184000     1.045000  
1 1 1 17 26 21 o 42.50000 0.4556000 41.99000 0.5736000 43.00000 0.7081000 -1.019000      0.9112000 
1 1 1 17 26 23 o 21.41000 0.3654000 21.73000 0.5218000 21.08000 0.5117000 0.6514000      0.7308000 
1 1 1 17 26 25 o 31.90000 0.3392000 31.43000 0.4214000 32.38000 0.5317000 -0.9483000     0.6784000 
1 1 1 17 26 27 o 39.57000 0.3501000 39.33000 0.4081000 39.80000 0.5689000 -0.4669000     0.7001000 
1 1 1 17 26 29 o 35.95000 0.3563000 35.36000 0.4455000 36.54000 0.5561000 -1.185000      0.7125000 
1 1 1 17 26 31 o 23.84000 0.3457000 24.50000 0.4620000 23.19000 0.5143000 1.315000       0.6913000 
1 1 1 17 26 33 o 17.00000 0.4022000 16.12000 0.5136000 17.87000 0.6190000 -1.757000      0.8044000 
1 1 1 17 26 35 o 13.40000 0.4382000 12.61000 0.5118000 14.19000 0.7114000 -1.577000      0.8764000 
1 1 1 17 26 37 f 23.20000 0.3566000 23.46000 0.4703000 22.93000 0.5361000 0.5272000      0.7132000 
1 1 1 17 26 39 o 15.40000 0.3778000 14.98000 0.5226000 15.83000 0.5458000 -0.8419000     0.7556000 
1 1 1 17 26 41 o 20.33000 0.3645000 19.89000 0.4674000 20.76000 0.5594000 -0.8655000     0.7290000 
1 1 1 17 26 43 o 21.33000 0.3329000 21.26000 0.4694000 21.40000 0.4721000 -0.1419000     0.6657000 
1 1 1 17 26 45 o 13.58000 0.4620000 13.47000 0.7185000 13.68000 0.5811000 -0.2118000     0.9240000 
1 1 1 17 26 47 o 6.248000 0.8487000 6.905000 1.144000  5.591000 1.254000  1.314000       1.697000  
1 1 1 17 26 49 o 9.393000 0.5517000 9.159000 0.8096000 9.628000 0.7496000 -0.4694000     1.103000  
1 1 1 17 26 51 o 9.385000 0.7119000 9.059000 1.078000  9.710000 0.9299000 -0.6505000     1.424000  
1 1 1 17 26 53 o 2.940000 0.9224000 3.183000 1.370000  2.697000 1.235000  0.4862000      1.845000  
1 1 1 17 26 55 o 4.661000 1.115000  3.732000 1.453000  5.590000 1.691000  -1.858000      2.230000  
1 1 1 17 26 57 o 4.291000 1.067000  4.105000 1.496000  4.477000 1.522000  -0.3719000     2.134000  
1 1 1 17 27 0  o 70.43000 0.7064000 70.43000 0.7064000 70.43000 0.7064000 0.000000       0.000000  
1 1 1 17 27 2  o 48.09000 0.3928000 47.78000 0.5961000 48.41000 0.5116000 -0.6345000     0.7856000 
1 1 1 17 27 4  o 7.344000 0.4995000 7.504000 0.9228000 7.183000 0.3827000 0.3205000      0.9990000 
1 1 1 17 27 6  o 11.90000 0.4880000 10.93000 0.6918000 12.87000 0.6884000 -1.941000      0.9759000 
1 1 1 17 27 8  o 47.17000 0.4760000 46.35000 0.5928000 48.00000 0.7450000 -1.650000      0.9520000 
1 1 1 17 27 10 o 61.50000 0.6361000 61.81000 0.8990000 61.19000 0.9002000 0.6233000      1.272000  
1 1 1 17 27 12 o 61.31000 0.5815000 60.84000 0.8922000 61.79000 0.7460000 -0.9559000     1.163000  
1 1 1 17 27 14 o 29.99000 0.4046000 29.66000 0.4911000 30.32000 0.6431000 -0.6556000     0.8091000 
1 1 1 17 27 16 o 19.78000 0.3972000 19.93000 0.6087000 19.64000 0.5105000 0.2911000      0.7945000 
1 1 1 17 27 18 o 47.18000 0.6141000 47.18000 1.062000  47.19000 0.6178000 -0.8377000E-02 1.228000  
1 1 1 17 27 20 o 44.10000 0.4618000 44.89000 0.5947000 43.31000 0.7066000 1.576000       0.9236000 
1 1 1 17 27 22 o 28.62000 0.3699000 29.52000 0.5359000 27.72000 0.5099000 1.798000       0.7397000 
1 1 1 17 27 24 o 4.451000 1.047000  3.775000 1.487000  5.127000 1.474000  -1.352000      2.094000  
1 1 1 17 27 26 o 15.20000 0.4632000 14.62000 0.6710000 15.79000 0.6388000 -1.178000      0.9264000 
1 1 1 17 27 28 o 33.50000 0.5137000 33.32000 0.3766000 33.68000 0.9558000 -0.3561000     1.027000  
1 1 1 17 27 30 o 17.38000 0.3926000 16.87000 0.5259000 17.88000 0.5830000 -1.014000      0.7852000 
1 1 1 17 27 32 o 20.56000 0.3431000 20.61000 0.3888000 20.50000 0.5655000 0.1106000      0.6863000 
1 1 1 17 27 34 o 15.72000 0.3867000 15.47000 0.4246000 15.96000 0.6465000 -0.4849000     0.7735000 
1 1 1 17 27 36 o 13.47000 0.4309000 13.73000 0.5466000 13.21000 0.6662000 0.5209000      0.8617000 
1 1 1 17 27 38 o 22.22000 0.3148000 21.96000 0.4226000 22.49000 0.4668000 -0.5243000     0.6297000 
1 1 1 17 27 40 o 9.452000 0.5530000 9.216000 0.7140000 9.687000 0.8446000 -0.4711000     1.106000  
1 1 1 17 27 42 o 10.02000 0.5547000 9.153000 0.8770000 10.88000 0.6796000 -1.731000      1.109000  
1 1 1 17 27 44 o 4.376000 0.9023000 5.556000 1.248000  3.196000 1.304000  2.360000       1.805000  
1 1 1 17 27 46 o 11.92000 0.4962000 11.89000 0.7414000 11.95000 0.6597000 -0.6138000E-01 0.9924000 
1 1 1 17 27 48 f 21.62000 0.3537000 21.75000 0.4986000 21.50000 0.5017000 0.2443000      0.7074000 
1 1 1 17 27 50 o 3.668000 1.043000  3.247000 1.324000  4.090000 1.611000  -0.8433000     2.086000  
1 1 1 17 27 52 f 4.853000 0.9928000 6.291000 1.479000  3.415000 1.324000  2.875000       1.986000  
1 1 1 17 27 54 o 4.651000 0.9878000 3.584000 1.430000  5.717000 1.363000  -2.134000      1.976000  
1 1 1 17 27 56 o 4.380000 0.9641000 5.258000 1.432000  3.503000 1.291000  1.754000       1.928000  
1 1 1 17 28 1  o 19.95000 0.3194000 19.67000 0.5182000 20.23000 0.3734000 -0.5627000     0.6387000 
1 1 1 17 28 3  o 16.00000 0.2686000 15.82000 0.4242000 16.17000 0.3296000 -0.3512000     0.5372000 
1 1 1 17 28 5  o 20.47000 0.6764000 20.15000 0.9879000 20.80000 0.9241000 -0.6503000     1.353000  
1 1 1 17 28 7  o 15.66000 0.4141000 15.92000 0.6291000 15.40000 0.5386000 0.5186000      0.8282000 
1 1 1 17 28 9  o 64.97000 0.6100000 65.24000 0.9415000 64.70000 0.7759000 0.5324000      1.220000  
1 1 1 17 28 11 f 40.00000 0.4326000 40.90000 0.6708000 39.10000 0.5465000 1.796000       0.8652000 
1 1 1 17 28 13 o 38.55000 0.3855000 38.33000 0.5395000 38.77000 0.5508000 -0.4384000     0.7710000 
1 1 1 17 28 15 o 47.14000 0.4786000 46.52000 0.7262000 47.76000 0.6235000 -1.242000      0.9571000 
1 1 1 17 28 17 o 42.38000 0.4600000 42.41000 0.7151000 42.36000 0.5787000 0.4967000E-01  0.9199000 
1 1 1 17 28 19 o 36.24000 0.4253000 35.70000 0.5360000 36.78000 0.6606000 -1.086000      0.8507000 
1 1 1 17 28 21 o 21.59000 0.3762000 21.18000 0.5415000 22.00000 0.5225000 -0.8181000     0.7525000 
1 1 1 17 28 23 o 19.66000 0.3900000 19.47000 0.5605000 19.84000 0.5423000 -0.3743000     0.7799000 
1 1 1 17 28 25 o 25.80000 0.3669000 25.97000 0.5221000 25.62000 0.5158000 0.3540000      0.7339000 
1 1 1 17 28 27 o 34.84000 0.3976000 34.61000 0.4162000 35.06000 0.6776000 -0.4483000     0.7953000 
1 1 1 17 28 29 o 6.695000 0.6850000 5.995000 0.8145000 7.396000 1.102000  -1.401000      1.370000  
1 1 1 17 28 31 o 24.05000 0.3352000 23.42000 0.4161000 24.68000 0.5257000 -1.256000      0.6704000 
1 1 1 17 28 33 o 13.20000 0.4101000 12.89000 0.4690000 13.50000 0.6728000 -0.6128000     0.8201000 
1 1 1 17 28 35 o 7.269000 0.6771000 6.880000 0.8471000 7.659000 1.056000  -0.7791000     1.354000  
1 1 1 17 28 37 o 18.54000 0.3309000 18.46000 0.4422000 18.62000 0.4923000 -0.1611000     0.6617000 
1 1 1 17 28 39 o 12.21000 0.5080000 11.75000 0.5947000 12.67000 0.8237000 -0.9155000     1.016000  
1 1 1 17 28 41 o 9.935000 0.5300000 8.582000 0.8227000 11.29000 0.6684000 -2.707000      1.060000  
1 1 1 17 28 43 o 17.81000 0.3864000 17.72000 0.5753000 17.91000 0.5159000 -0.1834000     0.7728000 
1 1 1 17 28 45 o 3.742000 0.9563000 3.403000 1.356000  4.081000 1.349000  -0.6778000     1.913000  
1 1 1 17 28 47 o 11.28000 0.5300000 11.68000 0.7074000 10.87000 0.7895000 0.8049000      1.060000  
1 1 1 17 28 49 f 5.103000 1.018000  5.353000 1.263000  4.852000 1.598000  0.5007000      2.037000  
1 1 1 17 28 51 o 13.29000 0.4698000 12.73000 0.7092000 13.84000 0.6163000 -1.114000      0.9396000 
1 1 1 17 28 53 o 9.439000 0.6414000 9.133000 0.8980000 9.745000 0.9160000 -0.6126000     1.283000  
1 1 1 17 28 55 o 4.928000 1.109000  5.707000 1.743000  4.149000 1.372000  1.559000       2.219000  
1 1 1 17 29 0  o 4.652000 1.057000  4.652000 1.057000  4.652000 1.057000  0.000000       0.000000  
1 1 1 17 29 2  o 26.88000 0.2724000 27.27000 0.4158000 26.48000 0.3520000 0.7948000      0.5448000 
1 1 1 17 29 4  o 9.112000 0.4325000 9.385000 0.7915000 8.839000 0.3491000 0.5461000      0.8651000 
1 1 1 17 29 6  o 23.94000 0.3869000 23.89000 0.4214000 23.99000 0.6489000 -0.1044000     0.7737000 
1 1 1 17 29 8  o 29.45000 0.3486000 29.23000 0.4862000 29.67000 0.4997000 -0.4355000     0.6972000 
1 1 1 17 29 10 o 41.63000 0.3972000 41.66000 0.5569000 41.59000 0.5666000 0.7101000E-01  0.7944000 
1 1 1 17 29 12 o 11.20000 0.5443000 11.31000 0.8337000 11.09000 0.6998000 0.2195000      1.089000  
1 1 1 17 29 14 o 19.69000 0.4521000 20.37000 0.6028000 19.01000 0.6739000 1.365000       0.9042000 
1 1 1 17 29 16 o 35.58000 0.4189000 35.83000 0.5333000 35.33000 0.6461000 0.5066000      0.8377000 
1 1 1 17 29 18 o 33.48000 0.5171000 32.95000 0.5160000 34.02000 0.8962000 -1.069000      1.034000  
1 1 1 17 29 20 o 16.31000 0.4252000 16.57000 0.6034000 16.06000 0.5992000 0.5112000      0.8504000 
1 1 1 17 29 22 o 23.30000 0.3726000 23.36000 0.5357000 23.24000 0.5179000 0.1235000      0.7451000 
1 1 1 17 29 24 o 14.80000 0.5582000 14.79000 0.7897000 14.82000 0.7892000 -0.3240000E-01 1.116000  
1 1 1 17 29 26 o 37.52000 0.3949000 37.51000 0.5522000 37.53000 0.5647000 -0.1535000E-01 0.7898000 
1 1 1 17 29 28 o 8.391000 0.5686000 8.035000 0.5690000 8.748000 0.9845000 -0.7137000     1.137000  
1 1 1 17 29 30 o 20.03000 0.3943000 19.91000 0.3993000 20.15000 0.6801000 -0.2393000     0.7886000 
1 1 1 17 29 32 o 8.801000 0.5897000 9.263000 0.6578000 8.338000 0.9790000 0.9253000      1.179000  
1 1 1 17 29 34 o 18.72000 0.3786000 19.36000 0.5069000 18.08000 0.5623000 1.286000       0.7571000 
1 1 1 17 29 36 o 15.74000 0.3661000 15.60000 0.4153000 15.88000 0.6029000 -0.2803000     0.7321000 
1 1 1 17 29 38 o 9.762000 0.4779000 9.757000 0.6144000 9.766000 0.7323000 -0.8171000E-02 0.9559000 
1 1 1 17 29 40 o 10.32000 0.4833000 10.30000 0.6371000 10.34000 0.7268000 -0.4072000E-01 0.9665000 
1 1 1 17 29 42 o 7.308000 0.7146000 6.597000 1.109000  8.019000 0.9014000 -1.422000      1.429000  
1 1 1 17 29 44 o 5.939000 0.8988000 6.576000 1.282000  5.302000 1.260000  1.274000       1.798000  
1 1 1 17 29 46 o 7.041000 0.8107000 7.223000 1.088000  6.858000 1.202000  0.3650000      1.621000  
1 1 1 17 29 48 o 8.963000 0.6736000 9.955000 0.7751000 7.970000 1.102000  1.985000       1.347000  
1 1 1 17 29 50 o 4.015000 0.9464000 2.931000 1.296000  5.100000 1.379000  -2.168000      1.893000  
1 1 1 17 29 52 f 7.422000 0.7994000 7.749000 1.116000  7.095000 1.145000  0.6534000      1.599000  
1 1 1 17 29 54 o 5.369000 0.9981000 5.481000 1.470000  5.257000 1.351000  0.2238000      1.996000  
1 1 1 17 30 1  o 10.44000 0.3861000 10.55000 0.6199000 10.33000 0.4604000 0.2143000      0.7722000 
1 1 1 17 30 3  o 15.76000 0.2547000 16.09000 0.3956000 15.43000 0.3209000 0.6608000      0.5094000 
1 1 1 17 30 5  o 40.70000 0.4238000 40.65000 0.4649000 40.74000 0.7088000 -0.8956000E-01 0.8476000 
1 1 1 17 30 7  o 49.33000 0.4731000 50.19000 0.5389000 48.47000 0.7777000 1.716000       0.9461000 
1 1 1 17 30 9  o 26.48000 0.4247000 26.46000 0.5586000 26.51000 0.6399000 -0.5604000E-01 0.8494000 
1 1 1 17 30 11 o 17.67000 0.4057000 17.86000 0.6101000 17.49000 0.5349000 0.3708000      0.8114000 
1 1 1 17 30 13 o 33.76000 0.3648000 33.57000 0.5083000 33.94000 0.5235000 -0.3631000     0.7297000 
1 1 1 17 30 15 o 35.79000 0.4184000 35.79000 0.5317000 35.79000 0.6461000 0.4829000E-02  0.8368000 
1 1 1 17 30 17 o 40.90000 0.4944000 40.33000 0.7034000 41.46000 0.6949000 -1.126000      0.9888000 
1 1 1 17 30 19 o 17.80000 0.4138000 17.48000 0.5911000 18.12000 0.5791000 -0.6453000     0.8275000 
1 1 1 17 30 21 o 13.42000 0.5575000 13.84000 0.7033000 13.00000 0.8651000 0.8349000      1.115000  
1 1 1 17 30 23 o 21.99000 0.4261000 22.08000 0.6482000 21.89000 0.5531000 0.1879000      0.8521000 
1 1 1 17 30 25 o 25.04000 0.3703000 25.33000 0.5179000 24.74000 0.5294000 0.5955000      0.7406000 
1 1 1 17 30 27 o 6.940000 0.9819000 5.330000 1.502000  8.550000 1.266000  -3.220000      1.964000  
1 1 1 17 30 29 o 20.71000 0.4052000 20.28000 0.4372000 21.14000 0.6824000 -0.8547000     0.8105000 
1 1 1 17 30 31 o 20.63000 0.3211000 20.27000 0.3568000 20.99000 0.5339000 -0.7104000     0.6421000 
1 1 1 17 30 33 o 19.95000 0.3354000 19.17000 0.3983000 20.73000 0.5399000 -1.558000      0.6709000 
1 1 1 17 30 35 o 17.25000 0.3890000 17.14000 0.5202000 17.36000 0.5786000 -0.2144000     0.7781000 
1 1 1 17 30 37 o 9.687000 0.4756000 8.922000 0.6982000 10.45000 0.6460000 -1.530000      0.9512000 
1 1 1 17 30 39 o 12.17000 0.4264000 11.85000 0.5854000 12.48000 0.6201000 -0.6215000     0.8527000 
1 1 1 17 30 41 o 8.793000 0.6014000 9.301000 0.8443000 8.285000 0.8567000 1.017000       1.203000  
1 1 1 17 30 43 o 8.434000 0.5578000 8.172000 0.7827000 8.697000 0.7950000 -0.5243000     1.116000  
1 1 1 17 30 45 o 12.57000 0.4689000 12.29000 0.6499000 12.84000 0.6760000 -0.5486000     0.9378000 
1 1 1 17 30 47 o 5.768000 1.031000  5.854000 1.469000  5.682000 1.448000  0.1720000      2.062000  
1 1 1 17 30 49 o 10.07000 0.6319000 9.621000 0.9274000 10.53000 0.8586000 -0.9047000     1.264000  
1 1 1 17 30 51 o 6.041000 0.9387000 5.452000 1.491000  6.629000 1.142000  -1.177000      1.877000  
1 1 1 17 30 53 o 10.01000 0.5643000 10.39000 0.8192000 9.639000 0.7763000 0.7509000      1.129000  
1 1 1 17 31 0  o 3.233000 1.132000  3.233000 1.132000  3.233000 1.132000  0.000000       0.000000  
1 1 1 17 31 2  o 26.09000 0.2587000 25.71000 0.3719000 26.47000 0.3597000 -0.7583000     0.5174000 
1 1 1 17 31 4  o 23.49000 0.2822000 23.55000 0.4590000 23.43000 0.3283000 0.1194000      0.5643000 
1 1 1 17 31 6  o 7.761000 0.7684000 7.415000 0.8218000 8.108000 1.299000  -0.6935000     1.537000  
1 1 1 17 31 8  o 44.97000 0.4694000 45.10000 0.5688000 44.83000 0.7468000 0.2739000      0.9388000 
1 1 1 17 31 10 o 9.115000 0.6398000 9.716000 0.6390000 8.513000 1.109000  1.204000       1.280000  
1 1 1 17 31 12 o 37.84000 0.4250000 37.07000 0.5291000 38.61000 0.6652000 -1.546000      0.8499000 
1 1 1 17 31 14 o 26.73000 0.3953000 26.70000 0.4998000 26.76000 0.6125000 -0.5721000E-01 0.7905000 
1 1 1 17 31 16 o 21.59000 0.4282000 21.37000 0.6658000 21.81000 0.5387000 -0.4427000     0.8565000 
1 1 1 17 31 18 o 17.65000 0.4156000 17.48000 0.5817000 17.82000 0.5936000 -0.3421000     0.8311000 
1 1 1 17 31 20 f 10.73000 0.7035000 10.27000 1.145000  11.19000 0.8180000 -0.9202000     1.407000  
1 1 1 17 31 22 o 14.51000 0.4884000 14.41000 0.7096000 14.61000 0.6713000 -0.1982000     0.9768000 
1 1 1 17 31 24 o 28.26000 0.3757000 28.55000 0.5320000 27.97000 0.5305000 0.5790000      0.7513000 
1 1 1 17 31 26 o 9.932000 0.7066000 9.572000 0.9454000 10.29000 1.050000  -0.7202000     1.413000  
1 1 1 17 31 28 o 23.49000 0.4137000 23.63000 0.5095000 23.34000 0.6519000 0.2911000      0.8274000 
1 1 1 17 31 30 o 7.829000 0.5475000 7.320000 0.6263000 8.337000 0.8982000 -1.016000      1.095000  
1 1 1 17 31 32 o 5.325000 0.8180000 5.534000 0.8818000 5.116000 1.378000  0.4179000      1.636000  
1 1 1 17 31 34 o 12.98000 0.4189000 13.18000 0.4922000 12.79000 0.6780000 0.3953000      0.8378000 
1 1 1 17 31 36 o 4.178000 0.8283000 5.479000 1.075000  2.877000 1.260000  2.601000       1.657000  
1 1 1 17 31 38 o 7.467000 0.7817000 7.615000 0.7616000 7.319000 1.365000  0.2956000      1.563000  
1 1 1 17 31 40 o 8.630000 0.5413000 8.218000 0.7515000 9.043000 0.7792000 -0.8248000     1.083000  
1 1 1 17 31 42 o 2.878000 0.8683000 2.832000 1.218000  2.924000 1.237000  -0.9182000E-01 1.737000  
1 1 1 17 31 44 o 5.837000 0.8654000 5.946000 1.182000  5.727000 1.264000  0.2182000      1.731000  
1 1 1 17 31 46 o 7.183000 0.7799000 6.309000 1.163000  8.058000 1.039000  -1.749000      1.560000  
1 1 1 17 31 48 o 4.454000 0.9775000 4.069000 1.394000  4.838000 1.370000  -0.7699000     1.955000  
1 1 1 17 31 50 o 3.471000 1.004000  3.061000 1.288000  3.881000 1.541000  -0.8198000     2.008000  
1 1 1 17 31 52 f 8.301000 0.7084000 6.950000 1.172000  9.652000 0.7965000 -2.702000      1.417000  
1 1 1 17 31 54 o 3.814000 1.017000  4.010000 1.442000  3.618000 1.436000  0.3913000      2.035000  
1 1 1 17 32 1  o 18.67000 0.2823000 18.55000 0.4142000 18.78000 0.3836000 -0.2323000     0.5645000 
1 1 1 17 32 3  o 9.505000 0.3832000 8.938000 0.6277000 10.07000 0.4397000 -1.133000      0.7664000 
1 1 1 17 32 5  f 24.92000 0.4667000 25.72000 0.4331000 24.12000 0.8269000 1.598000       0.9334000 
1 1 1 17 32 7  o 59.45000 0.7110000 58.26000 0.6081000 60.63000 1.286000  -2.372000      1.422000  
1 1 1 17 32 9  o 22.65000 0.4980000 22.83000 0.4052000 22.46000 0.9097000 0.3661000      0.9959000 
1 1 1 17 32 11 o 15.32000 0.5701000 14.56000 0.4936000 16.08000 1.028000  -1.520000      1.140000  
1 1 1 17 32 13 o 7.875000 0.8841000 8.489000 0.9590000 7.260000 1.486000  1.229000       1.768000  
1 1 1 17 32 15 o 9.261000 0.6811000 8.503000 1.051000  10.02000 0.8666000 -1.516000      1.362000  
1 1 1 17 32 17 o 34.26000 0.5724000 33.51000 0.9355000 35.00000 0.6597000 -1.492000      1.145000  
1 1 1 17 32 19 o 19.81000 0.4195000 19.23000 0.5953000 20.38000 0.5912000 -1.155000      0.8390000 
1 1 1 17 32 21 o 30.18000 0.3789000 30.16000 0.5322000 30.19000 0.5396000 -0.3822000E-01 0.7579000 
1 1 1 17 32 23 f 3.402000 1.004000  3.152000 1.370000  3.652000 1.467000  -0.4997000     2.007000  
1 1 1 17 32 25 o 25.92000 0.3763000 25.58000 0.5218000 26.27000 0.5422000 -0.6924000     0.7525000 
1 1 1 17 32 27 o 18.21000 0.4515000 18.64000 0.5554000 17.78000 0.7119000 0.8600000      0.9029000 
1 1 1 17 32 29 o 29.38000 0.4045000 29.31000 0.6125000 29.46000 0.5284000 -0.1559000     0.8089000 
1 1 1 17 32 31 o 5.618000 0.7658000 5.851000 0.7527000 5.385000 1.334000  0.4659000      1.532000  
1 1 1 17 32 33 o 2.547000 0.7952000 2.484000 1.043000  2.610000 1.201000  -0.1261000     1.590000  
1 1 1 17 32 35 o 5.608000 0.7779000 5.733000 0.9152000 5.482000 1.258000  0.2507000      1.556000  
1 1 1 17 32 37 o 4.374000 0.9265000 4.326000 1.166000  4.421000 1.440000  -0.9409000E-01 1.853000  
1 1 1 17 32 39 f 5.378000 0.8206000 4.954000 1.185000  5.802000 1.136000  -0.8487000     1.641000  
1 1 1 17 32 41 o 6.163000 0.7486000 5.997000 1.044000  6.329000 1.073000  -0.3320000     1.497000  
1 1 1 17 32 43 o 5.829000 0.8581000 5.109000 1.245000  6.548000 1.181000  -1.439000      1.716000  
1 1 1 17 32 45 o 13.40000 0.4954000 13.26000 0.7125000 13.55000 0.6884000 -0.2931000     0.9907000 
1 1 1 17 32 47 o 11.35000 0.4936000 11.35000 0.6718000 11.36000 0.7233000 -0.1122000E-01 0.9872000 
1 1 1 17 32 49 o 5.737000 0.9497000 5.811000 1.335000  5.663000 1.351000  0.1475000      1.899000  
1 1 1 17 32 51 o 3.499000 1.003000  3.383000 1.348000  3.615000 1.486000  -0.2322000     2.006000  
1 1 1 17 32 53 o 5.228000 0.9434000 5.629000 1.379000  4.827000 1.288000  0.8023000      1.887000  
1 1 1 17 33 0  o 6.016000 1.101000  6.016000 1.101000  6.016000 1.101000  0.000000       0.000000  
1 1 1 17 33 2  o 34.61000 0.3109000 35.02000 0.4286000 34.19000 0.4505000 0.8239000      0.6218000 
1 1 1 17 33 4  o 38.72000 0.3325000 38.65000 0.4548000 38.79000 0.4850000 -0.1325000     0.6649000 
1 1 1 17 33 6  o 15.63000 0.5807000 15.47000 0.4575000 15.79000 1.068000  -0.3205000     1.161000  
1 1 1 17 33 8  o 36.25000 0.4086000 37.20000 0.4531000 35.30000 0.6802000 1.902000       0.8172000 
1 1 1 17 33 10 f 26.29000 0.3889000 26.22000 0.4150000 26.36000 0.6578000 -0.1389000     0.7778000 
1 1 1 17 33 12 o 24.38000 0.4151000 24.60000 0.5008000 24.16000 0.6622000 0.4351000      0.8302000 
1 1 1 17 33 14 o 31.43000 0.4972000 31.82000 0.4462000 31.03000 0.8887000 0.7872000      0.9944000 
1 1 1 17 33 16 f 22.45000 0.4951000 21.78000 0.6633000 23.12000 0.7352000 -1.337000      0.9902000 
1 1 1 17 33 18 o 15.55000 0.4672000 15.77000 0.6462000 15.33000 0.6750000 0.4395000      0.9344000 
1 1 1 17 33 20 o 41.44000 0.4198000 41.25000 0.5811000 41.63000 0.6061000 -0.3750000     0.8397000 
1 1 1 17 33 22 o 28.68000 0.3767000 29.05000 0.5223000 28.30000 0.5430000 0.7484000      0.7534000 
1 1 1 17 33 24 o 6.791000 0.9213000 6.870000 1.313000  6.712000 1.293000  0.1580000      1.843000  
1 1 1 17 33 26 o 19.47000 0.5764000 19.64000 0.5484000 19.30000 1.014000  0.3404000      1.153000  
1 1 1 17 33 28 o 32.13000 0.4120000 32.61000 0.6382000 31.65000 0.5211000 0.9567000      0.8239000 
1 1 1 17 33 30 o 12.23000 0.4244000 12.23000 0.4244000 ?        ?         ?              ?         
1 1 1 17 33 32 o 8.417000 0.5267000 7.481000 0.6023000 9.354000 0.8641000 -1.873000      1.053000  
1 1 1 17 33 34 o 4.173000 0.9184000 3.828000 1.211000  4.518000 1.381000  -0.6891000     1.837000  
1 1 1 17 33 36 o 2.667000 0.8487000 2.198000 0.9969000 3.136000 1.374000  -0.9380000     1.697000  
1 1 1 17 33 38 o 11.92000 0.4231000 12.01000 0.5438000 11.83000 0.6483000 0.1867000      0.8461000 
1 1 1 17 33 40 o 8.382000 0.5952000 7.235000 0.9653000 9.529000 0.6966000 -2.294000      1.190000  
1 1 1 17 33 42 o 6.769000 0.7271000 6.710000 0.9453000 6.828000 1.105000  -0.1178000     1.454000  
1 1 1 17 33 44 o 4.756000 0.9397000 4.360000 1.307000  5.152000 1.350000  -0.7919000     1.879000  
1 1 1 17 33 46 o 10.01000 0.6273000 9.346000 1.025000  10.67000 0.7232000 -1.322000      1.255000  
1 1 1 17 33 48 o 15.92000 0.5129000 15.08000 0.8010000 16.76000 0.6406000 -1.684000      1.026000  
1 1 1 17 33 50 o 7.031000 0.9461000 6.930000 1.296000  7.132000 1.379000  -0.2023000     1.892000  
1 1 1 17 33 52 o 4.151000 0.9735000 4.789000 1.416000  3.513000 1.337000  1.276000       1.947000  
1 1 1 17 34 1  o 21.10000 0.3080000 21.06000 0.4709000 21.15000 0.3972000 -0.9115000E-01 0.6161000 
1 1 1 17 34 3  o 32.42000 0.3373000 32.14000 0.5051000 32.69000 0.4472000 -0.5550000     0.6746000 
1 1 1 17 34 5  o 21.60000 0.3910000 21.24000 0.4072000 21.95000 0.6676000 -0.7092000     0.7820000 
1 1 1 17 34 7  o 36.51000 0.4093000 36.59000 0.4516000 36.43000 0.6828000 0.1617000      0.8186000 
1 1 1 17 34 9  o 27.98000 0.3913000 27.53000 0.4188000 28.43000 0.6611000 -0.8985000     0.7826000 
1 1 1 17 34 11 o 10.76000 0.6094000 11.86000 0.6038000 9.667000 1.059000  2.190000       1.219000  
1 1 1 17 34 13 o 22.35000 0.4209000 21.90000 0.4951000 22.79000 0.6808000 -0.8903000     0.8418000 
1 1 1 17 34 15 f 16.55000 0.4806000 16.39000 0.5989000 16.71000 0.7518000 -0.3196000     0.9612000 
1 1 1 17 34 17 o 11.46000 0.5866000 10.99000 0.6608000 11.92000 0.9693000 -0.9343000     1.173000  
1 1 1 17 34 19 o 28.94000 0.4350000 29.16000 0.5196000 28.72000 0.6978000 0.4356000      0.8700000 
1 1 1 17 34 21 o 29.51000 0.3850000 29.23000 0.5280000 29.79000 0.5603000 -0.5637000     0.7699000 
1 1 1 17 34 23 o 21.72000 0.3799000 22.23000 0.5295000 21.22000 0.5449000 1.010000       0.7598000 
1 1 1 17 34 25 o 14.82000 0.5136000 15.06000 0.5975000 14.58000 0.8354000 0.4810000      1.027000  
1 1 1 17 34 27 o 16.77000 0.3968000 17.03000 0.5404000 16.51000 0.5811000 0.5182000      0.7936000 
1 1 1 17 34 29 o 15.07000 0.4845000 15.61000 0.7585000 14.53000 0.6030000 1.081000       0.9690000 
1 1 1 17 34 31 o 23.25000 0.4046000 23.15000 0.6137000 23.34000 0.5274000 -0.1863000     0.8092000 
1 1 1 17 34 33 o 23.19000 0.3122000 22.95000 0.3353000 23.43000 0.5269000 -0.4766000     0.6245000 
1 1 1 17 34 35 o 15.91000 0.4175000 15.48000 0.4480000 16.34000 0.7047000 -0.8623000     0.8350000 
1 1 1 17 34 37 o 6.433000 0.8934000 5.892000 1.176000  6.974000 1.345000  -1.083000      1.787000  
1 1 1 17 34 39 o 4.265000 0.9935000 5.022000 1.516000  3.507000 1.284000  1.516000       1.987000  
1 1 1 17 34 41 o 4.180000 0.9098000 4.943000 1.218000  3.418000 1.351000  1.525000       1.820000  
1 1 1 17 34 43 o 3.517000 0.9314000 3.814000 1.309000  3.221000 1.325000  0.5927000      1.863000  
1 1 1 17 34 45 o 4.310000 0.9480000 4.257000 1.316000  4.362000 1.364000  -0.1048000     1.896000  
1 1 1 17 34 47 o 3.077000 0.9341000 3.230000 1.353000  2.924000 1.288000  0.3056000      1.868000  
1 1 1 17 34 49 o 9.257000 0.8368000 7.902000 1.450000  10.61000 0.8348000 -2.708000      1.674000  
1 1 1 17 34 51 o 4.537000 1.027000  4.405000 1.570000  4.668000 1.326000  -0.2628000     2.055000  
1 1 1 17 35 0  o 9.171000 0.7957000 9.171000 0.7957000 9.171000 0.7957000 0.000000       0.000000  
1 1 1 17 35 2  o 8.187000 0.4502000 8.638000 0.6195000 7.736000 0.6534000 0.9017000      0.9004000 
1 1 1 17 35 4  o 9.179000 0.4051000 9.378000 0.6453000 8.980000 0.4900000 0.3981000      0.8102000 
1 1 1 17 35 6  o 16.30000 0.4881000 16.18000 0.5590000 16.42000 0.8002000 -0.2350000     0.9762000 
1 1 1 17 35 8  o 4.353000 1.085000  3.905000 1.313000  4.800000 1.727000  -0.8952000     2.169000  
1 1 1 17 35 10 o 13.16000 0.5400000 13.04000 0.6170000 13.27000 0.8863000 -0.2296000     1.080000  
1 1 1 17 35 12 o 34.80000 0.4370000 34.47000 0.5257000 35.13000 0.6982000 -0.6614000     0.8740000 
1 1 1 17 35 14 o 8.876000 0.7926000 9.610000 0.7243000 8.143000 1.410000  1.468000       1.585000  
1 1 1 17 35 16 o 18.16000 0.4441000 17.94000 0.4660000 18.38000 0.7561000 -0.4436000     0.8882000 
1 1 1 17 35 18 o 10.37000 0.6701000 10.75000 0.6695000 9.977000 1.161000  0.7767000      1.340000  
1 1 1 17 35 20 o 17.59000 0.4532000 16.78000 0.5042000 18.41000 0.7531000 -1.630000      0.9063000 
1 1 1 17 35 22 o 7.937000 1.175000  8.470000 0.9913000 7.405000 2.132000  1.065000       2.351000  
1 1 1 17 35 24 o 25.99000 0.3647000 26.51000 0.4984000 25.47000 0.5325000 1.037000       0.7293000 
1 1 1 17 35 26 o 3.916000 1.013000  3.459000 1.379000  4.372000 1.485000  -0.9128000     2.027000  
1 1 1 17 35 28 o 15.66000 0.4623000 15.81000 0.7258000 15.51000 0.5727000 0.3023000      0.9245000 
1 1 1 17 35 30 o 16.95000 0.4355000 17.24000 0.6496000 16.65000 0.5803000 0.5922000      0.8710000 
1 1 1 17 35 32 o 8.361000 0.5447000 6.771000 0.7728000 9.951000 0.7679000 -3.180000      1.089000  
1 1 1 17 35 34 o 4.031000 0.9528000 3.440000 1.090000  4.622000 1.563000  -1.181000      1.906000  
1 1 1 17 35 36 o 3.678000 0.9237000 3.496000 1.268000  3.860000 1.344000  -0.3638000     1.847000  
1 1 1 17 35 38 o 7.879000 0.6162000 7.439000 0.9539000 8.319000 0.7804000 -0.8807000     1.232000  
1 1 1 17 35 40 o 8.904000 0.5551000 8.235000 0.7784000 9.572000 0.7917000 -1.337000      1.110000  
1 1 1 17 35 42 o 7.820000 0.6694000 6.750000 0.9956000 8.890000 0.8949000 -2.140000      1.339000  
1 1 1 17 35 44 o 8.035000 0.6087000 7.993000 0.8783000 8.077000 0.8431000 -0.8395000E-01 1.217000  
1 1 1 17 35 46 o 5.504000 0.8176000 4.753000 1.244000  6.254000 1.062000  -1.501000      1.635000  
1 1 1 17 35 48 o 2.700000 0.8448000 2.171000 1.032000  3.229000 1.338000  -1.058000      1.690000  
1 1 1 17 35 50 o 3.062000 0.9111000 3.057000 1.304000  3.068000 1.272000  -0.1150000E-01 1.822000  
1 1 1 17 36 1  o 13.97000 0.3731000 14.65000 0.4490000 13.30000 0.5961000 1.354000       0.7463000 
1 1 1 17 36 3  o 12.12000 0.3465000 11.61000 0.5491000 12.62000 0.4229000 -1.014000      0.6930000 
1 1 1 17 36 5  o 4.745000 1.042000  4.935000 1.192000  4.556000 1.708000  0.3785000      2.083000  
1 1 1 17 36 7  o 29.16000 0.5115000 29.64000 0.4786000 28.69000 0.9041000 0.9468000      1.023000  
1 1 1 17 36 9  o 34.42000 0.4123000 34.40000 0.4509000 34.45000 0.6905000 -0.4966000E-01 0.8247000 
1 1 1 17 36 11 o 3.433000 1.049000  3.155000 1.366000  3.711000 1.593000  -0.5565000     2.098000  
1 1 1 17 36 13 f 8.695000 0.7769000 9.247000 0.7489000 8.143000 1.361000  1.104000       1.554000  
1 1 1 17 36 15 o 18.67000 0.4607000 18.92000 0.5432000 18.43000 0.7442000 0.4934000      0.9214000 
1 1 1 17 36 17 o 7.789000 0.8352000 7.989000 0.8674000 7.588000 1.428000  0.4009000      1.670000  
1 1 1 17 36 19 o 10.05000 0.6827000 9.930000 0.7230000 10.18000 1.158000  -0.2487000     1.365000  
1 1 1 17 36 21 o 22.52000 0.6047000 24.11000 0.4488000 20.93000 1.123000  3.174000       1.209000  
1 1 1 17 36 23 o 12.78000 0.5634000 13.71000 0.5238000 11.85000 0.9977000 1.860000       1.127000  
1 1 1 17 36 25 o 11.18000 0.5766000 11.28000 0.6563000 11.09000 0.9483000 0.1928000      1.153000  
1 1 1 17 36 27 f 17.78000 0.4373000 18.03000 0.6764000 17.53000 0.5545000 0.5018000      0.8746000 
1 1 1 17 36 29 o 3.802000 0.9527000 2.834000 1.286000  4.771000 1.406000  -1.938000      1.905000  
1 1 1 17 36 31 o 4.779000 0.9250000 3.855000 1.330000  5.703000 1.286000  -1.849000      1.850000  
1 1 1 17 36 33 o 13.45000 0.4583000 13.03000 0.5107000 13.88000 0.7611000 -0.8496000     0.9165000 
1 1 1 17 36 35 o 3.895000 0.9262000 3.747000 1.222000  4.044000 1.392000  -0.2973000     1.852000  
1 1 1 17 36 37 o 4.010000 0.9361000 3.870000 1.247000  4.150000 1.397000  -0.2805000     1.872000  
1 1 1 17 36 39 o 6.635000 0.7998000 6.862000 0.9395000 6.408000 1.295000  0.4539000      1.600000  
1 1 1 17 36 41 o 5.298000 0.9080000 5.456000 1.157000  5.140000 1.400000  0.3158000      1.816000  
1 1 1 17 36 43 o 4.296000 0.8927000 3.417000 1.295000  5.176000 1.229000  -1.758000      1.785000  
1 1 1 17 36 45 o 4.016000 0.9365000 4.122000 1.310000  3.910000 1.338000  0.2112000      1.873000  
1 1 1 17 36 47 o 4.149000 1.052000  3.790000 1.444000  4.509000 1.530000  -0.7194000     2.104000  
1 1 1 17 36 49 o 5.966000 0.9201000 5.116000 1.467000  6.817000 1.111000  -1.702000      1.840000  
1 1 1 17 37 0  o 29.32000 0.4010000 29.32000 0.4010000 29.32000 0.4010000 0.000000       0.000000  
1 1 1 17 37 2  o 17.49000 0.4760000 18.23000 0.5023000 16.75000 0.8086000 1.480000       0.9519000 
1 1 1 17 37 4  f 21.17000 0.2871000 21.20000 0.4201000 21.15000 0.3914000 0.5486000E-01  0.5742000 
1 1 1 17 37 6  o 19.96000 0.4179000 19.82000 0.4208000 20.10000 0.7221000 -0.2886000     0.8358000 
1 1 1 17 37 8  o 28.11000 0.4057000 28.30000 0.4281000 27.92000 0.6893000 0.3841000      0.8114000 
1 1 1 17 37 10 o 17.46000 0.4620000 17.25000 0.4751000 17.68000 0.7926000 -0.4235000     0.9241000 
1 1 1 17 37 12 o 11.32000 0.5844000 10.71000 0.6295000 11.92000 0.9847000 -1.215000      1.169000  
1 1 1 17 37 14 o 18.42000 0.4602000 18.33000 0.5555000 18.51000 0.7339000 -0.1798000     0.9204000 
1 1 1 17 37 16 o 22.92000 0.3908000 22.81000 0.4329000 23.03000 0.6507000 -0.2141000     0.7816000 
1 1 1 17 37 18 f 18.55000 0.5945000 18.37000 0.4652000 18.72000 1.094000  -0.3519000     1.189000  
1 1 1 17 37 20 o 13.68000 0.7666000 12.91000 0.5697000 14.44000 1.423000  -1.533000      1.533000  
1 1 1 17 37 22 o 14.23000 0.4764000 13.42000 0.5204000 15.03000 0.7982000 -1.603000      0.9529000 
1 1 1 17 37 24 o 10.51000 0.6931000 9.996000 0.8942000 11.02000 1.059000  -1.024000      1.386000  
1 1 1 17 37 26 o 12.74000 0.5177000 13.67000 0.5375000 11.81000 0.8850000 1.854000       1.035000  
1 1 1 17 37 28 f 17.23000 0.4200000 17.29000 0.5243000 17.17000 0.6562000 0.1241000      0.8399000 
1 1 1 17 37 30 o 20.84000 0.3969000 21.37000 0.4270000 20.31000 0.6693000 1.059000       0.7939000 
1 1 1 17 37 32 o 12.21000 0.5070000 12.48000 0.5972000 11.95000 0.8195000 0.5331000      1.014000  
1 1 1 17 37 34 o 9.276000 0.4849000 9.114000 0.5294000 9.437000 0.8126000 -0.3225000     0.9698000 
1 1 1 17 37 36 o 9.132000 0.5942000 9.385000 0.6116000 8.878000 1.019000  0.5068000      1.188000  
1 1 1 17 37 38 o 6.100000 0.9010000 5.429000 1.324000  6.770000 1.223000  -1.341000      1.802000  
1 1 1 17 37 40 o 5.967000 0.7858000 6.244000 0.8770000 5.690000 1.304000  0.5538000      1.572000  
1 1 1 17 37 42 o 2.680000 0.8195000 2.170000 1.015000  3.190000 1.287000  -1.020000      1.639000  
1 1 1 17 37 44 o 3.864000 0.9606000 3.569000 1.383000  4.159000 1.333000  -0.5900000     1.921000  
1 1 1 17 37 46 o 5.611000 0.8965000 5.558000 1.093000  5.664000 1.422000  -0.1067000     1.793000  
1 1 1 17 37 48 o 6.527000 1.038000  6.212000 1.760000  6.842000 1.100000  -0.6298000     2.075000  
1 1 1 17 38 1  o 28.63000 0.4360000 29.19000 0.6723000 28.07000 0.5554000 1.118000       0.8720000 
1 1 1 17 38 3  o 33.21000 0.3218000 33.43000 0.4893000 32.98000 0.4181000 0.4456000      0.6436000 
1 1 1 17 38 5  o 16.74000 0.2866000 17.31000 0.4493000 16.17000 0.3561000 1.141000       0.5733000 
1 1 1 17 38 7  o 39.61000 0.4363000 39.09000 0.4695000 40.12000 0.7356000 -1.027000      0.8727000 
1 1 1 17 38 9  o 41.32000 0.4427000 41.44000 0.4888000 41.20000 0.7383000 0.2318000      0.8854000 
1 1 1 17 38 11 o 12.10000 0.6108000 11.57000 0.7284000 12.63000 0.9808000 -1.062000      1.222000  
1 1 1 17 38 13 f 17.64000 0.4586000 17.98000 0.4771000 17.30000 0.7833000 0.6790000      0.9172000 
1 1 1 17 38 15 o 33.86000 0.4149000 33.46000 0.4553000 34.26000 0.6938000 -0.7998000     0.8299000 
1 1 1 17 38 17 f 23.55000 0.5546000 22.20000 0.4948000 24.89000 0.9926000 -2.686000      1.109000  
1 1 1 17 38 19 o 19.69000 0.4206000 19.75000 0.4516000 19.63000 0.7098000 0.1218000      0.8413000 
1 1 1 17 38 21 o 5.644000 1.015000  4.790000 1.299000  6.498000 1.559000  -1.708000      2.029000  
1 1 1 17 38 23 o 3.957000 1.104000  3.463000 1.445000  4.451000 1.670000  -0.9879000     2.209000  
1 1 1 17 38 25 o 9.776000 0.7491000 10.88000 0.7077000 8.674000 1.321000  2.204000       1.498000  
1 1 1 17 38 27 o 14.97000 0.4528000 15.55000 0.4793000 14.39000 0.7685000 1.159000       0.9057000 
1 1 1 17 38 29 o 13.41000 0.4748000 13.45000 0.5141000 13.36000 0.7984000 0.8787000E-01  0.9496000 
1 1 1 17 38 31 o 4.383000 1.072000  3.368000 1.209000  5.399000 1.771000  -2.031000      2.145000  
1 1 1 17 38 33 o 17.50000 0.4195000 16.98000 0.4616000 18.01000 0.7006000 -1.031000      0.8389000 
1 1 1 17 38 35 o 3.835000 0.9275000 2.986000 1.086000  4.684000 1.504000  -1.698000      1.855000  
1 1 1 17 38 37 o 6.188000 1.039000  6.324000 0.9062000 6.051000 1.869000  0.2726000      2.077000  
1 1 1 17 38 39 o 4.480000 0.8389000 5.120000 0.8884000 3.840000 1.423000  1.280000       1.678000  
1 1 1 17 38 41 o 7.956000 0.6141000 7.329000 0.9106000 8.584000 0.8242000 -1.255000      1.228000  
1 1 1 17 38 43 f 5.634000 0.9091000 3.730000 1.551000  7.538000 0.9481000 -3.808000      1.818000  
1 1 1 17 38 45 o 5.159000 1.051000  3.981000 1.774000  6.336000 1.128000  -2.355000      2.102000  
1 1 1 17 38 47 o 4.933000 1.092000  6.655000 1.740000  3.212000 1.321000  3.443000       2.185000  
1 1 1 17 39 0  o 26.71000 0.5713000 26.71000 0.5713000 26.71000 0.5713000 0.000000       0.000000  
1 1 1 17 39 2  o 18.77000 0.3282000 19.03000 0.4180000 18.51000 0.5061000 0.5214000      0.6564000 
1 1 1 17 39 4  o 14.63000 0.4612000 15.15000 0.8319000 14.12000 0.3983000 1.034000       0.9223000 
1 1 1 17 39 6  o 7.327000 0.6787000 6.203000 1.008000  8.452000 0.9090000 -2.249000      1.357000  
1 1 1 17 39 8  o 7.248000 0.9230000 7.341000 0.8981000 7.154000 1.613000  0.1868000      1.846000  
1 1 1 17 39 10 o 23.32000 0.4323000 23.53000 0.5047000 23.11000 0.7021000 0.4138000      0.8646000 
1 1 1 17 39 12 f 6.618000 0.9763000 6.672000 1.006000  6.564000 1.674000  0.1089000      1.953000  
1 1 1 17 39 14 o 13.31000 0.7413000 12.77000 0.6347000 13.85000 1.340000  -1.073000      1.483000  
1 1 1 17 39 16 o 12.89000 0.7363000 12.42000 0.5712000 13.36000 1.357000  -0.9398000     1.473000  
1 1 1 17 39 18 o 19.03000 0.4101000 19.62000 0.4465000 18.44000 0.6879000 1.180000       0.8201000 
1 1 1 17 39 20 o 34.13000 0.4245000 34.27000 0.5121000 33.99000 0.6772000 0.2857000      0.8490000 
1 1 1 17 39 22 o 9.459000 0.6703000 10.09000 0.6453000 8.826000 1.175000  1.266000       1.341000  
1 1 1 17 39 24 o 14.60000 0.5321000 14.46000 0.6072000 14.75000 0.8739000 -0.2973000     1.064000  
1 1 1 17 39 26 o 9.972000 0.7321000 11.19000 0.7225000 8.758000 1.273000  2.428000       1.464000  
1 1 1 17 39 28 o 6.602000 0.8274000 7.869000 0.7883000 5.335000 1.455000  2.535000       1.655000  
1 1 1 17 39 30 f 4.088000 1.098000  3.145000 1.183000  5.030000 1.850000  -1.885000      2.196000  
1 1 1 17 39 32 o 4.349000 0.9505000 4.043000 1.231000  4.655000 1.448000  -0.6117000     1.901000  
1 1 1 17 39 34 o 7.761000 0.7508000 7.450000 0.8373000 8.071000 1.247000  -0.6202000     1.502000  
1 1 1 17 39 36 o 8.615000 0.6155000 7.988000 0.5907000 9.243000 1.080000  -1.255000      1.231000  
1 1 1 17 39 38 o 4.796000 1.004000  3.689000 1.437000  5.904000 1.403000  -2.215000      2.008000  
1 1 1 17 39 40 o 5.830000 0.9625000 6.001000 1.366000  5.660000 1.356000  0.3406000      1.925000  
1 1 1 17 39 42 o 6.997000 0.8754000 6.824000 1.342000  7.169000 1.125000  -0.3452000     1.751000  
1 1 1 17 39 44 o 5.154000 1.009000  5.666000 1.474000  4.641000 1.379000  1.025000       2.019000  
1 1 1 17 39 46 f 3.187000 0.9553000 3.251000 1.354000  3.123000 1.348000  0.1280000      1.911000  
1 1 1 17 40 1  o 25.83000 0.3138000 26.43000 0.4943000 25.23000 0.3867000 1.198000       0.6276000 
1 1 1 17 40 3  f 13.06000 0.3510000 12.79000 0.5137000 13.33000 0.4785000 -0.5390000     0.7020000 
1 1 1 17 40 5  o 18.43000 0.2859000 17.79000 0.4449000 19.08000 0.3590000 -1.290000      0.5717000 
1 1 1 17 40 7  o 45.15000 0.5003000 44.52000 0.5982000 45.79000 0.8020000 -1.273000      1.001000  
1 1 1 17 40 9  o 39.01000 0.5092000 39.40000 0.7124000 38.62000 0.7277000 0.7778000      1.018000  
1 1 1 17 40 11 o 19.15000 0.4268000 19.37000 0.4329000 18.94000 0.7357000 0.4327000      0.8536000 
1 1 1 17 40 13 o 12.73000 0.7664000 12.18000 0.7080000 13.29000 1.360000  -1.115000      1.533000  
1 1 1 17 40 15 o 7.342000 0.7270000 6.803000 0.8551000 7.881000 1.176000  -1.078000      1.454000  
1 1 1 17 40 17 o 10.64000 0.5597000 10.62000 0.6042000 10.66000 0.9424000 -0.4562000E-01 1.119000  
1 1 1 17 40 19 o 9.094000 0.6896000 9.245000 0.7753000 8.943000 1.141000  0.3026000      1.379000  
1 1 1 17 40 21 o 3.036000 0.9047000 3.073000 1.214000  2.999000 1.342000  0.7389000E-01  1.809000  
1 1 1 17 40 23 o 13.51000 0.5299000 13.55000 0.6131000 13.46000 0.8646000 0.9297000E-01  1.060000  
1 1 1 17 40 25 o 10.34000 0.6811000 11.18000 0.6823000 9.511000 1.179000  1.666000       1.362000  
1 1 1 17 40 27 o 5.751000 0.9796000 6.478000 0.9998000 5.023000 1.685000  1.455000       1.959000  
1 1 1 17 40 29 o 3.865000 1.104000  2.580000 1.128000  5.150000 1.899000  -2.570000      2.209000  
1 1 1 17 40 31 o 7.189000 0.8530000 7.859000 0.7553000 6.519000 1.530000  1.340000       1.706000  
1 1 1 17 40 33 o 13.47000 0.4921000 13.58000 0.5703000 13.36000 0.8023000 0.2219000      0.9843000 
1 1 1 17 40 35 o 11.00000 0.5475000 10.89000 0.6383000 11.10000 0.8897000 -0.2092000     1.095000  
1 1 1 17 40 37 o 7.741000 0.6723000 6.514000 0.8658000 8.968000 1.029000  -2.455000      1.345000  
1 1 1 17 40 39 o 7.852000 0.7393000 8.400000 1.029000  7.304000 1.062000  1.096000       1.479000  
1 1 1 17 40 41 o 9.626000 0.6455000 9.807000 0.9386000 9.445000 0.8864000 0.3622000      1.291000  
1 1 1 17 40 43 o 4.556000 1.069000  4.322000 1.578000  4.789000 1.443000  -0.4676000     2.138000  
1 1 1 17 40 45 o 3.882000 1.031000  4.062000 1.459000  3.702000 1.457000  0.3596000      2.062000  
1 1 1 17 41 0  o 2.969000 1.224000  2.969000 1.224000  2.969000 1.224000  0.000000       0.000000  
1 1 1 17 41 2  o 27.55000 0.2805000 27.92000 0.4025000 27.17000 0.3906000 0.7466000      0.5609000 
1 1 1 17 41 4  o 18.58000 0.2827000 18.53000 0.4167000 18.62000 0.3823000 -0.8385000E-01 0.5655000 
1 1 1 17 41 6  o 21.56000 0.3311000 22.21000 0.4554000 20.92000 0.4809000 1.290000       0.6623000 
1 1 1 17 41 8  o 15.15000 0.4780000 15.16000 0.4790000 15.14000 0.8273000 0.2681000E-01  0.9560000 
1 1 1 17 41 10 o 14.60000 0.6228000 14.03000 0.5067000 15.17000 1.138000  -1.145000      1.246000  
1 1 1 17 41 12 o 11.16000 0.5909000 10.64000 0.6998000 11.69000 0.9523000 -1.050000      1.182000  
1 1 1 17 41 14 o 15.15000 0.4740000 15.69000 0.5164000 14.61000 0.7951000 1.084000       0.9480000 
1 1 1 17 41 16 o 10.41000 0.5637000 10.04000 0.6487000 10.77000 0.9221000 -0.7351000     1.127000  
1 1 1 17 41 18 o 6.891000 0.8409000 7.096000 0.9723000 6.687000 1.372000  0.4095000      1.682000  
1 1 1 17 41 20 o 14.34000 0.4824000 15.34000 0.5853000 13.35000 0.7671000 1.989000       0.9649000 
1 1 1 17 41 22 f 23.18000 0.4109000 22.44000 0.5009000 23.93000 0.6516000 -1.498000      0.8219000 
1 1 1 17 41 24 o 10.42000 0.6574000 11.90000 0.5748000 8.931000 1.182000  2.969000       1.315000  
1 1 1 17 41 26 o 13.95000 0.6215000 14.41000 0.5086000 13.49000 1.134000  0.9106000      1.243000  
1 1 1 17 41 28 o 3.998000 1.106000  3.217000 1.244000  4.778000 1.829000  -1.560000      2.212000  
1 1 1 17 41 30 o 9.820000 0.6417000 10.70000 0.6150000 8.937000 1.126000  1.767000       1.283000  
1 1 1 17 41 32 o 5.771000 0.8242000 6.941000 0.8452000 4.602000 1.415000  2.339000       1.648000  
1 1 1 17 41 34 o 6.373000 0.8613000 6.802000 0.8824000 5.944000 1.479000  0.8583000      1.723000  
1 1 1 17 41 36 o 4.017000 1.081000  3.754000 1.474000  4.280000 1.580000  -0.5266000     2.161000  
1 1 1 17 41 38 o 7.647000 0.7530000 6.606000 1.219000  8.688000 0.8839000 -2.082000      1.506000  
1 1 1 17 41 40 o 3.969000 1.039000  4.253000 1.525000  3.686000 1.412000  0.5666000      2.079000  
1 1 1 17 41 42 o 7.625000 0.8597000 6.979000 1.390000  8.271000 1.012000  -1.292000      1.719000  
1 1 1 17 41 44 o 7.705000 0.9744000 7.294000 1.706000  8.115000 0.9430000 -0.8202000     1.949000  
1 1 1 17 42 1  o 27.34000 0.2836000 27.53000 0.4071000 27.15000 0.3950000 0.3787000      0.5673000 
1 1 1 17 42 3  o 15.69000 0.3349000 15.98000 0.4315000 15.40000 0.5123000 0.5863000      0.6698000 
1 1 1 17 42 5  o 9.383000 0.3891000 9.185000 0.6178000 9.581000 0.4732000 -0.3953000     0.7782000 
1 1 1 17 42 7  f 16.58000 0.6990000 17.10000 0.4399000 16.06000 1.327000  1.036000       1.398000  
1 1 1 17 42 9  o 23.90000 0.5810000 24.47000 0.5722000 23.33000 1.011000  1.147000       1.162000  
1 1 1 17 42 11 o 27.10000 0.3949000 28.07000 0.4264000 26.12000 0.6649000 1.941000       0.7898000 
1 1 1 17 42 13 o 19.82000 0.4140000 20.56000 0.4433000 19.08000 0.6993000 1.477000       0.8279000 
1 1 1 17 42 15 o 4.368000 1.078000  3.908000 1.488000  4.829000 1.560000  -0.9219000     2.156000  
1 1 1 17 42 17 o 3.651000 1.000000  3.598000 1.442000  3.704000 1.387000  -0.1058000     2.001000  
1 1 1 17 42 19 o 10.69000 0.6117000 11.40000 0.6975000 9.984000 1.005000  1.419000       1.223000  
1 1 1 17 42 21 o 6.350000 0.8905000 5.705000 1.131000  6.995000 1.376000  -1.290000      1.781000  
1 1 1 17 42 23 o 19.09000 0.4119000 19.36000 0.4345000 18.82000 0.6999000 0.5419000      0.8238000 
1 1 1 17 42 25 o 15.25000 0.5362000 14.59000 0.4873000 15.91000 0.9554000 -1.324000      1.072000  
1 1 1 17 42 27 o 4.318000 1.057000  4.281000 1.280000  4.356000 1.681000  -0.7549000E-01 2.113000  
1 1 1 17 42 29 o 7.278000 0.9135000 8.403000 0.7452000 6.152000 1.668000  2.250000       1.827000  
1 1 1 17 42 31 o 5.538000 1.349000  4.309000 1.304000  6.767000 2.363000  -2.458000      2.699000  
1 1 1 17 42 33 o 5.981000 0.9608000 5.437000 1.331000  6.526000 1.386000  -1.089000      1.922000  
1 1 1 17 42 35 o 5.342000 0.9965000 4.773000 1.358000  5.911000 1.459000  -1.138000      1.993000  
1 1 1 17 42 37 o 5.032000 1.027000  3.596000 1.292000  6.468000 1.598000  -2.872000      2.055000  
1 1 1 17 42 39 o 7.366000 0.8105000 7.457000 1.188000  7.274000 1.103000  0.1828000      1.621000  
1 1 1 17 42 41 o 4.127000 1.067000  3.586000 1.517000  4.669000 1.502000  -1.082000      2.135000  
1 1 1 17 42 43 o 5.826000 0.9022000 5.979000 1.306000  5.672000 1.245000  0.3070000      1.804000  
1 1 1 17 43 0  o 18.82000 0.5337000 18.82000 0.5337000 18.82000 0.5337000 0.000000       0.000000  
1 1 1 17 43 2  o 6.409000 0.5710000 6.463000 0.7750000 6.356000 0.8388000 0.1067000      1.142000  
1 1 1 17 43 4  o 6.144000 0.5727000 6.750000 0.7924000 5.538000 0.8270000 1.212000       1.145000  
1 1 1 17 43 6  o 13.99000 0.2925000 14.58000 0.4509000 13.39000 0.3727000 1.192000       0.5850000 
1 1 1 17 43 8  o 5.497000 0.9864000 7.131000 1.026000  3.863000 1.685000  3.269000       1.973000  
1 1 1 17 43 10 f 14.44000 0.4777000 13.71000 0.4835000 15.17000 0.8241000 -1.457000      0.9554000 
1 1 1 17 43 12 o 17.29000 0.5568000 18.42000 0.8488000 16.16000 0.7209000 2.254000       1.114000  
1 1 1 17 43 14 f 13.60000 0.5253000 13.73000 0.6939000 13.47000 0.7888000 0.2639000      1.051000  
1 1 1 17 43 16 o 11.72000 0.5595000 11.91000 0.6783000 11.52000 0.8900000 0.3876000      1.119000  
1 1 1 17 43 18 o 12.83000 0.4894000 13.00000 0.5425000 12.66000 0.8147000 0.3381000      0.9788000 
1 1 1 17 43 20 o 15.86000 0.5139000 16.52000 0.7066000 15.20000 0.7464000 1.322000       1.028000  
1 1 1 17 43 22 o 5.090000 0.9678000 5.807000 1.098000  4.373000 1.594000  1.434000       1.936000  
1 1 1 17 43 24 o 8.147000 0.8318000 7.387000 0.8948000 8.908000 1.402000  -1.521000      1.664000  
1 1 1 17 43 26 o 4.936000 1.084000  4.732000 1.175000  5.139000 1.821000  -0.4070000     2.167000  
1 1 1 17 43 28 o 16.38000 0.5314000 17.67000 0.4906000 15.09000 0.9428000 2.572000       1.063000  
1 1 1 17 43 30 o 9.863000 1.178000  12.43000 0.5802000 7.294000 2.283000  5.138000       2.355000  
1 1 1 17 43 32 f 6.944000 0.9343000 7.681000 0.8349000 6.207000 1.672000  1.475000       1.869000  
1 1 1 17 43 34 o 12.46000 0.5452000 12.75000 0.5795000 12.16000 0.9235000 0.5924000      1.090000  
1 1 1 17 43 36 o 4.331000 0.9247000 5.574000 1.255000  3.087000 1.359000  2.487000       1.849000  
1 1 1 17 43 38 o 6.084000 0.9319000 5.573000 1.416000  6.595000 1.212000  -1.022000      1.864000  
1 1 1 17 43 40 o 8.705000 0.8111000 7.365000 1.362000  10.05000 0.8816000 -2.681000      1.622000  
1 1 1 17 43 42 o 12.83000 0.5341000 11.89000 0.8238000 13.76000 0.6800000 -1.867000      1.068000  
1 1 1 17 44 1  o 13.67000 0.3471000 13.82000 0.4694000 13.52000 0.5115000 0.2970000      0.6942000 
1 1 1 17 44 3  o 9.415000 0.4198000 9.230000 0.6457000 9.599000 0.5367000 -0.3685000     0.8397000 
1 1 1 17 44 5  o 8.911000 0.4352000 9.283000 0.6956000 8.538000 0.5233000 0.7455000      0.8704000 
1 1 1 17 44 7  o 8.847000 0.5020000 8.873000 0.7560000 8.820000 0.6607000 0.5311000E-01  1.004000  
1 1 1 17 44 9  o 16.42000 0.4762000 16.20000 0.5682000 16.64000 0.7644000 -0.4413000     0.9524000 
1 1 1 17 44 11 o 12.46000 0.6532000 12.90000 0.9373000 12.03000 0.9099000 0.8690000      1.306000  
1 1 1 17 44 13 o 14.50000 0.4894000 14.56000 0.5105000 14.44000 0.8352000 0.1237000      0.9788000 
1 1 1 17 44 15 o 6.317000 0.9239000 6.598000 1.003000  6.035000 1.552000  0.5632000      1.848000  
1 1 1 17 44 17 o 8.996000 0.6509000 9.290000 0.6649000 8.703000 1.119000  0.5871000      1.302000  
1 1 1 17 44 19 o 8.109000 0.6377000 8.153000 0.8065000 8.065000 0.9880000 0.8740000E-01  1.275000  
1 1 1 17 44 21 o 6.921000 0.9732000 6.994000 0.8380000 6.849000 1.757000  0.1459000      1.946000  
1 1 1 17 44 23 o 8.531000 0.7869000 7.691000 0.8850000 9.370000 1.301000  -1.679000      1.574000  
1 1 1 17 44 25 o 5.232000 1.041000  5.522000 1.338000  4.942000 1.594000  0.5806000      2.081000  
1 1 1 17 44 27 o 5.741000 1.105000  5.746000 1.175000  5.736000 1.872000  0.1058000E-01  2.210000  
1 1 1 17 44 29 o 8.411000 1.226000  7.837000 0.9006000 8.984000 2.281000  -1.146000      2.452000  
1 1 1 17 44 31 o 7.104000 0.9293000 8.035000 0.8000000 6.173000 1.678000  1.862000       1.859000  
1 1 1 17 44 33 o 11.93000 0.6283000 13.09000 0.5673000 10.77000 1.121000  2.320000       1.257000  
1 1 1 17 44 35 o 4.791000 1.082000  5.459000 1.473000  4.122000 1.585000  1.337000       2.164000  
1 1 1 17 44 37 o 3.279000 0.9902000 3.320000 1.376000  3.238000 1.424000  0.8193000E-01  1.980000  
1 1 1 17 44 39 o 4.115000 1.080000  4.310000 1.593000  3.920000 1.459000  0.3900000      2.160000  
1 1 1 17 44 41 o 3.173000 0.9485000 2.815000 1.294000  3.532000 1.387000  -0.7166000     1.897000  
1 1 1 17 45 0  o 3.332000 1.103000  3.332000 1.103000  3.332000 1.103000  0.000000       0.000000  
1 1 1 17 45 2  o 7.809000 0.4658000 8.859000 0.5802000 6.759000 0.7290000 2.100000       0.9317000 
1 1 1 17 45 4  o 6.789000 0.6139000 7.655000 0.6683000 5.923000 1.030000  1.733000       1.228000  
1 1 1 17 45 6  o 5.915000 0.5918000 6.429000 0.9330000 5.401000 0.7285000 1.029000       1.184000  
1 1 1 17 45 8  o 4.422000 1.012000  4.441000 1.244000  4.403000 1.597000  0.3783000E-01  2.025000  
1 1 1 17 45 10 o 15.98000 0.4602000 15.76000 0.4650000 16.20000 0.7942000 -0.4403000     0.9204000 
1 1 1 17 45 12 o 19.86000 0.4172000 20.20000 0.4252000 19.52000 0.7179000 0.6856000      0.8344000 
1 1 1 17 45 14 o 17.18000 0.4401000 16.84000 0.4495000 17.52000 0.7567000 -0.6857000     0.8801000 
1 1 1 17 45 16 o 5.412000 0.8849000 5.365000 1.037000  5.460000 1.434000  -0.9412000E-01 1.770000  
1 1 1 17 45 18 o 2.984000 0.9457000 2.883000 1.230000  3.086000 1.437000  -0.2038000     1.891000  
1 1 1 17 45 20 o 9.547000 0.7749000 9.285000 0.8055000 9.808000 1.324000  -0.5228000     1.550000  
1 1 1 17 45 22 o 11.94000 0.5258000 12.76000 0.5628000 11.11000 0.8883000 1.654000       1.052000  
1 1 1 17 45 24 o 9.523000 0.6270000 9.925000 0.6509000 9.122000 1.072000  0.8030000      1.254000  
1 1 1 17 45 26 o 6.305000 0.8885000 6.310000 1.006000  6.300000 1.464000  0.1026000E-01  1.777000  
1 1 1 17 45 28 o 16.77000 0.4614000 16.98000 0.4894000 16.57000 0.7822000 0.4107000      0.9227000 
1 1 1 17 45 30 o 6.319000 1.080000  7.053000 1.375000  5.584000 1.666000  1.469000       2.160000  
1 1 1 17 45 32 o 12.17000 0.6426000 13.16000 0.7075000 11.17000 1.073000  1.993000       1.285000  
1 1 1 17 45 34 o 7.005000 0.9410000 8.147000 0.8864000 5.863000 1.660000  2.284000       1.882000  
1 1 1 17 45 36 o 3.090000 0.9252000 3.412000 1.354000  2.767000 1.261000  0.6450000      1.850000  
1 1 1 17 45 38 o 5.528000 1.013000  5.569000 1.470000  5.486000 1.395000  0.8345000E-01  2.026000  
1 1 1 17 45 40 o 8.519000 0.7436000 8.855000 1.038000  8.182000 1.065000  0.6728000      1.487000  
1 1 1 17 46 1  o 26.46000 0.2939000 26.97000 0.4297000 25.96000 0.4010000 1.005000       0.5877000 
1 1 1 17 46 3  o 25.27000 0.3275000 25.55000 0.4358000 25.00000 0.4889000 0.5482000      0.6550000 
1 1 1 17 46 5  o 4.750000 0.8486000 4.780000 1.156000  4.720000 1.242000  0.6004000E-01  1.697000  
1 1 1 17 46 7  o 16.85000 0.3594000 16.65000 0.5168000 17.04000 0.4996000 -0.3990000     0.7188000 
1 1 1 17 46 9  o 15.46000 0.4930000 16.75000 0.4393000 14.17000 0.8826000 2.579000       0.9859000 
1 1 1 17 46 11 o 13.69000 0.5136000 13.90000 0.4907000 13.48000 0.9023000 0.4202000      1.027000  
1 1 1 17 46 13 o 6.520000 0.7952000 7.712000 0.7330000 5.328000 1.411000  2.384000       1.590000  
1 1 1 17 46 15 o 12.37000 0.6228000 11.86000 0.5423000 12.89000 1.121000  -1.030000      1.246000  
1 1 1 17 46 17 o 13.27000 0.6492000 14.04000 0.5030000 12.50000 1.197000  1.537000       1.298000  
1 1 1 17 46 19 o 13.06000 0.5223000 13.69000 0.5884000 12.43000 0.8630000 1.264000       1.045000  
1 1 1 17 46 21 o 14.17000 0.5024000 14.00000 0.6126000 14.35000 0.7965000 -0.3513000     1.005000  
1 1 1 17 46 23 o 4.967000 0.9665000 4.618000 1.230000  5.315000 1.491000  -0.6972000     1.933000  
1 1 1 17 46 25 o 11.77000 0.7851000 11.68000 0.6112000 11.85000 1.446000  -0.1695000     1.570000  
1 1 1 17 46 27 o 11.27000 0.5739000 10.86000 0.6672000 11.69000 0.9340000 -0.8343000     1.148000  
1 1 1 17 46 29 o 4.906000 0.9285000 6.564000 1.158000  3.249000 1.451000  3.315000       1.857000  
1 1 1 17 46 31 o 4.169000 1.051000  4.971000 1.493000  3.366000 1.480000  1.605000       2.102000  
1 1 1 17 46 33 o 4.732000 1.048000  5.096000 1.301000  4.369000 1.643000  0.7278000      2.096000  
1 1 1 17 46 35 o 5.750000 0.9090000 7.368000 0.8253000 4.132000 1.620000  3.236000       1.818000  
1 1 1 17 46 37 o 6.792000 1.240000  7.381000 1.956000  6.204000 1.526000  1.177000       2.481000  
1 1 1 17 46 39 o 6.015000 0.9065000 5.335000 1.423000  6.695000 1.124000  -1.361000      1.813000  
1 1 1 17 47 0  o 6.287000 0.8626000 6.287000 0.8626000 6.287000 0.8626000 0.000000       0.000000  
1 1 1 17 47 2  o 10.38000 0.4624000 10.87000 0.5023000 9.884000 0.7765000 0.9841000      0.9248000 
1 1 1 17 47 4  o 17.34000 0.3034000 18.05000 0.4497000 16.62000 0.4075000 1.431000       0.6069000 
1 1 1 17 47 6  o 12.25000 0.3713000 12.59000 0.6017000 11.91000 0.4354000 0.6813000      0.7427000 
1 1 1 17 47 8  o 6.592000 0.6181000 6.910000 0.7524000 6.275000 0.9808000 0.6357000      1.236000  
1 1 1 17 47 10 o 7.996000 0.8381000 8.619000 0.7354000 7.373000 1.506000  1.246000       1.676000  
1 1 1 17 47 12 f 7.811000 0.7817000 6.216000 0.9032000 9.407000 1.276000  -3.191000      1.563000  
1 1 1 17 47 14 o 11.09000 0.5769000 11.72000 0.5350000 10.45000 1.022000  1.279000       1.154000  
1 1 1 17 47 16 o 10.67000 0.5611000 9.768000 0.6573000 11.58000 0.9097000 -1.813000      1.122000  
1 1 1 17 47 18 o 3.600000 0.9483000 3.987000 1.284000  3.213000 1.396000  0.7742000      1.897000  
1 1 1 17 47 20 o 4.770000 0.9820000 5.411000 1.139000  4.129000 1.600000  1.282000       1.964000  
1 1 1 17 47 22 o 4.685000 0.9584000 4.546000 1.317000  4.825000 1.393000  -0.2798000     1.917000  
1 1 1 17 47 24 o 4.129000 1.116000  4.243000 1.361000  4.015000 1.770000  0.2281000      2.233000  
1 1 1 17 47 26 o 7.496000 0.8462000 7.518000 0.8636000 7.473000 1.455000  0.4504000E-01  1.692000  
1 1 1 17 47 28 o 6.721000 0.9079000 6.882000 1.063000  6.560000 1.472000  0.3219000      1.816000  
1 1 1 17 47 30 o 5.765000 1.003000  6.377000 1.199000  5.153000 1.609000  1.224000       2.007000  
1 1 1 17 47 32 f 5.185000 1.077000  4.628000 1.366000  5.742000 1.664000  -1.114000      2.153000  
1 1 1 17 47 34 o 5.144000 1.071000  4.816000 1.350000  5.472000 1.663000  -0.6559000     2.142000  
1 1 1 17 47 36 o 6.279000 0.9926000 7.711000 0.9845000 4.847000 1.724000  2.864000       1.985000  
1 1 1 17 47 38 o 9.692000 0.6799000 11.39000 0.7896000 7.990000 1.107000  3.404000       1.360000  
1 1 1 17 48 1  o 9.000000 0.4116000 8.870000 0.5831000 9.130000 0.5812000 -0.2596000     0.8233000 
1 1 1 17 48 3  o 5.955000 0.6196000 6.136000 0.8392000 5.774000 0.9119000 0.3619000      1.239000  
1 1 1 17 48 5  o 8.407000 0.5221000 7.825000 0.7155000 8.989000 0.7606000 -1.164000      1.044000  
1 1 1 17 48 7  o 9.495000 0.4396000 9.753000 0.5848000 9.237000 0.6565000 0.5162000      0.8792000 
1 1 1 17 48 9  f 5.911000 1.006000  5.978000 1.055000  5.845000 1.712000  0.1334000      2.012000  
1 1 1 17 48 11 o 9.446000 0.6750000 9.540000 0.5976000 9.352000 1.210000  0.1879000      1.350000  
1 1 1 17 48 13 o 6.395000 0.9532000 6.874000 0.7936000 5.916000 1.733000  0.9577000      1.906000  
1 1 1 17 48 15 o 3.357000 0.9585000 2.639000 1.106000  4.074000 1.566000  -1.435000      1.917000  
1 1 1 17 48 17 o 4.163000 0.9265000 4.772000 1.143000  3.554000 1.459000  1.218000       1.853000  
1 1 1 17 48 19 o 4.824000 0.9572000 5.567000 1.075000  4.080000 1.584000  1.487000       1.914000  
1 1 1 17 48 21 f 3.743000 1.012000  4.075000 1.444000  3.410000 1.417000  0.6652000      2.024000  
1 1 1 17 48 23 o 5.037000 1.099000  4.312000 1.237000  5.762000 1.816000  -1.450000      2.197000  
1 1 1 17 48 25 o 9.027000 0.7193000 9.343000 0.7263000 8.711000 1.242000  0.6315000      1.439000  
1 1 1 17 48 27 f 11.74000 0.5318000 12.32000 0.6888000 11.16000 0.8105000 1.164000       1.064000  
1 1 1 17 48 29 o 4.094000 1.044000  4.103000 1.355000  4.085000 1.589000  0.1818000E-01  2.088000  
1 1 1 17 48 31 o 3.925000 1.023000  3.958000 1.329000  3.893000 1.556000  0.6553000E-01  2.046000  
1 1 1 17 48 33 o 3.526000 1.013000  3.446000 1.298000  3.606000 1.557000  -0.1606000     2.027000  
1 1 1 17 48 35 o 6.672000 0.9638000 8.396000 0.8189000 4.948000 1.745000  3.448000       1.928000  
1 1 1 17 48 37 o 3.795000 1.203000  3.829000 1.664000  3.762000 1.739000  0.6666000E-01  2.407000  
1 1 1 17 49 0  o 2.130000 0.9778000 2.130000 0.9778000 2.130000 0.9778000 0.000000       0.000000  
1 1 1 17 49 2  o 12.42000 0.3391000 12.38000 0.4733000 12.45000 0.4859000 -0.6690000E-01 0.6783000 
1 1 1 17 49 4  o 18.00000 0.2794000 18.14000 0.4087000 17.86000 0.3811000 0.2795000      0.5588000 
1 1 1 17 49 6  o 10.84000 0.4309000 11.10000 0.5505000 10.57000 0.6630000 0.5308000      0.8617000 
1 1 1 17 49 8  o 10.94000 0.4389000 11.38000 0.6055000 10.50000 0.6354000 0.8836000      0.8777000 
1 1 1 17 49 10 o 7.141000 0.8158000 6.694000 0.8575000 7.587000 1.388000  -0.8930000     1.632000  
1 1 1 17 49 12 o 3.727000 0.9341000 4.149000 1.207000  3.304000 1.426000  0.8444000      1.868000  
1 1 1 17 49 14 o 3.424000 0.9659000 2.626000 1.132000  4.221000 1.566000  -1.594000      1.932000  
1 1 1 17 49 16 o 3.460000 0.9782000 2.627000 1.113000  4.293000 1.609000  -1.665000      1.956000  
1 1 1 17 49 18 o 3.190000 0.9147000 2.455000 1.121000  3.925000 1.446000  -1.469000      1.829000  
1 1 1 17 49 20 o 5.019000 1.009000  6.103000 0.9969000 3.935000 1.755000  2.168000       2.018000  
1 1 1 17 49 22 o 6.830000 0.8548000 7.271000 0.9181000 6.390000 1.442000  0.8810000      1.710000  
1 1 1 17 49 24 o 8.188000 0.8076000 8.764000 0.8889000 7.612000 1.349000  1.152000       1.615000  
1 1 1 17 49 26 f 3.108000 0.9255000 3.273000 1.250000  2.942000 1.365000  0.3309000      1.851000  
1 1 1 17 49 28 o 4.213000 0.9932000 3.118000 1.276000  5.309000 1.523000  -2.191000      1.986000  
1 1 1 17 49 30 o 4.119000 1.185000  4.149000 1.485000  4.089000 1.846000  0.5951000E-01  2.369000  
1 1 1 17 49 32 o 4.633000 1.012000  2.527000 1.178000  6.739000 1.646000  -4.212000      2.025000  
1 1 1 17 49 34 o 4.181000 1.083000  4.033000 1.426000  4.328000 1.631000  -0.2947000     2.167000  
1 1 1 17 50 1  o 10.82000 0.3836000 11.01000 0.5302000 10.63000 0.5545000 0.3838000      0.7672000 
1 1 1 17 50 3  o 9.283000 0.3996000 9.100000 0.6244000 9.467000 0.4990000 -0.3678000     0.7993000 
1 1 1 17 50 5  o 3.492000 0.8551000 3.381000 1.336000  3.602000 1.067000  -0.2212000     1.710000  
1 1 1 17 50 7  o 13.20000 0.5312000 13.06000 0.4812000 13.35000 0.9472000 -0.2947000     1.062000  
1 1 1 17 50 9  o 7.899000 0.4555000 8.637000 0.6517000 7.161000 0.6366000 1.476000       0.9110000 
1 1 1 17 50 11 o 5.675000 0.8819000 5.428000 1.017000  5.922000 1.441000  -0.4938000     1.764000  
1 1 1 17 50 13 o 2.833000 0.8812000 2.817000 1.179000  2.848000 1.310000  -0.3067000E-01 1.762000  
1 1 1 17 50 15 o 3.251000 0.9307000 3.518000 1.262000  2.984000 1.368000  0.5346000      1.861000  
1 1 1 17 50 17 o 3.764000 1.002000  3.657000 1.362000  3.871000 1.469000  -0.2135000     2.004000  
1 1 1 17 50 19 o 3.621000 1.091000  2.642000 1.126000  4.600000 1.870000  -1.958000      2.182000  
1 1 1 17 50 21 o 5.947000 0.9079000 5.863000 1.075000  6.031000 1.463000  -0.1681000     1.816000  
1 1 1 17 50 23 o 7.748000 0.8581000 8.256000 0.9281000 7.240000 1.444000  1.016000       1.716000  
1 1 1 17 50 25 o 7.141000 0.7943000 7.116000 0.9214000 7.166000 1.294000  -0.4984000E-01 1.589000  
1 1 1 17 50 27 o 5.048000 1.034000  4.733000 1.257000  5.364000 1.641000  -0.6304000     2.067000  
1 1 1 17 50 29 o 3.922000 1.091000  3.740000 1.454000  4.104000 1.625000  -0.3641000     2.181000  
1 1 1 17 50 31 o 5.254000 1.081000  4.221000 1.339000  6.288000 1.698000  -2.068000      2.163000  
1 1 1 17 50 33 o 4.338000 1.212000  4.471000 1.502000  4.204000 1.903000  0.2668000      2.424000  
1 1 1 17 51 0  o 6.724000 0.7880000 6.724000 0.7880000 6.724000 0.7880000 0.000000       0.000000  
1 1 1 17 51 2  o 9.376000 0.4194000 8.989000 0.6064000 9.763000 0.5795000 -0.7738000     0.8388000 
1 1 1 17 51 4  o 17.27000 0.4592000 17.81000 0.5161000 16.72000 0.7596000 1.088000       0.9183000 
1 1 1 17 51 6  o 12.47000 0.3742000 12.82000 0.4962000 12.11000 0.5603000 0.7126000      0.7484000 
1 1 1 17 51 8  o 10.41000 0.5993000 10.32000 0.6988000 10.49000 0.9739000 -0.1718000     1.199000  
1 1 1 17 51 10 o 5.724000 0.9952000 5.286000 1.099000  6.162000 1.659000  -0.8761000     1.990000  
1 1 1 17 51 12 o 5.883000 0.9492000 6.103000 0.9758000 5.664000 1.628000  0.4390000      1.898000  
1 1 1 17 51 14 o 4.560000 0.9709000 5.248000 1.131000  3.872000 1.578000  1.376000       1.942000  
1 1 1 17 51 16 o 6.530000 1.090000  7.019000 0.7774000 6.040000 2.036000  0.9789000      2.180000  
1 1 1 17 51 18 f 3.898000 1.045000  3.150000 1.248000  4.645000 1.677000  -1.495000      2.091000  
1 1 1 17 51 20 o 4.796000 1.050000  5.153000 1.458000  4.439000 1.512000  0.7136000      2.100000  
1 1 1 17 51 22 o 7.318000 0.7864000 6.660000 0.9130000 7.976000 1.281000  -1.316000      1.573000  
1 1 1 17 51 24 f 3.599000 1.047000  2.626000 1.180000  4.572000 1.731000  -1.946000      2.095000  
1 1 1 17 51 26 o 9.160000 0.6797000 7.609000 0.8974000 10.71000 1.021000  -3.103000      1.359000  
1 1 1 17 51 28 o 4.911000 1.048000  3.512000 1.388000  6.310000 1.570000  -2.799000      2.096000  
1 1 1 17 51 30 o 4.431000 1.064000  4.860000 1.328000  4.001000 1.663000  0.8593000      2.128000  
1 1 1 17 51 32 o 6.116000 2.033000  6.116000 2.033000  ?        ?         ?              ?         
1 1 1 17 52 1  o 7.957000 0.4810000 8.024000 0.6801000 7.890000 0.6803000 0.1344000      0.9620000 
1 1 1 17 52 3  o 6.226000 0.6877000 5.553000 0.9376000 6.900000 1.006000  -1.347000      1.375000  
1 1 1 17 52 5  o 4.652000 0.8597000 6.030000 0.9212000 3.273000 1.452000  2.757000       1.719000  
1 1 1 17 52 7  o 4.898000 1.025000  5.619000 1.193000  4.176000 1.667000  1.443000       2.050000  
1 1 1 17 52 9  o 7.019000 0.8263000 7.436000 0.7686000 6.602000 1.463000  0.8340000      1.653000  
1 1 1 17 52 11 f 5.746000 0.9980000 5.137000 1.163000  6.355000 1.622000  -1.218000      1.996000  
1 1 1 17 52 13 o 4.131000 1.176000  3.147000 1.235000  5.114000 2.002000  -1.967000      2.352000  
1 1 1 17 52 15 o 5.267000 1.293000  3.800000 1.278000  6.733000 2.249000  -2.933000      2.587000  
1 1 1 17 52 17 f 3.319000 0.9220000 3.568000 1.234000  3.071000 1.370000  0.4964000      1.844000  
1 1 1 17 52 19 o 5.577000 1.129000  4.919000 1.530000  6.235000 1.661000  -1.316000      2.258000  
1 1 1 17 52 21 f 7.952000 0.7074000 7.691000 0.8660000 8.213000 1.119000  -0.5214000     1.415000  
1 1 1 17 52 23 o 5.687000 1.063000  4.475000 1.294000  6.898000 1.688000  -2.423000      2.127000  
1 1 1 17 52 25 o 4.223000 0.9861000 4.797000 1.267000  3.650000 1.511000  1.147000       1.972000  
1 1 1 17 52 27 o 5.496000 1.017000  5.667000 1.060000  5.325000 1.735000  0.3421000      2.034000  
1 1 1 17 52 29 o 4.247000 1.058000  3.523000 1.297000  4.971000 1.673000  -1.448000      2.117000  
1 1 1 17 53 0  o 9.339000 0.6103000 9.339000 0.6103000 9.339000 0.6103000 0.000000       0.000000  
1 1 1 17 53 2  o 10.83000 0.3656000 11.29000 0.5228000 10.38000 0.5111000 0.9081000      0.7311000 
1 1 1 17 53 4  o 3.888000 0.8259000 4.481000 1.070000  3.295000 1.259000  1.186000       1.652000  
1 1 1 17 53 6  o 6.026000 0.7682000 7.369000 0.9065000 4.684000 1.240000  2.685000       1.536000  
1 1 1 17 53 8  o 4.089000 1.070000  3.502000 1.245000  4.675000 1.739000  -1.173000      2.139000  
1 1 1 17 53 10 o 6.193000 1.106000  6.389000 0.8879000 5.997000 2.025000  0.3920000      2.211000  
1 1 1 17 53 12 o 5.800000 1.077000  4.178000 1.226000  7.422000 1.772000  -3.244000      2.154000  
1 1 1 17 53 14 o 5.651000 0.9740000 6.229000 1.029000  5.072000 1.654000  1.157000       1.948000  
1 1 1 17 53 16 o 10.86000 0.6128000 10.34000 0.7285000 11.38000 0.9855000 -1.042000      1.226000  
1 1 1 17 53 18 o 6.320000 0.8773000 5.698000 1.016000  6.941000 1.431000  -1.243000      1.755000  
1 1 1 17 53 20 o 4.344000 1.007000  4.855000 1.258000  3.833000 1.572000  1.022000       2.013000  
1 1 1 17 53 22 o 3.955000 1.051000  3.379000 1.303000  4.531000 1.649000  -1.152000      2.102000  
1 1 1 17 53 24 o 2.936000 0.8946000 3.130000 1.219000  2.743000 1.310000  0.3865000      1.789000  
1 1 1 17 53 26 o 3.613000 0.9902000 3.801000 1.338000  3.425000 1.460000  0.3760000      1.980000  
1 1 1 17 54 1  o 4.117000 0.8823000 4.482000 1.310000  3.753000 1.182000  0.7296000      1.765000  
1 1 1 17 54 3  o 4.409000 0.9234000 4.929000 1.337000  3.888000 1.274000  1.041000       1.847000  
1 1 1 17 54 5  o 6.238000 0.9519000 7.478000 0.7794000 4.998000 1.737000  2.480000       1.904000  
1 1 1 17 54 7  o 4.403000 1.056000  4.591000 1.144000  4.215000 1.777000  0.3762000      2.113000  
1 1 1 17 54 9  f 4.519000 1.117000  4.483000 1.107000  4.555000 1.941000  -0.7244000E-01 2.234000  
1 1 1 17 54 11 o 6.844000 0.9056000 7.424000 0.8511000 6.263000 1.599000  1.162000       1.811000  
1 1 1 17 54 13 o 2.871000 0.8768000 3.045000 1.219000  2.696000 1.261000  0.3486000      1.754000  
1 1 1 17 54 15 o 5.096000 1.093000  5.571000 1.441000  4.621000 1.645000  0.9497000      2.187000  
1 1 1 17 54 17 o 4.808000 1.110000  4.598000 1.290000  5.018000 1.807000  -0.4204000     2.220000  
1 1 1 17 54 19 o 4.184000 1.059000  3.559000 1.313000  4.809000 1.663000  -1.250000      2.119000  
1 1 1 17 54 21 o 4.253000 1.071000  3.690000 1.280000  4.815000 1.717000  -1.125000      2.141000  
1 1 1 17 54 23 o 4.684000 1.055000  5.279000 1.320000  4.090000 1.646000  1.189000       2.110000  
1 1 1 17 54 25 f 3.900000 1.074000  3.991000 1.468000  3.810000 1.568000  0.1813000      2.147000  
1 1 1 17 55 0  o 3.218000 1.311000  3.218000 1.311000  3.218000 1.311000  0.000000       0.000000  
1 1 1 17 55 2  o 5.878000 0.8254000 6.004000 1.227000  5.752000 1.105000  0.2512000      1.651000  
1 1 1 17 55 4  o 6.216000 1.063000  6.062000 0.8915000 6.369000 1.930000  -0.3077000     2.126000  
1 1 1 17 55 6  o 10.29000 0.8925000 9.989000 0.6022000 10.60000 1.680000  -0.6095000     1.785000  
1 1 1 17 55 8  o 4.551000 1.066000  3.961000 1.245000  5.142000 1.730000  -1.181000      2.131000  
1 1 1 17 55 10 o 6.597000 0.8855000 7.445000 0.7409000 5.748000 1.609000  1.697000       1.771000  
1 1 1 17 55 12 o 3.979000 0.9903000 3.824000 1.298000  4.134000 1.496000  -0.3097000     1.981000  
1 1 1 17 55 14 o 5.533000 1.071000  5.507000 1.271000  5.560000 1.723000  -0.5285000E-01 2.141000  
1 1 1 17 55 16 o 3.255000 0.9409000 3.441000 1.264000  3.069000 1.394000  0.3718000      1.882000  
1 1 1 17 55 18 o 4.814000 1.119000  4.152000 1.230000  5.476000 1.869000  -1.324000      2.238000  
1 1 1 17 55 20 o 5.225000 1.046000  4.988000 1.341000  5.462000 1.606000  -0.4743000     2.092000  
1 1 1 17 55 22 o 3.888000 1.084000  3.393000 1.302000  4.383000 1.734000  -0.9903000     2.169000  
1 1 1 17 56 1  o 7.350000 1.186000  5.720000 1.318000  8.980000 1.972000  -3.260000      2.372000  
1 1 1 17 56 3  o 6.276000 0.9600000 5.939000 1.083000  6.613000 1.586000  -0.6747000     1.920000  
1 1 1 17 56 5  o 4.166000 0.9783000 2.625000 1.111000  5.707000 1.611000  -3.082000      1.957000  
1 1 1 17 56 7  o 3.368000 0.9812000 2.295000 1.021000  4.442000 1.676000  -2.147000      1.962000  
1 1 1 17 56 9  o 4.040000 1.028000  3.852000 1.237000  4.227000 1.642000  -0.3748000     2.056000  
1 1 1 17 56 11 o 3.218000 0.9424000 2.887000 1.146000  3.549000 1.496000  -0.6615000     1.885000  
1 1 1 17 56 13 o 4.225000 1.068000  3.342000 1.278000  5.108000 1.712000  -1.766000      2.136000  
1 1 1 17 56 15 o 3.832000 1.021000  3.955000 1.341000  3.708000 1.541000  0.2465000      2.042000  
1 1 1 17 56 17 o 4.277000 1.106000  3.202000 1.384000  5.353000 1.727000  -2.151000      2.213000  
1 1 1 17 56 19 o 5.618000 1.026000  4.985000 1.198000  6.252000 1.666000  -1.267000      2.052000  
1 1 1 17 57 0  o 5.665000 1.749000  5.665000 1.749000  5.665000 1.749000  0.000000       0.000000  
1 1 1 17 57 2  o 5.283000 1.167000  5.880000 1.654000  4.685000 1.648000  1.195000       2.335000  
1 1 1 17 57 4  o 7.166000 1.158000  6.657000 1.744000  7.675000 1.524000  -1.019000      2.316000  
1 1 1 17 57 6  o 3.444000 1.024000  2.909000 1.252000  3.980000 1.621000  -1.071000      2.048000  
1 1 1 17 57 8  o 4.618000 0.9705000 3.370000 1.278000  5.866000 1.461000  -2.496000      1.941000  
1 1 1 17 57 10 o 4.454000 1.030000  4.768000 1.217000  4.140000 1.662000  0.6275000      2.060000  
1 1 1 17 57 12 o 5.909000 0.9599000 4.685000 1.257000  7.134000 1.451000  -2.449000      1.920000  
1 1 1 17 57 14 o 3.332000 0.9313000 3.659000 1.260000  3.004000 1.372000  0.6553000      1.863000  
1 1 1 17 58 1  o 5.735000 1.502000  5.517000 2.067000  5.953000 2.178000  -0.4368000     3.003000  
1 1 1 17 58 3  o 5.265000 1.356000  6.020000 2.092000  4.510000 1.726000  1.510000       2.712000  
1 1 1 17 58 5  o 3.087000 0.9934000 3.393000 1.517000  2.781000 1.283000  0.6124000      1.987000  
1 1 1 17 58 7  f 5.439000 1.079000  5.165000 1.262000  5.712000 1.750000  -0.5472000     2.158000  
1 1 1 17 58 9  o 2.880000 0.9092000 2.259000 1.041000  3.501000 1.491000  -1.242000      1.818000  
1 1 1 17 58 11 o 3.848000 1.114000  2.916000 1.316000  4.780000 1.799000  -1.863000      2.229000  
1 1 1 18 0  2  o 39.97000 0.4408000 39.97000 0.4408000 39.97000 0.4408000 0.000000       0.000000  
1 1 1 18 0  4  o 18.29000 0.3552000 18.29000 0.3552000 18.29000 0.3552000 0.000000       0.000000  
1 1 1 18 0  6  o 105.9000 1.031000  105.9000 1.031000  105.9000 1.031000  0.000000       0.000000  
1 1 1 18 0  8  o 25.17000 0.3643000 25.17000 0.3643000 25.17000 0.3643000 0.000000       0.000000  
1 1 1 18 0  10 o 110.0000 1.070000  110.0000 1.070000  110.0000 1.070000  0.000000       0.000000  
1 1 1 18 0  12 o 129.5000 1.448000  129.5000 1.448000  129.5000 1.448000  0.000000       0.000000  
1 1 1 18 0  14 o 26.50000 0.3809000 26.50000 0.3809000 26.50000 0.3809000 0.000000       0.000000  
1 1 1 18 0  16 o 24.75000 0.3813000 24.75000 0.3813000 24.75000 0.3813000 0.000000       0.000000  
1 1 1 18 0  18 f 41.15000 0.5381000 41.15000 0.5381000 41.15000 0.5381000 0.000000       0.000000  
1 1 1 18 0  20 o 47.58000 0.5150000 47.58000 0.5150000 47.58000 0.5150000 0.000000       0.000000  
1 1 1 18 0  22 o 25.79000 0.4034000 25.79000 0.4034000 25.79000 0.4034000 0.000000       0.000000  
1 1 1 18 0  24 o 41.84000 0.5500000 41.84000 0.5500000 41.84000 0.5500000 0.000000       0.000000  
1 1 1 18 0  26 o 11.26000 0.5538000 11.26000 0.5538000 11.26000 0.5538000 0.000000       0.000000  
1 1 1 18 0  28 o 53.84000 0.6601000 53.84000 0.6601000 53.84000 0.6601000 0.000000       0.000000  
1 1 1 18 0  30 f 57.99000 0.7058000 57.99000 0.7058000 57.99000 0.7058000 0.000000       0.000000  
1 1 1 18 0  32 o 33.65000 0.5214000 33.65000 0.5214000 33.65000 0.5214000 0.000000       0.000000  
1 1 1 18 0  34 o 5.448000 1.294000  5.448000 1.294000  5.448000 1.294000  0.000000       0.000000  
1 1 1 18 0  36 o 6.952000 1.100000  6.952000 1.100000  6.952000 1.100000  0.000000       0.000000  
1 1 1 18 0  38 o 15.18000 0.6126000 15.18000 0.6126000 15.18000 0.6126000 0.000000       0.000000  
1 1 1 18 0  40 o 46.44000 0.6184000 46.44000 0.6184000 46.44000 0.6184000 0.000000       0.000000  
1 1 1 18 0  42 o 7.586000 1.119000  7.586000 1.119000  7.586000 1.119000  0.000000       0.000000  
1 1 1 18 0  44 o 14.92000 0.6950000 14.92000 0.6950000 14.92000 0.6950000 0.000000       0.000000  
1 1 1 18 0  46 o 24.40000 0.6611000 24.40000 0.6611000 24.40000 0.6611000 0.000000       0.000000  
1 1 1 18 0  48 o 3.342000 1.336000  3.342000 1.336000  3.342000 1.336000  0.000000       0.000000  
1 1 1 18 0  50 o 9.629000 0.7510000 9.629000 0.7510000 9.629000 0.7510000 0.000000       0.000000  
1 1 1 18 0  52 o 6.408000 1.148000  6.408000 1.148000  6.408000 1.148000  0.000000       0.000000  
1 1 1 18 0  54 o 7.198000 1.018000  7.198000 1.018000  7.198000 1.018000  0.000000       0.000000  
1 1 1 18 0  56 o 8.185000 1.373000  8.185000 1.373000  8.185000 1.373000  0.000000       0.000000  
1 1 1 18 0  58 o 6.242000 1.357000  6.242000 1.357000  6.242000 1.357000  0.000000       0.000000  
1 1 1 18 0  60 o 8.177000 0.9943000 8.177000 0.9943000 8.177000 0.9943000 0.000000       0.000000  
1 1 1 18 0  62 o 7.099000 1.125000  7.099000 1.125000  7.099000 1.125000  0.000000       0.000000  
1 1 1 18 1  1  o 80.09000 0.5586000 79.91000 0.7887000 80.27000 0.7913000 -0.3651000     1.117000  
1 1 1 18 1  3  o 78.84000 0.7108000 79.14000 1.104000  78.55000 0.8963000 0.5906000      1.422000  
1 1 1 18 1  5  o 47.51000 0.3553000 47.14000 0.4990000 47.89000 0.5059000 -0.7548000     0.7105000 
1 1 1 18 1  7  o 28.89000 0.2663000 29.13000 0.3774000 28.65000 0.3759000 0.4814000      0.5326000 
1 1 1 18 1  9  o 29.47000 0.2702000 29.20000 0.3811000 29.74000 0.3831000 -0.5465000     0.5404000 
1 1 1 18 1  11 o 77.74000 0.5880000 77.61000 0.8878000 77.88000 0.7713000 -0.2746000     1.176000  
1 1 1 18 1  13 f 46.99000 0.3848000 47.18000 0.5050000 46.80000 0.5807000 0.3770000      0.7696000 
1 1 1 18 1  15 o 71.12000 0.5039000 71.67000 0.7167000 70.58000 0.7085000 1.093000       1.008000  
1 1 1 18 1  17 f 37.95000 0.3588000 38.07000 0.5086000 37.83000 0.5061000 0.2356000      0.7175000 
1 1 1 18 1  19 o 16.04000 0.3056000 16.29000 0.4312000 15.79000 0.4331000 0.4943000      0.6112000 
1 1 1 18 1  21 o 6.707000 0.6175000 5.621000 0.9729000 7.794000 0.7608000 -2.173000      1.235000  
1 1 1 18 1  23 o 42.24000 0.3677000 41.96000 0.4793000 42.52000 0.5577000 -0.5610000     0.7354000 
1 1 1 18 1  25 o 22.88000 0.3141000 23.01000 0.4851000 22.75000 0.3989000 0.2600000      0.6281000 
1 1 1 18 1  27 o 38.65000 0.3529000 38.24000 0.4635000 39.07000 0.5324000 -0.8345000     0.7059000 
1 1 1 18 1  29 o 32.99000 0.3773000 33.50000 0.6155000 32.49000 0.4364000 1.004000       0.7545000 
1 1 1 18 1  31 o 45.22000 0.3635000 45.66000 0.5174000 44.79000 0.5106000 0.8776000      0.7269000 
1 1 1 18 1  33 o 47.79000 0.4346000 47.80000 0.6129000 47.78000 0.6162000 0.2114000E-01  0.8691000 
1 1 1 18 1  35 o 34.62000 0.3261000 34.88000 0.4617000 34.36000 0.4607000 0.5273000      0.6523000 
1 1 1 18 1  37 o 29.10000 0.3307000 29.48000 0.4703000 28.73000 0.4649000 0.7478000      0.6613000 
1 1 1 18 1  39 o 28.63000 0.3295000 28.47000 0.4678000 28.79000 0.4641000 -0.3243000     0.6590000 
1 1 1 18 1  41 o 18.23000 0.4138000 18.38000 0.6210000 18.07000 0.5471000 0.3138000      0.8276000 
1 1 1 18 1  43 o 9.284000 0.8308000 9.139000 1.020000  9.429000 1.312000  -0.2899000     1.662000  
1 1 1 18 1  45 o 14.96000 0.4518000 14.81000 0.7116000 15.11000 0.5568000 -0.2918000     0.9035000 
1 1 1 18 1  47 o 21.20000 0.3459000 21.57000 0.4917000 20.83000 0.4866000 0.7335000      0.6918000 
1 1 1 18 1  49 o 9.446000 0.5561000 9.123000 0.8186000 9.770000 0.7529000 -0.6474000     1.112000  
1 1 1 18 1  51 o 4.811000 0.8914000 6.048000 1.163000  3.574000 1.352000  2.474000       1.783000  
1 1 1 18 1  53 o 9.691000 0.5991000 9.474000 0.8238000 9.908000 0.8701000 -0.4340000     1.198000  
1 1 1 18 1  55 o 18.05000 0.4149000 17.93000 0.5326000 18.16000 0.6364000 -0.2270000     0.8299000 
1 1 1 18 1  57 o 6.760000 0.7981000 5.621000 1.285000  7.899000 0.9476000 -2.279000      1.596000  
1 1 1 18 1  59 o 7.947000 0.7183000 8.522000 0.9617000 7.372000 1.067000  1.150000       1.437000  
1 1 1 18 1  61 o 4.985000 1.003000  5.062000 1.375000  4.907000 1.460000  0.1553000      2.006000  
1 1 1 18 1  63 o 5.863000 1.064000  4.756000 1.528000  6.969000 1.481000  -2.213000      2.128000  
1 1 1 18 2  0  o 135.2000 1.307000  135.2000 1.307000  135.2000 1.307000  0.000000       0.000000  
1 1 1 18 2  2  o 71.84000 0.5050000 72.30000 0.7186000 71.38000 0.7098000 0.9239000      1.010000  
1 1 1 18 2  4  o 68.02000 0.5536000 67.97000 0.7816000 68.07000 0.7843000 -0.9936000E-01 1.107000  
1 1 1 18 2  6  o 109.1000 0.8124000 108.0000 1.051000  110.2000 1.239000  -2.170000      1.625000  
1 1 1 18 2  8  o 131.3000 0.8982000 130.9000 1.267000  131.6000 1.274000  -0.6493000     1.796000  
1 1 1 18 2  10 o 29.52000 0.2912000 29.17000 0.4357000 29.88000 0.3864000 -0.7156000     0.5824000 
1 1 1 18 2  12 o 68.07000 0.5215000 67.30000 0.7802000 68.83000 0.6922000 -1.524000      1.043000  
1 1 1 18 2  14 o 53.00000 0.4233000 52.67000 0.5498000 53.33000 0.6438000 -0.6584000     0.8466000 
1 1 1 18 2  16 o 35.40000 0.3220000 35.31000 0.4244000 35.49000 0.4845000 -0.1752000     0.6441000 
1 1 1 18 2  18 f 15.32000 0.3260000 15.51000 0.4742000 15.13000 0.4476000 0.3853000      0.6521000 
1 1 1 18 2  20 o 32.06000 0.2926000 32.32000 0.4163000 31.81000 0.4113000 0.5120000      0.5852000 
1 1 1 18 2  22 o 33.96000 0.3267000 34.00000 0.4248000 33.91000 0.4964000 0.9437000E-01  0.6534000 
1 1 1 18 2  24 o 42.53000 0.3410000 43.01000 0.4861000 42.05000 0.4784000 0.9617000      0.6820000 
1 1 1 18 2  26 o 50.20000 0.4439000 50.28000 0.6309000 50.13000 0.6246000 0.1560000      0.8878000 
1 1 1 18 2  28 o 27.72000 0.2973000 27.78000 0.4191000 27.66000 0.4218000 0.1268000      0.5946000 
1 1 1 18 2  30 o 25.59000 0.3443000 25.33000 0.4785000 25.84000 0.4952000 -0.5157000     0.6886000 
1 1 1 18 2  32 o 24.49000 0.3121000 24.34000 0.4362000 24.64000 0.4466000 -0.3019000     0.6242000 
1 1 1 18 2  34 o 31.61000 0.3166000 31.53000 0.4464000 31.70000 0.4489000 -0.1708000     0.6331000 
1 1 1 18 2  36 f 20.47000 0.3369000 20.12000 0.4867000 20.83000 0.4658000 -0.7154000     0.6737000 
1 1 1 18 2  38 o 4.786000 1.026000  5.770000 1.430000  3.802000 1.472000  1.968000       2.052000  
1 1 1 18 2  40 o 30.00000 0.3349000 29.72000 0.4738000 30.29000 0.4734000 -0.5760000     0.6698000 
1 1 1 18 2  42 o 10.26000 0.6369000 10.42000 1.004000  10.09000 0.7838000 0.3241000      1.274000  
1 1 1 18 2  44 o 27.21000 0.3446000 26.64000 0.5143000 27.79000 0.4589000 -1.144000      0.6892000 
1 1 1 18 2  46 o 18.44000 0.3991000 18.76000 0.5712000 18.12000 0.5576000 0.6404000      0.7982000 
1 1 1 18 2  48 o 15.55000 0.3875000 15.52000 0.5475000 15.58000 0.5484000 -0.5896000E-01 0.7750000 
1 1 1 18 2  50 o 17.91000 0.3458000 18.08000 0.4910000 17.74000 0.4869000 0.3381000      0.6915000 
1 1 1 18 2  52 o 14.32000 0.4405000 14.89000 0.5789000 13.74000 0.6642000 1.151000       0.8810000 
1 1 1 18 2  54 o 10.28000 0.6178000 11.25000 0.8231000 9.313000 0.9214000 1.937000       1.236000  
1 1 1 18 2  56 o 10.11000 0.6484000 10.07000 0.8421000 10.16000 0.9861000 -0.9585000E-01 1.297000  
1 1 1 18 2  58 o 2.869000 0.8991000 3.208000 1.345000  2.530000 1.194000  0.6780000      1.798000  
1 1 1 18 2  60 o 9.504000 0.5860000 9.992000 0.8314000 9.017000 0.8260000 0.9749000      1.172000  
1 1 1 18 2  62 o 3.836000 1.014000  3.670000 1.472000  4.002000 1.397000  -0.3318000     2.029000  
1 1 1 18 3  1  o 80.45000 0.5606000 80.23000 0.7911000 80.67000 0.7946000 -0.4423000     1.121000  
1 1 1 18 3  3  o 139.8000 0.9556000 140.6000 1.360000  139.0000 1.343000  1.592000       1.911000  
1 1 1 18 3  5  o 87.03000 0.6044000 86.63000 0.8511000 87.43000 0.8585000 -0.8017000     1.209000  
1 1 1 18 3  7  o 23.39000 0.3568000 23.13000 0.4990000 23.65000 0.5102000 -0.5197000     0.7137000 
1 1 1 18 3  9  o 18.81000 0.2811000 19.17000 0.3684000 18.45000 0.4246000 0.7200000      0.5622000 
1 1 1 18 3  11 o 131.2000 0.9709000 131.6000 1.471000  130.9000 1.267000  0.7169000      1.942000  
1 1 1 18 3  13 o 87.89000 0.6612000 87.89000 0.8648000 87.88000 1.001000  0.1031000E-01  1.322000  
1 1 1 18 3  15 o 17.14000 0.3095000 16.98000 0.4056000 17.30000 0.4676000 -0.3249000     0.6190000 
1 1 1 18 3  17 o 39.88000 0.3221000 39.91000 0.4533000 39.85000 0.4579000 0.5614000E-01  0.6443000 
1 1 1 18 3  19 o 44.05000 0.3717000 43.86000 0.4850000 44.24000 0.5635000 -0.3783000     0.7435000 
1 1 1 18 3  21 o 60.00000 0.4726000 59.77000 0.6154000 60.22000 0.7175000 -0.4582000     0.9452000 
1 1 1 18 3  23 o 26.84000 0.2859000 26.89000 0.4044000 26.78000 0.4042000 0.1034000      0.5718000 
1 1 1 18 3  25 o 42.65000 0.3701000 43.20000 0.4877000 42.11000 0.5568000 1.094000       0.7402000 
1 1 1 18 3  27 o 42.22000 0.3735000 42.40000 0.4889000 42.04000 0.5649000 0.3568000      0.7471000 
1 1 1 18 3  29 o 26.69000 0.3212000 26.70000 0.4758000 26.68000 0.4315000 0.1694000E-01  0.6424000 
1 1 1 18 3  31 o 26.20000 0.3368000 26.47000 0.5108000 25.93000 0.4391000 0.5486000      0.6736000 
1 1 1 18 3  33 o 40.43000 0.3956000 40.85000 0.5590000 40.02000 0.5598000 0.8298000      0.7912000 
1 1 1 18 3  35 o 35.50000 0.3310000 35.33000 0.4634000 35.67000 0.4728000 -0.3379000     0.6620000 
1 1 1 18 3  37 o 33.47000 0.3349000 33.74000 0.4752000 33.20000 0.4720000 0.5340000      0.6697000 
1 1 1 18 3  39 o 19.52000 0.3840000 19.73000 0.5177000 19.31000 0.5673000 0.4220000      0.7680000 
1 1 1 18 3  41 o 16.61000 0.4026000 16.47000 0.5646000 16.75000 0.5741000 -0.2834000     0.8052000 
1 1 1 18 3  43 o 19.65000 0.4713000 18.95000 0.7528000 20.35000 0.5675000 -1.401000      0.9427000 
1 1 1 18 3  45 o 8.819000 0.6360000 8.649000 0.9426000 8.989000 0.8539000 -0.3398000     1.272000  
1 1 1 18 3  47 o 28.63000 0.3285000 28.51000 0.4623000 28.75000 0.4670000 -0.2445000     0.6571000 
1 1 1 18 3  49 o 13.24000 0.4137000 12.69000 0.6272000 13.78000 0.5396000 -1.086000      0.8274000 
1 1 1 18 3  51 o 10.25000 0.5293000 9.697000 0.7925000 10.80000 0.7017000 -1.105000      1.059000  
1 1 1 18 3  53 o 5.145000 0.8988000 3.938000 1.361000  6.352000 1.175000  -2.414000      1.798000  
1 1 1 18 3  55 o 12.99000 0.5242000 12.61000 0.8178000 13.37000 0.6561000 -0.7630000     1.048000  
1 1 1 18 3  57 o 5.270000 0.9307000 6.433000 1.149000  4.106000 1.464000  2.327000       1.861000  
1 1 1 18 3  59 o 8.978000 0.6560000 8.801000 0.9518000 9.154000 0.9028000 -0.3523000     1.312000  
1 1 1 18 3  61 o 5.927000 0.9372000 5.819000 1.409000  6.035000 1.236000  -0.2159000     1.874000  
1 1 1 18 3  63 o 5.773000 1.286000  4.964000 1.954000  6.582000 1.673000  -1.618000      2.572000  
1 1 1 18 4  0  o 12.11000 0.4168000 12.11000 0.4168000 12.11000 0.4168000 0.000000       0.000000  
1 1 1 18 4  2  o 50.15000 0.3689000 50.18000 0.5221000 50.12000 0.5212000 0.6359000E-01  0.7377000 
1 1 1 18 4  4  o 14.08000 0.2796000 14.11000 0.3856000 14.06000 0.4049000 0.5566000E-01  0.5591000 
1 1 1 18 4  6  o 180.3000 1.227000  179.1000 1.724000  181.5000 1.747000  -2.395000      2.454000  
1 1 1 18 4  8  f 107.2000 0.7379000 106.2000 1.035000  108.1000 1.052000  -1.855000      1.476000  
1 1 1 18 4  10 f 93.64000 1.116000  92.56000 1.805000  94.72000 1.314000  -2.160000      2.233000  
1 1 1 18 4  12 o 159.8000 1.090000  160.6000 1.549000  159.0000 1.535000  1.594000       2.180000  
1 1 1 18 4  14 o 47.68000 0.3928000 47.27000 0.5090000 48.08000 0.5983000 -0.8092000     0.7856000 
1 1 1 18 4  16 o 79.06000 0.5993000 78.71000 0.7817000 79.40000 0.9088000 -0.6899000     1.199000  
1 1 1 18 4  18 o 51.35000 0.4435000 51.27000 0.6253000 51.43000 0.6290000 -0.1639000     0.8869000 
1 1 1 18 4  20 o 62.98000 0.4548000 62.88000 0.6416000 63.07000 0.6447000 -0.1957000     0.9095000 
1 1 1 18 4  22 o 33.12000 0.2965000 32.88000 0.4180000 33.36000 0.4205000 -0.4795000     0.5930000 
1 1 1 18 4  24 o 28.76000 0.3113000 28.58000 0.3989000 28.94000 0.4780000 -0.3564000     0.6225000 
1 1 1 18 4  26 o 16.11000 0.3414000 16.01000 0.4101000 16.20000 0.5460000 -0.1962000     0.6828000 
1 1 1 18 4  28 o 46.31000 0.3962000 46.16000 0.5166000 46.45000 0.6010000 -0.2918000     0.7925000 
1 1 1 18 4  30 o 77.64000 0.5985000 77.74000 0.7830000 77.54000 0.9052000 0.2002000      1.197000  
1 1 1 18 4  32 o 50.38000 0.4530000 50.25000 0.6423000 50.50000 0.6390000 -0.2520000     0.9060000 
1 1 1 18 4  34 o 46.30000 0.4029000 46.64000 0.6080000 45.96000 0.5289000 0.6811000      0.8058000 
1 1 1 18 4  36 o 26.82000 0.3220000 26.87000 0.4519000 26.76000 0.4587000 0.1173000      0.6439000 
1 1 1 18 4  38 o 31.33000 0.3576000 31.74000 0.4777000 30.92000 0.5321000 0.8142000      0.7151000 
1 1 1 18 4  40 o 17.28000 0.3942000 17.36000 0.5585000 17.20000 0.5565000 0.1574000      0.7884000 
1 1 1 18 4  42 o 10.18000 0.6008000 10.22000 0.9043000 10.14000 0.7913000 0.8123000E-01  1.202000  
1 1 1 18 4  44 o 7.577000 0.7480000 7.354000 1.098000  7.801000 1.016000  -0.4477000     1.496000  
1 1 1 18 4  46 o 5.431000 1.047000  4.523000 1.664000  6.339000 1.273000  -1.816000      2.095000  
1 1 1 18 4  48 o 13.86000 0.4063000 13.82000 0.5808000 13.90000 0.5684000 -0.8311000E-01 0.8127000 
1 1 1 18 4  50 o 6.080000 0.8078000 6.114000 1.144000  6.046000 1.141000  0.6751000E-01  1.616000  
1 1 1 18 4  52 o 12.06000 0.4646000 11.63000 0.6554000 12.48000 0.6587000 -0.8434000     0.9292000 
1 1 1 18 4  54 o 12.55000 0.6293000 12.69000 0.7463000 12.40000 1.013000  0.2956000      1.259000  
1 1 1 18 4  56 o 4.373000 1.123000  3.922000 1.628000  4.824000 1.547000  -0.9016000     2.246000  
1 1 1 18 4  58 o 5.534000 0.9881000 5.097000 1.561000  5.970000 1.212000  -0.8737000     1.976000  
1 1 1 18 4  60 o 4.446000 0.9770000 4.542000 1.419000  4.349000 1.343000  0.1924000      1.954000  
1 1 1 18 4  62 o 4.832000 1.074000  4.714000 1.389000  4.950000 1.638000  -0.2359000     2.148000  
1 1 1 18 5  1  o 111.1000 0.7630000 110.2000 1.070000  112.0000 1.088000  -1.829000      1.526000  
1 1 1 18 5  3  o 62.52000 0.4461000 62.11000 0.6267000 62.93000 0.6349000 -0.8151000     0.8922000 
1 1 1 18 5  5  o 94.04000 0.7028000 94.27000 0.9221000 93.82000 1.061000  0.4506000      1.406000  
1 1 1 18 5  7  o 28.26000 0.3077000 28.37000 0.4270000 28.15000 0.4431000 0.2254000      0.6154000 
1 1 1 18 5  9  o 53.67000 0.4544000 53.38000 0.6360000 53.96000 0.6491000 -0.5796000     0.9087000 
1 1 1 18 5  11 o 56.90000 0.4768000 56.76000 0.6714000 57.04000 0.6773000 -0.2788000     0.9537000 
1 1 1 18 5  13 o 41.16000 0.3776000 41.04000 0.5324000 41.28000 0.5356000 -0.2410000     0.7552000 
1 1 1 18 5  15 o 47.95000 0.4467000 47.06000 0.5066000 48.84000 0.7360000 -1.780000      0.8935000 
1 1 1 18 5  17 f 36.13000 0.3294000 35.72000 0.4272000 36.55000 0.5015000 -0.8317000     0.6587000 
1 1 1 18 5  19 o 48.10000 0.3949000 47.89000 0.5936000 48.31000 0.5210000 -0.4184000     0.7898000 
1 1 1 18 5  21 o 43.25000 0.3402000 42.76000 0.4757000 43.74000 0.4863000 -0.9857000     0.6803000 
1 1 1 18 5  23 o 44.02000 0.3742000 43.59000 0.5609000 44.45000 0.4955000 -0.8669000     0.7484000 
1 1 1 18 5  25 o 28.50000 0.3008000 28.27000 0.3576000 28.72000 0.4837000 -0.4489000     0.6016000 
1 1 1 18 5  27 o 52.02000 0.4079000 51.98000 0.4975000 52.06000 0.6465000 -0.8196000E-01 0.8158000 
1 1 1 18 5  29 o 26.39000 0.3452000 26.10000 0.4827000 26.68000 0.4937000 -0.5821000     0.6904000 
1 1 1 18 5  31 o 7.415000 0.6983000 6.956000 1.056000  7.874000 0.9146000 -0.9179000     1.397000  
1 1 1 18 5  33 o 66.35000 0.6248000 66.60000 0.9698000 66.10000 0.7881000 0.5037000      1.250000  
1 1 1 18 5  35 o 57.59000 0.4356000 58.18000 0.6167000 57.00000 0.6155000 1.178000       0.8713000 
1 1 1 18 5  37 o 42.75000 0.3907000 43.37000 0.5145000 42.13000 0.5882000 1.237000       0.7814000 
1 1 1 18 5  39 o 12.07000 0.5025000 11.83000 0.7562000 12.31000 0.6621000 -0.4838000     1.005000  
1 1 1 18 5  41 o 11.78000 0.5667000 11.91000 0.7388000 11.65000 0.8596000 0.2676000      1.133000  
1 1 1 18 5  43 o 11.91000 0.5663000 11.53000 0.8292000 12.30000 0.7715000 -0.7754000     1.133000  
1 1 1 18 5  45 o 15.78000 0.4035000 15.28000 0.5462000 16.27000 0.5941000 -0.9888000     0.8071000 
1 1 1 18 5  47 o 12.27000 0.5050000 11.88000 0.8128000 12.67000 0.5996000 -0.7868000     1.010000  
1 1 1 18 5  49 o 5.622000 0.8766000 5.668000 1.220000  5.575000 1.259000  0.9226000E-01  1.753000  
1 1 1 18 5  51 o 3.415000 0.9714000 3.360000 1.337000  3.470000 1.409000  -0.1095000     1.943000  
1 1 1 18 5  53 o 9.854000 0.6161000 9.373000 0.8088000 10.33000 0.9297000 -0.9614000     1.232000  
1 1 1 18 5  55 o 11.92000 0.4655000 11.77000 0.6701000 12.07000 0.6462000 -0.2988000     0.9309000 
1 1 1 18 5  57 o 11.49000 0.5087000 11.72000 0.7121000 11.26000 0.7267000 0.4673000      1.017000  
1 1 1 18 5  59 o 8.104000 0.7222000 7.750000 1.134000  8.457000 0.8945000 -0.7071000     1.444000  
1 1 1 18 5  61 o 11.05000 0.5403000 11.69000 0.7680000 10.41000 0.7601000 1.284000       1.081000  
1 1 1 18 6  0  o 36.53000 0.4774000 36.53000 0.4774000 36.53000 0.4774000 0.000000       0.000000  
1 1 1 18 6  2  o 58.07000 0.4527000 57.03000 0.5808000 59.11000 0.6946000 -2.077000      0.9054000 
1 1 1 18 6  4  o 73.61000 0.5589000 73.35000 0.7284000 73.87000 0.8480000 -0.5261000     1.118000  
1 1 1 18 6  6  f 48.17000 0.4144000 48.34000 0.5849000 48.00000 0.5872000 0.3419000      0.8287000 
1 1 1 18 6  8  o 65.76000 0.6058000 64.76000 0.7509000 66.75000 0.9508000 -1.987000      1.212000  
1 1 1 18 6  10 o 155.9000 1.148000  156.9000 1.513000  154.9000 1.727000  1.947000       2.296000  
1 1 1 18 6  12 o 62.10000 0.4831000 62.35000 0.6343000 61.85000 0.7289000 0.4988000      0.9662000 
1 1 1 18 6  14 o 76.93000 0.8832000 76.93000 0.8832000 ?        ?         ?              ?         
1 1 1 18 6  16 o 61.06000 0.5708000 61.73000 0.7286000 60.40000 0.8787000 1.327000       1.142000  
1 1 1 18 6  18 o 41.06000 0.3275000 41.20000 0.4642000 40.92000 0.4620000 0.2808000      0.6550000 
1 1 1 18 6  20 o 38.19000 0.3411000 38.42000 0.4491000 37.96000 0.5136000 0.4556000      0.6823000 
1 1 1 18 6  22 o 56.47000 0.4467000 56.41000 0.6728000 56.54000 0.5879000 -0.1232000     0.8935000 
1 1 1 18 6  24 o 3.531000 0.9063000 2.994000 1.157000  4.068000 1.396000  -1.074000      1.813000  
1 1 1 18 6  26 o 51.98000 0.4059000 52.46000 0.4998000 51.50000 0.6398000 0.9574000      0.8119000 
1 1 1 18 6  28 o 39.66000 0.3610000 38.98000 0.4625000 40.33000 0.5544000 -1.355000      0.7220000 
1 1 1 18 6  30 o 27.15000 0.3967000 26.68000 0.5016000 27.62000 0.6149000 -0.9339000     0.7935000 
1 1 1 18 6  32 o 28.27000 0.3317000 28.38000 0.4320000 28.16000 0.5035000 0.2236000      0.6634000 
1 1 1 18 6  34 o 23.19000 0.3526000 22.96000 0.5284000 23.42000 0.4670000 -0.4622000     0.7052000 
1 1 1 18 6  36 o 16.09000 0.4214000 15.97000 0.5556000 16.22000 0.6339000 -0.2473000     0.8429000 
1 1 1 18 6  38 o 7.601000 0.7629000 7.578000 1.082000  7.624000 1.075000  -0.4562000E-01 1.526000  
1 1 1 18 6  40 o 24.28000 0.3696000 24.86000 0.4923000 23.70000 0.5513000 1.164000       0.7391000 
1 1 1 18 6  42 o 6.502000 0.9121000 7.393000 1.098000  5.611000 1.457000  1.782000       1.824000  
1 1 1 18 6  44 o 17.98000 0.4011000 18.18000 0.6038000 17.78000 0.5280000 0.3985000      0.8021000 
1 1 1 18 6  46 o 7.695000 0.7108000 7.524000 1.101000  7.866000 0.8998000 -0.3421000     1.422000  
1 1 1 18 6  48 f 14.66000 0.4313000 14.05000 0.6829000 15.28000 0.5270000 -1.230000      0.8626000 
1 1 1 18 6  50 o 4.634000 0.9799000 5.256000 1.271000  4.013000 1.492000  1.243000       1.960000  
1 1 1 18 6  52 o 3.943000 0.9354000 4.689000 1.338000  3.197000 1.308000  1.491000       1.871000  
1 1 1 18 6  54 o 6.416000 0.9207000 7.204000 1.164000  5.628000 1.427000  1.575000       1.841000  
1 1 1 18 6  56 o 6.936000 0.8820000 6.376000 1.335000  7.497000 1.154000  -1.121000      1.764000  
1 1 1 18 6  58 o 3.696000 1.100000  4.027000 1.736000  3.366000 1.350000  0.6610000      2.199000  
1 1 1 18 6  60 o 3.707000 0.9933000 3.134000 1.361000  4.280000 1.447000  -1.146000      1.987000  
1 1 1 18 6  62 o 3.370000 0.9804000 2.986000 1.317000  3.753000 1.453000  -0.7668000     1.961000  
1 1 1 18 7  1  o 62.99000 0.4857000 62.70000 0.6320000 63.29000 0.7376000 -0.5954000     0.9713000 
1 1 1 18 7  3  o 60.71000 0.4704000 60.52000 0.6128000 60.91000 0.7140000 -0.3855000     0.9409000 
1 1 1 18 7  5  o 26.74000 0.2756000 26.58000 0.4139000 26.90000 0.3640000 -0.3209000     0.5512000 
1 1 1 18 7  7  o 55.78000 0.4358000 55.86000 0.6585000 55.71000 0.5712000 0.1521000      0.8717000 
1 1 1 18 7  9  o 55.28000 0.4024000 55.10000 0.5672000 55.47000 0.5709000 -0.3697000     0.8048000 
1 1 1 18 7  11 o 52.87000 0.4181000 52.63000 0.5458000 53.10000 0.6335000 -0.4633000     0.8362000 
1 1 1 18 7  13 o 65.33000 0.7320000 65.51000 0.6613000 65.15000 1.306000  0.3654000      1.464000  
1 1 1 18 7  15 o 79.96000 0.6913000 79.55000 0.7893000 80.36000 1.135000  -0.8120000     1.383000  
1 1 1 18 7  17 o 89.87000 0.6754000 89.08000 1.013000  90.66000 0.8933000 -1.578000      1.351000  
1 1 1 18 7  19 o 76.91000 0.6268000 76.39000 0.8800000 77.43000 0.8928000 -1.037000      1.254000  
1 1 1 18 7  21 o 27.03000 0.2980000 27.07000 0.4439000 27.00000 0.3976000 0.6891000E-01  0.5959000 
1 1 1 18 7  23 o 20.84000 0.2987000 20.61000 0.3513000 21.08000 0.4832000 -0.4634000     0.5974000 
1 1 1 18 7  25 o 32.36000 0.3109000 32.14000 0.3758000 32.58000 0.4953000 -0.4415000     0.6218000 
1 1 1 18 7  27 o 35.33000 0.3218000 35.43000 0.3924000 35.22000 0.5101000 0.2123000      0.6436000 
1 1 1 18 7  29 o 19.98000 0.3548000 20.23000 0.4740000 19.72000 0.5280000 0.5132000      0.7095000 
1 1 1 18 7  31 o 33.30000 0.3640000 33.66000 0.5195000 32.93000 0.5099000 0.7329000      0.7280000 
1 1 1 18 7  33 o 50.79000 0.4270000 51.17000 0.6433000 50.40000 0.5617000 0.7660000      0.8540000 
1 1 1 18 7  35 f 13.57000 0.5438000 13.85000 0.7966000 13.29000 0.7404000 0.5576000      1.088000  
1 1 1 18 7  37 o 34.82000 0.3383000 35.06000 0.4711000 34.59000 0.4857000 0.4737000      0.6767000 
1 1 1 18 7  39 o 13.91000 0.4805000 13.81000 0.6552000 14.01000 0.7029000 -0.2004000     0.9609000 
1 1 1 18 7  41 o 16.16000 0.4161000 15.28000 0.6196000 17.05000 0.5555000 -1.775000      0.8322000 
1 1 1 18 7  43 o 16.40000 0.4201000 15.65000 0.5359000 17.15000 0.6472000 -1.499000      0.8403000 
1 1 1 18 7  45 o 22.13000 0.4361000 22.82000 0.6810000 21.43000 0.5450000 1.395000       0.8722000 
1 1 1 18 7  47 o 17.14000 0.3667000 17.01000 0.5067000 17.27000 0.5302000 -0.2551000     0.7333000 
1 1 1 18 7  49 o 5.835000 0.8848000 5.374000 1.295000  6.295000 1.206000  -0.9214000     1.770000  
1 1 1 18 7  51 o 14.27000 0.3960000 13.94000 0.5543000 14.61000 0.5656000 -0.6671000     0.7919000 
1 1 1 18 7  53 o 11.50000 0.4698000 11.46000 0.6549000 11.53000 0.6739000 -0.6227000E-01 0.9397000 
1 1 1 18 7  55 o 8.882000 0.6121000 9.011000 0.8551000 8.753000 0.8762000 0.2577000      1.224000  
1 1 1 18 7  57 o 5.770000 1.096000  5.255000 1.794000  6.285000 1.260000  -1.029000      2.192000  
1 1 1 18 7  59 o 3.655000 0.9913000 2.833000 1.299000  4.478000 1.498000  -1.645000      1.983000  
1 1 1 18 7  61 o 5.260000 0.9525000 5.305000 1.363000  5.214000 1.331000  0.9081000E-01  1.905000  
1 1 1 18 8  0  o 116.0000 1.590000  116.0000 1.590000  116.0000 1.590000  0.000000       0.000000  
1 1 1 18 8  2  o 86.65000 0.6485000 85.94000 0.9731000 87.35000 0.8575000 -1.404000      1.297000  
1 1 1 18 8  4  o 50.11000 0.3984000 50.56000 0.6049000 49.67000 0.5185000 0.8920000      0.7968000 
1 1 1 18 8  6  o 73.14000 0.5142000 73.30000 0.7292000 72.98000 0.7252000 0.3248000      1.028000  
1 1 1 18 8  8  o 52.05000 0.4112000 52.22000 0.5420000 51.88000 0.6186000 0.3335000      0.8225000 
1 1 1 18 8  10 o 75.40000 0.5706000 75.65000 0.7508000 75.16000 0.8594000 0.4937000      1.141000  
1 1 1 18 8  12 o 19.94000 0.3096000 19.43000 0.3758000 20.44000 0.4921000 -1.005000      0.6192000 
1 1 1 18 8  14 o 51.50000 0.3832000 50.71000 0.5345000 52.28000 0.5493000 -1.568000      0.7664000 
1 1 1 18 8  16 o 52.57000 0.4822000 52.54000 0.5501000 52.60000 0.7921000 -0.6232000E-01 0.9643000 
1 1 1 18 8  18 o 30.03000 0.3233000 30.01000 0.4550000 30.06000 0.4595000 -0.5151000E-01 0.6466000 
1 1 1 18 8  20 o 50.99000 0.4893000 50.10000 0.7430000 51.89000 0.6368000 -1.793000      0.9786000 
1 1 1 18 8  22 o 44.28000 0.4148000 44.63000 0.4394000 43.94000 0.7037000 0.6870000      0.8297000 
1 1 1 18 8  24 o 11.88000 0.3950000 11.64000 0.4749000 12.12000 0.6313000 -0.4810000     0.7900000 
1 1 1 18 8  26 f 56.80000 0.4370000 56.40000 0.5286000 57.20000 0.6959000 -0.7962000     0.8739000 
1 1 1 18 8  28 o 16.58000 0.3485000 16.46000 0.4428000 16.70000 0.5382000 -0.2427000     0.6970000 
1 1 1 18 8  30 o 19.24000 0.3855000 18.95000 0.3968000 19.53000 0.6611000 -0.5775000     0.7711000 
1 1 1 18 8  32 o 30.28000 0.3694000 30.72000 0.5283000 29.83000 0.5165000 0.8916000      0.7389000 
1 1 1 18 8  34 o 26.11000 0.3421000 25.21000 0.4351000 27.01000 0.5279000 -1.799000      0.6841000 
1 1 1 18 8  36 o 8.933000 0.6710000 7.991000 1.047000  9.875000 0.8388000 -1.884000      1.342000  
1 1 1 18 8  38 o 28.68000 0.3609000 28.95000 0.4589000 28.41000 0.5571000 0.5368000      0.7218000 
1 1 1 18 8  40 o 16.11000 0.4013000 15.75000 0.5761000 16.47000 0.5587000 -0.7174000     0.8025000 
1 1 1 18 8  42 o 21.54000 0.3760000 21.75000 0.5583000 21.33000 0.5037000 0.4261000      0.7520000 
1 1 1 18 8  44 o 23.82000 0.3259000 24.10000 0.4567000 23.55000 0.4651000 0.5459000      0.6519000 
1 1 1 18 8  46 f 7.418000 0.8159000 7.124000 1.309000  7.711000 0.9739000 -0.5867000     1.632000  
1 1 1 18 8  48 o 14.41000 0.3958000 14.08000 0.5576000 14.74000 0.5619000 -0.6610000     0.7916000 
1 1 1 18 8  50 o 22.54000 0.3337000 22.44000 0.4725000 22.63000 0.4714000 -0.1897000     0.6674000 
1 1 1 18 8  52 o 9.689000 0.5255000 9.717000 0.7357000 9.660000 0.7505000 0.5733000E-01  1.051000  
1 1 1 18 8  54 o 5.800000 0.9522000 5.554000 1.294000  6.046000 1.397000  -0.4919000     1.904000  
1 1 1 18 8  56 o 11.92000 0.6227000 11.89000 0.9993000 11.94000 0.7432000 -0.5153000E-01 1.245000  
1 1 1 18 8  58 o 8.324000 0.7549000 8.780000 1.119000  7.868000 1.013000  0.9120000      1.510000  
1 1 1 18 8  60 o 5.116000 1.079000  6.256000 1.551000  3.977000 1.502000  2.279000       2.159000  
1 1 1 18 8  62 o 6.076000 0.9779000 6.520000 1.306000  5.632000 1.456000  0.8882000      1.956000  
1 1 1 18 9  1  o 66.85000 0.6095000 66.62000 0.9428000 67.08000 0.7726000 -0.4585000     1.219000  
1 1 1 18 9  3  o 32.38000 0.2950000 32.48000 0.3903000 32.27000 0.4425000 0.2132000      0.5901000 
1 1 1 18 9  5  o 111.2000 0.8240000 111.6000 1.084000  110.8000 1.241000  0.7311000      1.648000  
1 1 1 18 9  7  o 47.03000 0.4313000 47.60000 0.5049000 46.46000 0.6994000 1.133000       0.8626000 
1 1 1 18 9  9  o 67.50000 0.5537000 67.21000 0.7839000 67.78000 0.7822000 -0.5700000     1.107000  
1 1 1 18 9  11 o 48.08000 0.3872000 48.09000 0.5096000 48.08000 0.5832000 0.9510000E-02  0.7744000 
1 1 1 18 9  13 o 52.03000 0.4164000 51.64000 0.5410000 52.43000 0.6331000 -0.7863000     0.8327000 
1 1 1 18 9  15 o 17.57000 0.3030000 17.16000 0.3925000 17.98000 0.4617000 -0.8262000     0.6060000 
1 1 1 18 9  17 o 25.96000 0.2897000 26.07000 0.4390000 25.86000 0.3782000 0.2086000      0.5795000 
1 1 1 18 9  19 o 35.37000 0.3545000 35.16000 0.4921000 35.58000 0.5103000 -0.4238000     0.7090000 
1 1 1 18 9  21 o 24.47000 0.2867000 24.10000 0.3426000 24.84000 0.4597000 -0.7355000     0.5734000 
1 1 1 18 9  23 o 37.35000 0.3882000 37.04000 0.4359000 37.67000 0.6426000 -0.6237000     0.7765000 
1 1 1 18 9  25 o 54.59000 0.4883000 53.82000 0.5073000 55.37000 0.8345000 -1.548000      0.9766000 
1 1 1 18 9  27 o 71.49000 0.5523000 71.85000 0.7247000 71.12000 0.8337000 0.7324000      1.105000  
1 1 1 18 9  29 o 45.35000 0.3737000 45.70000 0.4578000 45.01000 0.5909000 0.6814000      0.7475000 
1 1 1 18 9  31 o 32.32000 0.3693000 32.18000 0.3917000 32.46000 0.6262000 -0.2851000     0.7386000 
1 1 1 18 9  33 f 18.33000 0.4028000 17.83000 0.5487000 18.83000 0.5899000 -0.9943000     0.8057000 
1 1 1 18 9  35 o 11.44000 0.5083000 10.86000 0.7578000 12.02000 0.6775000 -1.155000      1.017000  
1 1 1 18 9  37 o 21.74000 0.3709000 21.56000 0.4854000 21.93000 0.5610000 -0.3700000     0.7419000 
1 1 1 18 9  39 o 4.627000 0.9769000 5.807000 1.340000  3.447000 1.422000  2.360000       1.954000  
1 1 1 18 9  41 o 32.46000 0.3336000 32.48000 0.4667000 32.45000 0.4770000 0.3012000E-01  0.6673000 
1 1 1 18 9  43 o 28.91000 0.3562000 28.82000 0.4595000 29.01000 0.5445000 -0.1945000     0.7125000 
1 1 1 18 9  45 o 18.10000 0.4039000 17.90000 0.5592000 18.29000 0.5830000 -0.3833000     0.8078000 
1 1 1 18 9  47 o 9.732000 0.5591000 9.539000 0.8328000 9.924000 0.7463000 -0.3846000     1.118000  
1 1 1 18 9  49 o 12.88000 0.4852000 12.84000 0.7569000 12.92000 0.6073000 -0.8140000E-01 0.9704000 
1 1 1 18 9  51 o 12.07000 0.5171000 11.94000 0.6613000 12.20000 0.7952000 -0.2599000     1.034000  
1 1 1 18 9  53 o 4.142000 0.9455000 3.561000 1.379000  4.724000 1.294000  -1.163000      1.891000  
1 1 1 18 9  55 o 9.442000 0.5973000 10.27000 0.7860000 8.620000 0.8996000 1.646000       1.195000  
1 1 1 18 9  57 o 7.033000 0.8380000 6.233000 1.342000  7.832000 1.004000  -1.599000      1.676000  
1 1 1 18 9  59 o 3.362000 0.9866000 3.666000 1.423000  3.058000 1.367000  0.6084000      1.973000  
1 1 1 18 9  61 o 3.352000 0.9753000 3.557000 1.409000  3.148000 1.349000  0.4092000      1.951000  
1 1 1 18 10 0  o 154.5000 1.492000  154.5000 1.492000  154.5000 1.492000  0.000000       0.000000  
1 1 1 18 10 2  o 95.79000 0.7151000 95.57000 1.080000  96.00000 0.9378000 -0.4228000     1.430000  
1 1 1 18 10 4  o 10.52000 0.3490000 10.40000 0.4778000 10.63000 0.5089000 -0.2278000     0.6980000 
1 1 1 18 10 6  o 66.86000 0.5139000 66.68000 0.7780000 67.03000 0.6716000 -0.3510000     1.028000  
1 1 1 18 10 8  o 86.36000 0.6490000 85.78000 0.9774000 86.94000 0.8541000 -1.164000      1.298000  
1 1 1 18 10 10 o 84.76000 0.6815000 84.69000 0.9663000 84.84000 0.9614000 -0.1480000     1.363000  
1 1 1 18 10 12 o 33.26000 0.3139000 32.92000 0.4789000 33.59000 0.4059000 -0.6647000     0.6278000 
1 1 1 18 10 14 o 60.67000 0.4715000 60.42000 0.7089000 60.91000 0.6219000 -0.4903000     0.9430000 
1 1 1 18 10 16 o 59.42000 0.4972000 59.31000 0.6977000 59.53000 0.7086000 -0.2188000     0.9944000 
1 1 1 18 10 18 o 49.16000 0.3713000 48.74000 0.5214000 49.58000 0.5288000 -0.8353000     0.7426000 
1 1 1 18 10 20 o 25.53000 0.3209000 25.17000 0.4347000 25.89000 0.4721000 -0.7207000     0.6418000 
1 1 1 18 10 22 o 39.95000 0.4017000 39.56000 0.4488000 40.34000 0.6664000 -0.7810000     0.8034000 
1 1 1 18 10 24 o 27.24000 0.2931000 26.96000 0.3553000 27.53000 0.4663000 -0.5707000     0.5863000 
1 1 1 18 10 26 o 26.70000 0.3765000 27.37000 0.4500000 26.02000 0.6036000 1.351000       0.7529000 
1 1 1 18 10 28 o 4.493000 0.9073000 3.496000 1.203000  5.490000 1.358000  -1.994000      1.815000  
1 1 1 18 10 30 f 38.16000 0.3984000 38.32000 0.4119000 38.00000 0.6820000 0.3175000      0.7967000 
1 1 1 18 10 32 o 24.38000 0.3978000 24.40000 0.4380000 24.37000 0.6642000 0.3079000E-01  0.7957000 
1 1 1 18 10 34 o 12.49000 0.4617000 11.72000 0.6742000 13.26000 0.6311000 -1.537000      0.9235000 
1 1 1 18 10 36 o 18.33000 0.4345000 18.00000 0.6388000 18.66000 0.5891000 -0.6596000     0.8690000 
1 1 1 18 10 38 o 24.19000 0.3423000 23.91000 0.4732000 24.47000 0.4947000 -0.5583000     0.6846000 
1 1 1 18 10 40 o 20.75000 0.3584000 20.41000 0.5056000 21.08000 0.5081000 -0.6694000     0.7168000 
1 1 1 18 10 42 o 8.665000 0.6852000 8.319000 1.035000  9.011000 0.8984000 -0.6924000     1.370000  
1 1 1 18 10 44 o 8.318000 0.6511000 7.766000 0.9452000 8.869000 0.8957000 -1.103000      1.302000  
1 1 1 18 10 46 f 18.97000 0.3652000 18.94000 0.5131000 19.01000 0.5197000 -0.6735000E-01 0.7303000 
1 1 1 18 10 48 o 10.19000 0.5336000 10.99000 0.7055000 9.395000 0.8008000 1.597000       1.067000  
1 1 1 18 10 50 o 13.84000 0.5084000 14.30000 0.7132000 13.39000 0.7247000 0.9131000      1.017000  
1 1 1 18 10 52 o 9.888000 0.5421000 9.434000 0.7877000 10.34000 0.7451000 -0.9071000     1.084000  
1 1 1 18 10 54 o 6.092000 0.9303000 5.334000 1.469000  6.850000 1.142000  -1.516000      1.861000  
1 1 1 18 10 56 o 9.402000 0.6621000 8.463000 0.9907000 10.34000 0.8788000 -1.878000      1.324000  
1 1 1 18 10 58 o 5.507000 0.9729000 5.774000 1.356000  5.241000 1.395000  0.5332000      1.946000  
1 1 1 18 10 60 o 3.897000 1.018000  4.336000 1.464000  3.458000 1.415000  0.8783000      2.037000  
1 1 1 18 10 62 o 3.785000 1.009000  3.727000 1.419000  3.842000 1.435000  -0.1151000     2.018000  
1 1 1 18 11 1  o 32.02000 0.2739000 32.35000 0.3901000 31.68000 0.3845000 0.6730000      0.5477000 
1 1 1 18 11 3  o 27.25000 0.3344000 26.81000 0.5589000 27.69000 0.3673000 -0.8869000     0.6688000 
1 1 1 18 11 5  o 61.48000 0.4773000 61.80000 0.7273000 61.16000 0.6183000 0.6372000      0.9546000 
1 1 1 18 11 7  o 62.82000 0.4844000 61.92000 0.6268000 63.71000 0.7388000 -1.787000      0.9688000 
1 1 1 18 11 9  o 27.01000 0.2933000 26.97000 0.4148000 27.05000 0.4147000 -0.8217000E-01 0.5866000 
1 1 1 18 11 11 o 20.09000 0.2548000 20.19000 0.3601000 19.99000 0.3607000 0.1972000      0.5097000 
1 1 1 18 11 13 o 73.46000 0.6330000 72.90000 1.029000  74.02000 0.7369000 -1.117000      1.266000  
1 1 1 18 11 15 o 51.21000 0.4941000 51.70000 0.7703000 50.73000 0.6192000 0.9685000      0.9883000 
1 1 1 18 11 17 o 62.28000 0.4490000 62.26000 0.6345000 62.29000 0.6355000 -0.3163000E-01 0.8980000 
1 1 1 18 11 19 o 45.38000 0.3800000 45.07000 0.4876000 45.68000 0.5828000 -0.6039000     0.7599000 
1 1 1 18 11 21 o 52.61000 0.4266000 52.55000 0.5540000 52.66000 0.6488000 -0.1075000     0.8531000 
1 1 1 18 11 23 o 41.13000 0.3440000 40.79000 0.4130000 41.47000 0.5503000 -0.6803000     0.6881000 
1 1 1 18 11 25 o 17.26000 0.3593000 17.47000 0.3960000 17.05000 0.5996000 0.4223000      0.7186000 
1 1 1 18 11 27 o 38.42000 0.3511000 38.34000 0.4509000 38.51000 0.5384000 -0.1662000     0.7023000 
1 1 1 18 11 29 o 16.06000 0.4131000 16.04000 0.4428000 16.09000 0.6976000 -0.4920000E-01 0.8262000 
1 1 1 18 11 31 o 34.78000 0.5026000 35.13000 0.3977000 34.43000 0.9231000 0.7002000      1.005000  
1 1 1 18 11 33 o 18.27000 0.4144000 18.04000 0.6503000 18.49000 0.5138000 -0.4548000     0.8288000 
1 1 1 18 11 35 o 15.32000 0.4340000 15.46000 0.5427000 15.19000 0.6774000 0.2674000      0.8680000 
1 1 1 18 11 37 o 15.23000 0.4763000 15.64000 0.7500000 14.81000 0.5873000 0.8279000      0.9526000 
1 1 1 18 11 39 o 11.52000 0.5222000 11.13000 0.7733000 11.92000 0.7021000 -0.7857000     1.044000  
1 1 1 18 11 41 o 26.60000 0.3467000 26.16000 0.5109000 27.04000 0.4688000 -0.8807000     0.6934000 
1 1 1 18 11 43 o 13.94000 0.4476000 13.93000 0.5707000 13.95000 0.6897000 -0.1158000E-01 0.8952000 
1 1 1 18 11 45 o 8.891000 0.6588000 9.054000 0.9412000 8.728000 0.9221000 0.3260000      1.318000  
1 1 1 18 11 47 f 14.75000 0.4537000 14.83000 0.6249000 14.67000 0.6580000 0.1689000      0.9074000 
1 1 1 18 11 49 o 14.41000 0.4275000 14.78000 0.5491000 14.04000 0.6555000 0.7413000      0.8551000 
1 1 1 18 11 51 o 13.64000 0.4672000 13.56000 0.7302000 13.71000 0.5831000 -0.1474000     0.9344000 
1 1 1 18 11 53 o 8.627000 0.5866000 9.661000 0.7813000 7.593000 0.8752000 2.068000       1.173000  
1 1 1 18 11 55 o 7.170000 0.8148000 7.211000 1.199000  7.130000 1.104000  0.8051000E-01  1.630000  
1 1 1 18 11 57 o 6.138000 0.9052000 5.902000 1.368000  6.375000 1.186000  -0.4726000     1.810000  
1 1 1 18 11 59 o 3.880000 1.021000  3.228000 1.417000  4.532000 1.472000  -1.304000      2.043000  
1 1 1 18 11 61 o 4.596000 1.098000  4.468000 1.637000  4.724000 1.464000  -0.2564000     2.196000  
1 1 1 18 12 0  o 47.20000 0.4964000 47.20000 0.4964000 47.20000 0.4964000 0.000000       0.000000  
1 1 1 18 12 2  o 40.52000 0.3656000 40.21000 0.5236000 40.84000 0.5102000 -0.6352000     0.7311000 
1 1 1 18 12 4  o 65.39000 0.5359000 64.29000 0.7514000 66.49000 0.7642000 -2.194000      1.072000  
1 1 1 18 12 6  o 97.69000 0.7273000 98.15000 0.9595000 97.23000 1.093000  0.9203000      1.455000  
1 1 1 18 12 8  o 41.14000 0.3421000 41.85000 0.4594000 40.44000 0.5070000 1.413000       0.6842000 
1 1 1 18 12 10 o 51.49000 0.4083000 51.20000 0.6116000 51.79000 0.5412000 -0.5895000     0.8167000 
1 1 1 18 12 12 o 46.87000 0.3788000 46.46000 0.5665000 47.29000 0.5030000 -0.8310000     0.7576000 
1 1 1 18 12 14 o 34.89000 0.2924000 35.04000 0.4152000 34.74000 0.4119000 0.3018000      0.5848000 
1 1 1 18 12 16 o 39.88000 0.3746000 39.73000 0.5333000 40.02000 0.5262000 -0.2858000     0.7492000 
1 1 1 18 12 18 o 51.48000 0.3996000 50.97000 0.4779000 51.99000 0.6406000 -1.018000      0.7992000 
1 1 1 18 12 20 o 48.54000 0.3979000 48.54000 0.5161000 48.53000 0.6057000 0.1049000E-01  0.7957000 
1 1 1 18 12 22 o 12.73000 0.3795000 12.46000 0.4893000 13.01000 0.5803000 -0.5502000     0.7590000 
1 1 1 18 12 24 o 4.093000 0.8617000 3.814000 1.111000  4.371000 1.318000  -0.5572000     1.723000  
1 1 1 18 12 26 o 21.33000 0.3629000 21.36000 0.4340000 21.30000 0.5818000 0.6646000E-01  0.7259000 
1 1 1 18 12 28 o 11.06000 0.4355000 11.43000 0.4832000 10.69000 0.7246000 0.7401000      0.8709000 
1 1 1 18 12 30 o 17.61000 0.4785000 17.61000 0.4785000 ?        ?         ?              ?         
1 1 1 18 12 32 o 44.26000 0.4506000 43.29000 0.4933000 45.22000 0.7541000 -1.937000      0.9011000 
1 1 1 18 12 34 o 37.26000 0.3888000 36.82000 0.5362000 37.69000 0.5633000 -0.8680000     0.7777000 
1 1 1 18 12 36 o 8.350000 0.7078000 8.236000 0.9846000 8.464000 1.017000  -0.2282000     1.416000  
1 1 1 18 12 38 o 38.06000 0.3809000 38.36000 0.5709000 37.77000 0.5044000 0.5920000      0.7618000 
1 1 1 18 12 40 o 12.04000 0.5031000 11.36000 0.7120000 12.72000 0.7109000 -1.356000      1.006000  
1 1 1 18 12 42 o 33.49000 0.3897000 34.25000 0.5382000 32.72000 0.5637000 1.530000       0.7794000 
1 1 1 18 12 44 o 3.773000 0.9935000 3.877000 1.373000  3.669000 1.437000  0.2079000      1.987000  
1 1 1 18 12 46 o 10.37000 0.5559000 10.26000 0.7150000 10.49000 0.8513000 -0.2317000     1.112000  
1 1 1 18 12 48 o 7.784000 0.7368000 7.174000 1.210000  8.395000 0.8413000 -1.221000      1.474000  
1 1 1 18 12 50 o 6.677000 1.015000  5.816000 1.751000  7.538000 1.025000  -1.721000      2.029000  
1 1 1 18 12 52 o 11.06000 0.5356000 10.14000 0.8022000 11.99000 0.7100000 -1.853000      1.071000  
1 1 1 18 12 54 o 6.437000 0.9079000 5.214000 1.558000  7.660000 0.9324000 -2.446000      1.816000  
1 1 1 18 12 56 o 7.175000 0.8521000 6.642000 1.214000  7.709000 1.196000  -1.067000      1.704000  
1 1 1 18 12 58 o 4.509000 1.031000  5.067000 1.458000  3.951000 1.459000  1.116000       2.063000  
1 1 1 18 12 60 o 4.791000 0.9992000 5.973000 1.367000  3.608000 1.458000  2.365000       1.998000  
1 1 1 18 13 1  o 56.47000 0.5271000 56.57000 0.8229000 56.37000 0.6590000 0.2073000      1.054000  
1 1 1 18 13 3  o 32.78000 0.3504000 33.47000 0.5480000 32.10000 0.4367000 1.372000       0.7008000 
1 1 1 18 13 5  o 47.40000 0.4033000 47.86000 0.5752000 46.93000 0.5655000 0.9325000      0.8066000 
1 1 1 18 13 7  o 30.52000 0.3008000 30.84000 0.4270000 30.19000 0.4238000 0.6501000      0.6016000 
1 1 1 18 13 9  o 59.43000 0.4609000 59.80000 0.6984000 59.06000 0.6016000 0.7426000      0.9218000 
1 1 1 18 13 11 o 50.03000 0.3713000 50.37000 0.5281000 49.70000 0.5221000 0.6697000      0.7426000 
1 1 1 18 13 13 o 40.51000 0.3211000 40.66000 0.4550000 40.35000 0.4532000 0.3048000      0.6422000 
1 1 1 18 13 15 o 38.40000 0.3115000 38.45000 0.4423000 38.35000 0.4387000 0.1004000      0.6229000 
1 1 1 18 13 17 f 9.108000 0.4815000 8.783000 0.6106000 9.433000 0.7448000 -0.6500000     0.9631000 
1 1 1 18 13 19 o 54.17000 0.4648000 53.05000 0.6433000 55.30000 0.6710000 -2.253000      0.9296000 
1 1 1 18 13 21 o 65.78000 0.4870000 66.62000 0.6016000 64.94000 0.7661000 1.684000       0.9740000 
1 1 1 18 13 23 o 34.21000 0.3277000 33.86000 0.4215000 34.56000 0.5019000 -0.6998000     0.6554000 
1 1 1 18 13 25 o 29.77000 0.3088000 29.29000 0.3871000 30.25000 0.4813000 -0.9566000     0.6177000 
1 1 1 18 13 27 o 17.10000 0.3244000 17.45000 0.3686000 16.76000 0.5340000 0.6856000      0.6489000 
1 1 1 18 13 29 o 56.04000 0.6600000 55.85000 0.5817000 56.24000 1.185000  -0.3851000     1.320000  
1 1 1 18 13 31 o 38.69000 0.3475000 38.97000 0.4189000 38.41000 0.5546000 0.5633000      0.6950000 
1 1 1 18 13 33 o 22.50000 0.3714000 21.79000 0.4976000 23.21000 0.5514000 -1.421000      0.7427000 
1 1 1 18 13 35 o 15.59000 0.5130000 16.02000 0.7117000 15.16000 0.7389000 0.8516000      1.026000  
1 1 1 18 13 37 o 47.09000 0.3839000 46.98000 0.5349000 47.21000 0.5508000 -0.2282000     0.7678000 
1 1 1 18 13 39 o 15.73000 0.4627000 16.15000 0.7057000 15.31000 0.5986000 0.8355000      0.9254000 
1 1 1 18 13 41 o 11.57000 0.5133000 11.90000 0.7420000 11.23000 0.7094000 0.6694000      1.027000  
1 1 1 18 13 43 o 8.636000 0.5787000 8.621000 0.8283000 8.651000 0.8084000 -0.2942000E-01 1.157000  
1 1 1 18 13 45 o 4.360000 1.016000  3.670000 1.402000  5.050000 1.471000  -1.380000      2.032000  
1 1 1 18 13 47 o 9.723000 0.5396000 9.462000 0.7607000 9.983000 0.7656000 -0.5206000     1.079000  
1 1 1 18 13 49 o 4.214000 1.126000  5.093000 1.810000  3.336000 1.340000  1.757000       2.252000  
1 1 1 18 13 51 o 2.974000 0.9203000 3.544000 1.467000  2.404000 1.112000  1.140000       1.841000  
1 1 1 18 13 53 o 6.379000 0.9725000 6.360000 1.353000  6.397000 1.398000  -0.3738000E-01 1.945000  
1 1 1 18 13 55 f 5.891000 0.9631000 7.116000 1.321000  4.666000 1.402000  2.450000       1.926000  
1 1 1 18 13 57 o 3.602000 0.9955000 2.591000 1.220000  4.613000 1.574000  -2.022000      1.991000  
1 1 1 18 13 59 o 5.625000 0.9840000 3.293000 1.408000  7.957000 1.375000  -4.664000      1.968000  
1 1 1 18 13 61 o 7.721000 0.7664000 7.689000 1.205000  7.753000 0.9468000 -0.6346000E-01 1.533000  
1 1 1 18 14 2  o 51.03000 0.4283000 50.74000 0.6019000 51.32000 0.6093000 -0.5758000     0.8565000 
1 1 1 18 14 4  o 30.66000 0.3492000 31.41000 0.5358000 29.90000 0.4480000 1.511000       0.6984000 
1 1 1 18 14 6  o 27.46000 0.2891000 28.11000 0.4173000 26.82000 0.4003000 1.287000       0.5782000 
1 1 1 18 14 8  o 84.26000 0.5866000 84.18000 0.8288000 84.34000 0.8303000 -0.1648000     1.173000  
1 1 1 18 14 10 o 27.58000 0.2610000 27.64000 0.3727000 27.53000 0.3655000 0.1108000      0.5220000 
1 1 1 18 14 12 o 28.48000 0.2633000 28.25000 0.3704000 28.72000 0.3744000 -0.4637000     0.5267000 
1 1 1 18 14 14 o 37.24000 0.3030000 36.99000 0.4263000 37.49000 0.4307000 -0.5018000     0.6060000 
1 1 1 18 14 16 o 37.77000 0.3766000 38.01000 0.3853000 37.53000 0.6471000 0.4801000      0.7532000 
1 1 1 18 14 18 o 28.83000 0.3033000 28.87000 0.3887000 28.80000 0.4658000 0.6762000E-01  0.6067000 
1 1 1 18 14 20 o 49.67000 0.4344000 48.61000 0.5997000 50.73000 0.6287000 -2.117000      0.8688000 
1 1 1 18 14 22 o 31.78000 0.3022000 31.51000 0.3559000 32.05000 0.4886000 -0.5406000     0.6045000 
1 1 1 18 14 24 o 19.18000 0.3835000 19.60000 0.4460000 18.75000 0.6240000 0.8529000      0.7670000 
1 1 1 18 14 26 o 12.84000 0.3717000 12.77000 0.4277000 12.91000 0.6079000 -0.1443000     0.7433000 
1 1 1 18 14 28 o 13.86000 0.4234000 13.65000 0.4230000 14.06000 0.7335000 -0.4040000     0.8468000 
1 1 1 18 14 30 o 19.51000 0.5366000 20.67000 0.4193000 18.36000 0.9878000 2.313000       1.073000  
1 1 1 18 14 32 o 16.68000 0.3927000 16.66000 0.4906000 16.70000 0.6133000 -0.4148000E-01 0.7854000 
1 1 1 18 14 34 f 18.64000 0.3630000 18.32000 0.4962000 18.95000 0.5300000 -0.6267000     0.7260000 
1 1 1 18 14 36 o 31.53000 0.3591000 31.46000 0.5370000 31.60000 0.4768000 -0.1316000     0.7182000 
1 1 1 18 14 38 f 17.37000 0.4369000 17.81000 0.5868000 16.94000 0.6475000 0.8639000      0.8738000 
1 1 1 18 14 40 o 7.828000 0.7249000 8.492000 0.9265000 7.164000 1.115000  1.328000       1.450000  
1 1 1 18 14 42 o 12.63000 0.4809000 12.54000 0.6012000 12.73000 0.7506000 -0.1917000     0.9617000 
1 1 1 18 14 44 o 7.630000 0.8081000 7.854000 0.8524000 7.406000 1.373000  0.4487000      1.616000  
1 1 1 18 14 46 o 8.721000 0.6002000 8.301000 0.8785000 9.142000 0.8179000 -0.8410000     1.200000  
1 1 1 18 14 48 o 18.12000 0.3605000 17.90000 0.5053000 18.34000 0.5142000 -0.4391000     0.7209000 
1 1 1 18 14 50 o 9.154000 0.6011000 9.814000 0.7914000 8.494000 0.9050000 1.321000       1.202000  
1 1 1 18 14 52 o 11.79000 0.5525000 11.91000 0.8608000 11.67000 0.6930000 0.2394000      1.105000  
1 1 1 18 14 54 o 5.297000 0.9718000 6.153000 1.385000  4.441000 1.363000  1.712000       1.944000  
1 1 1 18 14 56 o 4.383000 1.073000  4.899000 1.471000  3.867000 1.562000  1.031000       2.146000  
1 1 1 18 14 58 o 4.074000 1.023000  4.760000 1.566000  3.388000 1.318000  1.371000       2.047000  
1 1 1 18 14 60 o 5.050000 1.059000  4.719000 1.624000  5.381000 1.360000  -0.6625000     2.118000  
1 1 1 18 15 1  o 77.42000 0.5870000 77.79000 0.8928000 77.05000 0.7623000 0.7402000      1.174000  
1 1 1 18 15 3  o 27.31000 0.2593000 27.45000 0.3700000 27.17000 0.3635000 0.2790000      0.5187000 
1 1 1 18 15 5  o 33.51000 0.2801000 33.02000 0.3914000 33.99000 0.4009000 -0.9726000     0.5603000 
1 1 1 18 15 7  o 8.710000 0.3914000 8.839000 0.5477000 8.581000 0.5591000 0.2576000      0.7827000 
1 1 1 18 15 9  o 47.60000 0.3563000 47.92000 0.5061000 47.28000 0.5016000 0.6364000      0.7126000 
1 1 1 18 15 11 o 43.89000 0.3360000 43.40000 0.4706000 44.37000 0.4796000 -0.9651000     0.6720000 
1 1 1 18 15 13 o 24.11000 0.2511000 23.94000 0.3558000 24.28000 0.3545000 -0.3415000     0.5022000 
1 1 1 18 15 15 o 32.35000 0.2972000 32.49000 0.3476000 32.21000 0.4823000 0.2789000      0.5945000 
1 1 1 18 15 17 o 65.73000 0.4873000 65.86000 0.5921000 65.61000 0.7742000 0.2477000      0.9746000 
1 1 1 18 15 19 o 59.33000 0.4652000 60.11000 0.6109000 58.56000 0.7019000 1.551000       0.9305000 
1 1 1 18 15 21 o 62.83000 0.4941000 62.61000 0.6408000 63.05000 0.7523000 -0.4420000     0.9882000 
1 1 1 18 15 23 o 64.88000 0.4850000 64.38000 0.5845000 65.37000 0.7741000 -0.9860000     0.9700000 
1 1 1 18 15 25 o 16.41000 0.3313000 15.82000 0.4330000 17.00000 0.5016000 -1.177000      0.6627000 
1 1 1 18 15 27 o 39.38000 0.3880000 39.49000 0.4070000 39.26000 0.6607000 0.2276000      0.7760000 
1 1 1 18 15 29 o 36.32000 0.5134000 36.29000 0.4013000 36.36000 0.9451000 -0.7546000E-01 1.027000  
1 1 1 18 15 31 o 42.64000 0.3794000 42.70000 0.4857000 42.59000 0.5831000 0.1094000      0.7589000 
1 1 1 18 15 33 o 31.35000 0.4090000 31.39000 0.4916000 31.31000 0.6537000 0.8290000E-01  0.8180000 
1 1 1 18 15 35 o 9.493000 0.5877000 9.762000 0.7964000 9.224000 0.8646000 0.5382000      1.175000  
1 1 1 18 15 37 o 30.52000 0.3534000 30.24000 0.5275000 30.80000 0.4705000 -0.5593000     0.7068000 
1 1 1 18 15 39 o 32.29000 0.3295000 32.45000 0.4609000 32.12000 0.4710000 0.3222000      0.6590000 
1 1 1 18 15 41 o 8.165000 0.7843000 8.984000 1.060000  7.346000 1.156000  1.638000       1.569000  
1 1 1 18 15 43 o 11.41000 0.5253000 11.24000 0.7308000 11.58000 0.7548000 -0.3426000     1.051000  
1 1 1 18 15 45 o 11.36000 0.5427000 9.673000 0.8956000 13.05000 0.6132000 -3.381000      1.085000  
1 1 1 18 15 47 o 4.620000 1.025000  4.805000 1.438000  4.435000 1.463000  0.3700000      2.051000  
1 1 1 18 15 49 o 8.208000 0.6287000 7.875000 0.8769000 8.541000 0.9010000 -0.6654000     1.257000  
1 1 1 18 15 51 o 3.299000 0.9357000 3.097000 1.328000  3.502000 1.319000  -0.4050000     1.871000  
1 1 1 18 15 53 o 3.919000 1.073000  3.956000 1.516000  3.882000 1.519000  0.7375000E-01  2.146000  
1 1 1 18 15 55 o 3.362000 0.9714000 4.188000 1.542000  2.536000 1.182000  1.653000       1.943000  
1 1 1 18 15 57 o 12.05000 0.4941000 12.13000 0.7187000 11.96000 0.6782000 0.1661000      0.9882000 
1 1 1 18 15 59 o 5.055000 1.055000  5.385000 1.522000  4.725000 1.463000  0.6603000      2.111000  
1 1 1 18 15 61 o 6.981000 1.324000  7.547000 1.668000  6.415000 2.055000  1.133000       2.647000  
1 1 1 18 16 0  f 21.94000 0.4290000 21.94000 0.4290000 21.94000 0.4290000 0.000000       0.000000  
1 1 1 18 16 2  o 42.15000 0.3235000 42.02000 0.4562000 42.29000 0.4588000 -0.2757000     0.6470000 
1 1 1 18 16 4  o 29.92000 0.2892000 29.92000 0.4395000 29.92000 0.3760000 0.3578000E-02  0.5784000 
1 1 1 18 16 6  o 20.04000 0.2447000 20.11000 0.3483000 19.97000 0.3437000 0.1444000      0.4893000 
1 1 1 18 16 8  o 51.53000 0.3798000 52.28000 0.5442000 50.79000 0.5299000 1.483000       0.7595000 
1 1 1 18 16 10 o 38.22000 0.3054000 38.13000 0.4311000 38.32000 0.4327000 -0.1918000     0.6108000 
1 1 1 18 16 12 o 43.32000 0.3331000 43.07000 0.4698000 43.57000 0.4723000 -0.4987000     0.6662000 
1 1 1 18 16 14 o 20.79000 0.2731000 20.58000 0.2969000 21.00000 0.4584000 -0.4162000     0.5462000 
1 1 1 18 16 16 o 50.10000 0.4531000 49.43000 0.4628000 50.78000 0.7791000 -1.344000      0.9062000 
1 1 1 18 16 18 o 46.84000 0.3730000 46.53000 0.4424000 47.15000 0.6006000 -0.6201000     0.7459000 
1 1 1 18 16 20 o 34.02000 0.3173000 34.06000 0.3988000 33.99000 0.4935000 0.7333000E-01  0.6345000 
1 1 1 18 16 22 o 45.74000 0.3858000 45.57000 0.4968000 45.91000 0.5904000 -0.3337000     0.7716000 
1 1 1 18 16 24 o 39.79000 0.3505000 39.96000 0.4477000 39.62000 0.5394000 0.3426000      0.7010000 
1 1 1 18 16 26 o 5.364000 0.9084000 4.692000 1.195000  6.036000 1.369000  -1.344000      1.817000  
1 1 1 18 16 28 o 36.91000 0.3954000 36.81000 0.4502000 37.00000 0.6501000 -0.1927000     0.7908000 
1 1 1 18 16 30 o 5.945000 0.9516000 6.743000 0.9315000 5.147000 1.660000  1.596000       1.903000  
1 1 1 18 16 32 f 37.28000 0.3441000 36.98000 0.4053000 37.58000 0.5561000 -0.6084000     0.6882000 
1 1 1 18 16 34 o 3.437000 0.9703000 3.959000 1.372000  2.914000 1.373000  1.045000       1.941000  
1 1 1 18 16 36 o 19.64000 0.3509000 19.88000 0.4705000 19.41000 0.5208000 0.4708000      0.7019000 
1 1 1 18 16 38 o 19.67000 0.3512000 19.76000 0.4801000 19.59000 0.5127000 0.1680000      0.7024000 
1 1 1 18 16 40 o 28.36000 0.4061000 29.61000 0.6638000 27.10000 0.4682000 2.518000       0.8123000 
1 1 1 18 16 42 o 14.79000 0.4427000 15.02000 0.5466000 14.56000 0.6965000 0.4658000      0.8854000 
1 1 1 18 16 44 o 6.015000 1.257000  6.022000 2.206000  6.008000 1.204000  0.1458000E-01  2.513000  
1 1 1 18 16 46 o 9.910000 0.5894000 10.99000 0.7954000 8.830000 0.8699000 2.160000       1.179000  
1 1 1 18 16 48 o 10.81000 0.4839000 10.66000 0.7055000 10.96000 0.6624000 -0.3053000     0.9678000 
1 1 1 18 16 50 o 6.745000 0.8511000 6.341000 1.384000  7.150000 0.9904000 -0.8088000     1.702000  
1 1 1 18 16 52 o 3.253000 0.9339000 3.312000 1.358000  3.194000 1.282000  0.1173000      1.868000  
1 1 1 18 16 54 o 4.241000 1.055000  4.181000 1.513000  4.302000 1.469000  -0.1213000     2.109000  
1 1 1 18 16 56 o 10.46000 0.5743000 10.55000 0.7990000 10.38000 0.8253000 0.1694000      1.149000  
1 1 1 18 16 58 o 4.273000 1.011000  4.439000 1.522000  4.106000 1.331000  0.3335000      2.021000  
1 1 1 18 16 60 o 4.089000 1.028000  4.452000 1.517000  3.726000 1.388000  0.7260000      2.056000  
1 1 1 18 17 1  o 59.36000 0.4640000 59.15000 0.6010000 59.56000 0.7071000 -0.4115000     0.9280000 
1 1 1 18 17 3  o 47.30000 0.3531000 47.21000 0.4985000 47.40000 0.5001000 -0.1924000     0.7061000 
1 1 1 18 17 5  o 53.18000 0.4534000 53.02000 0.6394000 53.34000 0.6430000 -0.3205000     0.9068000 
1 1 1 18 17 7  o 63.23000 0.4520000 62.97000 0.6372000 63.48000 0.6411000 -0.5181000     0.9039000 
1 1 1 18 17 9  o 29.66000 0.2641000 29.66000 0.3776000 29.65000 0.3695000 0.1229000E-01  0.5283000 
1 1 1 18 17 11 o 39.31000 0.3378000 39.42000 0.4416000 39.21000 0.5114000 0.2078000      0.6757000 
1 1 1 18 17 13 o 33.62000 0.2957000 34.13000 0.3499000 33.11000 0.4769000 1.024000       0.5915000 
1 1 1 18 17 15 o 29.46000 0.2871000 29.01000 0.3218000 29.90000 0.4754000 -0.8921000     0.5741000 
1 1 1 18 17 17 o 57.23000 0.4331000 57.70000 0.5283000 56.75000 0.6864000 0.9494000      0.8662000 
1 1 1 18 17 19 o 13.20000 0.3570000 12.70000 0.4500000 13.70000 0.5545000 -1.000000      0.7141000 
1 1 1 18 17 21 o 51.09000 0.3988000 50.91000 0.4796000 51.27000 0.6372000 -0.3653000     0.7975000 
1 1 1 18 17 23 o 19.76000 0.4123000 19.31000 0.6619000 20.21000 0.4918000 -0.8998000     0.8247000 
1 1 1 18 17 25 o 9.246000 0.5391000 8.970000 0.5189000 9.523000 0.9451000 -0.5539000     1.078000  
1 1 1 18 17 27 o 14.08000 0.4405000 13.72000 0.5033000 14.45000 0.7232000 -0.7306000     0.8811000 
1 1 1 18 17 29 o 13.32000 0.4532000 13.24000 0.4685000 13.41000 0.7759000 -0.1751000     0.9064000 
1 1 1 18 17 31 o 44.37000 0.3762000 44.30000 0.4507000 44.44000 0.6026000 -0.1465000     0.7525000 
1 1 1 18 17 33 o 17.50000 0.3826000 17.79000 0.4625000 17.22000 0.6097000 0.5686000      0.7653000 
1 1 1 18 17 35 o 14.09000 0.4053000 13.64000 0.5593000 14.54000 0.5867000 -0.8935000     0.8106000 
1 1 1 18 17 37 o 21.23000 0.3334000 21.44000 0.4573000 21.02000 0.4853000 0.4202000      0.6668000 
1 1 1 18 17 39 o 15.07000 0.4035000 14.93000 0.5582000 15.22000 0.5829000 -0.2862000     0.8070000 
1 1 1 18 17 41 o 20.03000 0.3842000 20.36000 0.5802000 19.70000 0.5040000 0.6604000      0.7685000 
1 1 1 18 17 43 o 13.82000 0.4425000 12.94000 0.6060000 14.70000 0.6449000 -1.762000      0.8850000 
1 1 1 18 17 45 o 10.05000 0.5539000 9.850000 0.7278000 10.25000 0.8352000 -0.4016000     1.108000  
1 1 1 18 17 47 f 4.526000 0.9169000 5.191000 1.301000  3.861000 1.292000  1.329000       1.834000  
1 1 1 18 17 49 o 4.084000 1.056000  3.731000 1.484000  4.437000 1.502000  -0.7061000     2.112000  
1 1 1 18 17 51 o 3.588000 0.9716000 4.120000 1.432000  3.057000 1.313000  1.063000       1.943000  
1 1 1 18 17 53 o 12.96000 0.6150000 12.50000 1.055000  13.42000 0.6321000 -0.9151000     1.230000  
1 1 1 18 17 55 o 9.666000 0.6322000 9.490000 0.8780000 9.841000 0.9097000 -0.3513000     1.264000  
1 1 1 18 17 57 o 4.135000 0.9962000 5.186000 1.441000  3.084000 1.376000  2.103000       1.992000  
1 1 1 18 17 59 o 4.915000 1.008000  5.261000 1.507000  4.569000 1.340000  0.6926000      2.016000  
1 1 1 18 18 0  o 34.58000 0.4048000 34.58000 0.4048000 34.58000 0.4048000 0.000000       0.000000  
1 1 1 18 18 2  o 86.87000 0.6039000 86.92000 0.8539000 86.82000 0.8540000 0.1042000      1.208000  
1 1 1 18 18 4  o 43.71000 0.3327000 43.07000 0.4645000 44.34000 0.4765000 -1.273000      0.6655000 
1 1 1 18 18 6  o 82.46000 0.5751000 82.27000 0.8109000 82.65000 0.8158000 -0.3786000     1.150000  
1 1 1 18 18 8  o 36.73000 0.2962000 37.13000 0.4238000 36.34000 0.4139000 0.7842000      0.5924000 
1 1 1 18 18 10 o 25.46000 0.2519000 25.78000 0.3630000 25.13000 0.3493000 0.6484000      0.5038000 
1 1 1 18 18 12 o 43.02000 0.3455000 43.15000 0.4122000 42.88000 0.5547000 0.2723000      0.6911000 
1 1 1 18 18 14 o 33.96000 0.3021000 34.16000 0.3498000 33.75000 0.4926000 0.4067000      0.6042000 
1 1 1 18 18 16 o 27.45000 0.3400000 27.21000 0.3134000 27.69000 0.6035000 -0.4803000     0.6801000 
1 1 1 18 18 18 o 63.06000 0.4706000 63.25000 0.5718000 62.86000 0.7477000 0.3871000      0.9413000 
1 1 1 18 18 20 o 18.17000 0.3644000 17.32000 0.3755000 19.02000 0.6245000 -1.705000      0.7287000 
1 1 1 18 18 22 o 20.02000 0.3212000 19.24000 0.4239000 20.79000 0.4826000 -1.556000      0.6424000 
1 1 1 18 18 24 o 30.23000 0.3622000 30.17000 0.4079000 30.29000 0.5988000 -0.1153000     0.7245000 
1 1 1 18 18 26 o 34.28000 0.3353000 34.43000 0.4362000 34.13000 0.5094000 0.2909000      0.6707000 
1 1 1 18 18 28 o 23.29000 0.3485000 23.61000 0.4789000 22.97000 0.5065000 0.6498000      0.6970000 
1 1 1 18 18 30 o 14.72000 0.3806000 14.37000 0.4366000 15.07000 0.6234000 -0.7021000     0.7611000 
1 1 1 18 18 32 o 56.14000 0.4591000 56.11000 0.5936000 56.17000 0.7005000 -0.6442000E-01 0.9182000 
1 1 1 18 18 34 o 25.47000 0.3483000 25.91000 0.4429000 25.04000 0.5378000 0.8699000      0.6967000 
1 1 1 18 18 36 o 25.89000 0.3237000 25.77000 0.4389000 26.02000 0.4759000 -0.2511000     0.6474000 
1 1 1 18 18 38 o 13.61000 0.5483000 13.11000 0.6815000 14.11000 0.8592000 -0.9979000     1.097000  
1 1 1 18 18 40 o 10.82000 0.5433000 10.09000 0.8302000 11.56000 0.7011000 -1.475000      1.087000  
1 1 1 18 18 42 o 15.05000 0.4300000 14.34000 0.5746000 15.76000 0.6400000 -1.420000      0.8601000 
1 1 1 18 18 44 o 18.21000 0.4043000 17.86000 0.5632000 18.55000 0.5803000 -0.6864000     0.8087000 
1 1 1 18 18 46 o 6.237000 0.7805000 6.076000 1.143000  6.399000 1.063000  -0.3235000     1.561000  
1 1 1 18 18 48 o 10.57000 0.5020000 10.64000 0.7401000 10.49000 0.6786000 0.1570000      1.004000  
1 1 1 18 18 50 o 9.583000 0.6378000 9.531000 0.9341000 9.636000 0.8686000 -0.1047000     1.276000  
1 1 1 18 18 52 o 8.083000 0.8391000 8.490000 1.286000  7.676000 1.078000  0.8137000      1.678000  
1 1 1 18 18 54 o 3.134000 0.9459000 3.064000 1.345000  3.204000 1.330000  -0.1399000     1.892000  
1 1 1 18 18 56 o 3.062000 0.9296000 3.433000 1.402000  2.691000 1.221000  0.7421000      1.859000  
1 1 1 18 18 58 o 5.067000 0.9983000 4.579000 1.533000  5.555000 1.279000  -0.9766000     1.997000  
1 1 1 18 18 60 f 5.375000 1.134000  4.379000 1.653000  6.372000 1.552000  -1.993000      2.268000  
1 1 1 18 19 1  o 28.23000 0.3974000 27.57000 0.6595000 28.89000 0.4436000 -1.323000      0.7948000 
1 1 1 18 19 3  o 9.479000 0.3270000 9.206000 0.4737000 9.753000 0.4509000 -0.5467000     0.6539000 
1 1 1 18 19 5  o 70.00000 0.5353000 70.35000 0.8131000 69.65000 0.6963000 0.7009000      1.071000  
1 1 1 18 19 7  o 110.2000 0.7591000 109.8000 1.069000  110.6000 1.078000  -0.8318000     1.518000  
1 1 1 18 19 9  o 38.89000 0.3705000 39.04000 0.5302000 38.74000 0.5176000 0.3005000      0.7410000 
1 1 1 18 19 11 o 9.880000 0.5157000 9.788000 0.7945000 9.972000 0.6578000 -0.1836000     1.031000  
1 1 1 18 19 13 o 47.09000 0.4205000 47.10000 0.5966000 47.08000 0.5929000 0.1972000E-01  0.8411000 
1 1 1 18 19 15 o 81.62000 0.7471000 80.93000 0.9316000 82.31000 1.168000  -1.373000      1.494000  
1 1 1 18 19 17 o 27.94000 0.2834000 27.77000 0.3135000 28.11000 0.4722000 -0.3333000     0.5668000 
1 1 1 18 19 19 o 22.34000 0.3273000 22.42000 0.4649000 22.26000 0.4608000 0.1630000      0.6546000 
1 1 1 18 19 21 o 29.91000 0.3443000 30.48000 0.3718000 29.34000 0.5796000 1.144000       0.6886000 
1 1 1 18 19 23 o 24.88000 0.2854000 25.13000 0.3288000 24.63000 0.4666000 0.4992000      0.5709000 
1 1 1 18 19 25 o 48.12000 0.4044000 48.38000 0.5242000 47.85000 0.6160000 0.5339000      0.8089000 
1 1 1 18 19 27 o 20.21000 0.3599000 19.92000 0.3905000 20.49000 0.6047000 -0.5733000     0.7198000 
1 1 1 18 19 29 o 28.36000 0.4914000 28.72000 0.4437000 27.99000 0.8768000 0.7267000      0.9827000 
1 1 1 18 19 31 o 37.78000 0.3461000 37.91000 0.4102000 37.64000 0.5575000 0.2654000      0.6922000 
1 1 1 18 19 33 o 20.70000 0.3395000 21.24000 0.3932000 20.16000 0.5536000 1.071000       0.6791000 
1 1 1 18 19 35 o 8.573000 0.6593000 8.591000 0.7597000 8.556000 1.078000  0.3577000E-01  1.319000  
1 1 1 18 19 37 o 17.87000 0.3619000 18.01000 0.4841000 17.73000 0.5381000 0.2859000      0.7238000 
1 1 1 18 19 39 o 15.95000 0.6645000 16.25000 1.202000  15.65000 0.5661000 0.6013000      1.329000  
1 1 1 18 19 41 o 12.37000 0.4968000 12.87000 0.5862000 11.88000 0.8024000 0.9941000      0.9937000 
1 1 1 18 19 43 o 4.144000 0.9888000 4.559000 1.380000  3.729000 1.417000  0.8297000      1.978000  
1 1 1 18 19 45 f 3.110000 0.9121000 2.972000 1.270000  3.248000 1.310000  -0.2758000     1.824000  
1 1 1 18 19 47 o 3.482000 0.9526000 3.783000 1.407000  3.181000 1.285000  0.6025000      1.905000  
1 1 1 18 19 49 o 15.33000 0.4132000 15.28000 0.6029000 15.39000 0.5652000 -0.1113000     0.8264000 
1 1 1 18 19 51 o 8.506000 0.7386000 7.892000 1.212000  9.121000 0.8448000 -1.229000      1.477000  
1 1 1 18 19 53 o 4.088000 1.039000  3.430000 1.439000  4.746000 1.499000  -1.316000      2.078000  
1 1 1 18 19 55 o 5.270000 1.145000  4.227000 1.559000  6.313000 1.678000  -2.086000      2.291000  
1 1 1 18 19 57 o 7.272000 0.7657000 8.024000 1.073000  6.520000 1.092000  1.504000       1.531000  
1 1 1 18 19 59 o 3.058000 0.9357000 3.240000 1.407000  2.877000 1.234000  0.3638000      1.871000  
1 1 1 18 20 0  o 13.60000 0.3794000 13.60000 0.3794000 13.60000 0.3794000 0.000000       0.000000  
1 1 1 18 20 2  o 33.02000 0.3060000 33.38000 0.3973000 32.66000 0.4656000 0.7110000      0.6121000 
1 1 1 18 20 4  o 36.82000 0.2947000 36.24000 0.4134000 37.41000 0.4200000 -1.174000      0.5894000 
1 1 1 18 20 6  o 36.06000 0.2925000 35.80000 0.4101000 36.32000 0.4172000 -0.5209000     0.5850000 
1 1 1 18 20 8  o 14.12000 0.3887000 14.73000 0.5683000 13.51000 0.5304000 1.225000       0.7773000 
1 1 1 18 20 10 o 50.98000 0.4443000 50.56000 0.6259000 51.39000 0.6307000 -0.8361000     0.8886000 
1 1 1 18 20 12 o 39.06000 0.4503000 38.87000 0.6376000 39.26000 0.6359000 -0.3885000     0.9005000 
1 1 1 18 20 14 o 25.15000 0.3302000 25.00000 0.4759000 25.30000 0.4580000 -0.2958000     0.6605000 
1 1 1 18 20 16 o 58.02000 0.5591000 58.16000 0.7016000 57.88000 0.8707000 0.2872000      1.118000  
1 1 1 18 20 18 o 17.94000 0.3943000 18.12000 0.2880000 17.76000 0.7342000 0.3561000      0.7887000 
1 1 1 18 20 20 o 41.68000 0.4066000 41.31000 0.4465000 42.06000 0.6798000 -0.7454000     0.8133000 
1 1 1 18 20 22 o 44.07000 0.3590000 44.54000 0.4321000 43.60000 0.5734000 0.9398000      0.7179000 
1 1 1 18 20 24 o 29.60000 0.3040000 29.00000 0.3439000 30.21000 0.5015000 -1.210000      0.6081000 
1 1 1 18 20 26 o 37.93000 0.4162000 37.31000 0.5043000 38.54000 0.6623000 -1.233000      0.8324000 
1 1 1 18 20 28 o 50.26000 0.4017000 50.63000 0.4854000 49.90000 0.6401000 0.7282000      0.8033000 
1 1 1 18 20 30 o 47.96000 0.3935000 47.74000 0.4687000 48.19000 0.6322000 -0.4486000     0.7870000 
1 1 1 18 20 32 o 16.36000 0.3812000 16.30000 0.4664000 16.42000 0.6030000 -0.1203000     0.7623000 
1 1 1 18 20 34 o 8.243000 0.6577000 8.035000 0.7932000 8.451000 1.049000  -0.4155000     1.315000  
1 1 1 18 20 36 o 7.645000 0.7152000 7.843000 0.9934000 7.446000 1.029000  0.3969000      1.430000  
1 1 1 18 20 38 o 6.761000 0.8010000 5.838000 1.286000  7.684000 0.9559000 -1.845000      1.602000  
1 1 1 18 20 40 o 7.972000 0.7129000 7.378000 1.140000  8.566000 0.8562000 -1.188000      1.426000  
1 1 1 18 20 42 o 9.431000 0.9234000 9.773000 0.8675000 9.089000 1.630000  0.6834000      1.847000  
1 1 1 18 20 44 o 10.75000 0.4843000 10.77000 0.6595000 10.72000 0.7094000 0.4679000E-01  0.9686000 
1 1 1 18 20 46 o 5.883000 0.9249000 4.847000 1.467000  6.920000 1.127000  -2.073000      1.850000  
1 1 1 18 20 48 o 16.19000 0.3847000 16.20000 0.5638000 16.17000 0.5235000 0.2892000E-01  0.7693000 
1 1 1 18 20 50 o 6.253000 0.8787000 5.434000 1.422000  7.073000 1.032000  -1.638000      1.757000  
1 1 1 18 20 52 o 5.277000 1.215000  5.834000 1.722000  4.720000 1.715000  1.114000       2.430000  
1 1 1 18 20 54 o 8.631000 0.7619000 7.332000 1.288000  9.930000 0.8133000 -2.599000      1.524000  
1 1 1 18 20 56 o 8.803000 0.6637000 8.823000 1.003000  8.784000 0.8696000 0.3903000E-01  1.327000  
1 1 1 18 20 58 o 2.973000 0.9474000 3.238000 1.437000  2.709000 1.235000  0.5297000      1.895000  
1 1 1 18 21 1  f 29.66000 0.2910000 29.99000 0.3755000 29.32000 0.4445000 0.6736000      0.5819000 
1 1 1 18 21 3  o 19.31000 0.2361000 19.11000 0.3356000 19.50000 0.3322000 -0.3909000     0.4722000 
1 1 1 18 21 5  f 65.92000 0.5080000 65.58000 0.7657000 66.27000 0.6678000 -0.6899000     1.016000  
1 1 1 18 21 7  o 36.55000 0.3593000 36.53000 0.5117000 36.57000 0.5045000 -0.4306000E-01 0.7186000 
1 1 1 18 21 9  o 45.64000 0.4688000 45.47000 0.5804000 45.81000 0.7364000 -0.3429000     0.9376000 
1 1 1 18 21 11 o 32.47000 0.3766000 32.20000 0.4861000 32.73000 0.5753000 -0.5342000     0.7531000 
1 1 1 18 21 13 o 63.18000 0.5299000 63.66000 0.7539000 62.71000 0.7447000 0.9438000      1.060000  
1 1 1 18 21 15 f 26.10000 0.3800000 26.19000 0.4757000 26.01000 0.5928000 0.1727000      0.7601000 
1 1 1 18 21 17 o 34.51000 0.3585000 34.27000 0.5091000 34.75000 0.5049000 -0.4823000     0.7170000 
1 1 1 18 21 19 o 24.11000 0.5099000 23.65000 0.8418000 24.57000 0.5758000 -0.9126000     1.020000  
1 1 1 18 21 21 o 24.36000 0.2859000 23.98000 0.3095000 24.75000 0.4809000 -0.7676000     0.5719000 
1 1 1 18 21 23 o 52.93000 0.4140000 52.37000 0.4899000 53.50000 0.6675000 -1.130000      0.8280000 
1 1 1 18 21 25 o 74.75000 0.6491000 75.75000 0.7525000 73.76000 1.058000  1.993000       1.298000  
1 1 1 18 21 27 o 38.38000 0.3586000 38.23000 0.4539000 38.54000 0.5552000 -0.3116000     0.7171000 
1 1 1 18 21 29 o 9.707000 0.6215000 9.081000 0.6218000 10.33000 1.076000  -1.252000      1.243000  
1 1 1 18 21 31 o 22.58000 0.3435000 22.29000 0.4227000 22.86000 0.5416000 -0.5663000     0.6870000 
1 1 1 18 21 33 o 14.88000 0.3976000 14.94000 0.4692000 14.82000 0.6419000 0.1244000      0.7951000 
1 1 1 18 21 35 o 22.95000 0.3383000 23.12000 0.4079000 22.78000 0.5397000 0.3387000      0.6765000 
1 1 1 18 21 37 o 22.70000 0.3255000 22.94000 0.4403000 22.46000 0.4795000 0.4724000      0.6510000 
1 1 1 18 21 39 o 9.697000 0.5606000 8.831000 0.8525000 10.56000 0.7283000 -1.733000      1.121000  
1 1 1 18 21 41 o 4.467000 0.9034000 5.936000 1.214000  2.998000 1.339000  2.938000       1.807000  
1 1 1 18 21 43 o 15.61000 0.4976000 16.21000 0.7609000 15.02000 0.6415000 1.194000       0.9952000 
1 1 1 18 21 45 o 12.30000 0.4869000 11.43000 0.7554000 13.17000 0.6145000 -1.739000      0.9738000 
1 1 1 18 21 47 o 5.100000 0.9234000 4.948000 1.395000  5.252000 1.210000  -0.3045000     1.847000  
1 1 1 18 21 49 o 8.038000 0.6360000 8.012000 0.9541000 8.064000 0.8412000 -0.5186000E-01 1.272000  
1 1 1 18 21 51 o 8.654000 0.7087000 9.604000 0.9786000 7.704000 1.025000  1.900000       1.417000  
1 1 1 18 21 53 o 5.564000 0.9545000 4.404000 1.584000  6.724000 1.066000  -2.320000      1.909000  
1 1 1 18 21 55 o 7.788000 0.8679000 8.643000 1.263000  6.933000 1.190000  1.709000       1.736000  
1 1 1 18 21 57 o 5.369000 0.9795000 5.499000 1.426000  5.238000 1.343000  0.2604000      1.959000  
1 1 1 18 22 0  o 24.45000 0.4237000 24.45000 0.4237000 24.45000 0.4237000 0.000000       0.000000  
1 1 1 18 22 2  o 10.80000 0.3266000 10.38000 0.4282000 11.22000 0.4931000 -0.8391000     0.6531000 
1 1 1 18 22 4  o 25.29000 0.2433000 25.21000 0.3444000 25.37000 0.3437000 -0.1530000     0.4865000 
1 1 1 18 22 6  o 35.82000 0.3946000 34.54000 0.4929000 37.11000 0.6165000 -2.568000      0.7893000 
1 1 1 18 22 8  o 43.85000 0.4014000 43.59000 0.5662000 44.11000 0.5691000 -0.5185000     0.8028000 
1 1 1 18 22 10 o 23.52000 0.3290000 23.34000 0.4755000 23.69000 0.4547000 -0.3478000     0.6579000 
1 1 1 18 22 12 o 39.73000 0.3799000 39.42000 0.5361000 40.05000 0.5383000 -0.6248000     0.7597000 
1 1 1 18 22 14 f 37.05000 0.3683000 36.52000 0.5183000 37.59000 0.5235000 -1.070000      0.7367000 
1 1 1 18 22 16 o 46.45000 0.4708000 46.14000 0.5945000 46.75000 0.7303000 -0.6094000     0.9416000 
1 1 1 18 22 18 o 26.97000 0.5341000 26.28000 0.9026000 27.67000 0.5715000 -1.387000      1.068000  
1 1 1 18 22 20 o 29.06000 0.3493000 29.24000 0.5003000 28.88000 0.4876000 0.3672000      0.6987000 
1 1 1 18 22 22 o 14.33000 0.3242000 13.77000 0.3331000 14.89000 0.5562000 -1.123000      0.6483000 
1 1 1 18 22 24 o 26.38000 0.3425000 27.08000 0.3678000 25.67000 0.5779000 1.414000       0.6850000 
1 1 1 18 22 26 o 16.70000 0.3361000 15.81000 0.3795000 17.59000 0.5548000 -1.782000      0.6722000 
1 1 1 18 22 28 o 21.60000 0.3905000 20.79000 0.4212000 22.40000 0.6576000 -1.608000      0.7810000 
1 1 1 18 22 30 o 46.70000 0.4074000 47.06000 0.5287000 46.33000 0.6199000 0.7298000      0.8148000 
1 1 1 18 22 32 o 12.68000 0.4219000 11.94000 0.5017000 13.41000 0.6783000 -1.478000      0.8437000 
1 1 1 18 22 34 o 36.15000 0.3946000 36.64000 0.5621000 35.65000 0.5539000 0.9908000      0.7891000 
1 1 1 18 22 36 o 10.47000 0.5635000 9.762000 0.7541000 11.18000 0.8374000 -1.421000      1.127000  
1 1 1 18 22 38 o 14.21000 0.4269000 14.01000 0.6184000 14.40000 0.5886000 -0.3938000     0.8538000 
1 1 1 18 22 40 o 11.51000 0.4523000 11.35000 0.6379000 11.67000 0.6415000 -0.3210000     0.9046000 
1 1 1 18 22 42 o 6.137000 0.8629000 6.384000 1.196000  5.890000 1.244000  0.4945000      1.726000  
1 1 1 18 22 44 o 23.67000 0.3664000 23.78000 0.5593000 23.56000 0.4736000 0.2281000      0.7329000 
1 1 1 18 22 46 o 19.45000 0.4377000 19.76000 0.4860000 19.14000 0.7280000 0.6185000      0.8753000 
1 1 1 18 22 48 o 8.666000 0.5776000 9.495000 0.8554000 7.836000 0.7764000 1.659000       1.155000  
1 1 1 18 22 50 o 6.064000 0.8954000 6.543000 1.178000  5.584000 1.348000  0.9583000      1.791000  
1 1 1 18 22 52 o 5.885000 0.8743000 4.582000 1.482000  7.188000 0.9276000 -2.606000      1.749000  
1 1 1 18 22 54 o 11.21000 0.5715000 12.31000 0.7490000 10.11000 0.8635000 2.208000       1.143000  
1 1 1 18 22 56 o 4.654000 0.9915000 4.188000 1.530000  5.119000 1.261000  -0.9311000     1.983000  
1 1 1 18 22 58 o 6.699000 0.8748000 6.782000 1.316000  6.616000 1.154000  0.1663000      1.750000  
1 1 1 18 23 1  o 12.45000 0.3177000 12.01000 0.3936000 12.89000 0.4989000 -0.8740000     0.6355000 
1 1 1 18 23 3  o 16.52000 0.2441000 17.03000 0.3454000 16.01000 0.3450000 1.022000       0.4882000 
1 1 1 18 23 5  f 52.18000 0.4845000 52.47000 0.8039000 51.90000 0.5409000 0.5770000      0.9689000 
1 1 1 18 23 7  o 25.36000 0.3636000 25.37000 0.5684000 25.34000 0.4537000 0.2744000E-01  0.7273000 
1 1 1 18 23 9  o 50.21000 0.4405000 50.07000 0.6222000 50.34000 0.6237000 -0.2731000     0.8810000 
1 1 1 18 23 11 o 36.76000 0.3671000 36.43000 0.5167000 37.09000 0.5216000 -0.6603000     0.7342000 
1 1 1 18 23 13 o 39.90000 0.3830000 39.90000 0.5444000 39.89000 0.5390000 0.8720000E-02  0.7660000 
1 1 1 18 23 15 o 53.14000 0.7069000 52.09000 0.7872000 54.19000 1.174000  -2.105000      1.414000  
1 1 1 18 23 17 o 43.13000 0.4536000 43.23000 0.7043000 43.03000 0.5717000 0.1989000      0.9071000 
1 1 1 18 23 19 o 35.30000 0.4120000 35.18000 0.6386000 35.42000 0.5207000 -0.2403000     0.8240000 
1 1 1 18 23 21 o 20.18000 0.4012000 20.52000 0.6327000 19.84000 0.4934000 0.6798000      0.8023000 
1 1 1 18 23 23 o 39.25000 0.3850000 39.46000 0.4008000 39.04000 0.6574000 0.4206000      0.7700000 
1 1 1 18 23 25 o 40.78000 0.3685000 40.73000 0.4700000 40.83000 0.5676000 -0.9565000E-01 0.7369000 
1 1 1 18 23 27 o 32.95000 0.3235000 33.22000 0.3797000 32.68000 0.5239000 0.5390000      0.6470000 
1 1 1 18 23 29 o 28.88000 0.3227000 28.76000 0.3696000 29.01000 0.5290000 -0.2519000     0.6454000 
1 1 1 18 23 31 o 25.07000 0.3640000 24.45000 0.4953000 25.69000 0.5337000 -1.237000      0.7281000 
1 1 1 18 23 33 o 22.41000 0.3402000 22.43000 0.3987000 22.39000 0.5514000 0.4327000E-01  0.6804000 
1 1 1 18 23 35 o 27.55000 0.3301000 28.06000 0.3905000 27.04000 0.5322000 1.025000       0.6602000 
1 1 1 18 23 37 f 11.17000 0.4846000 10.92000 0.6965000 11.42000 0.6740000 -0.5035000     0.9692000 
1 1 1 18 23 39 o 11.18000 0.5055000 11.47000 0.6278000 10.89000 0.7924000 0.5733000      1.011000  
1 1 1 18 23 41 o 2.975000 0.9401000 3.343000 1.434000  2.607000 1.216000  0.7360000      1.880000  
1 1 1 18 23 43 o 12.03000 0.4772000 11.91000 0.7377000 12.14000 0.6055000 -0.2331000     0.9543000 
1 1 1 18 23 45 o 7.729000 0.6632000 7.929000 0.9347000 7.529000 0.9410000 0.4005000      1.326000  
1 1 1 18 23 47 o 4.341000 1.073000  3.402000 1.373000  5.280000 1.649000  -1.878000      2.146000  
1 1 1 18 23 49 o 9.755000 0.5464000 8.640000 0.8687000 10.87000 0.6628000 -2.229000      1.093000  
1 1 1 18 23 51 o 3.450000 0.9497000 4.643000 1.553000  2.257000 1.093000  2.386000       1.899000  
1 1 1 18 23 53 o 5.141000 1.164000  5.172000 1.823000  5.110000 1.447000  0.6133000E-01  2.327000  
1 1 1 18 23 55 o 3.676000 0.9988000 3.533000 1.444000  3.820000 1.380000  -0.2862000     1.998000  
1 1 1 18 23 57 o 8.487000 0.6750000 8.845000 0.9568000 8.130000 0.9525000 0.7148000      1.350000  
1 1 1 18 24 0  f 22.11000 0.3465000 22.11000 0.3465000 22.11000 0.3465000 0.000000       0.000000  
1 1 1 18 24 2  o 51.00000 0.4106000 50.80000 0.5331000 51.20000 0.6247000 -0.4014000     0.8213000 
1 1 1 18 24 4  o 33.66000 0.2995000 33.74000 0.4885000 33.58000 0.3468000 0.1637000      0.5991000 
1 1 1 18 24 6  o 21.89000 0.3257000 22.18000 0.4728000 21.60000 0.4482000 0.5820000      0.6514000 
1 1 1 18 24 8  o 17.29000 0.3531000 17.10000 0.4961000 17.47000 0.5027000 -0.3654000     0.7063000 
1 1 1 18 24 10 o 53.90000 0.4676000 54.52000 0.6646000 53.27000 0.6578000 1.253000       0.9351000 
1 1 1 18 24 12 o 42.86000 0.4451000 42.15000 0.5590000 43.57000 0.6927000 -1.428000      0.8901000 
1 1 1 18 24 14 o 27.24000 0.4083000 26.94000 0.5860000 27.53000 0.5686000 -0.5906000     0.8165000 
1 1 1 18 24 16 o 34.44000 0.4107000 34.26000 0.6367000 34.62000 0.5191000 -0.3568000     0.8215000 
1 1 1 18 24 18 o 50.71000 0.5107000 50.34000 0.7893000 51.07000 0.6483000 -0.7349000     1.021000  
1 1 1 18 24 20 o 23.98000 0.3914000 23.71000 0.5963000 24.25000 0.5071000 -0.5411000     0.7828000 
1 1 1 18 24 22 o 5.417000 1.032000  6.461000 1.354000  4.374000 1.558000  2.088000       2.064000  
1 1 1 18 24 24 o 51.04000 0.4048000 51.06000 0.4840000 51.03000 0.6489000 0.2332000E-01  0.8095000 
1 1 1 18 24 26 o 48.80000 0.3965000 48.80000 0.4677000 48.81000 0.6404000 -0.1161000E-01 0.7930000 
1 1 1 18 24 28 o 23.38000 0.3757000 22.79000 0.3620000 23.97000 0.6585000 -1.177000      0.7514000 
1 1 1 18 24 30 o 26.62000 0.3720000 26.04000 0.5365000 27.19000 0.5155000 -1.146000      0.7440000 
1 1 1 18 24 32 o 8.202000 0.6867000 8.534000 0.8133000 7.870000 1.107000  0.6643000      1.373000  
1 1 1 18 24 34 o 11.40000 0.4980000 11.44000 0.5556000 11.35000 0.8265000 0.9210000E-01  0.9959000 
1 1 1 18 24 36 o 6.743000 0.7441000 6.542000 0.8456000 6.943000 1.225000  -0.4012000     1.488000  
1 1 1 18 24 38 o 7.539000 0.6686000 7.242000 1.013000  7.836000 0.8733000 -0.5938000     1.337000  
1 1 1 18 24 40 o 15.11000 0.4834000 15.18000 0.5193000 15.05000 0.8154000 0.1315000      0.9667000 
1 1 1 18 24 42 o 11.85000 0.5121000 11.59000 0.7764000 12.12000 0.6680000 -0.5365000     1.024000  
1 1 1 18 24 44 f 8.151000 0.6849000 7.241000 1.157000  9.061000 0.7340000 -1.821000      1.370000  
1 1 1 18 24 46 o 6.962000 0.7718000 7.224000 1.059000  6.700000 1.122000  0.5242000      1.544000  
1 1 1 18 24 48 o 2.738000 0.8509000 3.318000 1.362000  2.158000 1.020000  1.160000       1.702000  
1 1 1 18 24 50 o 3.829000 1.006000  4.707000 1.564000  2.952000 1.267000  1.755000       2.013000  
1 1 1 18 24 52 o 4.036000 1.013000  3.437000 1.394000  4.635000 1.471000  -1.197000      2.027000  
1 1 1 18 24 54 o 8.364000 0.8473000 6.848000 1.499000  9.880000 0.7908000 -3.032000      1.695000  
1 1 1 18 24 56 o 8.183000 0.7693000 7.867000 1.287000  8.498000 0.8432000 -0.6315000     1.539000  
1 1 1 18 25 1  o 38.81000 0.3379000 38.94000 0.4380000 38.68000 0.5146000 0.2593000      0.6758000 
1 1 1 18 25 3  o 44.99000 0.3577000 44.84000 0.5726000 45.15000 0.4289000 -0.3110000     0.7154000 
1 1 1 18 25 5  o 59.86000 0.5741000 59.93000 0.8961000 59.78000 0.7180000 0.1415000      1.148000  
1 1 1 18 25 7  o 43.86000 0.4029000 44.10000 0.5707000 43.61000 0.5689000 0.4922000      0.8058000 
1 1 1 18 25 9  o 7.065000 0.7657000 7.432000 1.021000  6.698000 1.141000  0.7333000      1.531000  
1 1 1 18 25 11 o 32.47000 0.4220000 32.87000 0.5965000 32.08000 0.5972000 0.7809000      0.8441000 
1 1 1 18 25 13 o 34.84000 0.4025000 35.17000 0.6233000 34.51000 0.5095000 0.6592000      0.8051000 
1 1 1 18 25 15 o 28.61000 0.3955000 28.27000 0.4850000 28.95000 0.6249000 -0.6797000     0.7910000 
1 1 1 18 25 17 o 39.61000 0.3913000 39.72000 0.5572000 39.51000 0.5497000 0.2014000      0.7827000 
1 1 1 18 25 19 o 49.07000 0.4951000 49.04000 0.7611000 49.10000 0.6334000 -0.5862000E-01 0.9902000 
1 1 1 18 25 21 o 22.56000 0.3993000 22.25000 0.5246000 22.88000 0.6022000 -0.6284000     0.7987000 
1 1 1 18 25 23 o 27.66000 0.3608000 27.27000 0.5199000 28.04000 0.5004000 -0.7735000     0.7216000 
1 1 1 18 25 25 o 32.07000 0.3310000 31.59000 0.4108000 32.56000 0.5191000 -0.9732000     0.6620000 
1 1 1 18 25 27 o 38.48000 0.3467000 38.63000 0.4060000 38.33000 0.5621000 0.2966000      0.6934000 
1 1 1 18 25 29 o 23.19000 0.3802000 22.59000 0.4008000 23.78000 0.6462000 -1.192000      0.7604000 
1 1 1 18 25 31 o 5.023000 0.9278000 4.247000 1.284000  5.798000 1.339000  -1.552000      1.856000  
1 1 1 18 25 33 o 8.366000 0.6663000 8.696000 0.8236000 8.037000 1.048000  0.6590000      1.333000  
1 1 1 18 25 35 o 5.529000 0.9891000 4.583000 1.231000  6.475000 1.548000  -1.892000      1.978000  
1 1 1 18 25 37 o 24.07000 0.3148000 23.88000 0.4314000 24.26000 0.4585000 -0.3827000     0.6296000 
1 1 1 18 25 39 o 13.13000 0.4064000 13.11000 0.5556000 13.14000 0.5933000 -0.2729000E-01 0.8129000 
1 1 1 18 25 41 o 15.07000 0.3883000 15.02000 0.5284000 15.12000 0.5692000 -0.9928000E-01 0.7767000 
1 1 1 18 25 43 o 3.499000 0.9549000 3.159000 1.332000  3.838000 1.369000  -0.6787000     1.910000  
1 1 1 18 25 45 f 2.747000 0.8812000 2.725000 1.266000  2.769000 1.226000  -0.4411000E-01 1.762000  
1 1 1 18 25 47 o 11.36000 0.4934000 11.23000 0.7323000 11.50000 0.6615000 -0.2682000     0.9869000 
1 1 1 18 25 49 o 2.918000 0.8957000 3.255000 1.351000  2.580000 1.176000  0.6749000      1.791000  
1 1 1 18 25 51 o 3.086000 0.9753000 3.254000 1.381000  2.918000 1.378000  0.3353000      1.951000  
1 1 1 18 25 53 o 10.69000 0.5183000 11.25000 0.7685000 10.13000 0.6956000 1.116000       1.037000  
1 1 1 18 25 55 o 8.840000 0.6635000 8.830000 0.9488000 8.851000 0.9279000 -0.2123000E-01 1.327000  
1 1 1 18 25 57 o 5.283000 1.224000  5.429000 1.710000  5.137000 1.751000  0.2920000      2.447000  
1 1 1 18 26 0  o 42.36000 0.5492000 42.36000 0.5492000 42.36000 0.5492000 0.000000       0.000000  
1 1 1 18 26 2  o 12.25000 0.3332000 12.16000 0.5535000 12.34000 0.3711000 -0.1741000     0.6664000 
1 1 1 18 26 4  o 56.83000 0.4473000 57.09000 0.6879000 56.57000 0.5720000 0.5120000      0.8946000 
1 1 1 18 26 6  o 42.10000 0.6093000 42.24000 1.016000  41.96000 0.6734000 0.2769000      1.219000  
1 1 1 18 26 8  o 8.611000 0.6939000 9.399000 0.9733000 7.822000 0.9892000 1.577000       1.388000  
1 1 1 18 26 10 o 55.69000 0.5369000 56.26000 0.8318000 55.13000 0.6790000 1.133000       1.074000  
1 1 1 18 26 12 o 27.53000 0.3825000 26.98000 0.5920000 28.08000 0.4843000 -1.096000      0.7649000 
1 1 1 18 26 14 o 12.72000 0.5324000 12.82000 0.6532000 12.61000 0.8410000 0.2055000      1.065000  
1 1 1 18 26 16 o 21.94000 0.3890000 22.28000 0.6024000 21.61000 0.4923000 0.6691000      0.7780000 
1 1 1 18 26 18 o 35.99000 0.4585000 35.07000 0.6543000 36.91000 0.6424000 -1.839000      0.9169000 
1 1 1 18 26 20 o 28.30000 0.3924000 28.53000 0.5086000 28.06000 0.5977000 0.4773000      0.7848000 
1 1 1 18 26 22 o 40.48000 0.4401000 39.93000 0.6753000 41.02000 0.5647000 -1.099000      0.8803000 
1 1 1 18 26 24 o 24.67000 0.3688000 24.07000 0.5277000 25.26000 0.5154000 -1.188000      0.7377000 
1 1 1 18 26 26 o 34.87000 0.3761000 34.77000 0.5278000 34.98000 0.5359000 -0.2099000     0.7522000 
1 1 1 18 26 28 o 23.91000 0.4202000 23.48000 0.5344000 24.34000 0.6487000 -0.8604000     0.8405000 
1 1 1 18 26 30 o 8.481000 0.5721000 7.855000 0.7176000 9.107000 0.8911000 -1.252000      1.144000  
1 1 1 18 26 32 o 27.04000 0.3720000 26.30000 0.3714000 27.77000 0.6446000 -1.471000      0.7440000 
1 1 1 18 26 34 o 9.503000 0.5877000 9.608000 0.6533000 9.397000 0.9771000 0.2105000      1.175000  
1 1 1 18 26 36 o 6.952000 0.7259000 6.054000 0.9824000 7.850000 1.069000  -1.796000      1.452000  
1 1 1 18 26 38 o 7.839000 0.6056000 7.597000 0.8521000 8.080000 0.8609000 -0.4828000     1.211000  
1 1 1 18 26 40 o 5.840000 0.8409000 5.987000 1.119000  5.694000 1.255000  0.2931000      1.682000  
1 1 1 18 26 42 o 8.414000 0.6467000 8.501000 0.9451000 8.327000 0.8829000 0.1735000      1.293000  
1 1 1 18 26 44 o 6.279000 0.7911000 7.113000 0.9974000 5.444000 1.228000  1.669000       1.582000  
1 1 1 18 26 46 o 19.89000 0.3893000 19.66000 0.5929000 20.11000 0.5046000 -0.4547000     0.7786000 
1 1 1 18 26 48 o 4.667000 1.068000  4.037000 1.466000  5.297000 1.553000  -1.260000      2.136000  
1 1 1 18 26 50 o 4.564000 1.121000  4.482000 1.513000  4.647000 1.655000  -0.1648000     2.243000  
1 1 1 18 26 52 o 6.485000 0.9615000 6.574000 1.361000  6.396000 1.359000  0.1782000      1.923000  
1 1 1 18 26 54 o 2.969000 0.8921000 2.484000 1.183000  3.454000 1.336000  -0.9701000     1.784000  
1 1 1 18 26 56 o 2.790000 0.8887000 2.919000 1.313000  2.660000 1.198000  0.2595000      1.777000  
1 1 1 18 27 1  o 51.89000 0.4962000 52.72000 0.7843000 51.06000 0.6082000 1.663000       0.9925000 
1 1 1 18 27 3  o 73.41000 0.6347000 73.67000 1.042000  73.15000 0.7247000 0.5207000      1.269000  
1 1 1 18 27 5  o 22.94000 0.5530000 23.06000 0.9627000 22.82000 0.5445000 0.2395000      1.106000  
1 1 1 18 27 7  o 13.68000 0.4347000 13.94000 0.6680000 13.41000 0.5565000 0.5344000      0.8694000 
1 1 1 18 27 9  o 15.67000 0.3893000 15.14000 0.5592000 16.19000 0.5417000 -1.051000      0.7786000 
1 1 1 18 27 11 o 39.91000 0.3859000 39.66000 0.5414000 40.17000 0.5500000 -0.5082000     0.7718000 
1 1 1 18 27 13 o 63.28000 0.5960000 62.63000 0.9107000 63.93000 0.7692000 -1.298000      1.192000  
1 1 1 18 27 15 o 36.10000 0.4139000 35.57000 0.6236000 36.63000 0.5445000 -1.062000      0.8279000 
1 1 1 18 27 17 o 51.35000 0.5635000 51.81000 0.8079000 50.90000 0.7856000 0.9019000      1.127000  
1 1 1 18 27 19 o 13.42000 0.4776000 13.05000 0.7073000 13.80000 0.6420000 -0.7516000     0.9552000 
1 1 1 18 27 21 o 16.58000 0.4279000 16.43000 0.6101000 16.72000 0.6000000 -0.2853000     0.8557000 
1 1 1 18 27 23 o 14.84000 0.4522000 15.05000 0.6446000 14.63000 0.6343000 0.4190000      0.9043000 
1 1 1 18 27 25 o 21.36000 0.3819000 21.58000 0.5426000 21.15000 0.5375000 0.4351000      0.7638000 
1 1 1 18 27 27 f 19.45000 0.4184000 19.43000 0.4248000 19.47000 0.7210000 -0.4318000E-01 0.8368000 
1 1 1 18 27 29 o 17.75000 0.3454000 17.47000 0.3721000 18.03000 0.5821000 -0.5669000     0.6909000 
1 1 1 18 27 31 o 16.46000 0.5571000 15.90000 0.8397000 17.03000 0.7322000 -1.132000      1.114000  
1 1 1 18 27 33 o 15.63000 0.3792000 14.71000 0.4420000 16.56000 0.6163000 -1.853000      0.7585000 
1 1 1 18 27 35 o 27.28000 0.3501000 27.27000 0.4624000 27.28000 0.5258000 -0.1099000E-02 0.7002000 
1 1 1 18 27 37 o 25.38000 0.3345000 25.50000 0.4152000 25.25000 0.5246000 0.2495000      0.6691000 
1 1 1 18 27 39 o 4.391000 0.9733000 2.976000 1.228000  5.807000 1.510000  -2.831000      1.947000  
1 1 1 18 27 41 o 18.16000 0.3467000 17.84000 0.4886000 18.49000 0.4919000 -0.6448000     0.6933000 
1 1 1 18 27 43 o 13.41000 0.4397000 13.71000 0.6652000 13.11000 0.5752000 0.5998000      0.8794000 
1 1 1 18 27 45 o 13.97000 0.4295000 13.84000 0.6161000 14.10000 0.5986000 -0.2638000     0.8590000 
1 1 1 18 27 47 o 12.22000 0.5379000 11.66000 0.7315000 12.78000 0.7888000 -1.122000      1.076000  
1 1 1 18 27 49 o 3.338000 0.9620000 3.616000 1.426000  3.059000 1.292000  0.5574000      1.924000  
1 1 1 18 27 51 o 4.071000 1.019000  3.368000 1.404000  4.774000 1.478000  -1.406000      2.038000  
1 1 1 18 27 53 o 2.697000 0.8713000 2.841000 1.293000  2.552000 1.168000  0.2893000      1.743000  
1 1 1 18 27 55 f 3.268000 1.001000  3.447000 1.505000  3.088000 1.320000  0.3586000      2.002000  
1 1 1 18 28 0  o 94.62000 0.9312000 94.62000 0.9312000 94.62000 0.9312000 0.000000       0.000000  
1 1 1 18 28 2  o 36.42000 0.3184000 35.33000 0.4716000 37.50000 0.4280000 -2.178000      0.6368000 
1 1 1 18 28 4  o 46.76000 0.5867000 46.52000 1.063000  46.99000 0.4977000 -0.4753000     1.173000  
1 1 1 18 28 6  o 41.36000 0.3933000 41.61000 0.5528000 41.11000 0.5596000 0.4990000      0.7866000 
1 1 1 18 28 8  o 29.04000 0.3407000 28.99000 0.4806000 29.09000 0.4832000 -0.9917000E-01 0.6815000 
1 1 1 18 28 10 o 25.12000 0.3438000 24.81000 0.4849000 25.42000 0.4875000 -0.6075000     0.6876000 
1 1 1 18 28 12 o 27.27000 0.3823000 26.89000 0.5845000 27.66000 0.4930000 -0.7700000     0.7647000 
1 1 1 18 28 14 o 24.93000 0.4974000 24.69000 0.5031000 25.17000 0.8582000 -0.4771000     0.9948000 
1 1 1 18 28 16 o 21.18000 0.3989000 20.92000 0.5164000 21.45000 0.6082000 -0.5228000     0.7979000 
1 1 1 18 28 18 o 14.68000 0.4294000 14.23000 0.6120000 15.13000 0.6026000 -0.9015000     0.8588000 
1 1 1 18 28 20 o 35.87000 0.3882000 36.10000 0.5528000 35.64000 0.5452000 0.4669000      0.7764000 
1 1 1 18 28 22 o 23.65000 0.3685000 23.79000 0.5326000 23.51000 0.5093000 0.2845000      0.7369000 
1 1 1 18 28 24 o 11.99000 0.5331000 12.33000 0.7462000 11.64000 0.7614000 0.6859000      1.066000  
1 1 1 18 28 26 o 24.77000 0.3667000 24.54000 0.5032000 25.01000 0.5336000 -0.4750000     0.7334000 
1 1 1 18 28 28 o 6.261000 0.8684000 5.770000 0.8420000 6.752000 1.519000  -0.9823000     1.737000  
1 1 1 18 28 30 f 11.39000 0.4403000 11.06000 0.5362000 11.72000 0.6986000 -0.6630000     0.8806000 
1 1 1 18 28 32 o 6.892000 0.7514000 6.857000 0.9041000 6.927000 1.200000  -0.7028000E-01 1.503000  
1 1 1 18 28 34 o 15.53000 0.4499000 14.70000 0.6891000 16.36000 0.5785000 -1.659000      0.8998000 
1 1 1 18 28 36 o 4.285000 0.9075000 3.410000 1.216000  5.159000 1.348000  -1.749000      1.815000  
1 1 1 18 28 38 o 4.564000 0.9439000 4.388000 1.232000  4.741000 1.431000  -0.3526000     1.888000  
1 1 1 18 28 40 o 10.70000 0.4511000 10.14000 0.6470000 11.27000 0.6289000 -1.133000      0.9023000 
1 1 1 18 28 42 o 14.34000 0.3940000 14.32000 0.5606000 14.37000 0.5540000 -0.4766000E-01 0.7881000 
1 1 1 18 28 44 o 7.091000 0.7782000 7.107000 1.169000  7.075000 1.027000  0.3183000E-01  1.556000  
1 1 1 18 28 46 o 9.744000 0.6411000 9.140000 0.9205000 10.35000 0.8926000 -1.208000      1.282000  
1 1 1 18 28 48 o 13.00000 0.5019000 12.56000 0.6732000 13.43000 0.7444000 -0.8706000     1.004000  
1 1 1 18 28 50 o 11.13000 0.5265000 10.56000 0.7784000 11.69000 0.7091000 -1.134000      1.053000  
1 1 1 18 28 52 o 4.642000 1.026000  5.171000 1.447000  4.114000 1.455000  1.058000       2.052000  
1 1 1 18 28 54 o 3.862000 1.016000  4.424000 1.543000  3.300000 1.322000  1.124000       2.032000  
1 1 1 18 29 1  o 22.67000 0.3147000 23.31000 0.4484000 22.03000 0.4417000 1.280000       0.6295000 
1 1 1 18 29 3  f 37.84000 0.3067000 37.84000 0.4385000 37.84000 0.4291000 -0.3483000E-02 0.6135000 
1 1 1 18 29 5  o 24.74000 0.3931000 24.16000 0.4643000 25.33000 0.6346000 -1.172000      0.7863000 
1 1 1 18 29 7  o 32.21000 0.3505000 32.12000 0.4903000 32.30000 0.5011000 -0.1869000     0.7010000 
1 1 1 18 29 9  o 45.54000 0.4656000 46.09000 0.7170000 44.99000 0.5943000 1.102000       0.9313000 
1 1 1 18 29 11 o 11.04000 0.5588000 10.68000 0.8764000 11.40000 0.6936000 -0.7200000     1.118000  
1 1 1 18 29 13 o 29.47000 0.3891000 29.38000 0.4977000 29.56000 0.5982000 -0.1826000     0.7782000 
1 1 1 18 29 15 o 26.22000 0.3896000 25.76000 0.5048000 26.68000 0.5937000 -0.9181000     0.7793000 
1 1 1 18 29 17 o 31.42000 0.4163000 31.70000 0.6490000 31.14000 0.5216000 0.5581000      0.8326000 
1 1 1 18 29 19 o 38.69000 0.3966000 39.05000 0.5588000 38.33000 0.5630000 0.7218000      0.7933000 
1 1 1 18 29 21 o 33.87000 0.3804000 34.22000 0.5401000 33.52000 0.5358000 0.6907000      0.7607000 
1 1 1 18 29 23 f 23.99000 0.3757000 24.32000 0.5320000 23.65000 0.5307000 0.6727000      0.7514000 
1 1 1 18 29 25 o 14.27000 0.4753000 15.50000 0.6267000 13.05000 0.7147000 2.445000       0.9506000 
1 1 1 18 29 27 o 14.95000 0.5381000 15.13000 0.7317000 14.76000 0.7892000 0.3654000      1.076000  
1 1 1 18 29 29 o 14.81000 0.4158000 14.02000 0.3745000 15.59000 0.7426000 -1.569000      0.8317000 
1 1 1 18 29 31 o 10.62000 0.4655000 10.76000 0.4665000 10.48000 0.8057000 0.2778000      0.9310000 
1 1 1 18 29 33 o 3.479000 0.9496000 3.080000 1.297000  3.878000 1.387000  -0.7974000     1.899000  
1 1 1 18 29 35 o 10.64000 0.5018000 10.36000 0.6953000 10.91000 0.7238000 -0.5574000     1.004000  
1 1 1 18 29 37 o 3.785000 0.9379000 2.580000 1.079000  4.991000 1.534000  -2.411000      1.876000  
1 1 1 18 29 39 o 11.55000 0.4321000 11.45000 0.5822000 11.64000 0.6386000 -0.1863000     0.8642000 
1 1 1 18 29 41 o 17.37000 0.3747000 17.35000 0.5596000 17.40000 0.4984000 -0.5122000E-01 0.7493000 
1 1 1 18 29 43 o 6.154000 0.7620000 7.248000 0.9008000 5.060000 1.229000  2.189000       1.524000  
1 1 1 18 29 45 o 14.72000 0.4470000 14.52000 0.5765000 14.92000 0.6833000 -0.4015000     0.8940000 
1 1 1 18 29 47 o 11.41000 0.6016000 11.15000 0.8714000 11.67000 0.8296000 -0.5136000     1.203000  
1 1 1 18 29 49 o 3.987000 1.021000  4.417000 1.434000  3.557000 1.454000  0.8601000      2.043000  
1 1 1 18 29 51 f 10.48000 0.6429000 9.975000 0.9625000 10.98000 0.8526000 -1.004000      1.286000  
1 1 1 18 29 53 o 4.862000 1.015000  5.111000 1.481000  4.612000 1.390000  0.4987000      2.031000  
1 1 1 18 30 0  o 75.14000 0.7531000 75.14000 0.7531000 75.14000 0.7531000 0.000000       0.000000  
1 1 1 18 30 2  o 12.09000 0.2980000 11.71000 0.4530000 12.47000 0.3873000 -0.7624000     0.5960000 
1 1 1 18 30 4  o 35.19000 0.4487000 35.07000 0.5959000 35.32000 0.6709000 -0.2517000     0.8974000 
1 1 1 18 30 6  o 13.89000 0.4447000 13.41000 0.5067000 14.36000 0.7309000 -0.9514000     0.8894000 
1 1 1 18 30 8  o 19.50000 0.4099000 19.65000 0.5768000 19.36000 0.5827000 0.2907000      0.8199000 
1 1 1 18 30 10 o 20.73000 0.4531000 20.40000 0.6823000 21.06000 0.5963000 -0.6580000     0.9061000 
1 1 1 18 30 12 o 23.79000 0.3884000 23.58000 0.5026000 23.99000 0.5923000 -0.4127000     0.7769000 
1 1 1 18 30 14 o 38.96000 0.4423000 38.49000 0.5427000 39.43000 0.6985000 -0.9380000     0.8845000 
1 1 1 18 30 16 o 32.31000 0.3714000 32.52000 0.5246000 32.09000 0.5259000 0.4321000      0.7429000 
1 1 1 18 30 18 o 35.99000 0.3874000 35.47000 0.5340000 36.50000 0.5613000 -1.034000      0.7747000 
1 1 1 18 30 20 o 29.49000 0.3725000 29.47000 0.5249000 29.51000 0.5287000 -0.4050000E-01 0.7450000 
1 1 1 18 30 22 o 17.91000 0.4270000 17.92000 0.5987000 17.91000 0.6091000 0.1632000E-01  0.8540000 
1 1 1 18 30 24 o 23.91000 0.4575000 23.81000 0.6672000 24.02000 0.6261000 -0.2132000     0.9149000 
1 1 1 18 30 26 f 12.61000 0.5854000 12.84000 0.6866000 12.38000 0.9484000 0.4591000      1.171000  
1 1 1 18 30 28 o 13.18000 0.5649000 13.30000 0.6876000 13.06000 0.8966000 0.2349000      1.130000  
1 1 1 18 30 30 o 10.10000 0.4642000 9.772000 0.4677000 10.42000 0.8020000 -0.6479000     0.9284000 
1 1 1 18 30 32 o 10.64000 0.5307000 9.325000 0.6182000 11.95000 0.8628000 -2.621000      1.061000  
1 1 1 18 30 34 o 14.06000 0.3708000 13.19000 0.4439000 14.93000 0.5941000 -1.735000      0.7416000 
1 1 1 18 30 36 o 6.012000 0.7106000 6.132000 0.9663000 5.891000 1.042000  0.2413000      1.421000  
1 1 1 18 30 38 o 10.52000 0.4712000 10.05000 0.5972000 10.98000 0.7290000 -0.9277000     0.9424000 
1 1 1 18 30 40 o 6.826000 0.6962000 5.312000 1.130000  8.339000 0.8140000 -3.027000      1.392000  
1 1 1 18 30 42 o 8.747000 0.5576000 8.796000 0.7769000 8.699000 0.8000000 0.9641000E-01  1.115000  
1 1 1 18 30 44 o 5.190000 0.9207000 3.862000 1.387000  6.518000 1.212000  -2.656000      1.841000  
1 1 1 18 30 46 o 3.246000 0.9513000 3.117000 1.264000  3.375000 1.422000  -0.2584000     1.903000  
1 1 1 18 30 48 o 6.829000 1.007000  6.521000 1.649000  7.137000 1.157000  -0.6160000     2.014000  
1 1 1 18 30 50 o 7.327000 0.7257000 7.576000 1.089000  7.077000 0.9597000 0.4982000      1.451000  
1 1 1 18 30 52 o 3.101000 0.9222000 3.717000 1.427000  2.486000 1.168000  1.231000       1.844000  
1 1 1 18 30 54 f 3.566000 1.050000  3.456000 1.412000  3.677000 1.556000  -0.2212000     2.101000  
1 1 1 18 31 1  o 15.39000 0.3463000 15.76000 0.5671000 15.01000 0.3977000 0.7524000      0.6926000 
1 1 1 18 31 3  o 26.59000 0.2837000 27.17000 0.4279000 26.00000 0.3726000 1.164000       0.5674000 
1 1 1 18 31 5  o 10.87000 0.6488000 10.55000 0.5563000 11.19000 1.172000  -0.6454000     1.298000  
1 1 1 18 31 7  o 24.51000 0.4900000 24.35000 0.3964000 24.67000 0.8962000 -0.3149000     0.9799000 
1 1 1 18 31 9  o 35.24000 0.5123000 35.46000 0.4420000 35.03000 0.9244000 0.4268000      1.025000  
1 1 1 18 31 11 f 24.93000 0.3552000 25.49000 0.4953000 24.37000 0.5093000 1.114000       0.7104000 
1 1 1 18 31 13 o 12.41000 0.5881000 13.27000 0.6657000 11.55000 0.9696000 1.720000       1.176000  
1 1 1 18 31 15 o 6.469000 0.9310000 6.771000 1.262000  6.167000 1.369000  0.6038000      1.862000  
1 1 1 18 31 17 f 32.90000 0.4352000 33.53000 0.6758000 32.27000 0.5485000 1.250000       0.8703000 
1 1 1 18 31 19 o 19.60000 0.4104000 19.62000 0.5702000 19.59000 0.5904000 0.2487000E-01  0.8208000 
1 1 1 18 31 21 o 5.869000 1.089000  5.380000 1.491000  6.357000 1.589000  -0.9769000     2.179000  
1 1 1 18 31 23 o 5.029000 1.130000  5.618000 1.675000  4.439000 1.519000  1.179000       2.261000  
1 1 1 18 31 25 o 13.46000 0.4763000 13.37000 0.6488000 13.55000 0.6975000 -0.1835000     0.9526000 
1 1 1 18 31 27 o 9.531000 0.6822000 9.152000 0.8813000 9.911000 1.042000  -0.7588000     1.364000  
1 1 1 18 31 29 o 15.38000 0.4560000 15.34000 0.6974000 15.42000 0.5879000 -0.7590000E-01 0.9121000 
1 1 1 18 31 31 o 11.65000 0.4604000 10.62000 0.6495000 12.68000 0.6526000 -2.061000      0.9207000 
1 1 1 18 31 33 o 17.81000 0.3900000 17.86000 0.5486000 17.77000 0.5545000 0.8893000E-01  0.7800000 
1 1 1 18 31 35 o 15.91000 0.3562000 15.78000 0.3967000 16.04000 0.5917000 -0.2586000     0.7124000 
1 1 1 18 31 37 o 5.357000 0.8059000 5.051000 0.8772000 5.664000 1.352000  -0.6132000     1.612000  
1 1 1 18 31 39 o 8.510000 0.5285000 8.215000 0.7223000 8.804000 0.7717000 -0.5889000     1.057000  
1 1 1 18 31 41 o 6.059000 0.7410000 5.595000 1.094000  6.523000 0.9994000 -0.9282000     1.482000  
1 1 1 18 31 43 o 6.945000 0.7424000 5.708000 1.137000  8.182000 0.9545000 -2.473000      1.485000  
1 1 1 18 31 45 o 10.79000 0.4742000 10.29000 0.6667000 11.29000 0.6744000 -1.002000      0.9484000 
1 1 1 18 31 47 o 9.151000 0.6244000 9.356000 0.8521000 8.946000 0.9129000 0.4093000      1.249000  
1 1 1 18 31 49 o 11.13000 0.5127000 10.58000 0.7316000 11.69000 0.7185000 -1.110000      1.025000  
1 1 1 18 31 51 o 2.872000 0.8963000 2.718000 1.245000  3.025000 1.290000  -0.3076000     1.793000  
1 1 1 18 31 53 o 6.429000 0.8415000 6.379000 1.210000  6.479000 1.170000  -0.1002000     1.683000  
1 1 1 18 32 0  o 2.768000 1.102000  2.768000 1.102000  2.768000 1.102000  0.000000       0.000000  
1 1 1 18 32 2  o 35.06000 0.2984000 34.44000 0.4225000 35.68000 0.4214000 -1.238000      0.5967000 
1 1 1 18 32 4  o 7.428000 0.4971000 7.376000 0.9018000 7.480000 0.4186000 -0.1047000     0.9942000 
1 1 1 18 32 6  o 51.76000 0.4903000 52.57000 0.5615000 50.96000 0.8039000 1.612000       0.9806000 
1 1 1 18 32 8  o 41.57000 0.4337000 41.51000 0.4813000 41.62000 0.7218000 -0.1096000     0.8675000 
1 1 1 18 32 10 o 15.08000 0.4635000 14.65000 0.4992000 15.51000 0.7811000 -0.8552000     0.9270000 
1 1 1 18 32 12 o 34.67000 0.3780000 34.52000 0.5240000 34.81000 0.5448000 -0.2913000     0.7559000 
1 1 1 18 32 14 o 21.40000 0.3767000 21.52000 0.5263000 21.28000 0.5390000 0.2416000      0.7533000 
1 1 1 18 32 16 o 26.64000 0.4306000 27.24000 0.6661000 26.03000 0.5460000 1.219000       0.8613000 
1 1 1 18 32 18 o 50.35000 0.4661000 49.99000 0.6435000 50.72000 0.6745000 -0.7209000     0.9323000 
1 1 1 18 32 20 o 8.398000 0.8586000 8.195000 1.423000  8.602000 0.9608000 -0.4073000     1.717000  
1 1 1 18 32 22 o 24.25000 0.4208000 24.91000 0.6331000 23.58000 0.5544000 1.329000       0.8416000 
1 1 1 18 32 24 o 13.93000 0.4762000 14.52000 0.6319000 13.34000 0.7125000 1.174000       0.9523000 
1 1 1 18 32 26 f 21.69000 0.5282000 20.45000 0.5193000 22.92000 0.9200000 -2.462000      1.056000  
1 1 1 18 32 28 o 14.69000 0.4649000 15.65000 0.6859000 13.74000 0.6277000 1.912000       0.9297000 
1 1 1 18 32 30 o 16.54000 0.5986000 17.40000 1.041000  15.68000 0.5908000 1.718000       1.197000  
1 1 1 18 32 32 o 5.716000 0.7573000 5.540000 0.7525000 5.893000 1.314000  -0.3535000     1.515000  
1 1 1 18 32 34 o 7.103000 0.6209000 7.183000 0.6830000 7.024000 1.037000  0.1595000      1.242000  
1 1 1 18 32 36 o 14.25000 0.3806000 14.29000 0.4385000 14.21000 0.6223000 0.8265000E-01  0.7613000 
1 1 1 18 32 38 o 7.132000 0.5798000 6.958000 0.7830000 7.305000 0.8554000 -0.3469000     1.160000  
1 1 1 18 32 40 o 11.12000 0.4595000 10.17000 0.6932000 12.07000 0.6034000 -1.892000      0.9190000 
1 1 1 18 32 42 f 6.324000 0.8142000 5.088000 1.244000  7.559000 1.051000  -2.471000      1.628000  
1 1 1 18 32 44 o 3.097000 0.8631000 3.699000 1.312000  2.495000 1.121000  1.205000       1.726000  
1 1 1 18 32 46 o 3.546000 0.9556000 2.719000 1.262000  4.372000 1.435000  -1.652000      1.911000  
1 1 1 18 32 48 o 4.161000 1.013000  3.648000 1.352000  4.673000 1.509000  -1.024000      2.026000  
1 1 1 18 32 50 o 4.732000 1.055000  4.268000 1.544000  5.195000 1.438000  -0.9267000     2.110000  
1 1 1 18 32 52 f 3.719000 0.9812000 3.854000 1.421000  3.584000 1.353000  0.2696000      1.962000  
1 1 1 18 33 1  o 11.00000 0.3513000 11.59000 0.4985000 10.41000 0.4952000 1.179000       0.7026000 
1 1 1 18 33 3  o 14.18000 0.3279000 14.31000 0.5483000 14.05000 0.3598000 0.2641000      0.6558000 
1 1 1 18 33 5  o 36.45000 0.4069000 36.77000 0.4501000 36.13000 0.6779000 0.6371000      0.8137000 
1 1 1 18 33 7  o 40.48000 0.4325000 40.56000 0.4737000 40.40000 0.7238000 0.1612000      0.8650000 
1 1 1 18 33 9  o 40.08000 0.4517000 39.49000 0.5351000 40.67000 0.7278000 -1.183000      0.9033000 
1 1 1 18 33 11 o 29.20000 0.3959000 29.30000 0.4268000 29.11000 0.6670000 0.1881000      0.7919000 
1 1 1 18 33 13 o 16.20000 0.4636000 16.90000 0.4646000 15.50000 0.8024000 1.400000       0.9272000 
1 1 1 18 33 15 f 8.992000 0.7355000 7.471000 1.213000  10.51000 0.8317000 -3.041000      1.471000  
1 1 1 18 33 17 o 28.78000 0.5294000 28.69000 0.8462000 28.87000 0.6364000 -0.1820000     1.059000  
1 1 1 18 33 19 o 25.55000 0.3854000 25.65000 0.5336000 25.46000 0.5562000 0.1943000      0.7708000 
1 1 1 18 33 21 o 8.002000 0.7794000 8.087000 1.132000  7.916000 1.072000  0.1702000      1.559000  
1 1 1 18 33 23 o 9.636000 0.6150000 10.30000 0.8271000 8.973000 0.9103000 1.327000       1.230000  
1 1 1 18 33 25 o 25.19000 0.4639000 24.99000 0.6289000 25.40000 0.6822000 -0.4088000     0.9278000 
1 1 1 18 33 27 o 9.981000 0.5460000 9.788000 0.7832000 10.17000 0.7610000 -0.3863000     1.092000  
1 1 1 18 33 29 o 10.89000 0.7496000 11.28000 1.288000  10.50000 0.7673000 0.7878000      1.499000  
1 1 1 18 33 31 o 14.63000 0.4193000 14.19000 0.5762000 15.08000 0.6093000 -0.8927000     0.8386000 
1 1 1 18 33 33 o 30.61000 0.3631000 30.70000 0.5024000 30.52000 0.5244000 0.1804000      0.7263000 
1 1 1 18 33 35 o 31.22000 0.3868000 30.97000 0.4283000 31.47000 0.6443000 -0.5069000     0.7736000 
1 1 1 18 33 37 o 5.605000 0.9210000 5.686000 1.095000  5.525000 1.481000  0.1607000      1.842000  
1 1 1 18 33 39 o 3.596000 0.8982000 2.987000 1.209000  4.204000 1.329000  -1.218000      1.796000  
1 1 1 18 33 41 o 6.091000 0.7880000 5.832000 1.057000  6.350000 1.169000  -0.5178000     1.576000  
1 1 1 18 33 43 o 5.893000 0.7734000 7.019000 0.9395000 4.767000 1.229000  2.252000       1.547000  
1 1 1 18 33 45 o 5.365000 0.9158000 5.551000 1.234000  5.179000 1.353000  0.3724000      1.832000  
1 1 1 18 33 47 o 5.949000 0.9279000 6.587000 1.230000  5.311000 1.390000  1.276000       1.856000  
1 1 1 18 33 49 o 3.914000 1.105000  3.978000 1.644000  3.849000 1.475000  0.1293000      2.209000  
1 1 1 18 33 51 o 3.101000 0.9465000 3.299000 1.420000  2.903000 1.252000  0.3964000      1.893000  
1 1 1 18 34 0  o 15.54000 0.5225000 15.54000 0.5225000 15.54000 0.5225000 0.000000       0.000000  
1 1 1 18 34 2  o 30.15000 0.2847000 30.29000 0.4112000 30.02000 0.3939000 0.2766000      0.5694000 
1 1 1 18 34 4  o 17.79000 0.2666000 18.14000 0.4290000 17.45000 0.3166000 0.6876000      0.5332000 
1 1 1 18 34 6  o 34.59000 0.5470000 33.38000 0.4328000 35.80000 1.005000  -2.426000      1.094000  
1 1 1 18 34 8  o 19.03000 0.4501000 18.18000 0.5355000 19.88000 0.7237000 -1.705000      0.9003000 
1 1 1 18 34 10 o 19.89000 0.4247000 19.67000 0.4397000 20.11000 0.7267000 -0.4451000     0.8494000 
1 1 1 18 34 12 f 11.58000 0.6466000 12.31000 0.7215000 10.86000 1.073000  1.450000       1.293000  
1 1 1 18 34 14 f 18.51000 0.4983000 18.01000 0.4655000 19.00000 0.8812000 -0.9897000     0.9966000 
1 1 1 18 34 16 o 13.98000 0.5068000 14.32000 0.5900000 13.65000 0.8243000 0.6683000      1.014000  
1 1 1 18 34 18 o 16.04000 0.4517000 15.99000 0.6351000 16.10000 0.6425000 -0.1116000     0.9034000 
1 1 1 18 34 20 o 21.48000 0.3937000 21.66000 0.5399000 21.29000 0.5730000 0.3696000      0.7873000 
1 1 1 18 34 22 o 9.201000 0.7437000 9.347000 0.9145000 9.055000 1.173000  0.2916000      1.487000  
1 1 1 18 34 24 o 10.89000 0.5783000 11.55000 0.6826000 10.22000 0.9337000 1.322000       1.157000  
1 1 1 18 34 26 o 12.59000 0.4657000 12.03000 0.6886000 13.14000 0.6272000 -1.108000      0.9314000 
1 1 1 18 34 28 f 26.43000 0.5556000 27.10000 0.9818000 25.77000 0.5204000 1.327000       1.111000  
1 1 1 18 34 30 o 25.69000 0.3625000 25.29000 0.5102000 26.09000 0.5151000 -0.8065000     0.7250000 
1 1 1 18 34 32 o 9.288000 0.5941000 9.033000 0.8500000 9.543000 0.8302000 -0.5098000     1.188000  
1 1 1 18 34 34 o 5.643000 0.8361000 5.826000 0.7180000 5.460000 1.510000  0.3659000      1.672000  
1 1 1 18 34 36 o 6.403000 0.7484000 6.647000 0.8854000 6.159000 1.207000  0.4882000      1.497000  
1 1 1 18 34 38 o 7.141000 0.8667000 6.484000 1.495000  7.798000 0.8764000 -1.314000      1.733000  
1 1 1 18 34 40 f 5.204000 0.9324000 5.365000 1.220000  5.044000 1.411000  0.3217000      1.865000  
1 1 1 18 34 42 o 2.862000 0.8490000 2.713000 1.164000  3.012000 1.236000  -0.2988000     1.698000  
1 1 1 18 34 44 o 16.26000 0.3677000 15.83000 0.4975000 16.70000 0.5416000 -0.8713000     0.7355000 
1 1 1 18 34 46 o 9.042000 0.5982000 8.778000 0.8331000 9.306000 0.8586000 -0.5278000     1.196000  
1 1 1 18 34 48 f 6.597000 0.8483000 6.521000 1.108000  6.673000 1.284000  -0.1522000     1.697000  
1 1 1 18 34 50 o 8.079000 0.7569000 7.362000 1.269000  8.795000 0.8257000 -1.434000      1.514000  
1 1 1 18 35 1  o 15.77000 0.2936000 15.54000 0.4309000 15.99000 0.3987000 -0.4485000     0.5871000 
1 1 1 18 35 3  o 12.06000 0.3762000 12.76000 0.6211000 11.35000 0.4249000 1.407000       0.7525000 
1 1 1 18 35 5  o 9.142000 0.7376000 9.460000 0.6866000 8.825000 1.306000  0.6346000      1.475000  
1 1 1 18 35 7  o 20.51000 0.4251000 19.49000 0.4327000 21.52000 0.7319000 -2.032000      0.8502000 
1 1 1 18 35 9  o 31.13000 0.4063000 31.09000 0.4334000 31.16000 0.6874000 -0.6863000E-01 0.8127000 
1 1 1 18 35 11 o 15.93000 0.4510000 16.66000 0.4866000 15.20000 0.7595000 1.462000       0.9020000 
1 1 1 18 35 13 o 18.10000 0.4633000 17.62000 0.5331000 18.58000 0.7580000 -0.9541000     0.9267000 
1 1 1 18 35 15 o 18.56000 0.4638000 18.36000 0.5606000 18.76000 0.7390000 -0.3971000     0.9276000 
1 1 1 18 35 17 o 15.45000 0.4797000 15.12000 0.5210000 15.78000 0.8057000 -0.6606000     0.9595000 
1 1 1 18 35 19 o 5.938000 0.9942000 6.965000 0.9648000 4.910000 1.739000  2.055000       1.988000  
1 1 1 18 35 21 o 5.998000 1.052000  6.703000 1.242000  5.293000 1.698000  1.410000       2.104000  
1 1 1 18 35 23 o 6.627000 0.8838000 6.364000 1.234000  6.889000 1.266000  -0.5249000     1.768000  
1 1 1 18 35 25 o 32.99000 0.4620000 33.59000 0.6414000 32.39000 0.6651000 1.205000       0.9240000 
1 1 1 18 35 27 o 10.40000 0.8279000 10.95000 1.455000  9.852000 0.7909000 1.097000       1.656000  
1 1 1 18 35 29 o 22.07000 0.3802000 22.28000 0.5231000 21.86000 0.5518000 0.4179000      0.7603000 
1 1 1 18 35 31 o 4.176000 0.8779000 5.265000 1.225000  3.087000 1.258000  2.178000       1.756000  
1 1 1 18 35 33 o 6.826000 0.8607000 6.978000 0.9631000 6.673000 1.427000  0.3045000      1.721000  
1 1 1 18 35 35 o 9.747000 0.4874000 9.774000 0.5338000 9.721000 0.8157000 0.5351000E-01  0.9749000 
1 1 1 18 35 37 o 2.577000 0.8193000 2.485000 1.108000  2.670000 1.207000  -0.1852000     1.639000  
1 1 1 18 35 39 o 7.267000 1.135000  8.629000 1.853000  5.906000 1.313000  2.723000       2.271000  
1 1 1 18 35 41 o 4.869000 0.8344000 3.715000 1.291000  6.023000 1.057000  -2.308000      1.669000  
1 1 1 18 35 43 o 4.018000 0.9238000 3.389000 1.316000  4.647000 1.297000  -1.258000      1.848000  
1 1 1 18 35 45 o 7.115000 0.6988000 6.439000 1.014000  7.792000 0.9614000 -1.354000      1.398000  
1 1 1 18 35 47 o 9.214000 0.6029000 8.275000 0.8532000 10.15000 0.8520000 -1.878000      1.206000  
1 1 1 18 35 49 o 3.281000 0.9432000 2.725000 1.256000  3.837000 1.407000  -1.112000      1.886000  
1 1 1 18 36 0  o 32.89000 0.5061000 32.89000 0.5061000 32.89000 0.5061000 0.000000       0.000000  
1 1 1 18 36 2  o 25.55000 0.5480000 25.17000 0.3998000 25.94000 1.020000  -0.7744000     1.096000  
1 1 1 18 36 4  o 7.156000 0.5209000 7.485000 0.8334000 6.828000 0.6252000 0.6576000      1.042000  
1 1 1 18 36 6  o 25.62000 0.4028000 25.99000 0.4215000 25.24000 0.6865000 0.7460000      0.8056000 
1 1 1 18 36 8  o 20.92000 0.4214000 21.36000 0.4289000 20.48000 0.7255000 0.8813000      0.8428000 
1 1 1 18 36 10 o 18.56000 0.4475000 19.04000 0.5079000 18.09000 0.7368000 0.9471000      0.8949000 
1 1 1 18 36 12 o 14.69000 0.5009000 14.98000 0.5230000 14.39000 0.8545000 0.5853000      1.002000  
1 1 1 18 36 14 o 30.80000 0.4082000 31.34000 0.4534000 30.26000 0.6790000 1.071000       0.8165000 
1 1 1 18 36 16 f 10.20000 0.6505000 10.30000 0.6877000 10.10000 1.104000  0.2023000      1.301000  
1 1 1 18 36 18 o 11.30000 0.8107000 11.12000 0.6580000 11.48000 1.482000  -0.3516000     1.621000  
1 1 1 18 36 20 o 10.72000 0.6127000 10.11000 0.6949000 11.34000 1.009000  -1.227000      1.225000  
1 1 1 18 36 22 o 3.606000 0.9868000 3.793000 1.284000  3.419000 1.499000  0.3731000      1.974000  
1 1 1 18 36 24 o 8.928000 0.8237000 8.998000 1.014000  8.859000 1.298000  0.1398000      1.647000  
1 1 1 18 36 26 o 4.391000 1.079000  5.058000 1.659000  3.724000 1.379000  1.334000       2.157000  
1 1 1 18 36 28 o 3.066000 0.9327000 2.996000 1.310000  3.136000 1.328000  -0.1402000     1.865000  
1 1 1 18 36 30 o 8.535000 0.6432000 8.576000 0.9088000 8.493000 0.9105000 0.8329000E-01  1.286000  
1 1 1 18 36 32 o 9.053000 0.6276000 8.946000 0.7715000 9.159000 0.9901000 -0.2124000     1.255000  
1 1 1 18 36 34 o 14.04000 0.3831000 13.82000 0.4376000 14.27000 0.6290000 -0.4427000     0.7662000 
1 1 1 18 36 36 f 5.367000 0.8475000 4.172000 1.046000  6.562000 1.333000  -2.390000      1.695000  
1 1 1 18 36 38 o 3.544000 0.9733000 2.388000 1.062000  4.699000 1.631000  -2.312000      1.947000  
1 1 1 18 36 40 o 2.921000 0.9010000 2.473000 1.148000  3.369000 1.389000  -0.8960000     1.802000  
1 1 1 18 36 42 o 3.280000 0.8971000 3.354000 1.252000  3.205000 1.285000  0.1489000      1.794000  
1 1 1 18 36 44 o 2.704000 0.8730000 2.759000 1.274000  2.649000 1.193000  0.1101000      1.746000  
1 1 1 18 36 46 o 13.40000 0.6051000 13.05000 0.9813000 13.76000 0.7082000 -0.7142000     1.210000  
1 1 1 18 36 48 o 6.562000 1.407000  7.176000 2.523000  5.948000 1.245000  1.228000       2.813000  
1 1 1 18 37 1  o 12.65000 0.5870000 11.85000 1.002000  13.45000 0.6123000 -1.602000      1.174000  
1 1 1 18 37 3  o 25.89000 0.3090000 25.86000 0.4860000 25.93000 0.3818000 -0.7450000E-01 0.6180000 
1 1 1 18 37 5  o 16.90000 0.4658000 17.55000 0.4540000 16.25000 0.8134000 1.299000       0.9315000 
1 1 1 18 37 7  o 7.575000 0.9592000 6.496000 0.9751000 8.653000 1.652000  -2.157000      1.918000  
1 1 1 18 37 9  o 10.62000 0.6328000 10.80000 0.6417000 10.44000 1.091000  0.3642000      1.266000  
1 1 1 18 37 11 f 13.00000 0.5908000 13.25000 0.6921000 12.75000 0.9577000 0.5051000      1.182000  
1 1 1 18 37 13 o 18.67000 0.4453000 18.84000 0.4668000 18.51000 0.7585000 0.3308000      0.8906000 
1 1 1 18 37 15 o 20.23000 0.4409000 20.44000 0.5275000 20.03000 0.7067000 0.4111000      0.8818000 
1 1 1 18 37 17 o 6.318000 1.169000  6.724000 0.9674000 5.911000 2.129000  0.8126000      2.339000  
1 1 1 18 37 19 o 11.87000 0.5562000 11.26000 0.6302000 12.47000 0.9166000 -1.211000      1.112000  
1 1 1 18 37 21 o 6.299000 0.9334000 6.721000 1.001000  5.876000 1.576000  0.8449000      1.867000  
1 1 1 18 37 23 o 4.283000 0.9887000 4.826000 1.229000  3.741000 1.549000  1.085000       1.977000  
1 1 1 18 37 25 o 12.91000 0.5784000 13.02000 0.6675000 12.80000 0.9448000 0.2117000      1.157000  
1 1 1 18 37 27 o 7.817000 0.8127000 8.499000 1.096000  7.135000 1.200000  1.364000       1.625000  
1 1 1 18 37 29 o 12.30000 0.4792000 12.60000 0.6730000 12.01000 0.6824000 0.5873000      0.9584000 
1 1 1 18 37 31 o 11.21000 0.5524000 11.77000 0.6548000 10.64000 0.8898000 1.122000       1.105000  
1 1 1 18 37 33 o 8.246000 0.6498000 7.721000 0.9602000 8.770000 0.8757000 -1.049000      1.300000  
1 1 1 18 37 35 o 6.233000 0.7156000 4.977000 0.7428000 7.488000 1.223000  -2.511000      1.431000  
1 1 1 18 37 37 o 3.050000 0.9093000 2.530000 1.054000  3.569000 1.482000  -1.039000      1.819000  
1 1 1 18 37 39 o 15.58000 0.4939000 14.35000 0.7695000 16.81000 0.6194000 -2.453000      0.9878000 
1 1 1 18 37 41 o 11.08000 0.4299000 10.42000 0.5918000 11.75000 0.6236000 -1.332000      0.8597000 
1 1 1 18 37 43 o 5.980000 1.015000  6.837000 1.528000  5.123000 1.337000  1.714000       2.030000  
1 1 1 18 37 45 o 4.856000 1.110000  4.706000 1.756000  5.006000 1.357000  -0.2998000     2.220000  
1 1 1 18 37 47 o 5.098000 1.201000  5.095000 1.933000  5.100000 1.426000  -0.4642000E-02 2.402000  
1 1 1 18 38 0  o 12.52000 0.4968000 12.52000 0.4968000 12.52000 0.4968000 0.000000       0.000000  
1 1 1 18 38 2  o 5.966000 0.7178000 5.956000 1.164000  5.975000 0.8404000 -0.1914000E-01 1.436000  
1 1 1 18 38 4  o 25.66000 0.4060000 25.59000 0.6466000 25.73000 0.4912000 -0.1322000     0.8120000 
1 1 1 18 38 6  f 15.52000 0.4784000 15.64000 0.4932000 15.40000 0.8199000 0.2386000      0.9569000 
1 1 1 18 38 8  o 12.12000 0.5911000 12.56000 0.5864000 11.67000 1.026000  0.8897000      1.182000  
1 1 1 18 38 10 o 12.40000 0.5577000 12.00000 0.5879000 12.79000 0.9480000 -0.7888000     1.115000  
1 1 1 18 38 12 o 16.49000 0.4672000 16.10000 0.4741000 16.89000 0.8052000 -0.7972000     0.9344000 
1 1 1 18 38 14 f 32.75000 0.5797000 33.83000 0.5370000 31.67000 1.028000  2.162000       1.159000  
1 1 1 18 38 16 o 5.415000 0.9899000 4.728000 1.252000  6.102000 1.534000  -1.374000      1.980000  
1 1 1 18 38 18 o 9.251000 0.6817000 9.921000 0.6381000 8.581000 1.205000  1.340000       1.363000  
1 1 1 18 38 20 o 16.23000 0.4449000 16.63000 0.5352000 15.84000 0.7109000 0.7967000      0.8898000 
1 1 1 18 38 22 o 6.344000 0.9715000 5.598000 1.310000  7.089000 1.435000  -1.491000      1.943000  
1 1 1 18 38 24 o 16.40000 0.4772000 16.42000 0.5478000 16.38000 0.7815000 0.4068000E-01  0.9544000 
1 1 1 18 38 26 o 4.565000 1.039000  5.170000 1.303000  3.960000 1.619000  1.211000       2.078000  
1 1 1 18 38 28 o 12.94000 0.4807000 13.33000 0.5565000 12.55000 0.7840000 0.7798000      0.9614000 
1 1 1 18 38 30 o 5.151000 0.9568000 5.069000 1.133000  5.232000 1.542000  -0.1622000     1.914000  
1 1 1 18 38 32 o 3.914000 1.011000  4.107000 1.401000  3.720000 1.458000  0.3863000      2.022000  
1 1 1 18 38 34 o 4.837000 0.9251000 5.496000 1.287000  4.179000 1.329000  1.317000       1.850000  
1 1 1 18 38 36 o 4.135000 0.9323000 3.045000 0.9817000 5.224000 1.585000  -2.179000      1.865000  
1 1 1 18 38 38 f 6.364000 1.024000  5.651000 1.659000  7.077000 1.201000  -1.427000      2.048000  
1 1 1 18 38 40 o 3.619000 0.9935000 3.285000 1.454000  3.953000 1.355000  -0.6680000     1.987000  
1 1 1 18 38 42 o 7.830000 0.7018000 6.988000 1.094000  8.673000 0.8797000 -1.685000      1.404000  
1 1 1 18 38 44 o 3.703000 1.084000  4.203000 1.714000  3.203000 1.328000  0.9999000      2.168000  
1 1 1 18 38 46 o 5.682000 1.102000  5.890000 1.762000  5.473000 1.323000  0.4171000      2.203000  
1 1 1 18 39 1  o 32.33000 0.3637000 31.80000 0.4235000 32.86000 0.5915000 -1.060000      0.7274000 
1 1 1 18 39 3  o 10.80000 0.3982000 10.11000 0.6572000 11.48000 0.4500000 -1.365000      0.7965000 
1 1 1 18 39 5  o 7.467000 0.6297000 6.743000 0.8966000 8.191000 0.8844000 -1.448000      1.259000  
1 1 1 18 39 7  o 11.92000 0.6078000 11.93000 0.7085000 11.90000 0.9879000 0.2823000E-01  1.216000  
1 1 1 18 39 9  o 27.12000 0.4646000 26.79000 0.6162000 27.45000 0.6955000 -0.6567000     0.9292000 
1 1 1 18 39 11 o 17.34000 0.6541000 17.94000 0.4679000 16.74000 1.222000  1.205000       1.308000  
1 1 1 18 39 13 o 8.420000 1.147000  10.14000 0.7528000 6.700000 2.168000  3.440000       2.295000  
1 1 1 18 39 15 o 11.91000 0.5518000 12.09000 0.5882000 11.73000 0.9337000 0.3562000      1.104000  
1 1 1 18 39 17 o 4.742000 0.9321000 5.844000 1.089000  3.640000 1.513000  2.204000       1.864000  
1 1 1 18 39 19 o 7.172000 0.8064000 5.981000 1.206000  8.363000 1.071000  -2.382000      1.613000  
1 1 1 18 39 21 o 5.074000 1.060000  4.896000 1.431000  5.251000 1.564000  -0.3550000     2.119000  
1 1 1 18 39 23 o 12.30000 0.5673000 12.53000 0.6939000 12.06000 0.8977000 0.4777000      1.135000  
1 1 1 18 39 25 o 10.25000 0.6559000 9.597000 0.6989000 10.91000 1.110000  -1.313000      1.312000  
1 1 1 18 39 27 o 5.525000 1.142000  4.642000 1.262000  6.407000 1.905000  -1.765000      2.285000  
1 1 1 18 39 29 o 8.243000 0.7781000 9.247000 0.6854000 7.239000 1.397000  2.008000       1.556000  
1 1 1 18 39 31 o 7.768000 0.6745000 8.145000 0.7533000 7.391000 1.119000  0.7543000      1.349000  
1 1 1 18 39 33 o 12.88000 0.4988000 13.44000 0.5440000 12.33000 0.8362000 1.107000       0.9976000 
1 1 1 18 39 35 o 10.26000 0.5921000 10.09000 0.6757000 10.42000 0.9724000 -0.3311000     1.184000  
1 1 1 18 39 37 f 4.199000 1.026000  4.879000 1.475000  3.520000 1.426000  1.360000       2.051000  
1 1 1 18 39 39 o 5.018000 1.129000  5.243000 1.713000  4.793000 1.469000  0.4500000      2.257000  
1 1 1 18 39 41 o 5.178000 1.050000  4.190000 1.672000  6.166000 1.272000  -1.975000      2.101000  
1 1 1 18 39 43 o 8.755000 0.7736000 7.430000 1.355000  10.08000 0.7470000 -2.648000      1.547000  
1 1 1 18 39 45 o 10.56000 0.7757000 11.24000 1.233000  9.872000 0.9412000 1.372000       1.551000  
1 1 1 18 39 47 o 6.794000 2.429000  6.794000 2.429000  ?        ?         ?              ?         
1 1 1 18 40 0  o 15.40000 0.4648000 15.40000 0.4648000 15.40000 0.4648000 0.000000       0.000000  
1 1 1 18 40 2  o 6.691000 0.5175000 6.848000 0.7547000 6.534000 0.7083000 0.3142000      1.035000  
1 1 1 18 40 4  o 26.57000 0.2914000 26.20000 0.4070000 26.93000 0.4170000 -0.7358000     0.5827000 
1 1 1 18 40 6  f 27.32000 0.4190000 26.24000 0.4190000 28.40000 0.7258000 -2.157000      0.8380000 
1 1 1 18 40 8  o 21.17000 0.5797000 21.84000 0.4328000 20.49000 1.076000  1.357000       1.159000  
1 1 1 18 40 10 o 8.283000 1.077000  7.593000 1.051000  8.974000 1.879000  -1.381000      2.153000  
1 1 1 18 40 12 o 9.055000 0.8477000 9.211000 1.162000  8.900000 1.234000  0.3108000      1.695000  
1 1 1 18 40 14 o 18.68000 0.4215000 18.54000 0.4731000 18.82000 0.6978000 -0.2858000     0.8431000 
1 1 1 18 40 16 f 8.192000 0.6832000 8.138000 0.8812000 8.245000 1.044000  -0.1071000     1.366000  
1 1 1 18 40 18 o 12.49000 0.5799000 12.93000 0.7308000 12.06000 0.9004000 0.8700000      1.160000  
1 1 1 18 40 20 o 9.424000 0.6808000 9.280000 0.8538000 9.568000 1.061000  -0.2880000     1.362000  
1 1 1 18 40 22 o 18.18000 0.4196000 18.40000 0.5141000 17.95000 0.6632000 0.4523000      0.8391000 
1 1 1 18 40 24 o 12.72000 0.5250000 12.78000 0.5240000 12.67000 0.9099000 0.1137000      1.050000  
1 1 1 18 40 26 o 4.371000 1.147000  3.503000 1.247000  5.239000 1.926000  -1.736000      2.294000  
1 1 1 18 40 28 o 3.645000 1.004000  3.694000 1.306000  3.596000 1.526000  0.9749000E-01  2.009000  
1 1 1 18 40 30 o 3.043000 0.9249000 2.820000 1.184000  3.267000 1.421000  -0.4475000     1.850000  
1 1 1 18 40 32 o 4.281000 0.9725000 4.661000 1.244000  3.901000 1.496000  0.7590000      1.945000  
1 1 1 18 40 34 o 6.906000 0.8469000 6.870000 1.004000  6.942000 1.364000  -0.7211000E-01 1.694000  
1 1 1 18 40 36 o 9.377000 0.6685000 8.085000 0.9205000 10.67000 0.9698000 -2.585000      1.337000  
1 1 1 18 40 38 o 10.57000 0.6899000 11.88000 0.7358000 9.261000 1.167000  2.622000       1.380000  
1 1 1 18 40 40 o 8.910000 0.6940000 8.604000 1.073000  9.215000 0.8802000 -0.6113000     1.388000  
1 1 1 18 40 42 o 5.890000 1.028000  5.175000 1.630000  6.605000 1.253000  -1.429000      2.056000  
1 1 1 18 40 44 o 4.884000 1.093000  4.938000 1.727000  4.830000 1.340000  0.1080000      2.186000  
1 1 1 18 40 46 o 5.286000 2.299000  5.286000 2.299000  ?        ?         ?              ?         
1 1 1 18 41 1  o 14.68000 0.3306000 14.30000 0.5266000 15.07000 0.3999000 -0.7675000     0.6612000 
1 1 1 18 41 3  o 5.122000 0.7116000 5.859000 0.9054000 4.385000 1.098000  1.474000       1.423000  
1 1 1 18 41 5  o 18.99000 0.2782000 18.87000 0.4150000 19.12000 0.3706000 -0.2492000     0.5564000 
1 1 1 18 41 7  o 4.396000 1.188000  3.957000 1.266000  4.836000 2.012000  -0.8791000     2.377000  
1 1 1 18 41 9  o 4.742000 1.070000  4.503000 1.398000  4.980000 1.619000  -0.4770000     2.139000  
1 1 1 18 41 11 o 20.62000 0.3966000 20.33000 0.4311000 20.91000 0.6658000 -0.5737000     0.7932000 
1 1 1 18 41 13 o 16.94000 0.4391000 16.59000 0.5425000 17.29000 0.6906000 -0.6940000     0.8782000 
1 1 1 18 41 15 o 17.98000 0.5812000 18.66000 0.9204000 17.31000 0.7100000 1.359000       1.162000  
1 1 1 18 41 17 o 4.902000 1.110000  4.294000 1.571000  5.510000 1.568000  -1.216000      2.220000  
1 1 1 18 41 19 o 4.185000 1.000000  4.070000 1.286000  4.300000 1.533000  -0.2297000     2.001000  
1 1 1 18 41 21 o 4.694000 0.9870000 5.048000 1.191000  4.339000 1.575000  0.7088000      1.974000  
1 1 1 18 41 23 o 8.385000 0.6982000 9.049000 0.6749000 7.720000 1.222000  1.329000       1.396000  
1 1 1 18 41 25 o 13.59000 0.6308000 14.04000 0.5522000 13.15000 1.134000  0.8886000      1.262000  
1 1 1 18 41 27 o 7.504000 0.9248000 8.463000 0.7104000 6.546000 1.708000  1.917000       1.850000  
1 1 1 18 41 29 o 4.406000 1.053000  3.698000 1.276000  5.113000 1.675000  -1.415000      2.106000  
1 1 1 18 41 31 o 3.753000 1.094000  2.846000 1.217000  4.659000 1.818000  -1.813000      2.188000  
1 1 1 18 41 33 o 15.60000 0.4925000 14.49000 0.6293000 16.71000 0.7576000 -2.221000      0.9849000 
1 1 1 18 41 35 o 9.891000 0.6263000 9.834000 0.8028000 9.948000 0.9615000 -0.1145000     1.253000  
1 1 1 18 41 37 f 10.52000 0.5875000 10.54000 0.7054000 10.49000 0.9397000 0.4931000E-01  1.175000  
1 1 1 18 41 39 o 12.50000 0.5372000 11.87000 0.7920000 13.14000 0.7260000 -1.272000      1.074000  
1 1 1 18 41 41 o 4.497000 1.083000  4.376000 1.605000  4.619000 1.454000  -0.2434000     2.166000  
1 1 1 18 41 43 o 3.398000 0.9980000 3.197000 1.397000  3.599000 1.425000  -0.4017000     1.996000  
1 1 1 18 41 45 o 4.464000 2.075000  4.464000 2.075000  ?        ?         ?              ?         
1 1 1 18 42 0  o 23.58000 0.4254000 23.58000 0.4254000 23.58000 0.4254000 0.000000       0.000000  
1 1 1 18 42 2  o 19.28000 0.3464000 19.10000 0.4307000 19.46000 0.5425000 -0.3622000     0.6927000 
1 1 1 18 42 4  o 17.06000 0.3052000 16.60000 0.4656000 17.52000 0.3946000 -0.9179000     0.6103000 
1 1 1 18 42 6  o 27.90000 0.5712000 29.24000 0.5354000 26.56000 1.009000  2.676000       1.142000  
1 1 1 18 42 8  o 24.23000 0.4283000 23.97000 0.4701000 24.50000 0.7161000 -0.5314000     0.8566000 
1 1 1 18 42 10 o 4.044000 1.041000  3.005000 1.270000  5.083000 1.650000  -2.077000      2.082000  
1 1 1 18 42 12 o 10.12000 0.8388000 10.02000 1.256000  10.22000 1.112000  -0.2015000     1.678000  
1 1 1 18 42 14 o 9.733000 0.6693000 9.556000 0.8000000 9.910000 1.073000  -0.3545000     1.339000  
1 1 1 18 42 16 o 18.85000 0.4051000 18.48000 0.4470000 19.23000 0.6757000 -0.7492000     0.8101000 
1 1 1 18 42 18 o 9.243000 0.5557000 8.943000 0.6786000 9.543000 0.8801000 -0.6003000     1.111000  
1 1 1 18 42 20 f 12.04000 0.6145000 11.11000 0.8869000 12.98000 0.8507000 -1.873000      1.229000  
1 1 1 18 42 22 f 7.036000 0.9343000 7.045000 1.029000  7.027000 1.560000  0.1762000E-01  1.869000  
1 1 1 18 42 24 o 5.904000 0.8761000 5.143000 1.221000  6.666000 1.257000  -1.523000      1.752000  
1 1 1 18 42 26 o 12.21000 0.5339000 12.26000 0.5516000 12.15000 0.9142000 0.1150000      1.068000  
1 1 1 18 42 28 o 8.166000 0.7988000 8.276000 0.7442000 8.056000 1.414000  0.2193000      1.598000  
1 1 1 18 42 30 o 3.391000 1.110000  2.710000 1.162000  4.072000 1.891000  -1.363000      2.219000  
1 1 1 18 42 32 o 4.184000 0.8513000 5.768000 1.194000  2.599000 1.214000  3.169000       1.703000  
1 1 1 18 42 34 o 4.617000 0.9929000 2.954000 1.285000  6.280000 1.514000  -3.326000      1.986000  
1 1 1 18 42 36 o 6.310000 1.032000  7.518000 1.185000  5.101000 1.689000  2.417000       2.063000  
1 1 1 18 42 38 o 4.834000 1.109000  4.264000 1.486000  5.404000 1.646000  -1.140000      2.218000  
1 1 1 18 42 40 o 3.930000 1.043000  4.273000 1.573000  3.587000 1.371000  0.6858000      2.086000  
1 1 1 18 42 42 o 3.961000 1.007000  3.571000 1.443000  4.350000 1.405000  -0.7789000     2.014000  
1 1 1 18 43 1  o 13.57000 0.3112000 13.91000 0.4422000 13.22000 0.4381000 0.6902000      0.6224000 
1 1 1 18 43 3  o 6.734000 0.5630000 6.766000 0.8724000 6.701000 0.7119000 0.6537000E-01  1.126000  
1 1 1 18 43 5  o 12.37000 0.3432000 12.29000 0.5680000 12.46000 0.3853000 -0.1681000     0.6863000 
1 1 1 18 43 7  o 5.036000 0.9626000 6.267000 1.034000  3.805000 1.624000  2.462000       1.925000  
1 1 1 18 43 9  o 11.14000 0.9069000 11.70000 0.7261000 10.58000 1.662000  1.114000       1.814000  
1 1 1 18 43 11 o 6.418000 0.9211000 5.299000 1.242000  7.538000 1.360000  -2.239000      1.842000  
1 1 1 18 43 13 o 21.86000 0.4133000 22.04000 0.4462000 21.68000 0.6958000 0.3682000      0.8265000 
1 1 1 18 43 15 f 9.245000 0.6027000 9.395000 0.6563000 9.096000 1.011000  0.2997000      1.205000  
1 1 1 18 43 17 o 7.665000 0.7465000 7.953000 0.7870000 7.378000 1.269000  0.5757000      1.493000  
1 1 1 18 43 19 o 11.25000 0.6871000 11.51000 0.5939000 10.98000 1.239000  0.5223000      1.374000  
1 1 1 18 43 21 o 3.629000 1.016000  3.479000 1.330000  3.780000 1.537000  -0.3008000     2.033000  
1 1 1 18 43 23 o 7.388000 0.7811000 6.976000 0.8801000 7.800000 1.291000  -0.8243000     1.562000  
1 1 1 18 43 25 o 5.208000 0.9665000 5.945000 1.229000  4.472000 1.492000  1.473000       1.933000  
1 1 1 18 43 27 o 3.767000 1.029000  3.909000 1.356000  3.624000 1.549000  0.2844000      2.058000  
1 1 1 18 43 29 o 4.515000 1.208000  3.933000 1.281000  5.097000 2.049000  -1.163000      2.417000  
1 1 1 18 43 31 o 9.551000 0.7226000 9.833000 0.6929000 9.270000 1.268000  0.5628000      1.445000  
1 1 1 18 43 33 o 8.404000 0.7769000 9.373000 0.8019000 7.435000 1.331000  1.938000       1.554000  
1 1 1 18 43 35 o 5.291000 1.012000  5.033000 1.343000  5.549000 1.514000  -0.5164000     2.024000  
1 1 1 18 43 37 o 3.643000 1.027000  3.369000 1.359000  3.917000 1.541000  -0.5481000     2.055000  
1 1 1 18 43 39 o 4.806000 1.059000  4.640000 1.490000  4.972000 1.506000  -0.3318000     2.118000  
1 1 1 18 43 41 o 3.884000 1.048000  4.003000 1.517000  3.765000 1.445000  0.2383000      2.096000  
1 1 1 18 44 0  o 4.339000 1.127000  4.339000 1.127000  4.339000 1.127000  0.000000       0.000000  
1 1 1 18 44 2  o 14.97000 0.2819000 14.92000 0.4145000 15.02000 0.3823000 -0.9852000E-01 0.5639000 
1 1 1 18 44 4  o 7.980000 0.4287000 6.712000 0.7176000 9.249000 0.4692000 -2.537000      0.8574000 
1 1 1 18 44 6  o 18.95000 0.3147000 19.01000 0.4632000 18.89000 0.4261000 0.1230000      0.6294000 
1 1 1 18 44 8  o 15.18000 0.4991000 15.15000 0.5263000 15.20000 0.8481000 -0.5766000E-01 0.9981000 
1 1 1 18 44 10 o 11.84000 0.5271000 11.94000 0.5223000 11.73000 0.9158000 0.2103000      1.054000  
1 1 1 18 44 12 o 9.547000 0.5779000 9.662000 0.6553000 9.432000 0.9519000 0.2300000      1.156000  
1 1 1 18 44 14 o 2.687000 0.8627000 2.366000 1.057000  3.007000 1.364000  -0.6412000     1.725000  
1 1 1 18 44 16 o 3.921000 1.031000  3.862000 1.198000  3.979000 1.678000  -0.1169000     2.062000  
1 1 1 18 44 18 o 11.17000 0.6471000 10.89000 0.5835000 11.44000 1.155000  -0.5566000     1.294000  
1 1 1 18 44 20 o 13.98000 0.4794000 14.91000 0.5798000 13.05000 0.7636000 1.867000       0.9588000 
1 1 1 18 44 22 o 14.33000 0.4870000 14.33000 0.5059000 14.33000 0.8323000 -0.3772000E-02 0.9740000 
1 1 1 18 44 24 o 15.93000 0.4637000 15.36000 0.4942000 16.51000 0.7849000 -1.148000      0.9275000 
1 1 1 18 44 26 o 5.316000 0.9694000 5.873000 1.110000  4.760000 1.590000  1.112000       1.939000  
1 1 1 18 44 28 o 10.69000 1.201000  12.24000 0.5722000 9.145000 2.332000  3.099000       2.401000  
1 1 1 18 44 30 o 4.204000 1.072000  3.904000 1.288000  4.505000 1.714000  -0.6016000     2.144000  
1 1 1 18 44 32 o 6.198000 1.146000  6.660000 1.488000  5.735000 1.744000  0.9248000      2.292000  
1 1 1 18 44 34 o 4.822000 1.043000  5.398000 1.298000  4.246000 1.633000  1.153000       2.086000  
1 1 1 18 44 36 o 6.792000 0.8539000 6.498000 1.030000  7.085000 1.362000  -0.5868000     1.708000  
1 1 1 18 44 38 o 3.845000 1.062000  3.418000 1.467000  4.271000 1.536000  -0.8525000     2.124000  
1 1 1 18 44 40 o 3.953000 0.9876000 4.243000 1.441000  3.664000 1.350000  0.5790000      1.975000  
1 1 1 18 45 1  o 11.74000 0.3479000 12.28000 0.4784000 11.19000 0.5053000 1.092000       0.6958000 
1 1 1 18 45 3  o 4.448000 0.8135000 5.519000 0.9659000 3.376000 1.309000  2.143000       1.627000  
1 1 1 18 45 5  o 5.289000 0.6172000 6.255000 0.8594000 4.323000 0.8862000 1.932000       1.234000  
1 1 1 18 45 7  f 3.370000 0.9535000 3.297000 1.199000  3.443000 1.483000  -0.1458000     1.907000  
1 1 1 18 45 9  o 4.653000 1.121000  3.283000 1.171000  6.024000 1.912000  -2.741000      2.242000  
1 1 1 18 45 11 o 3.787000 1.089000  2.704000 1.199000  4.870000 1.818000  -2.165000      2.178000  
1 1 1 18 45 13 o 4.151000 1.111000  3.574000 1.230000  4.729000 1.851000  -1.155000      2.222000  
1 1 1 18 45 15 o 5.374000 1.051000  4.502000 1.254000  6.246000 1.686000  -1.744000      2.101000  
1 1 1 18 45 17 o 4.120000 0.8686000 5.184000 1.138000  3.055000 1.312000  2.129000       1.737000  
1 1 1 18 45 19 o 16.30000 0.4609000 16.77000 0.4761000 15.84000 0.7892000 0.9245000      0.9217000 
1 1 1 18 45 21 o 15.38000 0.4320000 15.23000 0.4705000 15.53000 0.7246000 -0.3051000     0.8639000 
1 1 1 18 45 23 o 9.936000 0.6488000 9.641000 0.7127000 10.23000 1.084000  -0.5892000     1.298000  
1 1 1 18 45 25 o 10.92000 0.8993000 12.16000 0.5962000 9.676000 1.697000  2.487000       1.799000  
1 1 1 18 45 27 o 16.28000 0.4643000 16.53000 0.5067000 16.02000 0.7782000 0.5096000      0.9287000 
1 1 1 18 45 29 o 8.236000 0.8867000 7.535000 1.056000  8.937000 1.425000  -1.402000      1.773000  
1 1 1 18 45 31 o 5.713000 1.053000  6.408000 1.175000  5.018000 1.748000  1.390000       2.106000  
1 1 1 18 45 33 o 11.19000 0.6372000 12.31000 0.6379000 10.08000 1.103000  2.223000       1.274000  
1 1 1 18 45 35 o 3.310000 0.9711000 3.124000 1.240000  3.496000 1.495000  -0.3713000     1.942000  
1 1 1 18 45 37 o 8.675000 0.8676000 8.844000 1.178000  8.507000 1.274000  0.3367000      1.735000  
1 1 1 18 45 39 o 4.328000 1.025000  4.344000 1.413000  4.313000 1.484000  0.3009000E-01  2.049000  
1 1 1 18 46 0  o 11.94000 0.4601000 11.94000 0.4601000 11.94000 0.4601000 0.000000       0.000000  
1 1 1 18 46 2  o 11.19000 0.3608000 11.41000 0.4941000 10.96000 0.5257000 0.4539000      0.7215000 
1 1 1 18 46 4  o 7.745000 0.4454000 7.791000 0.6562000 7.698000 0.6023000 0.9257000E-01  0.8908000 
1 1 1 18 46 6  o 22.22000 0.3264000 21.93000 0.3985000 22.50000 0.5171000 -0.5740000     0.6528000 
1 1 1 18 46 8  o 18.21000 0.5738000 17.75000 0.4152000 18.68000 1.070000  -0.9308000     1.148000  
1 1 1 18 46 10 o 8.470000 0.9629000 9.150000 0.7479000 7.790000 1.775000  1.360000       1.926000  
1 1 1 18 46 12 o 3.836000 0.9695000 4.223000 1.220000  3.448000 1.507000  0.7755000      1.939000  
1 1 1 18 46 14 o 4.341000 1.002000  4.052000 1.204000  4.629000 1.601000  -0.5763000     2.003000  
1 1 1 18 46 16 o 3.695000 0.9698000 2.937000 1.172000  4.452000 1.545000  -1.515000      1.940000  
1 1 1 18 46 18 o 6.686000 0.8850000 6.588000 1.122000  6.784000 1.369000  -0.1956000     1.770000  
1 1 1 18 46 20 o 8.113000 0.6808000 8.113000 0.8238000 8.112000 1.084000  0.9470000E-03  1.362000  
1 1 1 18 46 22 o 6.684000 0.7782000 5.896000 0.9807000 7.471000 1.209000  -1.575000      1.556000  
1 1 1 18 46 24 o 8.809000 0.9932000 8.995000 0.6734000 8.624000 1.869000  0.3712000      1.986000  
1 1 1 18 46 26 o 17.40000 0.4287000 17.18000 0.4937000 17.62000 0.7010000 -0.4387000     0.8575000 
1 1 1 18 46 28 o 6.063000 1.037000  5.998000 1.276000  6.128000 1.634000  -0.1305000     2.073000  
1 1 1 18 46 30 o 9.112000 0.7708000 10.21000 0.6595000 8.013000 1.393000  2.199000       1.542000  
1 1 1 18 46 32 f 7.434000 0.9439000 8.829000 0.7837000 6.038000 1.717000  2.791000       1.888000  
1 1 1 18 46 34 o 6.324000 1.042000  7.023000 1.237000  5.624000 1.677000  1.399000       2.084000  
1 1 1 18 46 36 o 7.569000 0.9135000 8.563000 0.8692000 6.576000 1.607000  1.987000       1.827000  
1 1 1 18 46 38 o 11.71000 0.6119000 11.84000 0.7962000 11.59000 0.9293000 0.2430000      1.224000  
1 1 1 18 47 1  o 6.585000 0.5902000 7.137000 0.6840000 6.033000 0.9621000 1.104000       1.180000  
1 1 1 18 47 3  o 4.823000 0.7068000 5.026000 1.024000  4.620000 0.9746000 0.4060000      1.414000  
1 1 1 18 47 5  o 3.341000 0.7423000 4.433000 1.133000  2.249000 0.9593000 2.184000       1.485000  
1 1 1 18 47 7  o 6.288000 0.9875000 5.599000 1.194000  6.978000 1.573000  -1.379000      1.975000  
1 1 1 18 47 9  o 20.71000 0.4478000 20.79000 0.4085000 20.62000 0.7970000 0.1709000      0.8956000 
1 1 1 18 47 11 o 10.31000 0.6028000 9.807000 0.6229000 10.82000 1.032000  -1.014000      1.206000  
1 1 1 18 47 13 o 5.965000 0.8701000 6.346000 0.8131000 5.585000 1.538000  0.7610000      1.740000  
1 1 1 18 47 15 o 10.84000 0.5755000 9.934000 0.6282000 11.74000 0.9646000 -1.809000      1.151000  
1 1 1 18 47 17 o 9.003000 0.6621000 9.555000 0.6671000 8.452000 1.144000  1.104000       1.324000  
1 1 1 18 47 19 o 9.996000 0.6050000 8.961000 0.8204000 11.03000 0.8895000 -2.069000      1.210000  
1 1 1 18 47 21 o 3.752000 1.006000  3.714000 1.368000  3.790000 1.477000  -0.7620000E-01 2.013000  
1 1 1 18 47 23 o 9.315000 0.8315000 9.224000 0.7451000 9.406000 1.487000  -0.1817000     1.663000  
1 1 1 18 47 25 o 12.98000 0.5118000 13.22000 0.5300000 12.73000 0.8757000 0.4967000      1.024000  
1 1 1 18 47 27 o 7.211000 0.8147000 7.242000 0.8718000 7.181000 1.377000  0.6129000E-01  1.629000  
1 1 1 18 47 29 o 6.122000 1.007000  5.131000 1.280000  7.113000 1.554000  -1.982000      2.013000  
1 1 1 18 47 31 f 3.226000 0.9863000 2.934000 1.235000  3.517000 1.538000  -0.5825000     1.973000  
1 1 1 18 47 33 o 5.186000 1.069000  5.188000 1.320000  5.184000 1.682000  0.4249000E-02  2.138000  
1 1 1 18 47 35 o 3.948000 1.082000  3.683000 1.402000  4.213000 1.648000  -0.5298000     2.164000  
1 1 1 18 47 37 o 4.737000 1.050000  4.938000 1.252000  4.535000 1.685000  0.4033000      2.099000  
1 1 1 18 48 0  o 3.007000 1.130000  3.007000 1.130000  3.007000 1.130000  0.000000       0.000000  
1 1 1 18 48 2  o 2.915000 0.8236000 2.874000 1.126000  2.956000 1.202000  -0.8253000E-01 1.647000  
1 1 1 18 48 4  o 4.622000 0.8571000 4.489000 1.092000  4.755000 1.322000  -0.2664000     1.714000  
1 1 1 18 48 6  o 2.911000 0.8467000 3.090000 1.202000  2.732000 1.193000  0.3579000      1.693000  
1 1 1 18 48 8  o 3.945000 0.9926000 3.880000 1.132000  4.009000 1.631000  -0.1297000     1.985000  
1 1 1 18 48 10 o 8.712000 0.7523000 9.629000 0.7615000 7.794000 1.298000  1.834000       1.505000  
1 1 1 18 48 12 o 7.469000 0.7959000 7.301000 0.8064000 7.636000 1.372000  -0.3355000     1.592000  
1 1 1 18 48 14 o 15.17000 0.4846000 15.17000 0.4865000 15.17000 0.8381000 -0.8965000E-03 0.9691000 
1 1 1 18 48 16 o 10.13000 0.6411000 10.74000 0.5998000 9.528000 1.133000  1.213000       1.282000  
1 1 1 18 48 18 o 6.049000 0.9360000 5.078000 1.321000  7.021000 1.326000  -1.943000      1.872000  
1 1 1 18 48 20 o 11.77000 0.8267000 12.41000 0.5566000 11.12000 1.557000  1.296000       1.653000  
1 1 1 18 48 22 o 7.642000 0.7832000 7.029000 0.8630000 8.254000 1.307000  -1.226000      1.566000  
1 1 1 18 48 24 o 6.181000 0.9196000 6.290000 1.202000  6.072000 1.392000  0.2180000      1.839000  
1 1 1 18 48 26 o 11.42000 0.6073000 11.95000 0.5806000 10.88000 1.067000  1.078000       1.215000  
1 1 1 18 48 28 o 3.057000 0.9498000 2.618000 1.148000  3.496000 1.514000  -0.8781000     1.900000  
1 1 1 18 48 30 o 5.967000 1.071000  5.208000 1.486000  6.726000 1.543000  -1.518000      2.142000  
1 1 1 18 48 32 o 5.101000 1.057000  5.221000 1.287000  4.981000 1.678000  0.2392000      2.115000  
1 1 1 18 48 34 o 3.516000 1.018000  3.141000 1.284000  3.890000 1.581000  -0.7489000     2.037000  
1 1 1 18 48 36 o 4.262000 1.280000  4.857000 1.944000  3.667000 1.666000  1.191000       2.561000  
1 1 1 18 49 1  o 5.127000 0.7154000 4.243000 1.122000  6.010000 0.8884000 -1.767000      1.431000  
1 1 1 18 49 3  o 3.983000 0.7407000 4.034000 1.101000  3.932000 0.9915000 0.1013000      1.481000  
1 1 1 18 49 5  o 3.394000 0.8535000 3.157000 1.169000  3.631000 1.244000  -0.4738000     1.707000  
1 1 1 18 49 7  o 7.917000 0.4621000 9.229000 0.5853000 6.606000 0.7153000 2.623000       0.9243000 
1 1 1 18 49 9  o 7.728000 0.9205000 9.128000 0.7337000 6.328000 1.689000  2.801000       1.841000  
1 1 1 18 49 11 o 3.776000 0.9694000 4.131000 1.223000  3.420000 1.505000  0.7113000      1.939000  
1 1 1 18 49 13 f 3.943000 1.005000  3.914000 1.229000  3.971000 1.590000  -0.5739000E-01 2.010000  
1 1 1 18 49 15 o 3.338000 0.9620000 3.004000 1.208000  3.671000 1.497000  -0.6665000     1.924000  
1 1 1 18 49 17 o 3.549000 0.9608000 2.486000 1.101000  4.613000 1.575000  -2.127000      1.922000  
1 1 1 18 49 19 o 10.16000 0.7731000 10.56000 0.6403000 9.763000 1.407000  0.7949000      1.546000  
1 1 1 18 49 21 o 8.314000 0.7750000 7.444000 0.9996000 9.184000 1.185000  -1.740000      1.550000  
1 1 1 18 49 23 o 3.282000 0.9612000 2.921000 1.253000  3.644000 1.458000  -0.7221000     1.922000  
1 1 1 18 49 25 o 7.601000 0.8907000 7.990000 0.8634000 7.212000 1.558000  0.7787000      1.781000  
1 1 1 18 49 27 f 4.404000 1.035000  4.693000 1.395000  4.114000 1.529000  0.5781000      2.070000  
1 1 1 18 49 29 o 3.666000 1.012000  4.217000 1.431000  3.114000 1.432000  1.103000       2.024000  
1 1 1 18 49 31 o 6.079000 0.9556000 7.106000 1.052000  5.051000 1.595000  2.055000       1.911000  
1 1 1 18 49 33 o 2.671000 0.8820000 2.269000 1.056000  3.073000 1.413000  -0.8038000     1.764000  
1 1 1 18 50 0  o 16.24000 0.4163000 16.24000 0.4163000 16.24000 0.4163000 0.000000       0.000000  
1 1 1 18 50 2  f 14.90000 0.3292000 15.31000 0.4097000 14.49000 0.5154000 0.8126000      0.6584000 
1 1 1 18 50 4  o 12.95000 0.3015000 13.27000 0.4479000 12.62000 0.4039000 0.6518000      0.6031000 
1 1 1 18 50 6  o 9.898000 0.6671000 10.08000 0.7068000 9.714000 1.132000  0.3687000      1.334000  
1 1 1 18 50 8  o 8.498000 0.7036000 8.525000 0.6834000 8.472000 1.230000  0.5304000E-01  1.407000  
1 1 1 18 50 10 o 5.018000 1.025000  5.323000 1.101000  4.714000 1.729000  0.6092000      2.050000  
1 1 1 18 50 12 o 3.847000 0.9905000 3.588000 1.237000  4.105000 1.547000  -0.5171000     1.981000  
1 1 1 18 50 14 o 2.941000 0.9154000 2.683000 1.144000  3.199000 1.429000  -0.5166000     1.831000  
1 1 1 18 50 16 o 7.318000 1.057000  7.982000 0.7350000 6.654000 1.982000  1.327000       2.114000  
1 1 1 18 50 18 o 4.132000 0.9737000 4.581000 1.255000  3.683000 1.489000  0.8983000      1.947000  
1 1 1 18 50 20 o 4.238000 1.065000  3.414000 1.412000  5.063000 1.596000  -1.649000      2.131000  
1 1 1 18 50 22 o 4.707000 0.9703000 4.618000 1.226000  4.796000 1.504000  -0.1775000     1.941000  
1 1 1 18 50 24 o 8.835000 0.6990000 8.845000 0.7602000 8.826000 1.173000  0.1871000E-01  1.398000  
1 1 1 18 50 26 o 9.953000 0.7070000 8.830000 0.7942000 11.08000 1.170000  -2.246000      1.414000  
1 1 1 18 50 28 o 5.343000 1.018000  4.762000 1.222000  5.924000 1.629000  -1.162000      2.036000  
1 1 1 18 50 30 o 4.288000 1.265000  2.729000 1.251000  5.847000 2.198000  -3.118000      2.529000  
1 1 1 18 50 32 o 3.404000 1.000000  3.159000 1.267000  3.648000 1.548000  -0.4894000     2.001000  
1 1 1 18 51 1  o 10.91000 0.3688000 11.05000 0.5059000 10.77000 0.5367000 0.2805000      0.7376000 
1 1 1 18 51 3  o 6.501000 0.8439000 6.757000 0.7897000 6.244000 1.492000  0.5129000      1.688000  
1 1 1 18 51 5  o 4.147000 1.062000  2.979000 1.284000  5.315000 1.691000  -2.336000      2.124000  
1 1 1 18 51 7  o 4.242000 0.7327000 5.777000 0.9679000 2.707000 1.100000  3.070000       1.465000  
1 1 1 18 51 9  o 6.345000 0.8567000 5.931000 0.9182000 6.759000 1.447000  -0.8281000     1.713000  
1 1 1 18 51 11 o 4.823000 0.9648000 5.148000 1.104000  4.499000 1.582000  0.6484000      1.930000  
1 1 1 18 51 13 o 4.169000 1.158000  3.556000 1.253000  4.783000 1.948000  -1.227000      2.316000  
1 1 1 18 51 15 o 8.006000 0.7773000 7.228000 0.8487000 8.785000 1.303000  -1.557000      1.555000  
1 1 1 18 51 17 o 2.946000 0.9240000 2.368000 1.103000  3.525000 1.483000  -1.157000      1.848000  
1 1 1 18 51 19 o 10.80000 0.6244000 10.90000 0.6704000 10.70000 1.054000  0.1956000      1.249000  
1 1 1 18 51 21 o 8.475000 0.6699000 7.648000 0.8848000 9.303000 1.006000  -1.655000      1.340000  
1 1 1 18 51 23 o 3.026000 0.9118000 3.349000 1.297000  2.702000 1.282000  0.6471000      1.824000  
1 1 1 18 51 25 o 3.470000 1.006000  3.174000 1.252000  3.766000 1.574000  -0.5923000     2.011000  
1 1 1 18 51 27 o 4.472000 1.102000  3.340000 1.346000  5.603000 1.746000  -2.263000      2.205000  
1 1 1 18 51 29 o 2.662000 0.8711000 2.188000 1.015000  3.135000 1.416000  -0.9465000     1.742000  
1 1 1 18 52 0  o 2.599000 1.105000  2.599000 1.105000  2.599000 1.105000  0.000000       0.000000  
1 1 1 18 52 2  o 10.34000 0.4488000 10.54000 0.5254000 10.15000 0.7277000 0.3962000      0.8975000 
1 1 1 18 52 4  o 5.367000 0.7657000 5.843000 0.9049000 4.892000 1.236000  0.9504000      1.531000  
1 1 1 18 52 6  o 6.692000 0.8086000 6.894000 0.8242000 6.490000 1.391000  0.4043000      1.617000  
1 1 1 18 52 8  o 3.687000 0.9781000 4.076000 1.318000  3.298000 1.446000  0.7772000      1.956000  
1 1 1 18 52 10 o 4.700000 0.9504000 5.915000 0.9682000 3.484000 1.636000  2.432000       1.901000  
1 1 1 18 52 12 o 4.165000 1.107000  2.638000 1.102000  5.691000 1.921000  -3.053000      2.215000  
1 1 1 18 52 14 o 5.519000 0.9335000 5.853000 0.9939000 5.185000 1.581000  0.6684000      1.867000  
1 1 1 18 52 16 o 4.580000 1.087000  2.992000 1.327000  6.169000 1.721000  -3.177000      2.173000  
1 1 1 18 52 18 o 3.155000 0.9536000 3.040000 1.265000  3.269000 1.427000  -0.2294000     1.907000  
1 1 1 18 52 20 f 4.673000 1.084000  4.171000 1.256000  5.175000 1.767000  -1.004000      2.168000  
1 1 1 18 52 22 o 5.986000 0.9379000 6.049000 1.122000  5.924000 1.504000  0.1252000      1.876000  
1 1 1 18 52 24 o 4.744000 1.054000  5.643000 1.319000  3.846000 1.644000  1.797000       2.107000  
1 1 1 18 52 26 o 6.483000 0.9520000 5.374000 1.166000  7.592000 1.505000  -2.218000      1.904000  
1 1 1 18 52 28 o 3.082000 0.9726000 3.058000 1.329000  3.106000 1.420000  -0.4806000E-01 1.945000  
1 1 1 18 53 1  f 7.072000 0.4984000 7.018000 0.7084000 7.126000 0.7013000 -0.1078000     0.9969000 
1 1 1 18 53 3  o 6.965000 0.8172000 6.123000 0.8797000 7.807000 1.377000  -1.684000      1.634000  
1 1 1 18 53 5  o 3.619000 0.9672000 3.514000 1.205000  3.724000 1.514000  -0.2102000     1.934000  
1 1 1 18 53 7  o 5.132000 1.190000  4.584000 1.305000  5.679000 1.990000  -1.096000      2.380000  
1 1 1 18 53 9  o 3.876000 1.149000  2.777000 1.157000  4.976000 1.986000  -2.199000      2.298000  
1 1 1 18 53 11 o 4.921000 1.017000  4.400000 1.191000  5.442000 1.649000  -1.043000      2.034000  
1 1 1 18 53 13 o 4.387000 0.9788000 4.418000 1.202000  4.355000 1.545000  0.6309000E-01  1.958000  
1 1 1 18 53 15 o 4.486000 1.074000  4.021000 1.350000  4.951000 1.672000  -0.9302000     2.149000  
1 1 1 18 53 17 o 5.075000 0.9923000 5.874000 1.139000  4.276000 1.625000  1.598000       1.985000  
1 1 1 18 53 19 o 5.494000 1.055000  6.341000 1.243000  4.648000 1.705000  1.694000       2.110000  
1 1 1 18 53 21 o 4.210000 1.041000  4.372000 1.328000  4.047000 1.605000  0.3253000      2.083000  
1 1 1 18 53 23 o 4.007000 1.063000  3.597000 1.331000  4.417000 1.657000  -0.8202000     2.126000  
1 1 1 18 53 25 o 6.932000 1.006000  6.516000 1.092000  7.348000 1.691000  -0.8317000     2.013000  
1 1 1 18 54 0  o 3.265000 1.296000  3.265000 1.296000  3.265000 1.296000  0.000000       0.000000  
1 1 1 18 54 2  f 4.054000 1.129000  3.254000 1.298000  4.854000 1.849000  -1.600000      2.259000  
1 1 1 18 54 4  o 5.324000 1.143000  3.835000 1.349000  6.812000 1.845000  -2.977000      2.286000  
1 1 1 18 54 6  f 3.734000 1.156000  2.710000 1.150000  4.759000 2.007000  -2.050000      2.313000  
1 1 1 18 54 8  o 5.811000 0.9940000 6.130000 0.9468000 5.491000 1.748000  0.6390000      1.988000  
1 1 1 18 54 10 o 6.565000 0.8730000 7.725000 0.7409000 5.405000 1.581000  2.320000       1.746000  
1 1 1 18 54 12 o 4.301000 0.9987000 2.855000 1.202000  5.747000 1.595000  -2.891000      1.997000  
1 1 1 18 54 14 o 4.835000 0.9598000 2.576000 1.133000  7.095000 1.549000  -4.520000      1.920000  
1 1 1 18 54 16 o 4.201000 1.029000  3.533000 1.250000  4.869000 1.635000  -1.336000      2.058000  
1 1 1 18 54 18 f 7.004000 1.066000  7.296000 1.177000  6.712000 1.777000  0.5833000      2.132000  
1 1 1 18 54 20 o 3.859000 1.056000  3.836000 1.384000  3.883000 1.595000  -0.4649000E-01 2.112000  
1 1 1 18 54 22 o 4.027000 1.045000  3.866000 1.282000  4.188000 1.649000  -0.3220000     2.089000  
1 1 1 18 54 24 o 4.182000 1.721000  4.182000 1.721000  ?        ?         ?              ?         
1 1 1 18 55 1  o 5.447000 1.254000  4.678000 1.438000  6.216000 2.055000  -1.538000      2.508000  
1 1 1 18 55 3  o 3.891000 1.111000  3.856000 1.529000  3.926000 1.612000  -0.7012000E-01 2.222000  
1 1 1 18 55 5  o 11.45000 0.5916000 11.53000 0.6388000 11.38000 0.9959000 0.1522000      1.183000  
1 1 1 18 55 7  o 5.436000 0.9892000 4.854000 1.169000  6.018000 1.596000  -1.164000      1.978000  
1 1 1 18 55 9  o 4.896000 1.046000  4.156000 1.377000  5.635000 1.574000  -1.479000      2.091000  
1 1 1 18 55 11 o 5.452000 0.9785000 4.006000 1.341000  6.898000 1.426000  -2.892000      1.957000  
1 1 1 18 55 13 o 4.735000 1.044000  3.628000 1.314000  5.842000 1.621000  -2.215000      2.087000  
1 1 1 18 55 15 o 3.766000 1.096000  3.873000 1.521000  3.658000 1.579000  0.2144000      2.192000  
1 1 1 18 55 17 o 3.806000 1.052000  3.304000 1.306000  4.307000 1.650000  -1.003000      2.105000  
1 1 1 18 55 19 o 5.900000 1.070000  4.089000 1.302000  7.711000 1.699000  -3.622000      2.141000  
1 1 1 18 55 21 o 5.762000 1.733000  5.762000 1.733000  ?        ?         ?              ?         
1 1 1 18 56 0  o 8.714000 1.418000  8.714000 1.418000  8.714000 1.418000  0.000000       0.000000  
1 1 1 18 56 2  o 4.682000 1.197000  4.639000 1.752000  4.725000 1.631000  -0.8584000E-01 2.393000  
1 1 1 18 56 4  o 4.492000 1.150000  4.629000 1.556000  4.355000 1.695000  0.2734000      2.301000  
1 1 1 18 56 6  o 3.821000 1.049000  3.440000 1.377000  4.202000 1.583000  -0.7619000     2.098000  
1 1 1 18 56 8  o 2.967000 0.9152000 2.904000 1.187000  3.029000 1.393000  -0.1251000     1.830000  
1 1 1 18 56 10 o 2.699000 0.8963000 1.996000 0.9518000 3.402000 1.519000  -1.406000      1.793000  
1 1 1 18 56 12 o 3.340000 0.9456000 3.253000 1.249000  3.428000 1.420000  -0.1757000     1.891000  
1 1 1 18 56 14 o 5.091000 1.072000  3.217000 1.335000  6.965000 1.678000  -3.748000      2.145000  
1 1 1 18 56 16 o 4.701000 0.9878000 2.968000 1.207000  6.434000 1.564000  -3.467000      1.976000  
1 1 1 18 56 18 o 3.619000 1.600000  3.619000 1.600000  ?        ?         ?              ?         
1 1 1 18 57 1  o 6.034000 1.452000  6.741000 2.043000  5.327000 2.064000  1.414000       2.905000  
1 1 1 18 57 3  o 6.381000 1.275000  5.942000 1.786000  6.820000 1.820000  -0.8782000     2.550000  
1 1 1 18 57 5  o 4.242000 1.172000  4.701000 1.760000  3.784000 1.549000  0.9166000      2.344000  
1 1 1 18 57 7  o 4.116000 1.077000  4.572000 1.435000  3.660000 1.607000  0.9125000      2.154000  
1 1 1 18 57 9  o 3.465000 0.9880000 2.718000 1.160000  4.213000 1.599000  -1.496000      1.976000  
1 1 1 18 57 11 o 5.426000 0.9148000 6.795000 0.9053000 4.056000 1.590000  2.739000       1.830000  
1 1 1 18 57 13 o 3.449000 1.046000  3.097000 1.219000  3.800000 1.700000  -0.7029000     2.092000  
1 1 1 18 58 0  o 2.674000 1.261000  2.674000 1.261000  2.674000 1.261000  0.000000       0.000000  
1 1 1 18 58 2  o 4.969000 1.140000  4.276000 1.656000  5.662000 1.568000  -1.386000      2.281000  
1 1 1 18 58 4  o 6.630000 1.131000  7.744000 1.361000  5.516000 1.806000  2.228000       2.262000  
1 1 1 18 58 6  o 10.54000 1.220000  10.34000 1.768000  10.74000 1.682000  -0.3955000     2.440000  
1 1 1 19 0  1  o 39.61000 0.4427000 39.61000 0.4427000 39.61000 0.4427000 0.000000       0.000000  
1 1 1 19 0  3  o 41.25000 0.6418000 41.25000 0.6418000 41.25000 0.6418000 0.000000       0.000000  
1 1 1 19 0  5  o 12.94000 0.4393000 12.94000 0.4393000 12.94000 0.4393000 0.000000       0.000000  
1 1 1 19 0  7  o 52.69000 0.5480000 52.69000 0.5480000 52.69000 0.5480000 0.000000       0.000000  
1 1 1 19 0  9  o 68.75000 0.6894000 68.75000 0.6894000 68.75000 0.6894000 0.000000       0.000000  
1 1 1 19 0  11 o 37.83000 0.4991000 37.83000 0.4991000 37.83000 0.4991000 0.000000       0.000000  
1 1 1 19 0  13 o 37.11000 0.4302000 37.11000 0.4302000 37.11000 0.4302000 0.000000       0.000000  
1 1 1 19 0  15 o 13.23000 0.5136000 13.23000 0.5136000 13.23000 0.5136000 0.000000       0.000000  
1 1 1 19 0  17 o 36.62000 0.4349000 36.62000 0.4349000 36.62000 0.4349000 0.000000       0.000000  
1 1 1 19 0  19 o 6.177000 0.9003000 6.177000 0.9003000 6.177000 0.9003000 0.000000       0.000000  
1 1 1 19 0  21 o 6.326000 0.9563000 6.326000 0.9563000 6.326000 0.9563000 0.000000       0.000000  
1 1 1 19 0  23 o 3.838000 1.385000  3.838000 1.385000  3.838000 1.385000  0.000000       0.000000  
1 1 1 19 0  25 o 23.57000 0.4121000 23.57000 0.4121000 23.57000 0.4121000 0.000000       0.000000  
1 1 1 19 0  27 o 21.84000 0.4873000 21.84000 0.4873000 21.84000 0.4873000 0.000000       0.000000  
1 1 1 19 0  29 o 34.62000 0.6362000 34.62000 0.6362000 34.62000 0.6362000 0.000000       0.000000  
1 1 1 19 0  31 o 31.83000 0.4407000 31.83000 0.4407000 31.83000 0.4407000 0.000000       0.000000  
1 1 1 19 0  33 o 22.31000 0.4561000 22.31000 0.4561000 22.31000 0.4561000 0.000000       0.000000  
1 1 1 19 0  35 o 39.87000 0.4877000 39.87000 0.4877000 39.87000 0.4877000 0.000000       0.000000  
1 1 1 19 0  37 o 21.02000 0.5017000 21.02000 0.5017000 21.02000 0.5017000 0.000000       0.000000  
1 1 1 19 0  39 o 15.46000 0.6011000 15.46000 0.6011000 15.46000 0.6011000 0.000000       0.000000  
1 1 1 19 0  41 o 14.40000 0.6116000 14.40000 0.6116000 14.40000 0.6116000 0.000000       0.000000  
1 1 1 19 0  43 o 7.640000 0.9872000 7.640000 0.9872000 7.640000 0.9872000 0.000000       0.000000  
1 1 1 19 0  45 o 6.451000 1.296000  6.451000 1.296000  6.451000 1.296000  0.000000       0.000000  
1 1 1 19 0  47 o 5.905000 1.125000  5.905000 1.125000  5.905000 1.125000  0.000000       0.000000  
1 1 1 19 0  49 o 11.35000 0.6487000 11.35000 0.6487000 11.35000 0.6487000 0.000000       0.000000  
1 1 1 19 0  51 o 4.326000 1.384000  4.326000 1.384000  4.326000 1.384000  0.000000       0.000000  
1 1 1 19 0  53 o 5.240000 1.529000  5.240000 1.529000  5.240000 1.529000  0.000000       0.000000  
1 1 1 19 0  55 o 13.62000 0.6712000 13.62000 0.6712000 13.62000 0.6712000 0.000000       0.000000  
1 1 1 19 0  57 o 17.30000 0.5552000 17.30000 0.5552000 17.30000 0.5552000 0.000000       0.000000  
1 1 1 19 0  59 o 12.05000 0.6747000 12.05000 0.6747000 12.05000 0.6747000 0.000000       0.000000  
1 1 1 19 0  61 o 4.387000 1.360000  4.387000 1.360000  4.387000 1.360000  0.000000       0.000000  
1 1 1 19 1  0  o 41.08000 0.5192000 41.08000 0.5192000 41.08000 0.5192000 0.000000       0.000000  
1 1 1 19 1  2  o 47.75000 0.4136000 48.20000 0.5896000 47.29000 0.5801000 0.9058000      0.8271000 
1 1 1 19 1  4  o 101.5000 0.7000000 101.2000 0.9872000 101.8000 0.9928000 -0.5710000     1.400000  
1 1 1 19 1  6  o 21.38000 0.2938000 21.19000 0.4088000 21.58000 0.4222000 -0.3898000     0.5876000 
1 1 1 19 1  8  o 103.8000 0.7162000 103.8000 1.013000  103.9000 1.013000  -0.9181000E-01 1.432000  
1 1 1 19 1  10 o 76.32000 0.5791000 76.33000 0.8750000 76.31000 0.7589000 0.2201000E-01  1.158000  
1 1 1 19 1  12 o 74.50000 0.5673000 74.27000 0.7395000 74.73000 0.8604000 -0.4560000     1.135000  
1 1 1 19 1  14 o 46.63000 0.3548000 46.31000 0.4993000 46.95000 0.5042000 -0.6374000     0.7095000 
1 1 1 19 1  16 o 17.71000 0.3185000 17.94000 0.4604000 17.48000 0.4402000 0.4609000      0.6370000 
1 1 1 19 1  18 o 38.87000 0.3667000 39.79000 0.5262000 37.94000 0.5109000 1.851000       0.7334000 
1 1 1 19 1  20 o 19.47000 0.2897000 19.66000 0.4026000 19.29000 0.4166000 0.3671000      0.5793000 
1 1 1 19 1  22 o 21.20000 0.3163000 21.33000 0.4134000 21.06000 0.4788000 0.2714000      0.6326000 
1 1 1 19 1  24 o 33.56000 0.3296000 33.17000 0.5003000 33.95000 0.4292000 -0.7800000     0.6592000 
1 1 1 19 1  26 o 12.05000 0.4204000 12.24000 0.6251000 11.87000 0.5622000 0.3642000      0.8407000 
1 1 1 19 1  28 o 53.75000 0.5234000 53.68000 0.8105000 53.83000 0.6627000 -0.1463000     1.047000  
1 1 1 19 1  30 o 54.91000 0.4150000 55.12000 0.5873000 54.71000 0.5865000 0.4076000      0.8300000 
1 1 1 19 1  32 o 48.92000 0.4409000 49.30000 0.6267000 48.53000 0.6203000 0.7705000      0.8818000 
1 1 1 19 1  34 o 29.49000 0.3171000 29.79000 0.4516000 29.19000 0.4451000 0.6017000      0.6341000 
1 1 1 19 1  36 o 39.42000 0.3463000 39.59000 0.4893000 39.24000 0.4900000 0.3475000      0.6925000 
1 1 1 19 1  38 o 14.60000 0.4294000 14.89000 0.5849000 14.31000 0.6287000 0.5858000      0.8587000 
1 1 1 19 1  40 o 27.04000 0.3546000 27.41000 0.4681000 26.67000 0.5327000 0.7457000      0.7092000 
1 1 1 19 1  42 o 6.998000 0.9601000 5.835000 1.553000  8.161000 1.129000  -2.326000      1.920000  
1 1 1 19 1  44 o 7.043000 0.8631000 6.099000 1.401000  7.986000 1.009000  -1.887000      1.726000  
1 1 1 19 1  46 o 9.210000 0.5487000 9.602000 0.7627000 8.818000 0.7889000 0.7839000      1.097000  
1 1 1 19 1  48 o 3.654000 0.9365000 4.091000 1.371000  3.217000 1.276000  0.8747000      1.873000  
1 1 1 19 1  50 o 7.118000 0.7006000 6.811000 0.9936000 7.426000 0.9879000 -0.6158000     1.401000  
1 1 1 19 1  52 o 3.901000 0.9796000 4.364000 1.416000  3.439000 1.354000  0.9242000      1.959000  
1 1 1 19 1  54 o 4.507000 1.115000  4.257000 1.655000  4.756000 1.496000  -0.4991000     2.231000  
1 1 1 19 1  56 o 11.10000 0.5618000 11.88000 0.8231000 10.32000 0.7647000 1.556000       1.124000  
1 1 1 19 1  58 o 6.230000 0.8915000 5.745000 1.331000  6.715000 1.187000  -0.9703000     1.783000  
1 1 1 19 1  60 o 3.197000 0.9257000 3.694000 1.402000  2.700000 1.209000  0.9940000      1.851000  
1 1 1 19 1  62 f 4.936000 1.020000  4.814000 1.477000  5.058000 1.408000  -0.2443000     2.040000  
1 1 1 19 2  1  o 70.38000 0.5376000 69.70000 0.6973000 71.07000 0.8184000 -1.372000      1.075000  
1 1 1 19 2  3  o 82.31000 0.5740000 81.60000 0.8051000 83.02000 0.8184000 -1.416000      1.148000  
1 1 1 19 2  5  o 104.2000 0.7183000 103.9000 1.013000  104.5000 1.019000  -0.6015000     1.437000  
1 1 1 19 2  7  f 31.79000 0.3011000 32.19000 0.4564000 31.38000 0.3927000 0.8054000      0.6021000 
1 1 1 19 2  9  o 26.59000 0.3032000 26.80000 0.4314000 26.38000 0.4260000 0.4274000      0.6063000 
1 1 1 19 2  11 o 106.1000 0.7901000 106.1000 1.034000  106.0000 1.195000  0.5986000E-01  1.580000  
1 1 1 19 2  13 o 59.72000 0.4321000 59.14000 0.6045000 60.30000 0.6175000 -1.156000      0.8641000 
1 1 1 19 2  15 o 74.08000 0.5640000 73.93000 0.7373000 74.23000 0.8537000 -0.3025000     1.128000  
1 1 1 19 2  17 o 41.44000 0.3551000 41.36000 0.5338000 41.52000 0.4684000 -0.1538000     0.7101000 
1 1 1 19 2  19 o 71.84000 0.5516000 71.89000 0.7221000 71.79000 0.8340000 0.9610000E-01  1.103000  
1 1 1 19 2  21 o 48.47000 0.4020000 47.88000 0.5189000 49.06000 0.6141000 -1.180000      0.8040000 
1 1 1 19 2  23 o 37.72000 0.3195000 38.07000 0.4543000 37.37000 0.4492000 0.6991000      0.6389000 
1 1 1 19 2  25 o 60.28000 0.5399000 59.98000 0.8798000 60.59000 0.6262000 -0.6142000     1.080000  
1 1 1 19 2  27 o 47.12000 0.3803000 47.53000 0.4696000 46.72000 0.5984000 0.8054000      0.7606000 
1 1 1 19 2  29 o 38.01000 0.3824000 37.90000 0.5426000 38.11000 0.5391000 -0.2110000     0.7649000 
1 1 1 19 2  31 o 30.62000 0.3327000 30.61000 0.4409000 30.64000 0.4984000 -0.3246000E-01 0.6655000 
1 1 1 19 2  33 o 10.88000 0.4876000 10.53000 0.6929000 11.23000 0.6863000 -0.6926000     0.9753000 
1 1 1 19 2  35 o 20.40000 0.3326000 20.65000 0.4610000 20.15000 0.4796000 0.5009000      0.6653000 
1 1 1 19 2  37 o 22.99000 0.3313000 22.66000 0.4695000 23.31000 0.4675000 -0.6519000     0.6626000 
1 1 1 19 2  39 o 9.473000 0.6849000 9.146000 0.9139000 9.800000 1.020000  -0.6542000     1.370000  
1 1 1 19 2  41 o 16.77000 0.3935000 16.22000 0.5767000 17.33000 0.5354000 -1.118000      0.7869000 
1 1 1 19 2  43 o 12.82000 0.4668000 13.79000 0.6431000 11.86000 0.6769000 1.932000       0.9337000 
1 1 1 19 2  45 o 18.98000 0.4275000 18.20000 0.6539000 19.76000 0.5508000 -1.555000      0.8550000 
1 1 1 19 2  47 o 11.69000 0.4690000 11.60000 0.6726000 11.78000 0.6536000 -0.1823000     0.9379000 
1 1 1 19 2  49 o 17.48000 0.3502000 17.80000 0.5036000 17.16000 0.4868000 0.6379000      0.7004000 
1 1 1 19 2  51 o 7.237000 0.7253000 7.328000 1.036000  7.146000 1.016000  0.1818000      1.451000  
1 1 1 19 2  53 o 13.03000 0.4366000 12.99000 0.6338000 13.07000 0.6007000 -0.8362000E-01 0.8733000 
1 1 1 19 2  55 o 16.20000 0.4416000 16.44000 0.5788000 15.96000 0.6671000 0.4746000      0.8832000 
1 1 1 19 2  57 o 11.50000 0.5562000 11.83000 0.8509000 11.17000 0.7164000 0.6597000      1.112000  
1 1 1 19 2  59 o 11.14000 0.5240000 10.37000 0.8064000 11.91000 0.6692000 -1.544000      1.048000  
1 1 1 19 2  61 o 3.079000 0.9185000 3.137000 1.316000  3.022000 1.282000  0.1153000      1.837000  
1 1 1 19 3  0  o 69.54000 0.6946000 69.54000 0.6946000 69.54000 0.6946000 0.000000       0.000000  
1 1 1 19 3  2  o 103.1000 0.7104000 102.6000 1.000000  103.6000 1.009000  -0.9660000     1.421000  
1 1 1 19 3  4  o 67.60000 0.5526000 66.97000 0.7743000 68.23000 0.7886000 -1.257000      1.105000  
1 1 1 19 3  6  o 58.46000 0.4225000 58.39000 0.5974000 58.53000 0.5977000 -0.1425000     0.8451000 
1 1 1 19 3  8  o 44.90000 0.3700000 44.46000 0.5556000 45.34000 0.4888000 -0.8847000     0.7400000 
1 1 1 19 3  10 o 76.08000 0.6177000 75.73000 0.8682000 76.43000 0.8788000 -0.7015000     1.235000  
1 1 1 19 3  12 o 9.283000 0.4363000 9.049000 0.5800000 9.517000 0.6518000 -0.4675000     0.8725000 
1 1 1 19 3  14 o 32.24000 0.3069000 32.26000 0.4050000 32.22000 0.4613000 0.3211000E-01  0.6139000 
1 1 1 19 3  16 o 23.46000 0.2716000 23.44000 0.3868000 23.48000 0.3814000 -0.4174000E-01 0.5432000 
1 1 1 19 3  18 f 55.09000 0.4388000 55.35000 0.5769000 54.83000 0.6612000 0.5193000      0.8775000 
1 1 1 19 3  20 o 42.93000 0.3399000 42.80000 0.4785000 43.07000 0.4829000 -0.2693000     0.6798000 
1 1 1 19 3  22 o 40.30000 0.3292000 40.45000 0.4673000 40.16000 0.4638000 0.2882000      0.6584000 
1 1 1 19 3  24 o 23.18000 0.3074000 23.33000 0.4658000 23.03000 0.4011000 0.3004000      0.6147000 
1 1 1 19 3  26 o 23.97000 0.3166000 24.02000 0.4228000 23.92000 0.4714000 0.9934000E-01  0.6333000 
1 1 1 19 3  28 o 17.28000 0.3537000 17.35000 0.4457000 17.21000 0.5493000 0.1425000      0.7074000 
1 1 1 19 3  30 o 45.17000 0.3951000 45.92000 0.5982000 44.42000 0.5163000 1.497000       0.7902000 
1 1 1 19 3  32 o 27.41000 0.3499000 27.02000 0.4930000 27.80000 0.4966000 -0.7849000     0.6998000 
1 1 1 19 3  34 o 33.62000 0.3245000 34.03000 0.4606000 33.22000 0.4572000 0.8134000      0.6490000 
1 1 1 19 3  36 o 11.17000 0.5123000 10.66000 0.7353000 11.68000 0.7135000 -1.025000      1.025000  
1 1 1 19 3  38 o 19.01000 0.4009000 18.62000 0.5263000 19.39000 0.6049000 -0.7771000     0.8018000 
1 1 1 19 3  40 o 23.29000 0.3369000 23.47000 0.4877000 23.11000 0.4649000 0.3587000      0.6738000 
1 1 1 19 3  42 o 3.863000 1.097000  4.316000 1.695000  3.411000 1.394000  0.9044000      2.194000  
1 1 1 19 3  44 o 14.28000 0.4053000 14.81000 0.5735000 13.75000 0.5728000 1.062000       0.8106000 
1 1 1 19 3  46 o 5.784000 0.9792000 7.371000 1.308000  4.197000 1.458000  3.174000       1.958000  
1 1 1 19 3  48 o 6.104000 0.8280000 5.776000 1.237000  6.433000 1.101000  -0.6566000     1.656000  
1 1 1 19 3  50 o 6.009000 0.7714000 5.924000 1.184000  6.094000 0.9891000 -0.1694000     1.543000  
1 1 1 19 3  52 o 15.86000 0.3884000 16.35000 0.5484000 15.37000 0.5501000 0.9834000      0.7768000 
1 1 1 19 3  54 o 17.23000 0.5136000 16.94000 0.6355000 17.52000 0.8069000 -0.5763000     1.027000  
1 1 1 19 3  56 o 8.329000 0.6815000 7.882000 1.011000  8.775000 0.9142000 -0.8929000     1.363000  
1 1 1 19 3  58 o 5.293000 0.9960000 4.809000 1.481000  5.776000 1.332000  -0.9671000     1.992000  
1 1 1 19 3  60 o 6.223000 0.9162000 5.979000 1.419000  6.468000 1.160000  -0.4895000     1.832000  
1 1 1 19 3  62 o 5.937000 0.9916000 6.695000 1.178000  5.180000 1.596000  1.514000       1.983000  
1 1 1 19 4  1  o 55.47000 0.4037000 56.06000 0.5768000 54.87000 0.5649000 1.181000       0.8073000 
1 1 1 19 4  3  o 31.59000 0.2754000 32.08000 0.3921000 31.10000 0.3867000 0.9799000      0.5507000 
1 1 1 19 4  5  o 47.97000 0.3591000 47.54000 0.5042000 48.40000 0.5116000 -0.8552000     0.7183000 
1 1 1 19 4  7  o 59.58000 0.5525000 59.63000 0.8550000 59.53000 0.6999000 0.9741000E-01  1.105000  
1 1 1 19 4  9  o 39.82000 0.3162000 40.09000 0.4501000 39.54000 0.4441000 0.5521000      0.6323000 
1 1 1 19 4  11 f 22.50000 0.3536000 23.19000 0.5539000 21.82000 0.4396000 1.362000       0.7071000 
1 1 1 19 4  13 o 45.03000 0.4463000 44.31000 0.5576000 45.76000 0.6969000 -1.449000      0.8925000 
1 1 1 19 4  15 o 22.33000 0.3311000 22.45000 0.3773000 22.21000 0.5442000 0.2391000      0.6622000 
1 1 1 19 4  17 o 27.71000 0.3165000 27.06000 0.4420000 28.36000 0.4532000 -1.303000      0.6330000 
1 1 1 19 4  19 o 21.69000 0.2773000 21.43000 0.3983000 21.94000 0.3859000 -0.5069000     0.5546000 
1 1 1 19 4  21 o 41.28000 0.3317000 40.83000 0.4655000 41.73000 0.4728000 -0.9044000     0.6634000 
1 1 1 19 4  23 o 31.53000 0.3170000 31.78000 0.4798000 31.29000 0.4144000 0.4958000      0.6340000 
1 1 1 19 4  25 o 29.19000 0.3437000 29.04000 0.3667000 29.33000 0.5815000 -0.2913000     0.6875000 
1 1 1 19 4  27 o 34.25000 0.3603000 34.40000 0.5117000 34.10000 0.5073000 0.2997000      0.7205000 
1 1 1 19 4  29 o 33.23000 0.3840000 32.86000 0.4421000 33.61000 0.6279000 -0.7531000     0.7679000 
1 1 1 19 4  31 o 25.09000 0.3606000 25.04000 0.5112000 25.14000 0.5088000 -0.1007000     0.7212000 
1 1 1 19 4  33 o 7.287000 0.7684000 7.922000 1.091000  6.651000 1.083000  1.271000       1.537000  
1 1 1 19 4  35 o 21.43000 0.3372000 21.65000 0.4748000 21.21000 0.4789000 0.4408000      0.6744000 
1 1 1 19 4  37 o 16.33000 0.4312000 16.26000 0.5486000 16.39000 0.6655000 -0.1350000     0.8624000 
1 1 1 19 4  39 o 29.22000 0.3355000 29.72000 0.4786000 28.71000 0.4703000 1.010000       0.6710000 
1 1 1 19 4  41 o 12.20000 0.5318000 11.92000 0.7114000 12.48000 0.7908000 -0.5668000     1.064000  
1 1 1 19 4  43 o 15.15000 0.4337000 15.07000 0.6849000 15.23000 0.5321000 -0.1660000     0.8673000 
1 1 1 19 4  45 f 11.53000 0.5197000 11.05000 0.7898000 12.01000 0.6756000 -0.9514000     1.039000  
1 1 1 19 4  47 o 5.102000 0.9942000 5.315000 1.408000  4.888000 1.404000  0.4268000      1.988000  
1 1 1 19 4  49 o 8.846000 0.5557000 8.849000 0.7995000 8.843000 0.7720000 0.5720000E-02  1.111000  
1 1 1 19 4  51 o 7.191000 0.7586000 7.246000 1.036000  7.135000 1.108000  0.1116000      1.517000  
1 1 1 19 4  53 o 4.757000 0.9489000 5.103000 1.329000  4.412000 1.354000  0.6912000      1.898000  
1 1 1 19 4  55 o 7.481000 0.7671000 7.894000 1.026000  7.068000 1.140000  0.8260000      1.534000  
1 1 1 19 4  57 o 7.244000 0.7412000 7.472000 0.9938000 7.017000 1.100000  0.4556000      1.482000  
1 1 1 19 4  59 o 4.626000 1.127000  5.921000 1.838000  3.330000 1.304000  2.591000       2.254000  
1 1 1 19 4  61 o 4.495000 1.001000  3.984000 1.470000  5.006000 1.358000  -1.023000      2.001000  
1 1 1 19 5  0  o 26.76000 0.3685000 26.76000 0.3685000 26.76000 0.3685000 0.000000       0.000000  
1 1 1 19 5  2  o 50.80000 0.3758000 51.13000 0.5337000 50.48000 0.5291000 0.6511000      0.7515000 
1 1 1 19 5  4  o 59.12000 0.4589000 58.83000 0.6910000 59.40000 0.6042000 -0.5644000     0.9179000 
1 1 1 19 5  6  o 81.47000 0.6136000 80.97000 0.9227000 81.97000 0.8091000 -0.9968000     1.227000  
1 1 1 19 5  8  o 56.73000 0.4462000 55.97000 0.5775000 57.50000 0.6804000 -1.530000      0.8924000 
1 1 1 19 5  10 o 67.08000 0.4783000 66.66000 0.6731000 67.50000 0.6797000 -0.8418000     0.9566000 
1 1 1 19 5  12 o 31.87000 0.3089000 31.89000 0.4034000 31.84000 0.4679000 0.5752000E-01  0.6178000 
1 1 1 19 5  14 o 42.82000 0.4152000 42.36000 0.4716000 43.28000 0.6835000 -0.9188000     0.8304000 
1 1 1 19 5  16 o 44.03000 0.4415000 44.32000 0.5601000 43.74000 0.6827000 0.5866000      0.8830000 
1 1 1 19 5  18 o 17.99000 0.3033000 17.23000 0.4535000 18.76000 0.4030000 -1.529000      0.6067000 
1 1 1 19 5  20 o 21.43000 0.2780000 21.59000 0.3926000 21.27000 0.3938000 0.3222000      0.5560000 
1 1 1 19 5  22 o 110.8000 0.8262000 110.7000 1.248000  110.9000 1.083000  -0.1806000     1.652000  
1 1 1 19 5  24 o 39.83000 0.3573000 40.11000 0.4676000 39.54000 0.5403000 0.5719000      0.7146000 
1 1 1 19 5  26 o 34.47000 0.3210000 34.36000 0.3897000 34.58000 0.5102000 -0.2283000     0.6421000 
1 1 1 19 5  28 o 23.07000 0.3449000 23.49000 0.4849000 22.65000 0.4904000 0.8351000      0.6897000 
1 1 1 19 5  30 o 39.11000 0.3466000 39.55000 0.4235000 38.67000 0.5487000 0.8772000      0.6932000 
1 1 1 19 5  32 o 44.39000 0.4440000 44.62000 0.7218000 44.16000 0.5173000 0.4540000      0.8880000 
1 1 1 19 5  34 o 23.42000 0.3371000 23.61000 0.4708000 23.22000 0.4826000 0.3894000      0.6742000 
1 1 1 19 5  36 o 15.73000 0.4502000 15.54000 0.5820000 15.91000 0.6869000 -0.3717000     0.9003000 
1 1 1 19 5  38 o 16.69000 0.3925000 16.48000 0.5552000 16.90000 0.5551000 -0.4180000     0.7851000 
1 1 1 19 5  40 o 13.70000 0.5130000 14.03000 0.6724000 13.37000 0.7749000 0.6606000      1.026000  
1 1 1 19 5  42 o 11.88000 0.5638000 11.77000 0.8218000 11.99000 0.7722000 -0.2158000     1.128000  
1 1 1 19 5  44 o 14.48000 0.4419000 14.56000 0.6842000 14.39000 0.5596000 0.1722000      0.8839000 
1 1 1 19 5  46 o 15.10000 0.4053000 14.99000 0.6042000 15.21000 0.5405000 -0.2236000     0.8107000 
1 1 1 19 5  48 o 21.46000 0.3347000 21.32000 0.4799000 21.60000 0.4669000 -0.2870000     0.6695000 
1 1 1 19 5  50 o 12.07000 0.4898000 12.75000 0.6099000 11.38000 0.7665000 1.372000       0.9796000 
1 1 1 19 5  52 o 4.470000 0.9487000 3.675000 1.380000  5.265000 1.302000  -1.589000      1.897000  
1 1 1 19 5  54 o 7.175000 0.7610000 6.657000 1.139000  7.693000 1.010000  -1.036000      1.522000  
1 1 1 19 5  56 o 10.16000 0.5975000 10.15000 0.9239000 10.17000 0.7580000 -0.1708000E-01 1.195000  
1 1 1 19 5  58 o 5.069000 1.158000  5.096000 1.876000  5.041000 1.358000  0.5506000E-01  2.316000  
1 1 1 19 5  60 o 2.811000 0.8880000 2.852000 1.294000  2.770000 1.217000  0.8140000E-01  1.776000  
1 1 1 19 5  62 o 3.942000 1.015000  4.735000 1.492000  3.150000 1.375000  1.585000       2.030000  
1 1 1 19 6  1  o 72.73000 0.5522000 72.24000 0.8288000 73.21000 0.7300000 -0.9755000     1.104000  
1 1 1 19 6  3  o 51.85000 0.4105000 51.62000 0.6171000 52.09000 0.5415000 -0.4692000     0.8210000 
1 1 1 19 6  5  o 17.11000 0.2900000 17.06000 0.4350000 17.15000 0.3837000 -0.9068000E-01 0.5801000 
1 1 1 19 6  7  o 53.07000 0.3899000 53.62000 0.5556000 52.52000 0.5471000 1.102000       0.7798000 
1 1 1 19 6  9  o 60.44000 0.4718000 60.74000 0.6173000 60.14000 0.7136000 0.5941000      0.9435000 
1 1 1 19 6  11 o 56.81000 0.5297000 56.24000 0.6675000 57.38000 0.8227000 -1.139000      1.059000  
1 1 1 19 6  13 o 85.23000 0.9389000 85.01000 0.8407000 85.45000 1.679000  -0.4367000     1.878000  
1 1 1 19 6  15 o 70.75000 0.5028000 70.83000 0.7117000 70.67000 0.7103000 0.1580000      1.006000  
1 1 1 19 6  17 o 14.30000 0.3321000 14.37000 0.4909000 14.23000 0.4474000 0.1437000      0.6641000 
1 1 1 19 6  19 o 57.54000 0.4871000 57.17000 0.6832000 57.91000 0.6944000 -0.7456000     0.9742000 
1 1 1 19 6  21 f 81.83000 0.6202000 81.67000 0.9352000 81.98000 0.8148000 -0.3123000     1.240000  
1 1 1 19 6  23 o 58.84000 0.4312000 58.97000 0.6112000 58.70000 0.6082000 0.2747000      0.8623000 
1 1 1 19 6  25 o 9.566000 0.4696000 9.309000 0.5615000 9.823000 0.7528000 -0.5144000     0.9392000 
1 1 1 19 6  27 o 22.91000 0.3188000 22.81000 0.4079000 23.01000 0.4900000 -0.1950000     0.6376000 
1 1 1 19 6  29 o 31.48000 0.3824000 32.02000 0.4401000 30.93000 0.6254000 1.091000       0.7648000 
1 1 1 19 6  31 o 14.36000 0.4157000 14.45000 0.5405000 14.26000 0.6316000 0.1922000      0.8314000 
1 1 1 19 6  33 o 32.51000 0.3947000 32.34000 0.6407000 32.69000 0.4612000 -0.3475000     0.7894000 
1 1 1 19 6  35 o 28.78000 0.3506000 28.64000 0.4541000 28.92000 0.5344000 -0.2724000     0.7013000 
1 1 1 19 6  37 o 6.053000 0.9282000 5.009000 1.500000  7.097000 1.094000  -2.088000      1.856000  
1 1 1 19 6  39 o 25.71000 0.3587000 25.89000 0.4652000 25.53000 0.5462000 0.3588000      0.7174000 
1 1 1 19 6  41 o 10.71000 0.5674000 10.31000 0.8422000 11.11000 0.7606000 -0.7926000     1.135000  
1 1 1 19 6  43 o 11.83000 0.5019000 12.33000 0.6935000 11.34000 0.7257000 0.9919000      1.004000  
1 1 1 19 6  45 o 20.35000 0.3729000 20.03000 0.5670000 20.67000 0.4844000 -0.6389000     0.7458000 
1 1 1 19 6  47 o 2.983000 0.9050000 3.569000 1.448000  2.397000 1.086000  1.172000       1.810000  
1 1 1 19 6  49 o 4.246000 0.9692000 3.988000 1.400000  4.504000 1.341000  -0.5162000     1.938000  
1 1 1 19 6  51 o 6.324000 0.7972000 6.213000 1.107000  6.436000 1.148000  -0.2231000     1.594000  
1 1 1 19 6  53 o 5.770000 0.9623000 5.503000 1.383000  6.037000 1.339000  -0.5340000     1.925000  
1 1 1 19 6  55 o 3.467000 0.9695000 2.564000 1.212000  4.371000 1.514000  -1.806000      1.939000  
1 1 1 19 6  57 o 9.660000 0.5829000 8.651000 0.8856000 10.67000 0.7583000 -2.018000      1.166000  
1 1 1 19 6  59 o 6.892000 0.9079000 6.659000 1.466000  7.124000 1.071000  -0.4649000     1.816000  
1 1 1 19 6  61 o 3.075000 0.9458000 3.089000 1.302000  3.061000 1.372000  0.2810000E-01  1.892000  
1 1 1 19 7  0  o 25.30000 0.4125000 25.30000 0.4125000 25.30000 0.4125000 0.000000       0.000000  
1 1 1 19 7  2  o 19.25000 0.2884000 19.25000 0.4069000 19.25000 0.4089000 0.2092000E-02  0.5769000 
1 1 1 19 7  4  o 33.17000 0.3476000 33.11000 0.3988000 33.22000 0.5693000 -0.1159000     0.6951000 
1 1 1 19 7  6  o 50.11000 0.4554000 50.39000 0.5289000 49.83000 0.7415000 0.5605000      0.9108000 
1 1 1 19 7  8  o 86.02000 0.7341000 86.05000 0.8476000 86.00000 1.199000  0.5323000E-01  1.468000  
1 1 1 19 7  10 o 34.96000 0.4611000 34.53000 0.4122000 35.39000 0.8248000 -0.8610000     0.9221000 
1 1 1 19 7  12 o 15.07000 0.3310000 15.02000 0.4079000 15.12000 0.5214000 -0.1033000     0.6620000 
1 1 1 19 7  14 o 19.57000 0.3122000 20.05000 0.4372000 19.08000 0.4457000 0.9758000      0.6244000 
1 1 1 19 7  16 o 37.34000 0.3116000 37.10000 0.4393000 37.57000 0.4419000 -0.4740000     0.6232000 
1 1 1 19 7  18 o 39.58000 0.3865000 39.29000 0.6234000 39.87000 0.4572000 -0.5873000     0.7731000 
1 1 1 19 7  20 f 40.14000 0.3500000 40.16000 0.5272000 40.12000 0.4606000 0.4168000E-01  0.7001000 
1 1 1 19 7  22 o 11.56000 0.4175000 11.32000 0.6055000 11.79000 0.5749000 -0.4710000     0.8350000 
1 1 1 19 7  24 o 34.43000 0.3173000 34.16000 0.3821000 34.71000 0.5066000 -0.5527000     0.6345000 
1 1 1 19 7  26 o 5.841000 0.7754000 5.218000 1.049000  6.463000 1.142000  -1.245000      1.551000  
1 1 1 19 7  28 o 43.95000 0.3663000 44.30000 0.4481000 43.59000 0.5796000 0.7077000      0.7326000 
1 1 1 19 7  30 f 27.92000 0.3631000 28.53000 0.4478000 27.31000 0.5717000 1.220000       0.7262000 
1 1 1 19 7  32 o 15.22000 0.3897000 14.23000 0.5534000 16.21000 0.5487000 -1.981000      0.7793000 
1 1 1 19 7  34 o 14.21000 0.4980000 13.35000 0.7304000 15.08000 0.6772000 -1.733000      0.9960000 
1 1 1 19 7  36 o 26.52000 0.3249000 26.20000 0.4557000 26.85000 0.4631000 -0.6512000     0.6497000 
1 1 1 19 7  38 o 34.12000 0.3680000 34.51000 0.4831000 33.73000 0.5553000 0.7858000      0.7360000 
1 1 1 19 7  40 o 13.43000 0.4541000 12.91000 0.6531000 13.95000 0.6311000 -1.049000      0.9082000 
1 1 1 19 7  42 o 8.501000 0.7341000 8.574000 0.9372000 8.428000 1.130000  0.1458000      1.468000  
1 1 1 19 7  44 o 27.96000 0.3511000 28.80000 0.4725000 27.12000 0.5196000 1.672000       0.7023000 
1 1 1 19 7  46 o 7.797000 0.6704000 7.453000 1.017000  8.141000 0.8739000 -0.6883000     1.341000  
1 1 1 19 7  48 o 3.645000 0.9990000 3.455000 1.444000  3.834000 1.380000  -0.3788000     1.998000  
1 1 1 19 7  50 o 4.667000 0.8960000 3.450000 1.355000  5.884000 1.173000  -2.434000      1.792000  
1 1 1 19 7  52 o 5.505000 0.9826000 5.746000 1.263000  5.263000 1.506000  0.4831000      1.965000  
1 1 1 19 7  54 o 9.440000 0.6339000 9.246000 0.8720000 9.633000 0.9201000 -0.3872000     1.268000  
1 1 1 19 7  56 o 8.370000 0.6946000 7.810000 1.027000  8.929000 0.9358000 -1.119000      1.389000  
1 1 1 19 7  58 o 4.705000 1.012000  5.135000 1.408000  4.275000 1.452000  0.8607000      2.023000  
1 1 1 19 7  60 o 6.398000 1.072000  6.663000 1.276000  6.133000 1.721000  0.5293000      2.143000  
1 1 1 19 7  62 o 3.677000 1.590000  3.677000 1.590000  ?        ?         ?              ?         
1 1 1 19 8  1  f 32.99000 0.3034000 32.86000 0.3969000 33.12000 0.4588000 -0.2628000     0.6067000 
1 1 1 19 8  3  o 24.87000 0.3175000 25.13000 0.3618000 24.61000 0.5219000 0.5200000      0.6351000 
1 1 1 19 8  5  o 47.25000 0.4348000 47.13000 0.4992000 47.37000 0.7121000 -0.2406000     0.8697000 
1 1 1 19 8  7  o 41.79000 0.3484000 41.97000 0.4601000 41.61000 0.5234000 0.3549000      0.6969000 
1 1 1 19 8  9  o 90.85000 0.6813000 90.14000 0.8855000 91.56000 1.036000  -1.419000      1.363000  
1 1 1 19 8  11 o 103.6000 0.7716000 102.9000 1.004000  104.3000 1.172000  -1.377000      1.543000  
1 1 1 19 8  13 o 29.21000 0.3008000 29.20000 0.3849000 29.21000 0.4624000 -0.6681000E-02 0.6016000 
1 1 1 19 8  15 o 80.66000 0.7289000 82.11000 0.9363000 79.21000 1.117000  2.894000       1.458000  
1 1 1 19 8  17 o 30.28000 0.3020000 29.80000 0.4504000 30.77000 0.4024000 -0.9606000     0.6039000 
1 1 1 19 8  19 o 35.17000 0.3032000 34.93000 0.4267000 35.42000 0.4310000 -0.4932000     0.6065000 
1 1 1 19 8  21 o 47.50000 0.3941000 47.95000 0.5202000 47.05000 0.5921000 0.8996000      0.7881000 
1 1 1 19 8  23 o 41.95000 0.4123000 41.01000 0.4650000 42.89000 0.6811000 -1.875000      0.8247000 
1 1 1 19 8  25 o 36.63000 0.3894000 35.83000 0.4342000 37.43000 0.6466000 -1.606000      0.7788000 
1 1 1 19 8  27 o 35.12000 0.3395000 34.74000 0.4323000 35.50000 0.5236000 -0.7554000     0.6790000 
1 1 1 19 8  29 o 27.26000 0.3611000 26.88000 0.3780000 27.63000 0.6154000 -0.7487000     0.7222000 
1 1 1 19 8  31 o 33.96000 0.3941000 33.31000 0.4537000 34.61000 0.6445000 -1.302000      0.7881000 
1 1 1 19 8  33 o 17.67000 0.4145000 17.12000 0.5486000 18.23000 0.6214000 -1.112000      0.8289000 
1 1 1 19 8  35 o 22.03000 0.3733000 22.48000 0.5610000 21.58000 0.4925000 0.8972000      0.7465000 
1 1 1 19 8  37 o 22.80000 0.4222000 23.77000 0.6502000 21.84000 0.5387000 1.931000       0.8444000 
1 1 1 19 8  39 o 40.10000 0.3597000 40.47000 0.5089000 39.72000 0.5084000 0.7563000      0.7194000 
1 1 1 19 8  41 o 15.26000 0.4359000 14.52000 0.6795000 15.99000 0.5461000 -1.462000      0.8717000 
1 1 1 19 8  43 o 10.67000 0.5297000 10.82000 0.7354000 10.51000 0.7625000 0.3179000      1.059000  
1 1 1 19 8  45 o 3.295000 0.9527000 3.522000 1.394000  3.068000 1.299000  0.4538000      1.905000  
1 1 1 19 8  47 o 4.165000 0.9851000 4.683000 1.417000  3.647000 1.369000  1.036000       1.970000  
1 1 1 19 8  49 o 10.07000 0.6015000 10.54000 0.8912000 9.606000 0.8081000 0.9333000      1.203000  
1 1 1 19 8  51 o 3.856000 1.012000  3.519000 1.374000  4.193000 1.485000  -0.6742000     2.023000  
1 1 1 19 8  53 o 3.489000 0.9632000 4.505000 1.529000  2.473000 1.172000  2.033000       1.926000  
1 1 1 19 8  55 o 10.01000 0.6162000 9.731000 0.8660000 10.30000 0.8769000 -0.5658000     1.232000  
1 1 1 19 8  57 o 3.266000 0.9459000 2.767000 1.250000  3.766000 1.420000  -0.9985000     1.892000  
1 1 1 19 8  59 o 7.130000 0.8237000 6.573000 1.289000  7.687000 1.026000  -1.114000      1.647000  
1 1 1 19 8  61 o 3.882000 0.9273000 2.639000 1.218000  5.125000 1.399000  -2.486000      1.855000  
1 1 1 19 9  0  o 79.40000 0.7855000 79.40000 0.7855000 79.40000 0.7855000 0.000000       0.000000  
1 1 1 19 9  2  o 81.50000 0.6144000 82.01000 0.8088000 81.00000 0.9251000 1.008000       1.229000  
1 1 1 19 9  4  o 52.23000 0.3846000 52.45000 0.5450000 52.00000 0.5428000 0.4431000      0.7692000 
1 1 1 19 9  6  o 47.35000 0.3555000 47.04000 0.4996000 47.67000 0.5059000 -0.6228000     0.7110000 
1 1 1 19 9  8  o 29.33000 0.2886000 28.91000 0.3766000 29.74000 0.4374000 -0.8375000     0.5772000 
1 1 1 19 9  10 o 29.14000 0.2716000 29.07000 0.3832000 29.20000 0.3852000 -0.1327000     0.5433000 
1 1 1 19 9  12 o 35.18000 0.2951000 34.77000 0.4135000 35.59000 0.4213000 -0.8222000     0.5903000 
1 1 1 19 9  14 o 25.98000 0.3078000 25.53000 0.4329000 26.43000 0.4376000 -0.9026000     0.6156000 
1 1 1 19 9  16 o 21.78000 0.3170000 21.23000 0.4290000 22.32000 0.4667000 -1.091000      0.6339000 
1 1 1 19 9  18 o 56.17000 0.5298000 56.75000 0.8238000 55.58000 0.6664000 1.172000       1.060000  
1 1 1 19 9  20 o 38.57000 0.3180000 38.07000 0.4463000 39.07000 0.4531000 -1.004000      0.6360000 
1 1 1 19 9  22 o 31.61000 0.3028000 32.07000 0.3689000 31.14000 0.4804000 0.9270000      0.6057000 
1 1 1 19 9  24 o 4.293000 0.8773000 4.104000 1.118000  4.482000 1.352000  -0.3778000     1.755000  
1 1 1 19 9  26 o 11.85000 0.4240000 11.45000 0.5620000 12.25000 0.6351000 -0.7953000     0.8481000 
1 1 1 19 9  28 o 27.27000 0.3654000 27.31000 0.4067000 27.24000 0.6072000 0.7617000E-01  0.7308000 
1 1 1 19 9  30 o 24.19000 0.4690000 24.43000 0.3729000 23.95000 0.8607000 0.4768000      0.9380000 
1 1 1 19 9  32 f 33.45000 0.4158000 33.33000 0.5097000 33.56000 0.6571000 -0.2216000     0.8316000 
1 1 1 19 9  34 o 52.03000 0.4408000 52.28000 0.6649000 51.79000 0.5790000 0.4890000      0.8817000 
1 1 1 19 9  36 o 30.54000 0.3794000 30.66000 0.5341000 30.42000 0.5390000 0.2397000      0.7588000 
1 1 1 19 9  38 o 26.67000 0.3360000 26.37000 0.4712000 26.98000 0.4792000 -0.6066000     0.6720000 
1 1 1 19 9  40 o 4.659000 1.042000  5.312000 1.497000  4.006000 1.451000  1.306000       2.085000  
1 1 1 19 9  42 o 13.39000 0.4706000 12.86000 0.6480000 13.91000 0.6825000 -1.047000      0.9411000 
1 1 1 19 9  44 o 9.145000 0.6099000 8.892000 0.8305000 9.398000 0.8935000 -0.5061000     1.220000  
1 1 1 19 9  46 o 9.995000 0.5820000 9.857000 0.9086000 10.13000 0.7275000 -0.2760000     1.164000  
1 1 1 19 9  48 o 8.484000 0.6612000 8.705000 0.8845000 8.264000 0.9831000 0.4412000      1.322000  
1 1 1 19 9  50 o 3.810000 1.023000  3.602000 1.406000  4.018000 1.488000  -0.4156000     2.047000  
1 1 1 19 9  52 o 6.772000 0.9057000 6.455000 1.471000  7.089000 1.058000  -0.6342000     1.811000  
1 1 1 19 9  54 o 8.611000 0.6051000 8.134000 0.9242000 9.088000 0.7813000 -0.9533000     1.210000  
1 1 1 19 9  56 o 15.23000 0.4350000 15.37000 0.6046000 15.10000 0.6256000 0.2729000      0.8701000 
1 1 1 19 9  58 o 6.389000 0.9340000 5.180000 1.601000  7.599000 0.9624000 -2.419000      1.868000  
1 1 1 19 9  60 o 4.080000 1.057000  4.651000 1.602000  3.510000 1.380000  1.141000       2.114000  
1 1 1 19 10 1  o 16.52000 0.2911000 15.87000 0.3645000 17.17000 0.4540000 -1.309000      0.5822000 
1 1 1 19 10 3  o 35.86000 0.2944000 35.58000 0.4135000 36.14000 0.4193000 -0.5616000     0.5889000 
1 1 1 19 10 5  o 54.94000 0.4302000 55.33000 0.5699000 54.56000 0.6445000 0.7761000      0.8603000 
1 1 1 19 10 7  o 36.12000 0.3160000 35.70000 0.4176000 36.55000 0.4744000 -0.8488000     0.6320000 
1 1 1 19 10 9  o 69.97000 0.4956000 69.14000 0.6928000 70.80000 0.7087000 -1.658000      0.9911000 
1 1 1 19 10 11 f 33.73000 0.3080000 33.73000 0.4622000 33.72000 0.4073000 0.4265000E-02  0.6160000 
1 1 1 19 10 13 o 45.09000 0.3708000 44.90000 0.5558000 45.28000 0.4910000 -0.3792000     0.7416000 
1 1 1 19 10 15 o 44.94000 0.3772000 44.38000 0.4860000 45.50000 0.5769000 -1.118000      0.7543000 
1 1 1 19 10 17 o 31.57000 0.3138000 30.74000 0.4011000 32.39000 0.4828000 -1.650000      0.6276000 
1 1 1 19 10 19 o 62.41000 0.7911000 61.50000 0.8814000 63.32000 1.314000  -1.814000      1.582000  
1 1 1 19 10 21 o 26.10000 0.2906000 26.16000 0.3393000 26.04000 0.4719000 0.1275000      0.5812000 
1 1 1 19 10 23 o 30.93000 0.3049000 30.81000 0.3639000 31.04000 0.4894000 -0.2293000     0.6098000 
1 1 1 19 10 25 o 36.91000 0.3854000 36.60000 0.4395000 37.21000 0.6333000 -0.6067000     0.7709000 
1 1 1 19 10 27 o 25.40000 0.3154000 25.04000 0.4136000 25.76000 0.4762000 -0.7138000     0.6307000 
1 1 1 19 10 29 o 22.70000 0.4711000 22.53000 0.3989000 22.88000 0.8537000 -0.3483000     0.9423000 
1 1 1 19 10 31 o 19.87000 0.5549000 19.71000 0.4276000 20.04000 1.024000  -0.3280000     1.110000  
1 1 1 19 10 33 o 5.743000 1.026000  6.375000 1.550000  5.111000 1.347000  1.264000       2.053000  
1 1 1 19 10 35 o 24.21000 0.3532000 24.06000 0.4622000 24.36000 0.5341000 -0.2987000     0.7063000 
1 1 1 19 10 37 o 37.19000 0.3780000 37.37000 0.5682000 37.01000 0.4988000 0.3621000      0.7561000 
1 1 1 19 10 39 o 32.78000 0.3368000 32.65000 0.4747000 32.92000 0.4780000 -0.2694000     0.6736000 
1 1 1 19 10 41 o 27.21000 0.3593000 27.68000 0.5409000 26.75000 0.4731000 0.9270000      0.7186000 
1 1 1 19 10 43 o 31.47000 0.3246000 31.69000 0.4516000 31.25000 0.4663000 0.4382000      0.6491000 
1 1 1 19 10 45 o 26.06000 0.3541000 26.46000 0.5323000 25.66000 0.4672000 0.7988000      0.7082000 
1 1 1 19 10 47 o 12.59000 0.5182000 12.63000 0.7072000 12.56000 0.7577000 0.6656000E-01  1.036000  
1 1 1 19 10 49 o 6.953000 0.6797000 7.082000 0.9352000 6.824000 0.9867000 0.2582000      1.359000  
1 1 1 19 10 51 o 6.439000 1.018000  5.557000 1.774000  7.321000 1.000000  -1.764000      2.037000  
1 1 1 19 10 53 o 7.267000 0.8336000 7.597000 1.104000  6.937000 1.249000  0.6603000      1.667000  
1 1 1 19 10 55 o 4.607000 0.9972000 5.709000 1.428000  3.504000 1.392000  2.205000       1.994000  
1 1 1 19 10 57 o 10.84000 0.5498000 9.835000 0.8077000 11.85000 0.7463000 -2.019000      1.100000  
1 1 1 19 10 59 o 6.353000 0.8791000 5.983000 1.333000  6.723000 1.147000  -0.7394000     1.758000  
1 1 1 19 10 61 o 2.819000 0.9113000 3.065000 1.388000  2.573000 1.181000  0.4920000      1.823000  
1 1 1 19 11 0  o 40.07000 0.5190000 40.07000 0.5190000 40.07000 0.5190000 0.000000       0.000000  
1 1 1 19 11 2  o 22.91000 0.2709000 22.67000 0.3659000 23.15000 0.3996000 -0.4797000     0.5418000 
1 1 1 19 11 4  o 29.04000 0.2849000 29.22000 0.3800000 28.86000 0.4246000 0.3524000      0.5698000 
1 1 1 19 11 6  o 6.051000 0.6862000 6.619000 0.9723000 5.482000 0.9684000 1.137000       1.372000  
1 1 1 19 11 8  f 105.3000 0.8898000 105.0000 1.449000  105.7000 1.033000  -0.7060000     1.780000  
1 1 1 19 11 10 o 15.93000 0.3599000 15.87000 0.5994000 15.99000 0.3985000 -0.1211000     0.7198000 
1 1 1 19 11 12 o 68.92000 0.6004000 68.59000 0.9783000 69.24000 0.6963000 -0.6489000     1.201000  
1 1 1 19 11 14 o 63.31000 0.5660000 62.30000 0.6340000 64.31000 0.9379000 -2.006000      1.132000  
1 1 1 19 11 16 o 59.96000 0.4344000 59.61000 0.6102000 60.32000 0.6184000 -0.7110000     0.8688000 
1 1 1 19 11 18 o 91.09000 0.6841000 90.01000 1.024000  92.17000 0.9074000 -2.159000      1.368000  
1 1 1 19 11 20 o 57.25000 0.4571000 56.75000 0.5905000 57.75000 0.6980000 -0.9948000     0.9143000 
1 1 1 19 11 22 o 24.28000 0.3439000 23.64000 0.3688000 24.92000 0.5805000 -1.277000      0.6878000 
1 1 1 19 11 24 o 38.46000 0.3475000 37.94000 0.4442000 38.98000 0.5346000 -1.036000      0.6950000 
1 1 1 19 11 26 o 33.42000 0.3144000 33.56000 0.3836000 33.28000 0.4983000 0.2810000      0.6288000 
1 1 1 19 11 28 o 24.51000 0.3028000 24.29000 0.3578000 24.74000 0.4886000 -0.4468000     0.6056000 
1 1 1 19 11 30 o 17.78000 0.4053000 18.67000 0.4602000 16.90000 0.6674000 1.769000       0.8107000 
1 1 1 19 11 32 o 58.62000 0.4743000 59.55000 0.6254000 57.69000 0.7132000 1.860000       0.9485000 
1 1 1 19 11 34 o 16.02000 0.7153000 15.86000 1.290000  16.17000 0.6189000 -0.3060000     1.431000  
1 1 1 19 11 36 o 13.74000 0.4672000 13.09000 0.6694000 14.39000 0.6519000 -1.305000      0.9344000 
1 1 1 19 11 38 o 23.14000 0.3427000 23.68000 0.4681000 22.60000 0.5007000 1.074000       0.6854000 
1 1 1 19 11 40 o 4.615000 0.9655000 5.313000 1.318000  3.917000 1.411000  1.395000       1.931000  
1 1 1 19 11 42 o 18.90000 0.3870000 18.93000 0.5054000 18.86000 0.5862000 0.6881000E-01  0.7740000 
1 1 1 19 11 44 o 15.74000 0.3949000 14.70000 0.5647000 16.78000 0.5522000 -2.079000      0.7898000 
1 1 1 19 11 46 o 10.65000 0.5572000 10.60000 0.7515000 10.70000 0.8228000 -0.1015000     1.114000  
1 1 1 19 11 48 o 13.90000 0.3951000 13.71000 0.5662000 14.10000 0.5512000 -0.3889000     0.7902000 
1 1 1 19 11 50 o 14.55000 0.5241000 14.25000 0.8793000 14.85000 0.5705000 -0.5977000     1.048000  
1 1 1 19 11 52 o 15.85000 0.3927000 15.45000 0.5780000 16.25000 0.5316000 -0.7957000     0.7853000 
1 1 1 19 11 54 o 4.754000 0.9959000 4.770000 1.451000  4.738000 1.364000  0.3138000E-01  1.992000  
1 1 1 19 11 56 o 15.07000 0.4383000 15.17000 0.6155000 14.97000 0.6242000 0.1935000      0.8766000 
1 1 1 19 11 58 o 6.255000 0.9654000 5.791000 1.416000  6.719000 1.313000  -0.9283000     1.931000  
1 1 1 19 11 60 o 5.490000 0.9783000 6.686000 1.234000  4.294000 1.519000  2.392000       1.957000  
1 1 1 19 12 1  o 51.28000 0.4853000 51.75000 0.7581000 50.82000 0.6062000 0.9260000      0.9707000 
1 1 1 19 12 3  o 47.38000 0.4061000 47.18000 0.5729000 47.58000 0.5757000 -0.4049000     0.8122000 
1 1 1 19 12 5  o 30.39000 0.3395000 30.49000 0.5569000 30.29000 0.3883000 0.2013000      0.6789000 
1 1 1 19 12 7  o 26.70000 0.3266000 26.43000 0.5377000 26.97000 0.3708000 -0.5326000     0.6531000 
1 1 1 19 12 9  o 25.97000 0.2733000 26.37000 0.4086000 25.56000 0.3631000 0.8145000      0.5466000 
1 1 1 19 12 11 f 79.30000 0.5556000 78.93000 0.7822000 79.66000 0.7892000 -0.7273000     1.111000  
1 1 1 19 12 13 o 67.51000 0.5213000 67.38000 0.7889000 67.64000 0.6818000 -0.2604000     1.043000  
1 1 1 19 12 15 o 15.26000 0.3492000 15.48000 0.5221000 15.05000 0.4638000 0.4287000      0.6984000 
1 1 1 19 12 17 o 29.97000 0.2778000 30.12000 0.3936000 29.82000 0.3922000 0.2932000      0.5556000 
1 1 1 19 12 19 o 42.93000 0.3683000 42.31000 0.4680000 43.55000 0.5689000 -1.237000      0.7366000 
1 1 1 19 12 21 o 22.59000 0.3031000 21.70000 0.3894000 23.48000 0.4645000 -1.786000      0.6061000 
1 1 1 19 12 23 o 30.14000 0.3418000 29.53000 0.3555000 30.75000 0.5838000 -1.228000      0.6836000 
1 1 1 19 12 25 o 54.10000 0.4381000 53.73000 0.5643000 54.47000 0.6702000 -0.7426000     0.8761000 
1 1 1 19 12 27 o 32.71000 0.3142000 32.17000 0.3715000 33.25000 0.5067000 -1.078000      0.6283000 
1 1 1 19 12 29 o 27.50000 0.3701000 27.50000 0.3701000 ?        ?         ?              ?         
1 1 1 19 12 31 o 12.99000 0.4321000 12.56000 0.5155000 13.42000 0.6935000 -0.8642000     0.8641000 
1 1 1 19 12 33 o 7.001000 0.7685000 6.301000 0.9851000 7.702000 1.180000  -1.401000      1.537000  
1 1 1 19 12 35 o 16.85000 0.4031000 16.71000 0.5812000 16.99000 0.5586000 -0.2747000     0.8061000 
1 1 1 19 12 37 o 18.77000 0.4345000 19.35000 0.5800000 18.19000 0.6471000 1.152000       0.8690000 
1 1 1 19 12 39 o 23.60000 0.3382000 23.95000 0.4681000 23.24000 0.4881000 0.7106000      0.6763000 
1 1 1 19 12 41 o 14.20000 0.4286000 14.57000 0.5873000 13.83000 0.6244000 0.7432000      0.8572000 
1 1 1 19 12 43 f 6.506000 0.8681000 6.905000 1.087000  6.108000 1.353000  0.7970000      1.736000  
1 1 1 19 12 45 o 13.40000 0.4677000 13.75000 0.5918000 13.06000 0.7243000 0.6919000      0.9353000 
1 1 1 19 12 47 o 10.35000 0.5234000 10.08000 0.7467000 10.62000 0.7336000 -0.5431000     1.047000  
1 1 1 19 12 49 o 4.867000 0.9441000 4.114000 1.438000  5.620000 1.224000  -1.505000      1.888000  
1 1 1 19 12 51 o 4.533000 1.058000  5.200000 1.593000  3.866000 1.392000  1.335000       2.116000  
1 1 1 19 12 53 o 4.553000 1.042000  5.333000 1.456000  3.773000 1.490000  1.560000       2.083000  
1 1 1 19 12 55 o 9.059000 0.6040000 8.932000 0.8657000 9.185000 0.8424000 -0.2526000     1.208000  
1 1 1 19 12 57 o 5.530000 1.025000  6.355000 1.284000  4.704000 1.598000  1.651000       2.050000  
1 1 1 19 12 59 o 4.912000 1.086000  4.468000 1.455000  5.355000 1.613000  -0.8870000     2.172000  
1 1 1 19 12 61 o 4.160000 1.056000  4.574000 1.549000  3.745000 1.434000  0.8294000      2.111000  
1 1 1 19 13 0  f 5.350000 0.8623000 5.350000 0.8623000 5.350000 0.8623000 0.000000       0.000000  
1 1 1 19 13 2  o 38.52000 0.3333000 38.69000 0.5086000 38.36000 0.4310000 0.3271000      0.6667000 
1 1 1 19 13 4  f 17.57000 0.2984000 17.25000 0.4704000 17.88000 0.3673000 -0.6331000     0.5968000 
1 1 1 19 13 6  o 40.53000 0.3189000 40.86000 0.4541000 40.19000 0.4477000 0.6635000      0.6377000 
1 1 1 19 13 8  o 28.76000 0.2666000 29.11000 0.3808000 28.40000 0.3732000 0.7096000      0.5332000 
1 1 1 19 13 10 o 12.87000 0.2912000 12.57000 0.4168000 13.16000 0.4067000 -0.5929000     0.5824000 
1 1 1 19 13 12 o 43.39000 0.3351000 43.67000 0.4752000 43.11000 0.4726000 0.5556000      0.6701000 
1 1 1 19 13 14 o 86.34000 0.6022000 85.60000 0.8442000 87.09000 0.8589000 -1.490000      1.204000  
1 1 1 19 13 16 o 39.49000 0.3493000 39.24000 0.5327000 39.74000 0.4520000 -0.4972000     0.6986000 
1 1 1 19 13 18 o 28.64000 0.3782000 29.01000 0.5923000 28.27000 0.4703000 0.7383000      0.7563000 
1 1 1 19 13 20 o 14.12000 0.3273000 13.64000 0.3782000 14.59000 0.5343000 -0.9506000     0.6546000 
1 1 1 19 13 22 o 35.98000 0.3349000 35.83000 0.4343000 36.12000 0.5099000 -0.2886000     0.6697000 
1 1 1 19 13 24 o 9.077000 0.4859000 8.681000 0.5851000 9.473000 0.7760000 -0.7924000     0.9718000 
1 1 1 19 13 26 o 22.66000 0.3508000 22.27000 0.3820000 23.04000 0.5886000 -0.7684000     0.7017000 
1 1 1 19 13 28 o 8.611000 0.8193000 8.721000 0.6067000 8.502000 1.522000  0.2192000      1.639000  
1 1 1 19 13 30 f 26.53000 0.3165000 26.28000 0.3709000 26.77000 0.5131000 -0.4984000     0.6331000 
1 1 1 19 13 32 o 20.43000 0.3636000 20.47000 0.4802000 20.38000 0.5462000 0.8962000E-01  0.7273000 
1 1 1 19 13 34 o 24.09000 0.3523000 23.47000 0.4460000 24.70000 0.5456000 -1.234000      0.7047000 
1 1 1 19 13 36 o 39.52000 0.3519000 39.89000 0.4942000 39.14000 0.5012000 0.7535000      0.7038000 
1 1 1 19 13 38 o 15.28000 0.5376000 15.76000 0.8890000 14.80000 0.6048000 0.9589000      1.075000  
1 1 1 19 13 40 o 34.02000 0.4270000 34.68000 0.6485000 33.36000 0.5557000 1.314000       0.8540000 
1 1 1 19 13 42 o 18.73000 0.3732000 18.42000 0.4953000 19.03000 0.5584000 -0.6043000     0.7464000 
1 1 1 19 13 44 o 15.57000 0.4183000 15.60000 0.5863000 15.53000 0.5967000 0.7010000E-01  0.8365000 
1 1 1 19 13 46 o 14.53000 0.3935000 14.14000 0.5785000 14.92000 0.5335000 -0.7816000     0.7870000 
1 1 1 19 13 48 o 6.979000 0.7592000 7.303000 1.098000  6.656000 1.049000  0.6473000      1.518000  
1 1 1 19 13 50 o 3.670000 0.9609000 3.069000 1.292000  4.271000 1.423000  -1.202000      1.922000  
1 1 1 19 13 52 o 4.988000 0.8713000 3.454000 1.392000  6.521000 1.048000  -3.066000      1.743000  
1 1 1 19 13 54 o 4.732000 0.9641000 5.738000 1.302000  3.726000 1.422000  2.012000       1.928000  
1 1 1 19 13 56 o 5.522000 0.9610000 5.730000 1.369000  5.314000 1.349000  0.4157000      1.922000  
1 1 1 19 13 58 o 8.812000 0.6430000 8.872000 0.9456000 8.752000 0.8716000 0.1196000      1.286000  
1 1 1 19 13 60 o 4.024000 1.070000  4.594000 1.669000  3.454000 1.339000  1.140000       2.140000  
1 1 1 19 14 1  o 49.21000 0.3662000 48.92000 0.5151000 49.50000 0.5206000 -0.5784000     0.7324000 
1 1 1 19 14 3  o 13.31000 0.4110000 14.00000 0.7044000 12.62000 0.4237000 1.384000       0.8220000 
1 1 1 19 14 5  o 50.54000 0.3741000 50.78000 0.5317000 50.30000 0.5265000 0.4845000      0.7483000 
1 1 1 19 14 7  o 25.49000 0.2582000 25.38000 0.3680000 25.61000 0.3624000 -0.2319000     0.5165000 
1 1 1 19 14 9  o 16.63000 0.2599000 16.76000 0.3641000 16.50000 0.3710000 0.2579000      0.5198000 
1 1 1 19 14 11 o 33.80000 0.2868000 33.55000 0.4019000 34.05000 0.4093000 -0.5030000     0.5736000 
1 1 1 19 14 13 o 49.39000 0.3709000 49.32000 0.5249000 49.47000 0.5240000 -0.1459000     0.7417000 
1 1 1 19 14 15 o 20.63000 0.2824000 21.17000 0.3735000 20.10000 0.4238000 1.076000       0.5649000 
1 1 1 19 14 17 o 36.01000 0.3148000 36.06000 0.3768000 35.96000 0.5045000 0.9470000E-01  0.6297000 
1 1 1 19 14 19 o 34.07000 0.3789000 34.34000 0.5735000 33.81000 0.4953000 0.5274000      0.7578000 
1 1 1 19 14 21 o 40.93000 0.3424000 40.40000 0.4059000 41.47000 0.5515000 -1.067000      0.6848000 
1 1 1 19 14 23 o 40.99000 0.3843000 41.25000 0.5405000 40.74000 0.5466000 0.5095000      0.7687000 
1 1 1 19 14 25 o 25.72000 0.2936000 25.61000 0.3440000 25.84000 0.4760000 -0.2275000     0.5873000 
1 1 1 19 14 27 o 20.50000 0.4613000 19.96000 0.3595000 21.04000 0.8497000 -1.088000      0.9226000 
1 1 1 19 14 29 o 27.86000 0.3691000 28.05000 0.3690000 27.66000 0.6394000 0.3853000      0.7382000 
1 1 1 19 14 31 o 27.73000 0.3288000 27.54000 0.4155000 27.93000 0.5098000 -0.3904000     0.6577000 
1 1 1 19 14 33 o 38.28000 0.3509000 38.62000 0.4245000 37.94000 0.5589000 0.6781000      0.7019000 
1 1 1 19 14 35 o 17.91000 0.3961000 17.48000 0.5855000 18.34000 0.5337000 -0.8635000     0.7923000 
1 1 1 19 14 37 o 33.10000 0.3336000 33.32000 0.4625000 32.87000 0.4807000 0.4476000      0.6671000 
1 1 1 19 14 39 f 19.89000 0.4108000 19.29000 0.6463000 20.49000 0.5073000 -1.206000      0.8216000 
1 1 1 19 14 41 o 10.06000 0.5469000 10.18000 0.7534000 9.933000 0.7930000 0.2463000      1.094000  
1 1 1 19 14 43 o 6.192000 0.9804000 6.977000 1.119000  5.407000 1.610000  1.570000       1.961000  
1 1 1 19 14 45 o 13.23000 0.5869000 12.62000 1.021000  13.84000 0.5794000 -1.226000      1.174000  
1 1 1 19 14 47 o 9.176000 0.6052000 9.004000 0.8372000 9.347000 0.8741000 -0.3434000     1.210000  
1 1 1 19 14 49 o 5.827000 0.9161000 5.122000 1.455000  6.533000 1.113000  -1.411000      1.832000  
1 1 1 19 14 51 o 8.851000 0.6175000 9.249000 0.8609000 8.453000 0.8856000 0.7963000      1.235000  
1 1 1 19 14 53 o 10.20000 0.5668000 10.45000 0.7834000 9.949000 0.8194000 0.5032000      1.134000  
1 1 1 19 14 55 o 10.84000 0.5261000 11.39000 0.7384000 10.29000 0.7495000 1.094000       1.052000  
1 1 1 19 14 57 o 4.575000 1.033000  3.973000 1.440000  5.177000 1.480000  -1.204000      2.065000  
1 1 1 19 14 59 o 3.365000 0.9650000 3.128000 1.357000  3.602000 1.372000  -0.4748000     1.930000  
1 1 1 19 15 0  o 24.43000 0.4208000 24.43000 0.4208000 24.43000 0.4208000 0.000000       0.000000  
1 1 1 19 15 2  f 24.76000 0.3056000 25.11000 0.4405000 24.42000 0.4238000 0.6866000      0.6112000 
1 1 1 19 15 4  o 49.80000 0.3694000 49.64000 0.5204000 49.97000 0.5245000 -0.3250000     0.7389000 
1 1 1 19 15 6  o 36.70000 0.2992000 36.97000 0.4280000 36.44000 0.4182000 0.5302000      0.5984000 
1 1 1 19 15 8  o 68.52000 0.4857000 68.82000 0.6895000 68.21000 0.6842000 0.6082000      0.9713000 
1 1 1 19 15 10 f 54.70000 0.3997000 54.89000 0.5668000 54.50000 0.5637000 0.3825000      0.7994000 
1 1 1 19 15 12 o 44.38000 0.3740000 44.60000 0.4840000 44.16000 0.5703000 0.4402000      0.7480000 
1 1 1 19 15 14 o 66.62000 0.4761000 66.50000 0.6725000 66.73000 0.6741000 -0.2266000     0.9522000 
1 1 1 19 15 16 o 39.83000 0.3322000 39.78000 0.3958000 39.89000 0.5336000 -0.1115000     0.6644000 
1 1 1 19 15 18 o 67.06000 0.5184000 67.10000 0.6733000 67.02000 0.7883000 0.7590000E-01  1.037000  
1 1 1 19 15 20 o 51.94000 0.4227000 51.85000 0.5488000 52.04000 0.6431000 -0.1945000     0.8455000 
1 1 1 19 15 22 o 28.37000 0.3092000 28.27000 0.3875000 28.47000 0.4818000 -0.1983000     0.6183000 
1 1 1 19 15 24 o 31.59000 0.3254000 30.49000 0.4070000 32.70000 0.5079000 -2.205000      0.6508000 
1 1 1 19 15 26 o 26.63000 0.3452000 26.58000 0.3511000 26.67000 0.5945000 -0.9631000E-01 0.6904000 
1 1 1 19 15 28 o 2.902000 0.8665000 2.767000 1.129000  3.037000 1.315000  -0.2705000     1.733000  
1 1 1 19 15 30 o 34.28000 0.3876000 34.55000 0.4279000 34.00000 0.6463000 0.5520000      0.7751000 
1 1 1 19 15 32 o 22.06000 0.3419000 22.38000 0.4270000 21.73000 0.5340000 0.6491000      0.6837000 
1 1 1 19 15 34 o 23.06000 0.3364000 23.29000 0.4088000 22.83000 0.5343000 0.4648000      0.6727000 
1 1 1 19 15 36 o 9.926000 0.6123000 9.454000 0.9447000 10.40000 0.7794000 -0.9444000     1.225000  
1 1 1 19 15 38 f 10.32000 0.5237000 9.868000 0.7521000 10.76000 0.7291000 -0.8937000     1.047000  
1 1 1 19 15 40 o 22.92000 0.4209000 23.50000 0.6989000 22.34000 0.4693000 1.162000       0.8418000 
1 1 1 19 15 42 o 12.76000 0.4481000 13.04000 0.6018000 12.47000 0.6641000 0.5715000      0.8962000 
1 1 1 19 15 44 o 18.90000 0.6162000 18.42000 1.134000  19.38000 0.4836000 -0.9608000     1.232000  
1 1 1 19 15 46 o 5.429000 1.008000  5.682000 1.366000  5.176000 1.484000  0.5057000      2.017000  
1 1 1 19 15 48 o 15.75000 0.3887000 15.84000 0.5246000 15.65000 0.5736000 0.1953000      0.7773000 
1 1 1 19 15 50 o 5.274000 0.9985000 6.205000 1.398000  4.343000 1.426000  1.862000       1.997000  
1 1 1 19 15 52 o 7.846000 0.8862000 7.778000 1.445000  7.914000 1.026000  -0.1360000     1.772000  
1 1 1 19 15 54 o 12.76000 0.5379000 12.85000 0.7783000 12.67000 0.7427000 0.1830000      1.076000  
1 1 1 19 15 56 o 6.068000 0.8968000 6.648000 1.171000  5.488000 1.359000  1.160000       1.794000  
1 1 1 19 15 58 o 11.66000 0.5714000 12.01000 0.8498000 11.31000 0.7643000 0.7005000      1.143000  
1 1 1 19 15 60 o 5.036000 1.018000  4.481000 1.550000  5.591000 1.320000  -1.110000      2.036000  
1 1 1 19 16 1  o 75.95000 0.5768000 75.34000 0.8686000 76.56000 0.7593000 -1.214000      1.154000  
1 1 1 19 16 3  o 73.35000 0.5588000 73.05000 0.8430000 73.65000 0.7337000 -0.5983000     1.118000  
1 1 1 19 16 5  o 39.51000 0.3406000 39.00000 0.4371000 40.02000 0.5224000 -1.028000      0.6811000 
1 1 1 19 16 7  o 24.64000 0.2527000 24.66000 0.3604000 24.63000 0.3542000 0.2972000E-01  0.5054000 
1 1 1 19 16 9  o 30.30000 0.3028000 30.73000 0.4369000 29.88000 0.4192000 0.8560000      0.6055000 
1 1 1 19 16 11 o 36.05000 0.2965000 35.89000 0.4173000 36.20000 0.4213000 -0.3047000     0.5930000 
1 1 1 19 16 13 o 34.77000 0.2911000 34.68000 0.4136000 34.86000 0.4096000 -0.1776000     0.5821000 
1 1 1 19 16 15 o 32.77000 0.3573000 32.52000 0.3484000 33.03000 0.6240000 -0.5131000     0.7147000 
1 1 1 19 16 17 o 36.49000 0.3165000 36.60000 0.3762000 36.39000 0.5091000 0.2154000      0.6330000 
1 1 1 19 16 19 o 24.71000 0.3474000 24.54000 0.3479000 24.88000 0.6014000 -0.3419000     0.6948000 
1 1 1 19 16 21 o 13.46000 0.3888000 13.34000 0.4868000 13.57000 0.6063000 -0.2258000     0.7775000 
1 1 1 19 16 23 o 28.41000 0.3451000 28.83000 0.4945000 27.99000 0.4816000 0.8303000      0.6903000 
1 1 1 19 16 25 o 33.92000 0.3791000 33.71000 0.4303000 34.13000 0.6242000 -0.4152000     0.7581000 
1 1 1 19 16 27 o 8.028000 0.6193000 7.827000 0.6066000 8.229000 1.080000  -0.4025000     1.239000  
1 1 1 19 16 29 o 33.68000 0.3909000 33.74000 0.4214000 33.62000 0.6585000 0.1228000      0.7818000 
1 1 1 19 16 31 f 6.441000 0.7726000 5.755000 1.040000  7.127000 1.143000  -1.372000      1.545000  
1 1 1 19 16 33 o 27.48000 0.3291000 27.40000 0.3953000 27.56000 0.5262000 -0.1585000     0.6582000 
1 1 1 19 16 35 o 17.85000 0.3801000 17.11000 0.4986000 18.58000 0.5738000 -1.472000      0.7602000 
1 1 1 19 16 37 o 22.93000 0.3573000 23.02000 0.5255000 22.85000 0.4843000 0.1742000      0.7146000 
1 1 1 19 16 39 o 10.33000 0.5493000 10.20000 0.8066000 10.45000 0.7459000 -0.2476000     1.099000  
1 1 1 19 16 41 o 23.91000 0.3564000 23.92000 0.4625000 23.91000 0.5425000 0.9346000E-02  0.7128000 
1 1 1 19 16 43 o 9.993000 0.5239000 9.804000 0.7428000 10.18000 0.7391000 -0.3792000     1.048000  
1 1 1 19 16 45 o 9.848000 0.5528000 10.13000 0.7042000 9.565000 0.8524000 0.5654000      1.106000  
1 1 1 19 16 47 o 9.577000 0.5168000 9.071000 0.7721000 10.08000 0.6872000 -1.012000      1.034000  
1 1 1 19 16 49 o 9.102000 0.6435000 9.151000 0.8916000 9.053000 0.9282000 0.9779000E-01  1.287000  
1 1 1 19 16 51 o 4.761000 0.9663000 4.218000 1.431000  5.304000 1.299000  -1.086000      1.933000  
1 1 1 19 16 53 o 6.366000 1.006000  7.165000 1.445000  5.568000 1.399000  1.597000       2.011000  
1 1 1 19 16 55 o 9.143000 0.7447000 9.421000 0.8861000 8.866000 1.197000  0.5546000      1.489000  
1 1 1 19 16 57 o 9.381000 0.7331000 11.20000 0.8790000 7.563000 1.174000  3.638000       1.466000  
1 1 1 19 16 59 o 2.878000 0.8879000 2.981000 1.318000  2.776000 1.190000  0.2043000      1.776000  
1 1 1 19 17 0  o 78.94000 0.9077000 78.94000 0.9077000 78.94000 0.9077000 0.000000       0.000000  
1 1 1 19 17 2  o 40.06000 0.3160000 40.12000 0.4470000 40.00000 0.4469000 0.1226000      0.6321000 
1 1 1 19 17 4  o 33.65000 0.4073000 33.10000 0.7083000 34.21000 0.4025000 -1.108000      0.8147000 
1 1 1 19 17 6  o 59.39000 0.4288000 59.70000 0.6095000 59.08000 0.6032000 0.6156000      0.8576000 
1 1 1 19 17 8  o 20.21000 0.2464000 20.09000 0.3491000 20.32000 0.3479000 -0.2265000     0.4928000 
1 1 1 19 17 10 o 33.27000 0.2820000 33.11000 0.4005000 33.43000 0.3972000 -0.3207000     0.5641000 
1 1 1 19 17 12 o 68.16000 0.4840000 68.36000 0.6859000 67.95000 0.6831000 0.4138000      0.9681000 
1 1 1 19 17 14 o 20.92000 0.2739000 21.10000 0.2931000 20.75000 0.4627000 0.3481000      0.5477000 
1 1 1 19 17 16 o 28.46000 0.2840000 28.47000 0.3257000 28.44000 0.4653000 0.3316000E-01  0.5680000 
1 1 1 19 17 18 o 41.45000 0.3573000 41.65000 0.4556000 41.26000 0.5506000 0.3953000      0.7147000 
1 1 1 19 17 20 o 57.09000 0.4537000 57.77000 0.5921000 56.41000 0.6877000 1.359000       0.9074000 
1 1 1 19 17 22 o 9.427000 0.4672000 9.490000 0.5403000 9.363000 0.7624000 0.1267000      0.9345000 
1 1 1 19 17 24 o 32.77000 0.3533000 32.74000 0.3693000 32.81000 0.6025000 -0.6348000E-01 0.7067000 
1 1 1 19 17 26 o 21.60000 0.3385000 21.54000 0.3299000 21.65000 0.5913000 -0.1160000     0.6771000 
1 1 1 19 17 28 o 39.29000 0.3597000 39.67000 0.4575000 38.90000 0.5552000 0.7767000      0.7194000 
1 1 1 19 17 30 o 10.50000 0.5011000 10.49000 0.5777000 10.51000 0.8190000 -0.1174000E-01 1.002000  
1 1 1 19 17 32 o 9.366000 0.5932000 9.458000 0.6802000 9.273000 0.9720000 0.1850000      1.186000  
1 1 1 19 17 34 o 8.151000 0.8143000 8.641000 0.7884000 7.660000 1.425000  0.9807000      1.629000  
1 1 1 19 17 36 o 10.75000 0.5043000 11.02000 0.6764000 10.48000 0.7481000 0.5359000      1.009000  
1 1 1 19 17 38 o 11.90000 0.4923000 11.57000 0.7322000 12.23000 0.6583000 -0.6610000     0.9846000 
1 1 1 19 17 40 o 6.002000 1.096000  5.363000 1.862000  6.641000 1.155000  -1.278000      2.191000  
1 1 1 19 17 42 o 15.17000 0.4336000 15.53000 0.5646000 14.81000 0.6582000 0.7207000      0.8672000 
1 1 1 19 17 44 o 6.265000 0.8882000 6.176000 1.285000  6.354000 1.227000  -0.1782000     1.776000  
1 1 1 19 17 46 o 3.522000 0.9145000 3.438000 1.319000  3.606000 1.267000  -0.1676000     1.829000  
1 1 1 19 17 48 o 4.485000 0.9447000 4.195000 1.407000  4.775000 1.261000  -0.5802000     1.889000  
1 1 1 19 17 50 f 4.936000 0.9626000 5.070000 1.340000  4.803000 1.383000  0.2675000      1.925000  
1 1 1 19 17 52 o 3.632000 1.020000  3.893000 1.537000  3.372000 1.342000  0.5216000      2.041000  
1 1 1 19 17 54 o 3.877000 1.118000  4.052000 1.564000  3.702000 1.598000  0.3502000      2.236000  
1 1 1 19 17 56 o 9.561000 0.6295000 9.446000 0.8483000 9.675000 0.9302000 -0.2289000     1.259000  
1 1 1 19 17 58 o 4.568000 1.010000  4.081000 1.516000  5.055000 1.335000  -0.9739000     2.020000  
1 1 1 19 18 1  o 42.95000 0.3291000 42.94000 0.4656000 42.96000 0.4653000 -0.2271000E-01 0.6582000 
1 1 1 19 18 3  o 12.17000 0.2910000 12.54000 0.4148000 11.80000 0.4081000 0.7367000      0.5819000 
1 1 1 19 18 5  o 49.55000 0.3691000 49.85000 0.5249000 49.26000 0.5190000 0.5928000      0.7381000 
1 1 1 19 18 7  o 75.84000 0.5341000 74.91000 0.7460000 76.77000 0.7646000 -1.860000      1.068000  
1 1 1 19 18 9  o 43.42000 0.3332000 43.64000 0.4725000 43.21000 0.4700000 0.4315000      0.6664000 
1 1 1 19 18 11 o 26.39000 0.2544000 26.58000 0.3625000 26.20000 0.3569000 0.3821000      0.5087000 
1 1 1 19 18 13 o 39.98000 0.3316000 39.69000 0.3889000 40.27000 0.5371000 -0.5802000     0.6631000 
1 1 1 19 18 15 o 62.87000 0.5444000 62.45000 0.5635000 63.29000 0.9316000 -0.8457000     1.089000  
1 1 1 19 18 17 o 12.34000 0.3423000 12.69000 0.3092000 11.98000 0.6108000 0.7107000      0.6846000 
1 1 1 19 18 19 o 39.27000 0.3640000 39.18000 0.4917000 39.37000 0.5369000 -0.1887000     0.7281000 
1 1 1 19 18 21 o 29.92000 0.3344000 29.88000 0.3394000 29.96000 0.5762000 -0.8566000E-01 0.6688000 
1 1 1 19 18 23 o 20.77000 0.2974000 20.81000 0.3412000 20.72000 0.4871000 0.9009000E-01  0.5948000 
1 1 1 19 18 25 o 32.93000 0.3629000 32.48000 0.3661000 33.38000 0.6268000 -0.8941000     0.7259000 
1 1 1 19 18 27 o 52.05000 0.4609000 52.02000 0.6456000 52.07000 0.6578000 -0.5302000E-01 0.9217000 
1 1 1 19 18 29 o 14.53000 0.4364000 14.57000 0.4048000 14.48000 0.7733000 0.8761000E-01  0.8728000 
1 1 1 19 18 31 o 16.88000 0.3595000 16.13000 0.4119000 17.64000 0.5894000 -1.518000      0.7190000 
1 1 1 19 18 33 o 18.14000 0.3727000 18.83000 0.4279000 17.46000 0.6104000 1.372000       0.7455000 
1 1 1 19 18 35 o 16.24000 0.3720000 16.80000 0.4460000 15.69000 0.5956000 1.111000       0.7440000 
1 1 1 19 18 37 o 12.54000 0.4482000 12.15000 0.6312000 12.93000 0.6364000 -0.7816000     0.8964000 
1 1 1 19 18 39 o 20.17000 0.4420000 19.69000 0.7387000 20.65000 0.4855000 -0.9616000     0.8840000 
1 1 1 19 18 41 o 7.702000 0.8819000 8.315000 1.068000  7.090000 1.404000  1.225000       1.764000  
1 1 1 19 18 43 o 11.50000 0.5153000 11.03000 0.7278000 11.97000 0.7297000 -0.9371000     1.031000  
1 1 1 19 18 45 o 8.062000 0.6205000 7.072000 0.9577000 9.052000 0.7894000 -1.981000      1.241000  
1 1 1 19 18 47 o 8.002000 0.6177000 8.950000 0.8250000 7.054000 0.9196000 1.896000       1.235000  
1 1 1 19 18 49 o 13.86000 0.4137000 14.26000 0.5811000 13.46000 0.5890000 0.7922000      0.8274000 
1 1 1 19 18 51 o 6.402000 0.9911000 6.330000 1.522000  6.475000 1.270000  -0.1454000     1.982000  
1 1 1 19 18 53 o 3.961000 1.051000  3.735000 1.442000  4.186000 1.528000  -0.4516000     2.101000  
1 1 1 19 18 55 o 4.369000 1.122000  3.251000 1.405000  5.487000 1.750000  -2.236000      2.244000  
1 1 1 19 18 57 o 4.178000 1.044000  5.207000 1.600000  3.150000 1.341000  2.056000       2.088000  
1 1 1 19 18 59 o 4.215000 1.000000  4.628000 1.524000  3.803000 1.295000  0.8247000      2.000000  
1 1 1 19 19 0  o 41.98000 0.5429000 41.98000 0.5429000 41.98000 0.5429000 0.000000       0.000000  
1 1 1 19 19 2  o 43.51000 0.3319000 43.44000 0.4689000 43.59000 0.4700000 -0.1495000     0.6639000 
1 1 1 19 19 4  o 15.57000 0.2757000 15.40000 0.3999000 15.74000 0.3796000 -0.3392000     0.5514000 
1 1 1 19 19 6  f 27.00000 0.2534000 27.20000 0.3601000 26.80000 0.3565000 0.3958000      0.5068000 
1 1 1 19 19 8  f 91.99000 0.6387000 91.81000 0.9009000 92.16000 0.9056000 -0.3547000     1.277000  
1 1 1 19 19 10 o 87.35000 0.6093000 87.45000 0.8622000 87.25000 0.8612000 0.2005000      1.219000  
1 1 1 19 19 12 o 60.97000 0.5143000 61.29000 0.7300000 60.65000 0.7245000 0.6341000      1.029000  
1 1 1 19 19 14 o 33.93000 0.4066000 33.43000 0.5035000 34.44000 0.6387000 -1.015000      0.8133000 
1 1 1 19 19 16 o 31.28000 0.2934000 31.00000 0.3326000 31.56000 0.4835000 -0.5582000     0.5868000 
1 1 1 19 19 18 o 51.76000 0.4445000 52.23000 0.6192000 51.29000 0.6378000 0.9412000      0.8889000 
1 1 1 19 19 20 f 12.10000 0.4142000 11.84000 0.3437000 12.36000 0.7538000 -0.5173000     0.8284000 
1 1 1 19 19 22 o 20.95000 0.2919000 21.00000 0.3197000 20.90000 0.4886000 0.1021000      0.5838000 
1 1 1 19 19 24 o 27.41000 0.3916000 27.07000 0.5141000 27.74000 0.5909000 -0.6712000     0.7832000 
1 1 1 19 19 26 o 25.24000 0.3085000 24.98000 0.3700000 25.50000 0.4938000 -0.5130000     0.6170000 
1 1 1 19 19 28 o 46.53000 0.4607000 47.19000 0.5290000 45.87000 0.7544000 1.323000       0.9214000 
1 1 1 19 19 30 o 57.16000 0.4444000 57.26000 0.5375000 57.07000 0.7079000 0.1929000      0.8888000 
1 1 1 19 19 32 o 47.72000 0.4073000 48.25000 0.5283000 47.19000 0.6201000 1.068000       0.8146000 
1 1 1 19 19 34 o 32.23000 0.3350000 31.88000 0.4019000 32.58000 0.5360000 -0.6975000     0.6699000 
1 1 1 19 19 36 o 30.62000 0.3502000 30.92000 0.4521000 30.32000 0.5350000 0.6006000      0.7005000 
1 1 1 19 19 38 o 21.81000 0.4199000 21.72000 0.5282000 21.91000 0.6528000 -0.1908000     0.8397000 
1 1 1 19 19 40 o 7.821000 0.6461000 7.396000 0.9523000 8.247000 0.8734000 -0.8517000     1.292000  
1 1 1 19 19 42 o 18.94000 0.4014000 19.28000 0.5694000 18.60000 0.5660000 0.6789000      0.8029000 
1 1 1 19 19 44 o 8.916000 0.5586000 9.347000 0.7505000 8.485000 0.8276000 0.8622000      1.117000  
1 1 1 19 19 46 o 3.247000 0.9089000 2.933000 1.246000  3.561000 1.323000  -0.6285000     1.818000  
1 1 1 19 19 48 o 16.38000 0.3626000 16.29000 0.5349000 16.46000 0.4897000 -0.1679000     0.7252000 
1 1 1 19 19 50 o 3.792000 1.018000  3.359000 1.423000  4.225000 1.456000  -0.8655000     2.036000  
1 1 1 19 19 52 o 4.564000 1.127000  4.754000 1.615000  4.374000 1.571000  0.3798000      2.253000  
1 1 1 19 19 54 o 3.448000 1.014000  3.902000 1.568000  2.994000 1.286000  0.9086000      2.028000  
1 1 1 19 19 56 o 15.96000 0.4076000 15.94000 0.5967000 15.97000 0.5555000 -0.3315000E-01 0.8152000 
1 1 1 19 19 58 o 9.935000 0.5836000 10.68000 0.8694000 9.189000 0.7787000 1.493000       1.167000  
1 1 1 19 20 1  o 28.54000 0.2893000 28.25000 0.3631000 28.83000 0.4504000 -0.5784000     0.5785000 
1 1 1 19 20 3  o 26.31000 0.2509000 25.79000 0.3513000 26.83000 0.3584000 -1.041000      0.5019000 
1 1 1 19 20 5  o 42.67000 0.3279000 42.48000 0.4619000 42.87000 0.4656000 -0.3883000     0.6558000 
1 1 1 19 20 7  o 10.97000 0.3620000 11.05000 0.3754000 10.89000 0.6191000 0.1615000      0.7240000 
1 1 1 19 20 9  o 9.491000 0.5014000 9.371000 0.7506000 9.612000 0.6651000 -0.2410000     1.003000  
1 1 1 19 20 11 o 5.782000 0.8502000 5.649000 1.289000  5.915000 1.109000  -0.2654000     1.700000  
1 1 1 19 20 13 o 18.69000 0.4113000 18.42000 0.5243000 18.96000 0.6339000 -0.5410000     0.8227000 
1 1 1 19 20 15 o 14.86000 0.4716000 13.97000 0.6277000 15.76000 0.7040000 -1.791000      0.9432000 
1 1 1 19 20 17 o 30.46000 0.3849000 30.34000 0.6004000 30.59000 0.4817000 -0.2422000     0.7698000 
1 1 1 19 20 19 o 10.25000 0.4875000 10.66000 0.4088000 9.838000 0.8853000 0.8207000      0.9751000 
1 1 1 19 20 21 o 20.34000 0.3061000 20.13000 0.3638000 20.55000 0.4924000 -0.4181000     0.6122000 
1 1 1 19 20 23 o 55.11000 0.4862000 55.07000 0.5120000 55.14000 0.8267000 -0.6540000E-01 0.9724000 
1 1 1 19 20 25 o 10.93000 0.4325000 11.32000 0.4637000 10.53000 0.7302000 0.7822000      0.8650000 
1 1 1 19 20 27 o 10.98000 0.4548000 11.25000 0.4743000 10.72000 0.7761000 0.5318000      0.9095000 
1 1 1 19 20 29 o 16.09000 0.3862000 15.95000 0.5264000 16.22000 0.5653000 -0.2697000     0.7724000 
1 1 1 19 20 31 o 20.03000 0.3442000 19.31000 0.4177000 20.75000 0.5472000 -1.438000      0.6884000 
1 1 1 19 20 33 o 15.25000 0.3821000 14.88000 0.4467000 15.62000 0.6200000 -0.7341000     0.7641000 
1 1 1 19 20 35 o 22.53000 0.3911000 22.04000 0.5735000 23.02000 0.5320000 -0.9788000     0.7822000 
1 1 1 19 20 37 o 23.38000 0.3474000 23.56000 0.4992000 23.20000 0.4832000 0.3609000      0.6948000 
1 1 1 19 20 39 o 11.60000 0.5574000 11.44000 0.6578000 11.76000 0.9001000 -0.3196000     1.115000  
1 1 1 19 20 41 o 11.44000 0.5716000 11.19000 0.6379000 11.69000 0.9486000 -0.5019000     1.143000  
1 1 1 19 20 43 o 16.36000 0.4702000 16.60000 0.7724000 16.13000 0.5364000 0.4682000      0.9404000 
1 1 1 19 20 45 f 5.828000 0.8202000 5.217000 1.307000  6.439000 0.9913000 -1.222000      1.640000  
1 1 1 19 20 47 o 5.975000 0.8492000 5.506000 1.237000  6.443000 1.164000  -0.9374000     1.698000  
1 1 1 19 20 49 f 6.667000 0.7727000 7.415000 1.095000  5.919000 1.091000  1.496000       1.545000  
1 1 1 19 20 51 o 4.270000 1.057000  4.173000 1.486000  4.368000 1.503000  -0.1949000     2.113000  
1 1 1 19 20 53 o 5.386000 1.026000  5.511000 1.541000  5.261000 1.354000  0.2494000      2.051000  
1 1 1 19 20 55 o 7.860000 0.8758000 8.495000 1.326000  7.226000 1.144000  1.269000       1.752000  
1 1 1 19 20 57 o 2.919000 0.9038000 3.129000 1.365000  2.708000 1.185000  0.4205000      1.808000  
1 1 1 19 21 0  o 52.18000 0.5411000 52.18000 0.5411000 52.18000 0.5411000 0.000000       0.000000  
1 1 1 19 21 2  o 18.89000 0.2389000 19.55000 0.3392000 18.22000 0.3364000 1.334000       0.4777000 
1 1 1 19 21 4  o 35.14000 0.3125000 34.43000 0.4711000 35.85000 0.4107000 -1.418000      0.6250000 
1 1 1 19 21 6  o 23.43000 0.2400000 23.32000 0.3379000 23.54000 0.3409000 -0.2161000     0.4800000 
1 1 1 19 21 8  o 15.51000 0.4548000 16.17000 0.5313000 14.85000 0.7382000 1.318000       0.9095000 
1 1 1 19 21 10 o 16.68000 0.3535000 16.64000 0.5213000 16.73000 0.4775000 -0.8921000E-01 0.7069000 
1 1 1 19 21 12 o 41.43000 0.3880000 41.28000 0.5466000 41.58000 0.5508000 -0.2971000     0.7760000 
1 1 1 19 21 14 o 54.32000 0.4711000 53.68000 0.6606000 54.97000 0.6718000 -1.288000      0.9422000 
1 1 1 19 21 16 o 45.70000 0.5078000 45.56000 0.7167000 45.84000 0.7195000 -0.2827000     1.016000  
1 1 1 19 21 18 o 35.78000 0.4158000 35.94000 0.6520000 35.62000 0.5163000 0.3181000      0.8317000 
1 1 1 19 21 20 o 53.24000 0.4134000 53.18000 0.4948000 53.29000 0.6623000 -0.1070000     0.8267000 
1 1 1 19 21 22 o 21.95000 0.3295000 22.58000 0.3335000 21.32000 0.5684000 1.263000       0.6590000 
1 1 1 19 21 24 o 18.08000 0.3089000 18.28000 0.3305000 17.89000 0.5221000 0.3936000      0.6179000 
1 1 1 19 21 26 o 4.157000 0.9379000 3.618000 1.144000  4.695000 1.487000  -1.077000      1.876000  
1 1 1 19 21 28 o 12.49000 0.5055000 12.84000 0.4359000 12.13000 0.9122000 0.7059000      1.011000  
1 1 1 19 21 30 o 21.95000 0.3515000 21.38000 0.4579000 22.52000 0.5335000 -1.138000      0.7031000 
1 1 1 19 21 32 f 21.01000 0.3343000 20.92000 0.3947000 21.09000 0.5397000 -0.1620000     0.6686000 
1 1 1 19 21 34 o 16.42000 0.3729000 15.91000 0.4551000 16.93000 0.5908000 -1.021000      0.7457000 
1 1 1 19 21 36 o 25.41000 0.3297000 25.14000 0.3953000 25.69000 0.5279000 -0.5490000     0.6595000 
1 1 1 19 21 38 o 8.298000 0.6593000 7.688000 0.9520000 8.907000 0.9122000 -1.219000      1.319000  
1 1 1 19 21 40 o 15.21000 0.5120000 14.38000 0.6271000 16.04000 0.8094000 -1.657000      1.024000  
1 1 1 19 21 42 o 9.162000 0.5460000 8.472000 0.8010000 9.853000 0.7422000 -1.381000      1.092000  
1 1 1 19 21 44 o 9.608000 0.5283000 9.157000 0.7761000 10.06000 0.7170000 -0.9025000     1.057000  
1 1 1 19 21 46 o 11.81000 0.4633000 12.27000 0.6739000 11.35000 0.6360000 0.9163000      0.9266000 
1 1 1 19 21 48 o 3.934000 0.9630000 3.896000 1.406000  3.972000 1.317000  -0.7577000E-01 1.926000  
1 1 1 19 21 50 o 11.71000 0.5006000 11.49000 0.7858000 11.93000 0.6203000 -0.4432000     1.001000  
1 1 1 19 21 52 o 6.590000 0.8737000 6.631000 1.284000  6.550000 1.186000  0.8080000E-01  1.747000  
1 1 1 19 21 54 o 6.634000 0.8337000 7.162000 1.170000  6.106000 1.188000  1.056000       1.667000  
1 1 1 19 21 56 o 4.466000 1.016000  4.198000 1.484000  4.733000 1.388000  -0.5352000     2.032000  
1 1 1 19 21 58 o 6.095000 0.9747000 6.352000 1.390000  5.838000 1.367000  0.5138000      1.949000  
1 1 1 19 22 1  o 12.59000 0.3082000 12.22000 0.3881000 12.96000 0.4789000 -0.7364000     0.6164000 
1 1 1 19 22 3  o 17.86000 0.2392000 17.72000 0.3361000 17.99000 0.3406000 -0.2753000     0.4785000 
1 1 1 19 22 5  o 5.004000 0.5317000 4.759000 0.7587000 5.250000 0.7451000 -0.4910000     1.063000  
1 1 1 19 22 7  o 30.80000 0.3984000 30.24000 0.4776000 31.35000 0.6378000 -1.114000      0.7968000 
1 1 1 19 22 9  o 15.76000 0.4532000 15.61000 0.5583000 15.92000 0.7140000 -0.3104000     0.9063000 
1 1 1 19 22 11 o 5.733000 0.8337000 6.327000 1.150000  5.140000 1.208000  1.187000       1.667000  
1 1 1 19 22 13 o 40.88000 0.4694000 41.36000 0.6743000 40.41000 0.6533000 0.9441000      0.9389000 
1 1 1 19 22 15 o 43.84000 0.6208000 43.78000 0.6989000 43.90000 1.026000  -0.1202000     1.242000  
1 1 1 19 22 17 o 25.63000 0.3465000 25.41000 0.4928000 25.84000 0.4873000 -0.4335000     0.6931000 
1 1 1 19 22 19 f 28.85000 0.3460000 28.18000 0.4850000 29.53000 0.4936000 -1.353000      0.6920000 
1 1 1 19 22 21 o 10.33000 0.6461000 10.86000 0.9341000 9.797000 0.8930000 1.058000       1.292000  
1 1 1 19 22 23 o 29.00000 0.2991000 28.90000 0.3369000 29.09000 0.4943000 -0.1946000     0.5982000 
1 1 1 19 22 25 o 31.93000 0.3147000 31.87000 0.3648000 32.00000 0.5129000 -0.1355000     0.6294000 
1 1 1 19 22 27 o 28.59000 0.3122000 28.27000 0.3553000 28.92000 0.5134000 -0.6444000     0.6244000 
1 1 1 19 22 29 o 19.94000 0.3451000 19.47000 0.3846000 20.41000 0.5732000 -0.9355000     0.6902000 
1 1 1 19 22 31 f 13.51000 0.5733000 13.16000 0.9313000 13.86000 0.6688000 -0.6966000     1.147000  
1 1 1 19 22 33 o 9.335000 0.5588000 9.161000 0.6986000 9.509000 0.8724000 -0.3481000     1.118000  
1 1 1 19 22 35 o 37.48000 0.3501000 37.88000 0.4229000 37.08000 0.5579000 0.7968000      0.7001000 
1 1 1 19 22 37 o 13.07000 0.4233000 12.81000 0.5545000 13.33000 0.6398000 -0.5208000     0.8466000 
1 1 1 19 22 39 o 3.944000 0.9454000 4.653000 1.353000  3.235000 1.321000  1.418000       1.891000  
1 1 1 19 22 41 o 11.48000 0.5238000 10.85000 0.7958000 12.12000 0.6813000 -1.269000      1.048000  
1 1 1 19 22 43 o 5.839000 1.136000  5.901000 1.109000  5.778000 1.984000  0.1238000      2.273000  
1 1 1 19 22 45 o 9.959000 0.5573000 10.84000 0.7692000 9.082000 0.8068000 1.755000       1.115000  
1 1 1 19 22 47 o 5.229000 0.9020000 4.867000 1.404000  5.591000 1.133000  -0.7233000     1.804000  
1 1 1 19 22 49 o 10.19000 0.5186000 9.938000 0.7521000 10.44000 0.7142000 -0.4973000     1.037000  
1 1 1 19 22 51 o 8.889000 0.6890000 8.161000 0.9995000 9.618000 0.9485000 -1.457000      1.378000  
1 1 1 19 22 53 o 3.176000 0.9490000 3.265000 1.413000  3.086000 1.267000  0.1789000      1.898000  
1 1 1 19 22 55 o 5.572000 0.9733000 4.800000 1.462000  6.344000 1.285000  -1.544000      1.947000  
1 1 1 19 22 57 o 5.682000 0.8538000 7.314000 1.151000  4.049000 1.261000  3.265000       1.708000  
1 1 1 19 23 0  o 13.58000 0.3743000 13.58000 0.3743000 13.58000 0.3743000 0.000000       0.000000  
1 1 1 19 23 2  o 23.79000 0.2431000 23.80000 0.3450000 23.79000 0.3426000 0.9569000E-02  0.4862000 
1 1 1 19 23 4  o 15.22000 0.2616000 15.43000 0.3927000 15.00000 0.3457000 0.4309000      0.5232000 
1 1 1 19 23 6  o 52.82000 0.5208000 52.38000 0.6425000 53.27000 0.8198000 -0.8951000     1.042000  
1 1 1 19 23 8  o 38.83000 0.3753000 38.51000 0.5303000 39.16000 0.5313000 -0.6442000     0.7506000 
1 1 1 19 23 10 o 42.14000 0.3936000 42.74000 0.5628000 41.54000 0.5504000 1.206000       0.7872000 
1 1 1 19 23 12 o 18.42000 0.4215000 18.45000 0.6241000 18.38000 0.5666000 0.6117000E-01  0.8429000 
1 1 1 19 23 14 o 14.99000 0.4338000 15.18000 0.6993000 14.79000 0.5135000 0.3830000      0.8676000 
1 1 1 19 23 16 o 5.075000 0.9764000 4.503000 1.490000  5.648000 1.263000  -1.145000      1.953000  
1 1 1 19 23 18 o 12.93000 0.5085000 12.91000 0.8009000 12.96000 0.6269000 -0.5130000E-01 1.017000  
1 1 1 19 23 20 o 29.08000 0.5891000 29.42000 0.8627000 28.73000 0.8025000 0.6912000      1.178000  
1 1 1 19 23 22 o 29.14000 0.3539000 29.01000 0.5076000 29.27000 0.4934000 -0.2612000     0.7079000 
1 1 1 19 23 24 o 27.21000 0.2990000 27.12000 0.3341000 27.31000 0.4959000 -0.1899000     0.5979000 
1 1 1 19 23 26 o 41.51000 0.3565000 41.36000 0.4200000 41.66000 0.5761000 -0.3015000     0.7129000 
1 1 1 19 23 28 o 17.47000 0.4115000 16.60000 0.3906000 18.33000 0.7244000 -1.732000      0.8230000 
1 1 1 19 23 30 o 22.57000 0.3745000 22.72000 0.5216000 22.42000 0.5376000 0.3030000      0.7491000 
1 1 1 19 23 32 o 17.08000 0.3823000 17.29000 0.4949000 16.87000 0.5827000 0.4248000      0.7645000 
1 1 1 19 23 34 o 12.84000 0.4505000 12.52000 0.5216000 13.15000 0.7345000 -0.6315000     0.9009000 
1 1 1 19 23 36 o 17.19000 0.4261000 17.70000 0.4634000 16.69000 0.7151000 1.014000       0.8521000 
1 1 1 19 23 38 o 6.173000 0.7977000 6.280000 1.105000  6.065000 1.151000  0.2150000      1.595000  
1 1 1 19 23 40 o 11.97000 0.4946000 12.46000 0.5980000 11.48000 0.7878000 0.9800000      0.9891000 
1 1 1 19 23 42 o 6.032000 1.101000  6.949000 1.786000  5.115000 1.287000  1.834000       2.201000  
1 1 1 19 23 44 o 7.610000 0.7197000 7.243000 1.131000  7.978000 0.8907000 -0.7352000     1.439000  
1 1 1 19 23 46 o 9.560000 0.5553000 9.364000 0.8030000 9.757000 0.7671000 -0.3933000     1.111000  
1 1 1 19 23 48 o 7.449000 0.6906000 7.840000 0.9517000 7.058000 1.001000  0.7819000      1.381000  
1 1 1 19 23 50 o 6.210000 0.8944000 7.638000 1.214000  4.782000 1.314000  2.856000       1.789000  
1 1 1 19 23 52 o 12.01000 0.6408000 11.63000 0.8612000 12.39000 0.9492000 -0.7626000     1.282000  
1 1 1 19 23 54 o 4.229000 1.080000  4.365000 1.615000  4.094000 1.435000  0.2712000      2.160000  
1 1 1 19 23 56 o 3.378000 0.9749000 3.183000 1.419000  3.572000 1.337000  -0.3890000     1.950000  
1 1 1 19 24 1  o 42.66000 0.3617000 42.10000 0.4644000 43.22000 0.5548000 -1.125000      0.7235000 
1 1 1 19 24 3  o 34.47000 0.2869000 34.48000 0.4072000 34.46000 0.4042000 0.2687000E-01  0.5737000 
1 1 1 19 24 5  o 29.58000 0.3552000 29.88000 0.6063000 29.27000 0.3702000 0.6045000      0.7103000 
1 1 1 19 24 7  o 16.32000 0.3878000 16.12000 0.5258000 16.52000 0.5702000 -0.3992000     0.7756000 
1 1 1 19 24 9  o 59.25000 0.6139000 58.37000 0.8578000 60.12000 0.8785000 -1.745000      1.228000  
1 1 1 19 24 11 o 37.21000 0.4472000 36.66000 0.6346000 37.75000 0.6303000 -1.098000      0.8944000 
1 1 1 19 24 13 o 21.99000 0.3490000 21.27000 0.5070000 22.72000 0.4799000 -1.447000      0.6981000 
1 1 1 19 24 15 o 24.08000 0.3944000 23.64000 0.4823000 24.52000 0.6241000 -0.8755000     0.7888000 
1 1 1 19 24 17 f 7.919000 0.7581000 8.550000 1.136000  7.288000 1.004000  1.262000       1.516000  
1 1 1 19 24 19 o 14.96000 0.4963000 14.38000 0.7461000 15.55000 0.6546000 -1.169000      0.9926000 
1 1 1 19 24 21 o 25.97000 0.3562000 26.19000 0.5179000 25.75000 0.4892000 0.4360000      0.7124000 
1 1 1 19 24 23 o 10.68000 0.5582000 10.80000 0.8504000 10.56000 0.7234000 0.2405000      1.116000  
1 1 1 19 24 25 o 13.50000 0.3794000 13.61000 0.3735000 13.40000 0.6606000 0.2115000      0.7589000 
1 1 1 19 24 27 o 5.808000 0.7930000 4.892000 1.049000  6.725000 1.189000  -1.833000      1.586000  
1 1 1 19 24 29 o 6.836000 0.8177000 7.602000 0.8932000 6.069000 1.370000  1.533000       1.635000  
1 1 1 19 24 31 o 13.32000 0.4212000 13.92000 0.4800000 12.72000 0.6922000 1.203000       0.8424000 
1 1 1 19 24 33 o 9.921000 0.5347000 9.758000 0.5902000 10.09000 0.8917000 -0.3275000     1.069000  
1 1 1 19 24 35 o 21.04000 0.3381000 21.04000 0.4190000 21.05000 0.5309000 -0.9680000E-02 0.6763000 
1 1 1 19 24 37 o 20.45000 0.3348000 20.07000 0.3856000 20.83000 0.5475000 -0.7621000     0.6696000 
1 1 1 19 24 39 o 5.727000 0.8847000 6.684000 1.002000  4.769000 1.459000  1.915000       1.769000  
1 1 1 19 24 41 o 8.204000 0.6228000 7.545000 0.9966000 8.863000 0.7472000 -1.318000      1.246000  
1 1 1 19 24 43 o 4.948000 0.9214000 4.555000 1.396000  5.342000 1.202000  -0.7866000     1.843000  
1 1 1 19 24 45 o 3.131000 0.9449000 3.242000 1.380000  3.020000 1.291000  0.2217000      1.890000  
1 1 1 19 24 47 o 7.513000 0.8323000 7.245000 1.041000  7.781000 1.299000  -0.5364000     1.665000  
1 1 1 19 24 49 o 3.268000 0.9775000 3.206000 1.381000  3.331000 1.384000  -0.1248000     1.955000  
1 1 1 19 24 51 o 3.840000 1.022000  4.274000 1.462000  3.405000 1.428000  0.8689000      2.043000  
1 1 1 19 24 53 o 5.279000 1.030000  5.208000 1.464000  5.350000 1.450000  -0.1421000     2.061000  
1 1 1 19 24 55 o 7.589000 0.7598000 7.476000 1.227000  7.702000 0.8970000 -0.2254000     1.520000  
1 1 1 19 25 0  o 49.75000 0.5997000 49.75000 0.5997000 49.75000 0.5997000 0.000000       0.000000  
1 1 1 19 25 2  o 21.53000 0.2683000 21.35000 0.3804000 21.71000 0.3784000 -0.3612000     0.5366000 
1 1 1 19 25 4  o 45.55000 0.5665000 44.65000 1.025000  46.44000 0.4825000 -1.785000      1.133000  
1 1 1 19 25 6  f 32.54000 0.4805000 32.11000 0.5927000 32.98000 0.7565000 -0.8632000     0.9610000 
1 1 1 19 25 8  o 14.87000 0.4247000 15.65000 0.6753000 14.10000 0.5153000 1.546000       0.8495000 
1 1 1 19 25 10 o 18.88000 0.3522000 19.24000 0.4979000 18.53000 0.4983000 0.7133000      0.7044000 
1 1 1 19 25 12 o 69.96000 0.5841000 69.64000 0.8204000 70.29000 0.8317000 -0.6473000     1.168000  
1 1 1 19 25 14 o 40.07000 0.4475000 40.47000 0.5580000 39.67000 0.6997000 0.8020000      0.8949000 
1 1 1 19 25 16 f 8.269000 0.7242000 8.032000 1.157000  8.505000 0.8712000 -0.4724000     1.448000  
1 1 1 19 25 18 o 21.32000 0.4358000 20.48000 0.6458000 22.15000 0.5852000 -1.669000      0.8715000 
1 1 1 19 25 20 o 36.56000 0.3831000 36.84000 0.5525000 36.28000 0.5309000 0.5572000      0.7662000 
1 1 1 19 25 22 o 25.89000 0.3609000 25.89000 0.5191000 25.89000 0.5017000 -0.7273000E-02 0.7219000 
1 1 1 19 25 24 o 13.15000 0.5005000 12.08000 0.7565000 14.22000 0.6553000 -2.139000      1.001000  
1 1 1 19 25 26 o 55.49000 0.4915000 55.81000 0.6958000 55.18000 0.6944000 0.6285000      0.9830000 
1 1 1 19 25 28 o 3.919000 0.9487000 3.948000 1.174000  3.890000 1.491000  0.5741000E-01  1.897000  
1 1 1 19 25 30 o 4.719000 0.9622000 3.992000 1.320000  5.446000 1.401000  -1.454000      1.924000  
1 1 1 19 25 32 o 7.936000 0.6281000 7.178000 0.7673000 8.694000 0.9945000 -1.516000      1.256000  
1 1 1 19 25 34 o 15.50000 0.3879000 15.38000 0.4811000 15.62000 0.6086000 -0.2444000     0.7758000 
1 1 1 19 25 36 o 19.78000 0.3325000 19.44000 0.3921000 20.13000 0.5371000 -0.6860000     0.6650000 
1 1 1 19 25 38 o 10.23000 0.5340000 10.22000 0.7447000 10.25000 0.7656000 -0.3824000E-01 1.068000  
1 1 1 19 25 40 o 3.407000 0.9318000 3.510000 1.332000  3.304000 1.303000  0.2064000      1.864000  
1 1 1 19 25 42 o 8.503000 0.6236000 8.050000 0.9842000 8.956000 0.7659000 -0.9069000     1.247000  
1 1 1 19 25 44 o 4.887000 0.9331000 5.278000 1.259000  4.496000 1.378000  0.7818000      1.866000  
1 1 1 19 25 46 o 13.91000 0.4250000 13.23000 0.6038000 14.58000 0.5983000 -1.348000      0.8500000 
1 1 1 19 25 48 o 12.87000 0.4694000 13.47000 0.6297000 12.27000 0.6962000 1.204000       0.9387000 
1 1 1 19 25 50 o 5.176000 0.9624000 6.656000 1.174000  3.696000 1.525000  2.959000       1.925000  
1 1 1 19 25 52 o 3.668000 1.025000  4.029000 1.541000  3.308000 1.353000  0.7213000      2.051000  
1 1 1 19 25 54 o 3.581000 0.9545000 2.946000 1.321000  4.215000 1.378000  -1.269000      1.909000  
1 1 1 19 25 56 o 4.857000 0.9751000 3.909000 1.522000  5.805000 1.220000  -1.897000      1.950000  
1 1 1 19 26 1  o 14.77000 0.3251000 15.24000 0.3951000 14.30000 0.5164000 0.9367000      0.6502000 
1 1 1 19 26 3  f 21.83000 0.2981000 21.91000 0.5216000 21.74000 0.2889000 0.1753000      0.5962000 
1 1 1 19 26 5  o 19.25000 0.3971000 18.61000 0.6410000 19.90000 0.4689000 -1.294000      0.7941000 
1 1 1 19 26 7  o 31.84000 0.3510000 31.49000 0.4927000 32.19000 0.5001000 -0.6976000     0.7020000 
1 1 1 19 26 9  o 4.642000 0.9821000 4.360000 1.414000  4.924000 1.363000  -0.5643000     1.964000  
1 1 1 19 26 11 o 29.75000 0.3447000 30.26000 0.4864000 29.23000 0.4885000 1.035000       0.6894000 
1 1 1 19 26 13 o 47.31000 0.4806000 47.28000 0.7396000 47.35000 0.6141000 -0.6487000E-01 0.9613000 
1 1 1 19 26 15 o 25.23000 0.4144000 25.79000 0.5825000 24.67000 0.5895000 1.114000       0.8288000 
1 1 1 19 26 17 o 19.97000 0.4548000 20.12000 0.6821000 19.82000 0.6018000 0.2944000      0.9096000 
1 1 1 19 26 19 o 36.24000 0.3774000 36.04000 0.5328000 36.43000 0.5347000 -0.3945000     0.7549000 
1 1 1 19 26 21 o 25.33000 0.3661000 24.92000 0.5262000 25.74000 0.5092000 -0.8177000     0.7322000 
1 1 1 19 26 23 o 46.45000 0.4352000 47.25000 0.6225000 45.64000 0.6085000 1.609000       0.8705000 
1 1 1 19 26 25 o 48.30000 0.4473000 48.57000 0.6318000 48.02000 0.6334000 0.5492000      0.8946000 
1 1 1 19 26 27 o 25.10000 0.3643000 24.66000 0.3384000 25.55000 0.6453000 -0.8847000     0.7287000 
1 1 1 19 26 29 o 20.05000 0.3243000 19.65000 0.3531000 20.45000 0.5441000 -0.8010000     0.6487000 
1 1 1 19 26 31 f 12.60000 0.4376000 11.87000 0.5779000 13.34000 0.6572000 -1.475000      0.8752000 
1 1 1 19 26 33 o 7.654000 0.6388000 7.304000 0.7535000 8.004000 1.032000  -0.6998000     1.278000  
1 1 1 19 26 35 o 19.05000 0.3776000 19.01000 0.3946000 19.09000 0.6440000 -0.7067000E-01 0.7553000 
1 1 1 19 26 37 o 28.85000 0.3681000 28.32000 0.3861000 29.39000 0.6267000 -1.076000      0.7361000 
1 1 1 19 26 39 o 16.02000 0.3964000 15.90000 0.4900000 16.14000 0.6232000 -0.2412000     0.7927000 
1 1 1 19 26 41 o 11.97000 0.4357000 12.06000 0.5999000 11.88000 0.6320000 0.1818000      0.8714000 
1 1 1 19 26 43 o 10.77000 0.5264000 10.52000 0.8305000 11.01000 0.6472000 -0.4805000     1.053000  
1 1 1 19 26 45 o 13.20000 0.4393000 13.12000 0.6235000 13.29000 0.6190000 -0.1664000     0.8786000 
1 1 1 19 26 47 o 6.751000 0.8555000 7.139000 1.116000  6.364000 1.297000  0.7749000      1.711000  
1 1 1 19 26 49 o 3.046000 0.9475000 2.997000 1.324000  3.095000 1.355000  -0.9782000E-01 1.895000  
1 1 1 19 26 51 o 4.534000 1.030000  3.387000 1.454000  5.680000 1.459000  -2.293000      2.060000  
1 1 1 19 26 53 o 4.401000 1.051000  4.799000 1.541000  4.003000 1.429000  0.7966000      2.101000  
1 1 1 19 26 55 o 6.887000 0.9811000 7.355000 1.526000  6.418000 1.233000  0.9369000      1.962000  
1 1 1 19 27 0  o 50.65000 0.6272000 50.65000 0.6272000 50.65000 0.6272000 0.000000       0.000000  
1 1 1 19 27 2  o 31.75000 0.2922000 31.61000 0.4746000 31.89000 0.3410000 -0.2825000     0.5845000 
1 1 1 19 27 4  o 5.322000 0.8368000 5.011000 1.588000  5.633000 0.5286000 -0.6224000     1.674000  
1 1 1 19 27 6  o 20.30000 0.3455000 20.02000 0.4991000 20.59000 0.4780000 -0.5730000     0.6911000 
1 1 1 19 27 8  o 18.95000 0.3469000 18.88000 0.4952000 19.03000 0.4860000 -0.1522000     0.6938000 
1 1 1 19 27 10 o 33.77000 0.3972000 33.74000 0.6036000 33.80000 0.5163000 -0.6897000E-01 0.7944000 
1 1 1 19 27 12 o 40.76000 0.4734000 41.24000 0.6690000 40.27000 0.6698000 0.9682000      0.9467000 
1 1 1 19 27 14 o 26.73000 0.5009000 26.05000 0.4964000 27.41000 0.8702000 -1.360000      1.002000  
1 1 1 19 27 16 o 16.54000 0.4040000 16.40000 0.5907000 16.67000 0.5515000 -0.2653000     0.8081000 
1 1 1 19 27 18 o 25.28000 0.3596000 25.31000 0.5153000 25.25000 0.5017000 0.6726000E-01  0.7192000 
1 1 1 19 27 20 o 21.86000 0.3677000 21.98000 0.5384000 21.74000 0.5008000 0.2459000      0.7353000 
1 1 1 19 27 22 o 26.32000 0.3681000 26.07000 0.5397000 26.57000 0.5008000 -0.5071000     0.7362000 
1 1 1 19 27 24 o 21.42000 0.3732000 20.92000 0.5313000 21.92000 0.5242000 -1.006000      0.7464000 
1 1 1 19 27 26 o 6.810000 0.8992000 6.735000 1.319000  6.885000 1.222000  -0.1497000     1.798000  
1 1 1 19 27 28 o 23.30000 0.3276000 22.51000 0.4085000 24.10000 0.5122000 -1.589000      0.6552000 
1 1 1 19 27 30 o 14.88000 0.3632000 15.09000 0.4005000 14.67000 0.6060000 0.4151000      0.7264000 
1 1 1 19 27 32 o 18.75000 0.4101000 19.05000 0.4314000 18.46000 0.6975000 0.5940000      0.8202000 
1 1 1 19 27 34 o 6.648000 0.7215000 5.671000 1.043000  7.625000 0.9968000 -1.954000      1.443000  
1 1 1 19 27 36 o 14.23000 0.3868000 14.12000 0.4616000 14.33000 0.6209000 -0.2099000     0.7737000 
1 1 1 19 27 38 o 16.94000 0.3512000 17.13000 0.4709000 16.76000 0.5213000 0.3695000      0.7025000 
1 1 1 19 27 40 o 6.420000 0.7527000 5.580000 1.168000  7.259000 0.9496000 -1.679000      1.505000  
1 1 1 19 27 42 o 9.741000 0.5057000 9.792000 0.7185000 9.690000 0.7119000 0.1020000      1.011000  
1 1 1 19 27 44 o 2.685000 0.8618000 2.977000 1.323000  2.393000 1.105000  0.5835000      1.724000  
1 1 1 19 27 46 o 3.761000 0.9264000 2.415000 1.115000  5.107000 1.480000  -2.692000      1.853000  
1 1 1 19 27 48 o 12.42000 0.5077000 12.44000 0.7063000 12.39000 0.7294000 0.4231000E-01  1.015000  
1 1 1 19 27 50 o 11.11000 0.5241000 11.56000 0.7286000 10.66000 0.7536000 0.9040000      1.048000  
1 1 1 19 27 52 o 9.184000 0.8000000 9.160000 0.9462000 9.208000 1.290000  -0.4743000E-01 1.600000  
1 1 1 19 27 54 o 5.203000 0.9744000 4.408000 1.530000  5.998000 1.207000  -1.590000      1.949000  
1 1 1 19 28 1  o 7.599000 0.4942000 8.310000 0.7850000 6.888000 0.6006000 1.421000       0.9884000 
1 1 1 19 28 3  o 35.87000 0.3303000 35.70000 0.5060000 36.05000 0.4247000 -0.3477000     0.6606000 
1 1 1 19 28 5  f 27.93000 0.3403000 26.94000 0.4816000 28.92000 0.4808000 -1.981000      0.6805000 
1 1 1 19 28 7  o 25.79000 0.3704000 26.05000 0.5512000 25.53000 0.4950000 0.5178000      0.7408000 
1 1 1 19 28 9  o 41.71000 0.4788000 42.49000 0.6810000 40.92000 0.6733000 1.570000       0.9576000 
1 1 1 19 28 11 o 15.50000 0.4377000 15.66000 0.5915000 15.34000 0.6453000 0.3138000      0.8754000 
1 1 1 19 28 13 o 10.12000 0.5997000 9.850000 0.8065000 10.38000 0.8878000 -0.5309000     1.199000  
1 1 1 19 28 15 o 18.13000 0.3858000 17.99000 0.5467000 18.27000 0.5445000 -0.2796000     0.7716000 
1 1 1 19 28 17 o 11.89000 0.5874000 11.84000 0.9457000 11.94000 0.6968000 -0.9933000E-01 1.175000  
1 1 1 19 28 19 o 10.20000 0.5822000 10.37000 0.8448000 10.02000 0.8014000 0.3519000      1.164000  
1 1 1 19 28 21 o 17.99000 0.4017000 17.78000 0.5871000 18.20000 0.5486000 -0.4175000     0.8035000 
1 1 1 19 28 23 o 11.21000 0.5799000 10.99000 0.8602000 11.42000 0.7780000 -0.4348000     1.160000  
1 1 1 19 28 25 o 18.21000 0.4056000 17.93000 0.5706000 18.49000 0.5766000 -0.5621000     0.8112000 
1 1 1 19 28 27 o 3.417000 0.9783000 4.145000 1.486000  2.689000 1.274000  1.456000       1.957000  
1 1 1 19 28 29 o 14.52000 0.4591000 13.60000 0.4915000 15.44000 0.7755000 -1.834000      0.9181000 
1 1 1 19 28 31 o 13.87000 0.5881000 13.36000 0.4232000 14.39000 1.097000  -1.030000      1.176000  
1 1 1 19 28 33 o 6.883000 0.7629000 6.643000 1.137000  7.124000 1.018000  -0.4808000     1.526000  
1 1 1 19 28 35 o 5.621000 0.8556000 4.923000 1.270000  6.318000 1.147000  -1.395000      1.711000  
1 1 1 19 28 37 o 3.842000 0.9171000 4.277000 1.152000  3.408000 1.427000  0.8695000      1.834000  
1 1 1 19 28 39 o 7.354000 0.6342000 6.920000 0.9071000 7.788000 0.8866000 -0.8678000     1.268000  
1 1 1 19 28 41 o 10.60000 0.5006000 10.34000 0.7451000 10.86000 0.6687000 -0.5220000     1.001000  
1 1 1 19 28 43 o 4.522000 0.9227000 4.288000 1.340000  4.756000 1.269000  -0.4683000     1.845000  
1 1 1 19 28 45 o 11.20000 0.5769000 11.70000 0.7806000 10.69000 0.8496000 1.010000       1.154000  
1 1 1 19 28 47 o 6.133000 0.8967000 6.629000 1.286000  5.638000 1.250000  0.9919000      1.793000  
1 1 1 19 28 49 o 6.036000 0.9412000 6.026000 1.270000  6.045000 1.389000  -0.1901000E-01 1.882000  
1 1 1 19 28 51 o 4.581000 0.9439000 3.159000 1.404000  6.003000 1.262000  -2.845000      1.888000  
1 1 1 19 28 53 o 2.951000 0.9030000 2.580000 1.222000  3.321000 1.330000  -0.7413000     1.806000  
1 1 1 19 29 0  o 9.791000 0.5214000 9.791000 0.5214000 9.791000 0.5214000 0.000000       0.000000  
1 1 1 19 29 2  o 40.23000 0.3579000 40.09000 0.5102000 40.36000 0.5019000 -0.2764000     0.7157000 
1 1 1 19 29 4  o 18.62000 0.5283000 18.48000 0.9120000 18.76000 0.5337000 -0.2791000     1.057000  
1 1 1 19 29 6  o 34.54000 0.4254000 35.22000 0.6048000 33.85000 0.5983000 1.368000       0.8507000 
1 1 1 19 29 8  o 18.78000 0.3925000 18.34000 0.5345000 19.21000 0.5749000 -0.8706000     0.7850000 
1 1 1 19 29 10 o 10.56000 0.5730000 10.84000 0.7465000 10.28000 0.8696000 0.5534000      1.146000  
1 1 1 19 29 12 o 35.98000 0.3777000 36.65000 0.5357000 35.32000 0.5327000 1.328000       0.7555000 
1 1 1 19 29 14 o 23.50000 0.4162000 23.96000 0.5115000 23.04000 0.6566000 0.9219000      0.8323000 
1 1 1 19 29 16 o 26.64000 0.3663000 26.67000 0.5203000 26.61000 0.5156000 0.5942000E-01  0.7325000 
1 1 1 19 29 18 f 26.29000 0.3643000 25.81000 0.5219000 26.78000 0.5083000 -0.9776000     0.7285000 
1 1 1 19 29 20 o 35.21000 0.3807000 35.01000 0.5384000 35.40000 0.5383000 -0.3857000     0.7613000 
1 1 1 19 29 22 o 17.65000 0.4168000 17.41000 0.5956000 17.89000 0.5833000 -0.4838000     0.8336000 
1 1 1 19 29 24 o 6.968000 0.8326000 7.239000 1.086000  6.697000 1.262000  0.5412000      1.665000  
1 1 1 19 29 26 o 16.30000 0.4870000 16.53000 0.6111000 16.07000 0.7584000 0.4657000      0.9740000 
1 1 1 19 29 28 o 15.79000 0.6052000 14.82000 0.6439000 16.77000 1.025000  -1.946000      1.210000  
1 1 1 19 29 30 o 5.123000 0.8378000 6.019000 0.7874000 4.227000 1.479000  1.792000       1.676000  
1 1 1 19 29 32 o 9.067000 0.4899000 8.307000 0.6114000 9.827000 0.7658000 -1.520000      0.9799000 
1 1 1 19 29 34 o 9.265000 0.5314000 9.453000 0.6514000 9.077000 0.8397000 0.3762000      1.063000  
1 1 1 19 29 36 o 3.546000 0.9665000 2.698000 1.159000  4.394000 1.547000  -1.695000      1.933000  
1 1 1 19 29 38 o 8.489000 0.6495000 8.612000 0.6284000 8.366000 1.137000  0.2457000      1.299000  
1 1 1 19 29 40 o 4.534000 0.9142000 4.420000 1.256000  4.648000 1.328000  -0.2285000     1.828000  
1 1 1 19 29 42 o 8.347000 0.5701000 8.749000 0.7665000 7.944000 0.8443000 0.8053000      1.140000  
1 1 1 19 29 44 o 7.838000 0.7232000 8.366000 0.8522000 7.311000 1.169000  1.055000       1.446000  
1 1 1 19 29 46 o 4.546000 0.9523000 4.954000 1.314000  4.137000 1.378000  0.8171000      1.905000  
1 1 1 19 29 48 o 2.919000 0.9237000 3.353000 1.449000  2.485000 1.146000  0.8677000      1.847000  
1 1 1 19 29 50 o 10.00000 0.6171000 9.136000 0.8784000 10.86000 0.8669000 -1.729000      1.234000  
1 1 1 19 29 52 o 10.24000 0.5904000 10.43000 0.8063000 10.05000 0.8626000 0.3847000      1.181000  
1 1 1 19 29 54 o 4.486000 1.141000  5.677000 1.715000  3.295000 1.504000  2.382000       2.281000  
1 1 1 19 30 1  o 19.78000 0.3164000 19.84000 0.5110000 19.72000 0.3731000 0.1146000      0.6327000 
1 1 1 19 30 3  o 29.24000 0.3381000 29.67000 0.4453000 28.82000 0.5088000 0.8485000      0.6761000 
1 1 1 19 30 5  o 12.28000 0.6262000 13.28000 0.4504000 11.28000 1.169000  2.005000       1.252000  
1 1 1 19 30 7  o 24.53000 0.3469000 24.17000 0.4907000 24.89000 0.4906000 -0.7230000     0.6939000 
1 1 1 19 30 9  o 27.03000 0.3503000 26.93000 0.4901000 27.12000 0.5006000 -0.1958000     0.7006000 
1 1 1 19 30 11 o 19.55000 0.3793000 19.84000 0.5404000 19.27000 0.5325000 0.5716000      0.7587000 
1 1 1 19 30 13 o 10.56000 0.6725000 10.76000 0.7904000 10.37000 1.088000  0.3989000      1.345000  
1 1 1 19 30 15 o 18.33000 0.4026000 18.17000 0.5703000 18.48000 0.5683000 -0.3068000     0.8051000 
1 1 1 19 30 17 o 36.66000 0.4412000 36.96000 0.6862000 36.36000 0.5547000 0.5988000      0.8823000 
1 1 1 19 30 19 o 13.47000 0.4872000 12.62000 0.7074000 14.32000 0.6702000 -1.694000      0.9745000 
1 1 1 19 30 21 o 17.94000 0.4062000 18.08000 0.5812000 17.81000 0.5677000 0.2668000      0.8125000 
1 1 1 19 30 23 o 6.540000 0.9237000 5.596000 1.501000  7.485000 1.077000  -1.889000      1.847000  
1 1 1 19 30 25 o 12.62000 0.5144000 12.85000 0.7121000 12.39000 0.7425000 0.4674000      1.029000  
1 1 1 19 30 27 o 20.90000 0.4794000 21.64000 0.6833000 20.15000 0.6726000 1.485000       0.9588000 
1 1 1 19 30 29 o 14.88000 0.5073000 15.93000 0.7695000 13.84000 0.6612000 2.090000       1.015000  
1 1 1 19 30 31 o 19.65000 0.5767000 20.05000 1.015000  19.26000 0.5475000 0.7877000      1.153000  
1 1 1 19 30 33 o 12.37000 0.3963000 11.93000 0.4360000 12.81000 0.6620000 -0.8829000     0.7927000 
1 1 1 19 30 35 o 15.86000 0.4018000 15.42000 0.3982000 16.30000 0.6981000 -0.8828000     0.8037000 
1 1 1 19 30 37 o 9.687000 0.5297000 9.128000 0.6737000 10.25000 0.8177000 -1.118000      1.059000  
1 1 1 19 30 39 o 7.239000 0.6170000 6.686000 0.8931000 7.793000 0.8514000 -1.107000      1.234000  
1 1 1 19 30 41 o 8.349000 0.5436000 8.593000 0.7292000 8.105000 0.8064000 0.4882000      1.087000  
1 1 1 19 30 43 o 2.910000 0.8818000 2.487000 1.112000  3.334000 1.369000  -0.8466000     1.764000  
1 1 1 19 30 45 o 3.085000 0.9031000 3.380000 1.325000  2.790000 1.227000  0.5897000      1.806000  
1 1 1 19 30 47 o 7.890000 0.7131000 7.859000 1.039000  7.921000 0.9769000 -0.6224000E-01 1.426000  
1 1 1 19 30 49 o 5.204000 0.9806000 5.761000 1.238000  4.647000 1.521000  1.114000       1.961000  
1 1 1 19 30 51 f 3.646000 0.9972000 4.070000 1.475000  3.222000 1.342000  0.8475000      1.994000  
1 1 1 19 30 53 o 4.558000 0.9868000 3.896000 1.463000  5.220000 1.325000  -1.324000      1.974000  
1 1 1 19 31 0  o 21.51000 0.3725000 21.51000 0.3725000 21.51000 0.3725000 0.000000       0.000000  
1 1 1 19 31 2  o 24.70000 0.2934000 24.38000 0.4656000 25.03000 0.3571000 -0.6509000     0.5868000 
1 1 1 19 31 4  o 12.64000 0.5183000 12.91000 0.5794000 12.36000 0.8595000 0.5458000      1.037000  
1 1 1 19 31 6  o 10.43000 0.6025000 10.92000 0.5617000 9.940000 1.066000  0.9787000      1.205000  
1 1 1 19 31 8  o 26.89000 0.3523000 26.75000 0.4985000 27.03000 0.4979000 -0.2809000     0.7046000 
1 1 1 19 31 10 o 43.18000 0.4140000 43.44000 0.5841000 42.91000 0.5869000 0.5263000      0.8280000 
1 1 1 19 31 12 o 12.65000 0.4917000 12.97000 0.6756000 12.34000 0.7145000 0.6374000      0.9834000 
1 1 1 19 31 14 o 26.73000 0.3600000 26.35000 0.5038000 27.10000 0.5145000 -0.7480000     0.7200000 
1 1 1 19 31 16 o 11.34000 0.6393000 11.25000 0.9966000 11.44000 0.8008000 -0.1924000     1.279000  
1 1 1 19 31 18 o 33.80000 0.4222000 32.89000 0.6298000 34.71000 0.5624000 -1.824000      0.8444000 
1 1 1 19 31 20 o 32.70000 0.3803000 32.38000 0.5377000 33.01000 0.5379000 -0.6245000     0.7606000 
1 1 1 19 31 22 o 4.511000 1.058000  5.155000 1.537000  3.867000 1.453000  1.288000       2.115000  
1 1 1 19 31 24 o 17.48000 0.5180000 17.42000 0.7004000 17.55000 0.7634000 -0.1270000     1.036000  
1 1 1 19 31 26 o 12.06000 0.7584000 11.39000 0.7532000 12.73000 1.317000  -1.345000      1.517000  
1 1 1 19 31 28 o 20.37000 0.4301000 20.61000 0.6735000 20.12000 0.5350000 0.4820000      0.8601000 
1 1 1 19 31 30 o 8.607000 1.021000  7.444000 1.872000  9.770000 0.8152000 -2.326000      2.042000  
1 1 1 19 31 32 o 21.48000 0.3350000 20.73000 0.4062000 22.22000 0.5329000 -1.490000      0.6701000 
1 1 1 19 31 34 o 20.38000 0.4275000 20.43000 0.5366000 20.32000 0.6658000 0.1042000      0.8551000 
1 1 1 19 31 36 o 17.64000 0.3393000 16.96000 0.3857000 18.31000 0.5584000 -1.345000      0.6787000 
1 1 1 19 31 38 o 3.177000 0.8836000 2.549000 1.055000  3.804000 1.418000  -1.255000      1.767000  
1 1 1 19 31 40 o 3.104000 0.8929000 3.191000 1.289000  3.017000 1.236000  0.1733000      1.786000  
1 1 1 19 31 42 o 3.224000 0.9232000 2.819000 1.200000  3.630000 1.403000  -0.8105000     1.846000  
1 1 1 19 31 44 o 4.464000 0.9548000 3.816000 1.344000  5.113000 1.357000  -1.297000      1.910000  
1 1 1 19 31 46 o 9.436000 0.6151000 9.661000 0.8967000 9.210000 0.8421000 0.4503000      1.230000  
1 1 1 19 31 48 o 7.408000 0.8282000 8.416000 0.8743000 6.400000 1.407000  2.016000       1.656000  
1 1 1 19 31 50 o 5.851000 0.9165000 4.505000 1.493000  7.197000 1.064000  -2.692000      1.833000  
1 1 1 19 31 52 o 5.431000 0.9143000 6.105000 1.249000  4.756000 1.336000  1.349000       1.829000  
1 1 1 19 32 1  o 20.15000 0.3027000 19.82000 0.4809000 20.48000 0.3679000 -0.6560000     0.6055000 
1 1 1 19 32 3  o 10.23000 0.3401000 10.42000 0.5524000 10.04000 0.3969000 0.3777000      0.6802000 
1 1 1 19 32 5  o 11.65000 0.5498000 12.13000 0.5113000 11.16000 0.9736000 0.9755000      1.100000  
1 1 1 19 32 7  o 3.918000 1.034000  3.513000 1.263000  4.323000 1.637000  -0.8098000     2.068000  
1 1 1 19 32 9  o 22.56000 0.3973000 23.16000 0.4123000 21.97000 0.6793000 1.187000       0.7947000 
1 1 1 19 32 11 o 20.14000 0.3854000 19.29000 0.5543000 20.99000 0.5355000 -1.706000      0.7707000 
1 1 1 19 32 13 o 9.366000 0.7774000 9.609000 0.8995000 9.123000 1.268000  0.4852000      1.555000  
1 1 1 19 32 15 o 18.10000 0.4099000 17.97000 0.5780000 18.23000 0.5814000 -0.2604000     0.8199000 
1 1 1 19 32 17 o 21.17000 0.3944000 21.04000 0.5600000 21.30000 0.5555000 -0.2577000     0.7888000 
1 1 1 19 32 19 o 11.83000 0.5497000 11.23000 0.7974000 12.44000 0.7569000 -1.207000      1.099000  
1 1 1 19 32 21 o 25.79000 0.4143000 25.80000 0.5302000 25.78000 0.6368000 0.2218000E-01  0.8287000 
1 1 1 19 32 23 f 32.21000 0.4693000 32.16000 0.6693000 32.25000 0.6581000 -0.8451000E-01 0.9387000 
1 1 1 19 32 25 o 22.15000 0.4394000 21.62000 0.5357000 22.68000 0.6967000 -1.061000      0.8789000 
1 1 1 19 32 27 o 26.06000 0.3740000 26.48000 0.5282000 25.63000 0.5296000 0.8564000      0.7480000 
1 1 1 19 32 29 o 28.10000 0.5106000 27.67000 0.8781000 28.53000 0.5212000 -0.8541000     1.021000  
1 1 1 19 32 31 o 13.47000 0.4453000 13.60000 0.6220000 13.34000 0.6374000 0.2598000      0.8906000 
1 1 1 19 32 33 f 9.145000 0.5240000 7.635000 0.5443000 10.65000 0.8957000 -3.020000      1.048000  
1 1 1 19 32 35 o 23.15000 0.3715000 22.10000 0.5272000 24.19000 0.5236000 -2.092000      0.7430000 
1 1 1 19 32 37 o 7.893000 0.6954000 7.885000 0.7948000 7.901000 1.141000  -0.1596000E-01 1.391000  
1 1 1 19 32 39 o 5.843000 0.7259000 5.844000 1.006000  5.842000 1.047000  0.1926000E-02  1.452000  
1 1 1 19 32 41 o 4.529000 0.9420000 3.857000 1.277000  5.201000 1.385000  -1.345000      1.884000  
1 1 1 19 32 43 o 3.138000 0.8841000 3.684000 1.317000  2.591000 1.180000  1.093000       1.768000  
1 1 1 19 32 45 o 3.468000 0.9616000 3.634000 1.388000  3.302000 1.331000  0.3322000      1.923000  
1 1 1 19 32 47 o 10.55000 0.6053000 10.45000 0.8632000 10.66000 0.8487000 -0.2095000     1.211000  
1 1 1 19 32 49 o 10.49000 0.6090000 9.048000 0.9925000 11.94000 0.7061000 -2.887000      1.218000  
1 1 1 19 32 51 o 2.772000 0.8874000 2.905000 1.339000  2.638000 1.165000  0.2671000      1.775000  
1 1 1 19 33 0  o 16.49000 0.3856000 16.49000 0.3856000 16.49000 0.3856000 0.000000       0.000000  
1 1 1 19 33 2  o 44.46000 0.3485000 43.91000 0.4917000 45.01000 0.4939000 -1.098000      0.6969000 
1 1 1 19 33 4  o 12.59000 0.5020000 12.34000 0.4883000 12.85000 0.8772000 -0.5078000     1.004000  
1 1 1 19 33 6  o 23.33000 0.3902000 23.68000 0.4086000 22.99000 0.6649000 0.6916000      0.7804000 
1 1 1 19 33 8  f 7.035000 0.9219000 7.400000 0.8706000 6.671000 1.625000  0.7287000      1.844000  
1 1 1 19 33 10 o 20.10000 0.4240000 20.12000 0.4335000 20.09000 0.7287000 0.3015000E-01  0.8479000 
1 1 1 19 33 12 o 17.38000 0.4845000 17.74000 0.5718000 17.02000 0.7822000 0.7187000      0.9690000 
1 1 1 19 33 14 o 14.08000 0.4715000 14.24000 0.6514000 13.93000 0.6819000 0.3139000      0.9430000 
1 1 1 19 33 16 o 11.60000 0.6364000 12.31000 0.9836000 10.88000 0.8078000 1.426000       1.273000  
1 1 1 19 33 18 o 49.93000 0.4642000 49.70000 0.6436000 50.16000 0.6690000 -0.4622000     0.9284000 
1 1 1 19 33 20 o 25.64000 0.4406000 25.66000 0.6791000 25.61000 0.5614000 0.4919000E-01  0.8811000 
1 1 1 19 33 22 o 20.13000 0.4512000 20.02000 0.5610000 20.25000 0.7067000 -0.2226000     0.9023000 
1 1 1 19 33 24 o 17.40000 0.4165000 17.54000 0.5759000 17.25000 0.6019000 0.2889000      0.8331000 
1 1 1 19 33 26 o 18.18000 0.4090000 18.56000 0.5814000 17.80000 0.5754000 0.7679000      0.8180000 
1 1 1 19 33 28 o 12.01000 0.7557000 12.23000 1.327000  11.79000 0.7239000 0.4338000      1.511000  
1 1 1 19 33 30 o 6.526000 0.8314000 7.347000 1.074000  5.705000 1.269000  1.643000       1.663000  
1 1 1 19 33 32 o 15.16000 0.4689000 15.37000 0.5966000 14.96000 0.7236000 0.4050000      0.9378000 
1 1 1 19 33 34 o 10.19000 0.4469000 9.502000 0.4562000 10.88000 0.7687000 -1.375000      0.8939000 
1 1 1 19 33 36 o 17.60000 0.3631000 16.82000 0.4555000 18.38000 0.5655000 -1.561000      0.7261000 
1 1 1 19 33 38 o 9.736000 0.5243000 9.217000 0.7347000 10.26000 0.7481000 -1.039000      1.049000  
1 1 1 19 33 40 o 3.181000 0.9033000 2.771000 1.159000  3.591000 1.386000  -0.8200000     1.807000  
1 1 1 19 33 42 o 3.419000 0.9034000 2.762000 1.177000  4.076000 1.371000  -1.314000      1.807000  
1 1 1 19 33 44 o 13.68000 0.4054000 13.40000 0.5446000 13.96000 0.6005000 -0.5604000     0.8107000 
1 1 1 19 33 46 o 6.769000 0.7654000 7.101000 0.9544000 6.438000 1.197000  0.6623000      1.531000  
1 1 1 19 33 48 o 3.987000 1.035000  3.722000 1.355000  4.252000 1.563000  -0.5303000     2.069000  
1 1 1 19 33 50 o 7.656000 0.6827000 7.883000 1.069000  7.430000 0.8491000 0.4529000      1.365000  
1 1 1 19 34 1  o 17.57000 0.2791000 17.04000 0.4106000 18.10000 0.3781000 -1.063000      0.5581000 
1 1 1 19 34 3  o 5.634000 0.7155000 6.251000 1.156000  5.017000 0.8437000 1.234000       1.431000  
1 1 1 19 34 5  o 5.498000 1.004000  5.692000 1.081000  5.303000 1.691000  0.3885000      2.007000  
1 1 1 19 34 7  o 21.29000 0.4105000 21.69000 0.4184000 20.89000 0.7065000 0.7977000      0.8211000 
1 1 1 19 34 9  o 6.054000 1.027000  5.614000 1.152000  6.493000 1.700000  -0.8788000     2.054000  
1 1 1 19 34 11 o 36.21000 0.4248000 35.89000 0.4570000 36.53000 0.7163000 -0.6364000     0.8497000 
1 1 1 19 34 13 o 21.53000 0.4137000 21.59000 0.4397000 21.46000 0.7008000 0.1298000      0.8273000 
1 1 1 19 34 15 f 30.54000 0.4801000 30.90000 0.6867000 30.19000 0.6712000 0.7152000      0.9602000 
1 1 1 19 34 17 o 40.51000 0.5012000 39.68000 0.7087000 41.34000 0.7090000 -1.661000      1.002000  
1 1 1 19 34 19 o 5.698000 1.061000  5.737000 1.480000  5.658000 1.521000  0.7954000E-01  2.122000  
1 1 1 19 34 21 o 7.781000 0.9618000 8.744000 1.009000  6.819000 1.638000  1.925000       1.924000  
1 1 1 19 34 23 o 7.831000 0.7710000 7.289000 1.198000  8.372000 0.9706000 -1.083000      1.542000  
1 1 1 19 34 25 o 29.98000 0.4479000 28.92000 0.6031000 31.04000 0.6624000 -2.119000      0.8959000 
1 1 1 19 34 27 o 9.530000 0.7012000 9.515000 1.110000  9.545000 0.8576000 -0.3048000E-01 1.402000  
1 1 1 19 34 29 o 26.81000 0.3636000 26.65000 0.5137000 26.96000 0.5149000 -0.3026000     0.7273000 
1 1 1 19 34 31 o 4.273000 1.043000  3.820000 1.423000  4.727000 1.527000  -0.9076000     2.087000  
1 1 1 19 34 33 o 17.43000 0.4075000 17.88000 0.5622000 16.98000 0.5902000 0.9015000      0.8151000 
1 1 1 19 34 35 o 4.308000 0.8178000 5.180000 0.9185000 3.437000 1.353000  1.742000       1.636000  
1 1 1 19 34 37 o 3.469000 0.9293000 2.732000 1.134000  4.206000 1.472000  -1.474000      1.859000  
1 1 1 19 34 39 o 12.88000 0.4903000 11.91000 0.7402000 13.85000 0.6433000 -1.934000      0.9807000 
1 1 1 19 34 41 o 9.445000 0.5074000 8.793000 0.6895000 10.10000 0.7446000 -1.304000      1.015000  
1 1 1 19 34 43 o 7.113000 0.6723000 6.463000 0.9529000 7.763000 0.9487000 -1.299000      1.345000  
1 1 1 19 34 45 o 8.106000 0.6272000 6.890000 0.9504000 9.322000 0.8188000 -2.432000      1.254000  
1 1 1 19 34 47 o 3.630000 1.005000  3.633000 1.307000  3.627000 1.526000  0.6684000E-02  2.009000  
1 1 1 19 34 49 o 6.008000 0.9961000 6.846000 1.584000  5.171000 1.209000  1.676000       1.992000  
1 1 1 19 35 0  o 27.60000 0.6724000 27.60000 0.6724000 27.60000 0.6724000 0.000000       0.000000  
1 1 1 19 35 2  o 24.68000 0.3932000 24.03000 0.3994000 25.32000 0.6775000 -1.292000      0.7864000 
1 1 1 19 35 4  o 15.56000 0.4704000 15.31000 0.4924000 15.81000 0.8017000 -0.4981000     0.9408000 
1 1 1 19 35 6  o 4.294000 0.9931000 4.936000 1.220000  3.651000 1.567000  1.285000       1.986000  
1 1 1 19 35 8  o 24.16000 0.4115000 23.67000 0.4234000 24.64000 0.7057000 -0.9728000     0.8230000 
1 1 1 19 35 10 o 11.91000 0.5737000 11.32000 0.5934000 12.51000 0.9821000 -1.188000      1.147000  
1 1 1 19 35 12 o 6.795000 1.032000  5.460000 1.450000  8.130000 1.468000  -2.670000      2.064000  
1 1 1 19 35 14 o 7.654000 1.079000  7.824000 0.9103000 7.483000 1.956000  0.3416000      2.157000  
1 1 1 19 35 16 o 11.09000 0.6137000 10.95000 0.6357000 11.23000 1.050000  -0.2819000     1.227000  
1 1 1 19 35 18 o 20.73000 0.4440000 20.81000 0.5307000 20.64000 0.7120000 0.1620000      0.8880000 
1 1 1 19 35 20 o 3.357000 0.9870000 3.622000 1.438000  3.093000 1.352000  0.5299000      1.974000  
1 1 1 19 35 22 o 5.499000 1.014000  5.724000 1.403000  5.275000 1.465000  0.4497000      2.028000  
1 1 1 19 35 24 o 5.175000 1.229000  5.237000 1.942000  5.113000 1.506000  0.1235000      2.457000  
1 1 1 19 35 26 o 25.03000 0.3760000 25.07000 0.5291000 24.98000 0.5344000 0.9631000E-01  0.7521000 
1 1 1 19 35 28 o 15.95000 0.4205000 16.74000 0.5787000 15.16000 0.6102000 1.576000       0.8409000 
1 1 1 19 35 30 o 7.477000 0.8060000 7.225000 1.068000  7.730000 1.208000  -0.5048000     1.612000  
1 1 1 19 35 32 o 12.94000 0.4541000 13.06000 0.6042000 12.82000 0.6780000 0.2408000      0.9082000 
1 1 1 19 35 34 o 13.64000 0.4467000 14.06000 0.6048000 13.22000 0.6575000 0.8363000      0.8934000 
1 1 1 19 35 36 f 6.522000 0.8070000 7.261000 0.5903000 5.783000 1.502000  1.478000       1.614000  
1 1 1 19 35 38 o 13.17000 0.4845000 12.13000 0.5809000 14.21000 0.7756000 -2.073000      0.9690000 
1 1 1 19 35 40 o 6.557000 0.9390000 6.553000 1.559000  6.561000 1.047000  -0.7920000E-02 1.878000  
1 1 1 19 35 42 o 4.626000 0.9006000 4.629000 1.227000  4.623000 1.319000  0.5801000E-02  1.801000  
1 1 1 19 35 44 o 3.226000 0.9270000 2.979000 1.302000  3.473000 1.320000  -0.4933000     1.854000  
1 1 1 19 35 46 o 7.096000 1.320000  6.975000 1.763000  7.216000 1.966000  -0.2414000     2.641000  
1 1 1 19 35 48 o 3.023000 0.9418000 3.039000 1.406000  3.006000 1.253000  0.3244000E-01  1.884000  
1 1 1 19 36 1  o 24.59000 0.3817000 24.43000 0.6587000 24.75000 0.3859000 -0.3110000     0.7635000 
1 1 1 19 36 3  o 13.16000 0.3741000 13.15000 0.6333000 13.16000 0.3985000 -0.1335000E-01 0.7483000 
1 1 1 19 36 5  o 7.748000 0.8950000 8.896000 0.7472000 6.601000 1.627000  2.295000       1.790000  
1 1 1 19 36 7  o 14.20000 0.4907000 13.90000 0.5171000 14.50000 0.8341000 -0.6053000     0.9814000 
1 1 1 19 36 9  o 30.32000 0.4037000 30.02000 0.4347000 30.63000 0.6804000 -0.6124000     0.8074000 
1 1 1 19 36 11 o 7.225000 0.8886000 8.533000 0.9663000 5.918000 1.491000  2.615000       1.777000  
1 1 1 19 36 13 o 23.20000 0.4297000 23.34000 0.4947000 23.05000 0.7028000 0.2914000      0.8594000 
1 1 1 19 36 15 o 34.64000 0.5802000 34.90000 0.5379000 34.38000 1.028000  0.5243000      1.160000  
1 1 1 19 36 17 o 4.684000 1.237000  3.323000 1.294000  6.046000 2.108000  -2.723000      2.474000  
1 1 1 19 36 19 o 13.16000 0.5114000 13.68000 0.5383000 12.64000 0.8697000 1.047000       1.023000  
1 1 1 19 36 21 o 19.13000 0.4027000 19.17000 0.5608000 19.09000 0.5782000 0.7807000E-01  0.8055000 
1 1 1 19 36 23 o 9.851000 0.8615000 9.332000 1.524000  10.37000 0.8030000 -1.038000      1.723000  
1 1 1 19 36 25 o 10.43000 0.5533000 10.75000 0.8131000 10.11000 0.7507000 0.6452000      1.107000  
1 1 1 19 36 27 o 9.420000 0.6556000 9.409000 1.009000  9.432000 0.8371000 -0.2323000E-01 1.311000  
1 1 1 19 36 29 o 6.838000 0.8909000 7.585000 1.063000  6.090000 1.430000  1.495000       1.782000  
1 1 1 19 36 31 o 12.67000 0.4934000 13.12000 0.6759000 12.22000 0.7189000 0.8933000      0.9868000 
1 1 1 19 36 33 f 5.747000 0.8605000 6.979000 1.093000  4.516000 1.329000  2.463000       1.721000  
1 1 1 19 36 35 o 2.885000 0.8864000 3.005000 1.276000  2.765000 1.231000  0.2396000      1.773000  
1 1 1 19 36 37 o 8.337000 0.6677000 8.004000 0.5809000 8.670000 1.202000  -0.6664000     1.335000  
1 1 1 19 36 39 o 6.215000 0.7370000 6.715000 0.9199000 5.715000 1.152000  1.001000       1.474000  
1 1 1 19 36 41 o 9.054000 0.6122000 8.056000 0.9477000 10.05000 0.7751000 -1.995000      1.224000  
1 1 1 19 36 43 o 9.600000 0.6189000 8.677000 1.003000  10.52000 0.7257000 -1.845000      1.238000  
1 1 1 19 36 45 o 12.92000 0.5587000 14.10000 0.8453000 11.75000 0.7306000 2.349000       1.117000  
1 1 1 19 36 47 o 4.692000 1.203000  5.931000 1.999000  3.454000 1.338000  2.477000       2.406000  
1 1 1 19 37 0  o 4.024000 1.407000  4.024000 1.407000  4.024000 1.407000  0.000000       0.000000  
1 1 1 19 37 2  o 4.460000 0.7735000 5.081000 1.091000  3.838000 1.096000  1.244000       1.547000  
1 1 1 19 37 4  o 12.52000 0.5969000 12.85000 0.6972000 12.20000 0.9690000 0.6496000      1.194000  
1 1 1 19 37 6  o 13.11000 0.5514000 12.28000 0.6950000 13.94000 0.8562000 -1.653000      1.103000  
1 1 1 19 37 8  o 17.13000 0.4523000 17.27000 0.4678000 16.99000 0.7743000 0.2805000      0.9047000 
1 1 1 19 37 10 o 10.20000 0.7275000 11.29000 0.7055000 9.119000 1.273000  2.170000       1.455000  
1 1 1 19 37 12 o 24.00000 0.4115000 23.72000 0.4288000 24.28000 0.7025000 -0.5557000     0.8230000 
1 1 1 19 37 14 o 12.79000 0.7771000 11.61000 0.6938000 13.98000 1.391000  -2.366000      1.554000  
1 1 1 19 37 16 o 14.63000 0.4723000 14.39000 0.5162000 14.88000 0.7911000 -0.4892000     0.9446000 
1 1 1 19 37 18 o 13.49000 0.5037000 13.36000 0.5472000 13.61000 0.8457000 -0.2458000     1.007000  
1 1 1 19 37 20 o 14.79000 0.4948000 13.91000 0.5516000 15.67000 0.8216000 -1.760000      0.9896000 
1 1 1 19 37 22 o 6.123000 0.9982000 6.045000 1.252000  6.201000 1.555000  -0.1559000     1.996000  
1 1 1 19 37 24 o 16.31000 0.4972000 16.32000 0.5772000 16.30000 0.8097000 0.1551000E-01  0.9944000 
1 1 1 19 37 26 o 12.95000 0.5052000 13.34000 0.7824000 12.56000 0.6392000 0.7784000      1.010000  
1 1 1 19 37 28 o 10.82000 0.6176000 12.35000 0.6952000 9.287000 1.021000  3.065000       1.235000  
1 1 1 19 37 30 o 4.325000 0.9936000 4.565000 1.413000  4.086000 1.398000  0.4795000      1.987000  
1 1 1 19 37 32 o 6.698000 0.8470000 6.231000 1.254000  7.165000 1.139000  -0.9341000     1.694000  
1 1 1 19 37 34 o 4.841000 0.9531000 5.712000 1.302000  3.970000 1.392000  1.742000       1.906000  
1 1 1 19 37 36 o 8.151000 0.7618000 8.495000 0.9139000 7.807000 1.219000  0.6880000      1.524000  
1 1 1 19 37 38 o 10.91000 0.5096000 10.40000 0.6861000 11.42000 0.7537000 -1.014000      1.019000  
1 1 1 19 37 40 o 13.66000 0.5431000 13.04000 0.9081000 14.28000 0.5961000 -1.244000      1.086000  
1 1 1 19 37 42 o 11.55000 0.6865000 10.99000 1.198000  12.12000 0.6712000 -1.130000      1.373000  
1 1 1 19 37 44 o 7.359000 0.9920000 7.380000 1.689000  7.338000 1.042000  0.4156000E-01  1.984000  
1 1 1 19 37 46 o 5.542000 1.160000  6.883000 1.803000  4.201000 1.459000  2.682000       2.319000  
1 1 1 19 37 48 o 4.425000 1.818000  4.425000 1.818000  ?        ?         ?              ?         
1 1 1 19 38 1  o 30.43000 0.2908000 30.39000 0.4187000 30.46000 0.4036000 -0.6995000E-01 0.5815000 
1 1 1 19 38 3  o 17.77000 0.2808000 17.37000 0.4404000 18.17000 0.3484000 -0.7976000     0.5616000 
1 1 1 19 38 5  o 16.43000 0.4824000 16.72000 0.4595000 16.13000 0.8484000 0.5853000      0.9648000 
1 1 1 19 38 7  o 9.326000 0.7560000 8.066000 0.7421000 10.59000 1.317000  -2.520000      1.512000  
1 1 1 19 38 9  o 5.739000 1.024000  4.586000 1.316000  6.891000 1.569000  -2.305000      2.047000  
1 1 1 19 38 11 o 15.12000 0.7375000 15.04000 0.6221000 15.20000 1.337000  -0.1617000     1.475000  
1 1 1 19 38 13 o 4.678000 1.174000  4.793000 1.264000  4.563000 1.979000  0.2301000      2.348000  
1 1 1 19 38 15 o 22.72000 0.4106000 23.14000 0.4493000 22.29000 0.6873000 0.8484000      0.8211000 
1 1 1 19 38 17 o 11.81000 0.5478000 11.50000 0.5928000 12.12000 0.9213000 -0.6172000     1.096000  
1 1 1 19 38 19 o 9.326000 0.7030000 8.680000 0.9745000 9.972000 1.013000  -1.292000      1.406000  
1 1 1 19 38 21 o 20.16000 0.4204000 20.64000 0.4439000 19.69000 0.7141000 0.9513000      0.8409000 
1 1 1 19 38 23 o 17.76000 0.5353000 17.73000 0.5211000 17.79000 0.9353000 -0.6612000E-01 1.071000  
1 1 1 19 38 25 o 10.27000 0.6719000 10.93000 0.5931000 9.608000 1.206000  1.318000       1.344000  
1 1 1 19 38 27 o 4.557000 1.099000  3.161000 1.204000  5.953000 1.840000  -2.791000      2.199000  
1 1 1 19 38 29 o 3.551000 0.9681000 3.203000 1.353000  3.898000 1.385000  -0.6943000     1.936000  
1 1 1 19 38 31 f 3.361000 0.9527000 3.711000 1.392000  3.011000 1.301000  0.7001000      1.905000  
1 1 1 19 38 33 f 2.517000 0.8168000 3.064000 1.317000  1.970000 0.9672000 1.093000       1.634000  
1 1 1 19 38 35 o 8.747000 0.9134000 8.614000 0.8988000 8.881000 1.590000  -0.2670000     1.827000  
1 1 1 19 38 37 o 7.319000 1.181000  6.772000 2.124000  7.866000 1.032000  -1.094000      2.362000  
1 1 1 19 38 39 o 5.373000 1.111000  5.534000 1.717000  5.212000 1.409000  0.3226000      2.221000  
1 1 1 19 38 41 o 4.895000 1.209000  6.252000 1.997000  3.539000 1.365000  2.713000       2.419000  
1 1 1 19 38 43 f 5.082000 1.050000  5.931000 1.588000  4.233000 1.373000  1.698000       2.099000  
1 1 1 19 38 45 o 5.163000 1.255000  5.923000 1.930000  4.402000 1.604000  1.521000       2.510000  
1 1 1 19 38 47 o 6.501000 2.475000  6.501000 2.475000  ?        ?         ?              ?         
1 1 1 19 39 0  o 9.447000 0.5797000 9.447000 0.5797000 9.447000 0.5797000 0.000000       0.000000  
1 1 1 19 39 2  o 21.54000 0.2962000 21.97000 0.4666000 21.11000 0.3649000 0.8647000      0.5923000 
1 1 1 19 39 4  o 13.87000 0.3389000 14.62000 0.4625000 13.12000 0.4954000 1.497000       0.6778000 
1 1 1 19 39 6  o 16.34000 0.4870000 17.07000 0.4579000 15.61000 0.8596000 1.457000       0.9740000 
1 1 1 19 39 8  o 6.167000 1.071000  7.758000 0.8361000 4.577000 1.972000  3.181000       2.142000  
1 1 1 19 39 10 o 14.88000 0.7726000 16.12000 0.5819000 13.63000 1.432000  2.490000       1.545000  
1 1 1 19 39 12 o 18.66000 0.5140000 18.87000 0.6921000 18.44000 0.7600000 0.4241000      1.028000  
1 1 1 19 39 14 o 16.97000 0.4674000 17.35000 0.5537000 16.59000 0.7532000 0.7612000      0.9349000 
1 1 1 19 39 16 o 14.13000 0.5305000 14.73000 0.6711000 13.54000 0.8217000 1.192000       1.061000  
1 1 1 19 39 18 o 19.39000 0.4253000 19.61000 0.5270000 19.17000 0.6677000 0.4397000      0.8506000 
1 1 1 19 39 20 o 21.66000 0.4088000 22.01000 0.4562000 21.31000 0.6786000 0.7008000      0.8177000 
1 1 1 19 39 22 o 3.868000 1.008000  3.375000 1.243000  4.360000 1.587000  -0.9851000     2.016000  
1 1 1 19 39 24 o 11.41000 0.6533000 10.63000 0.5813000 12.19000 1.170000  -1.553000      1.307000  
1 1 1 19 39 26 o 5.368000 0.9486000 6.305000 1.020000  4.432000 1.599000  1.873000       1.897000  
1 1 1 19 39 28 o 5.733000 0.9638000 4.790000 1.212000  6.676000 1.499000  -1.886000      1.928000  
1 1 1 19 39 30 o 6.230000 0.8649000 6.980000 0.8386000 5.479000 1.513000  1.501000       1.730000  
1 1 1 19 39 32 o 5.284000 0.9278000 6.047000 0.9566000 4.520000 1.590000  1.527000       1.856000  
1 1 1 19 39 34 o 7.940000 0.7512000 7.506000 1.007000  8.375000 1.115000  -0.8687000     1.502000  
1 1 1 19 39 36 o 3.857000 1.030000  4.027000 1.575000  3.686000 1.326000  0.3406000      2.059000  
1 1 1 19 39 38 o 3.082000 0.9304000 2.690000 1.239000  3.475000 1.388000  -0.7851000     1.861000  
1 1 1 19 39 40 o 3.515000 1.051000  3.668000 1.622000  3.362000 1.337000  0.3061000      2.102000  
1 1 1 19 39 42 f 4.049000 1.098000  4.646000 1.747000  3.453000 1.330000  1.193000       2.195000  
1 1 1 19 39 44 o 3.370000 1.048000  3.569000 1.609000  3.171000 1.344000  0.3981000      2.096000  
1 1 1 19 39 46 o 4.590000 1.224000  4.921000 1.845000  4.259000 1.608000  0.6621000      2.448000  
1 1 1 19 40 1  f 12.55000 0.4103000 12.61000 0.4788000 12.50000 0.6664000 0.1099000      0.8205000 
1 1 1 19 40 3  o 22.85000 0.2958000 22.79000 0.4328000 22.90000 0.4033000 -0.1081000     0.5916000 
1 1 1 19 40 5  o 4.815000 1.191000  4.442000 1.185000  5.189000 2.067000  -0.7463000     2.382000  
1 1 1 19 40 7  o 14.49000 0.6865000 15.77000 0.4645000 13.21000 1.292000  2.557000       1.373000  
1 1 1 19 40 9  o 20.70000 0.4208000 20.90000 0.4345000 20.51000 0.7207000 0.3886000      0.8415000 
1 1 1 19 40 11 o 10.65000 0.5887000 10.91000 0.6665000 10.38000 0.9705000 0.5278000      1.177000  
1 1 1 19 40 13 o 16.20000 0.5644000 16.57000 0.8530000 15.82000 0.7392000 0.7492000      1.129000  
1 1 1 19 40 15 o 20.75000 0.5583000 20.22000 0.8848000 21.29000 0.6811000 -1.075000      1.117000  
1 1 1 19 40 17 o 5.127000 0.9502000 5.945000 1.195000  4.310000 1.478000  1.636000       1.900000  
1 1 1 19 40 19 o 12.41000 0.5233000 12.49000 0.5706000 12.32000 0.8773000 0.1686000      1.047000  
1 1 1 19 40 21 o 6.067000 0.9396000 7.155000 0.9604000 4.978000 1.615000  2.177000       1.879000  
1 1 1 19 40 23 o 4.989000 1.113000  4.503000 1.237000  5.476000 1.851000  -0.9733000     2.226000  
1 1 1 19 40 25 o 11.73000 0.5816000 11.88000 0.6064000 11.59000 0.9926000 0.2944000      1.163000  
1 1 1 19 40 27 o 7.299000 0.9442000 8.409000 0.7073000 6.189000 1.751000  2.220000       1.888000  
1 1 1 19 40 29 o 5.237000 1.071000  4.504000 1.191000  5.971000 1.781000  -1.467000      2.142000  
1 1 1 19 40 31 o 9.297000 0.7922000 9.586000 0.7073000 9.009000 1.418000  0.5776000      1.584000  
1 1 1 19 40 33 o 3.604000 0.9873000 3.702000 1.313000  3.507000 1.475000  0.1955000      1.975000  
1 1 1 19 40 35 o 9.453000 0.7119000 9.979000 0.7967000 8.928000 1.180000  1.051000       1.424000  
1 1 1 19 40 37 o 10.94000 0.5979000 11.68000 0.6426000 10.19000 1.009000  1.495000       1.196000  
1 1 1 19 40 39 o 4.652000 1.005000  3.393000 1.415000  5.911000 1.427000  -2.518000      2.010000  
1 1 1 19 40 41 o 4.061000 1.007000  3.912000 1.446000  4.211000 1.400000  -0.2983000     2.013000  
1 1 1 19 40 43 o 5.368000 1.247000  5.903000 1.938000  4.834000 1.569000  1.069000       2.493000  
1 1 1 19 40 45 f 5.416000 1.359000  5.239000 1.925000  5.592000 1.919000  -0.3535000     2.718000  
1 1 1 19 41 0  o 2.831000 1.159000  2.831000 1.159000  2.831000 1.159000  0.000000       0.000000  
1 1 1 19 41 2  o 16.91000 0.2886000 16.37000 0.4201000 17.45000 0.3957000 -1.080000      0.5771000 
1 1 1 19 41 4  o 9.919000 0.3646000 9.963000 0.6007000 9.874000 0.4135000 0.8842000E-01  0.7292000 
1 1 1 19 41 6  o 21.88000 0.4389000 22.21000 0.4400000 21.56000 0.7596000 0.6470000      0.8778000 
1 1 1 19 41 8  o 5.652000 1.036000  5.676000 1.218000  5.629000 1.676000  0.4655000E-01  2.072000  
1 1 1 19 41 10 o 22.48000 0.4519000 21.72000 0.6033000 23.23000 0.6730000 -1.510000      0.9038000 
1 1 1 19 41 12 o 23.45000 0.4097000 23.29000 0.4887000 23.61000 0.6578000 -0.3139000     0.8195000 
1 1 1 19 41 14 o 19.90000 0.4097000 20.37000 0.4519000 19.42000 0.6835000 0.9497000      0.8194000 
1 1 1 19 41 16 o 29.31000 0.4139000 29.76000 0.4978000 28.87000 0.6615000 0.8844000      0.8278000 
1 1 1 19 41 18 o 12.10000 0.5642000 13.66000 0.5255000 10.54000 0.9987000 3.122000       1.128000  
1 1 1 19 41 20 o 10.91000 0.6235000 10.70000 0.7436000 11.12000 1.001000  -0.4198000     1.247000  
1 1 1 19 41 22 o 6.632000 1.187000  5.595000 1.602000  7.669000 1.751000  -2.074000      2.373000  
1 1 1 19 41 24 o 3.311000 0.9489000 2.090000 0.9953000 4.532000 1.616000  -2.442000      1.898000  
1 1 1 19 41 26 o 3.973000 1.012000  2.816000 1.173000  5.131000 1.649000  -2.315000      2.024000  
1 1 1 19 41 28 o 10.21000 0.6758000 10.03000 0.6348000 10.39000 1.193000  -0.3666000     1.352000  
1 1 1 19 41 30 o 5.400000 1.231000  5.531000 1.119000  5.270000 2.192000  0.2612000      2.461000  
1 1 1 19 41 32 o 3.749000 1.021000  3.674000 1.338000  3.824000 1.542000  -0.1500000     2.041000  
1 1 1 19 41 34 o 16.91000 0.4620000 16.78000 0.5987000 17.04000 0.7039000 -0.2557000     0.9241000 
1 1 1 19 41 36 f 16.48000 0.4984000 16.06000 0.6408000 16.90000 0.7635000 -0.8415000     0.9968000 
1 1 1 19 41 38 o 3.942000 1.048000  3.157000 1.328000  4.727000 1.622000  -1.570000      2.096000  
1 1 1 19 41 40 o 3.923000 1.049000  4.110000 1.498000  3.735000 1.469000  0.3757000      2.098000  
1 1 1 19 41 42 o 3.409000 0.9864000 3.293000 1.421000  3.525000 1.368000  -0.2319000     1.973000  
1 1 1 19 41 44 o 5.226000 1.896000  5.226000 1.896000  ?        ?         ?              ?         
1 1 1 19 42 1  o 5.477000 0.8008000 6.012000 0.9191000 4.942000 1.312000  1.070000       1.602000  
1 1 1 19 42 3  o 22.02000 0.3580000 22.22000 0.3960000 21.83000 0.5967000 0.3943000      0.7161000 
1 1 1 19 42 5  o 25.66000 0.5161000 24.87000 0.4501000 26.46000 0.9289000 -1.590000      1.032000  
1 1 1 19 42 7  o 14.97000 0.4857000 14.60000 0.4425000 15.35000 0.8647000 -0.7469000     0.9713000 
1 1 1 19 42 9  o 10.28000 0.6894000 10.64000 0.8667000 9.921000 1.072000  0.7236000      1.379000  
1 1 1 19 42 11 o 18.51000 0.4271000 18.78000 0.4569000 18.24000 0.7216000 0.5392000      0.8541000 
1 1 1 19 42 13 o 8.468000 0.7370000 8.218000 0.8686000 8.718000 1.191000  -0.5005000     1.474000  
1 1 1 19 42 15 o 5.747000 0.9457000 5.470000 1.058000  6.024000 1.568000  -0.5544000     1.891000  
1 1 1 19 42 17 o 9.311000 0.7530000 8.972000 0.6900000 9.650000 1.339000  -0.6779000     1.506000  
1 1 1 19 42 19 o 10.07000 0.6333000 10.23000 0.6457000 9.905000 1.090000  0.3201000      1.267000  
1 1 1 19 42 21 o 14.23000 0.5338000 14.66000 0.6220000 13.79000 0.8676000 0.8743000      1.068000  
1 1 1 19 42 23 o 2.817000 0.8704000 2.436000 1.110000  3.198000 1.341000  -0.7621000     1.741000  
1 1 1 19 42 25 o 4.166000 1.072000  3.682000 1.385000  4.651000 1.638000  -0.9698000     2.145000  
1 1 1 19 42 27 o 7.326000 0.9125000 7.736000 0.9672000 6.916000 1.548000  0.8196000      1.825000  
1 1 1 19 42 29 o 4.193000 1.179000  3.898000 1.254000  4.488000 1.996000  -0.5894000     2.357000  
1 1 1 19 42 31 o 11.75000 0.5995000 11.91000 0.5884000 11.59000 1.045000  0.3153000      1.199000  
1 1 1 19 42 33 o 16.03000 0.6419000 15.80000 0.6442000 16.26000 1.110000  -0.4663000     1.284000  
1 1 1 19 42 35 o 5.043000 1.080000  4.609000 1.351000  5.476000 1.686000  -0.8668000     2.161000  
1 1 1 19 42 37 o 5.102000 1.050000  5.241000 1.397000  4.962000 1.568000  0.2785000      2.100000  
1 1 1 19 42 39 o 5.385000 0.9104000 6.710000 1.148000  4.060000 1.413000  2.650000       1.821000  
1 1 1 19 42 41 o 5.255000 1.081000  4.660000 1.527000  5.850000 1.530000  -1.190000      2.162000  
1 1 1 19 42 43 o 5.112000 1.883000  5.112000 1.883000  ?        ?         ?              ?         
1 1 1 19 43 0  o 4.197000 1.049000  4.197000 1.049000  4.197000 1.049000  0.000000       0.000000  
1 1 1 19 43 2  o 6.940000 0.5570000 6.525000 0.7260000 7.355000 0.8451000 -0.8304000     1.114000  
1 1 1 19 43 4  o 3.001000 0.7820000 3.216000 1.206000  2.786000 0.9958000 0.4297000      1.564000  
1 1 1 19 43 6  o 21.41000 0.5833000 21.04000 0.4430000 21.77000 1.079000  -0.7320000     1.167000  
1 1 1 19 43 8  o 3.597000 0.9671000 3.666000 1.197000  3.528000 1.519000  0.1387000      1.934000  
1 1 1 19 43 10 o 8.496000 0.6810000 7.650000 0.8018000 9.342000 1.101000  -1.692000      1.362000  
1 1 1 19 43 12 o 5.530000 1.043000  5.332000 1.294000  5.728000 1.636000  -0.3960000     2.086000  
1 1 1 19 43 14 o 4.205000 1.072000  4.035000 1.220000  4.375000 1.762000  -0.3399000     2.143000  
1 1 1 19 43 16 o 4.489000 0.9874000 3.200000 1.210000  5.777000 1.560000  -2.577000      1.975000  
1 1 1 19 43 18 o 18.09000 0.4321000 17.86000 0.4518000 18.32000 0.7367000 -0.4581000     0.8642000 
1 1 1 19 43 20 o 7.845000 0.7481000 7.979000 0.7256000 7.711000 1.308000  0.2672000      1.496000  
1 1 1 19 43 22 o 4.331000 0.9158000 4.758000 1.120000  3.904000 1.449000  0.8541000      1.832000  
1 1 1 19 43 24 o 3.065000 0.9256000 3.056000 1.279000  3.074000 1.339000  -0.1800000E-01 1.851000  
1 1 1 19 43 26 o 5.262000 1.017000  6.022000 1.104000  4.502000 1.708000  1.520000       2.034000  
1 1 1 19 43 28 o 10.20000 1.152000  11.65000 0.6263000 8.741000 2.218000  2.909000       2.305000  
1 1 1 19 43 30 o 6.851000 0.9717000 7.084000 1.017000  6.618000 1.656000  0.4657000      1.943000  
1 1 1 19 43 32 o 5.065000 1.144000  4.916000 1.534000  5.214000 1.699000  -0.2972000     2.289000  
1 1 1 19 43 34 o 6.727000 0.9089000 6.461000 1.239000  6.994000 1.330000  -0.5327000     1.818000  
1 1 1 19 43 36 o 4.726000 1.133000  4.856000 1.531000  4.596000 1.669000  0.2602000      2.265000  
1 1 1 19 43 38 o 6.565000 0.9483000 6.951000 1.047000  6.179000 1.582000  0.7718000      1.897000  
1 1 1 19 43 40 o 2.974000 0.9317000 2.365000 1.119000  3.582000 1.490000  -1.217000      1.863000  
1 1 1 19 44 1  o 11.84000 0.3281000 11.52000 0.4604000 12.16000 0.4676000 -0.6370000     0.6562000 
1 1 1 19 44 3  o 5.989000 0.6006000 6.184000 0.8367000 5.793000 0.8618000 0.3908000      1.201000  
1 1 1 19 44 5  o 11.44000 0.8133000 11.04000 0.5214000 11.83000 1.541000  -0.7887000     1.627000  
1 1 1 19 44 7  o 8.003000 1.110000  8.912000 0.6432000 7.094000 2.125000  1.818000       2.220000  
1 1 1 19 44 9  o 5.779000 1.374000  5.779000 1.374000  ?        ?         ?              ?         
1 1 1 19 44 11 o 4.985000 1.112000  4.772000 1.241000  5.199000 1.846000  -0.4274000     2.224000  
1 1 1 19 44 13 f 6.344000 0.9989000 6.270000 1.008000  6.418000 1.725000  -0.1482000     1.998000  
1 1 1 19 44 15 o 5.103000 0.9465000 5.607000 1.014000  4.600000 1.598000  1.007000       1.893000  
1 1 1 19 44 17 o 12.84000 0.5339000 12.99000 0.5538000 12.70000 0.9129000 0.2938000      1.068000  
1 1 1 19 44 19 o 8.720000 0.6317000 8.457000 0.7364000 8.983000 1.027000  -0.5268000     1.263000  
1 1 1 19 44 21 o 11.28000 0.5478000 11.58000 0.5661000 10.98000 0.9380000 0.5972000      1.096000  
1 1 1 19 44 23 o 7.816000 0.8002000 8.726000 0.6842000 6.907000 1.447000  1.819000       1.600000  
1 1 1 19 44 25 o 3.298000 0.9873000 3.112000 1.223000  3.484000 1.550000  -0.3722000     1.975000  
1 1 1 19 44 27 o 8.550000 0.7011000 8.453000 0.7964000 8.647000 1.154000  -0.1943000     1.402000  
1 1 1 19 44 29 o 3.722000 1.027000  3.336000 1.323000  4.108000 1.570000  -0.7722000     2.054000  
1 1 1 19 44 31 o 5.257000 1.097000  4.809000 1.291000  5.706000 1.774000  -0.8969000     2.194000  
1 1 1 19 44 33 o 2.907000 0.9279000 2.583000 1.157000  3.230000 1.451000  -0.6464000     1.856000  
1 1 1 19 44 35 o 3.071000 0.9387000 2.855000 1.227000  3.287000 1.421000  -0.4316000     1.877000  
1 1 1 19 44 37 o 8.102000 0.7583000 7.470000 1.054000  8.734000 1.091000  -1.264000      1.517000  
1 1 1 19 44 39 f 4.550000 1.167000  4.412000 1.765000  4.688000 1.527000  -0.2755000     2.334000  
1 1 1 19 45 0  f 7.657000 0.7264000 7.657000 0.7264000 7.657000 0.7264000 0.000000       0.000000  
1 1 1 19 45 2  o 13.55000 0.3760000 14.12000 0.4543000 12.98000 0.5993000 1.141000       0.7520000 
1 1 1 19 45 4  o 12.85000 0.2919000 13.11000 0.4469000 12.58000 0.3758000 0.5228000      0.5839000 
1 1 1 19 45 6  o 17.78000 0.4813000 18.27000 0.4082000 17.29000 0.8718000 0.9820000      0.9627000 
1 1 1 19 45 8  o 12.78000 0.6150000 13.09000 0.5995000 12.48000 1.074000  0.6100000      1.230000  
1 1 1 19 45 10 o 7.325000 0.9871000 7.598000 0.7160000 7.052000 1.840000  0.5452000      1.974000  
1 1 1 19 45 12 o 4.621000 1.204000  4.403000 1.282000  4.838000 2.037000  -0.4352000     2.407000  
1 1 1 19 45 14 o 2.304000 0.7735000 2.149000 1.001000  2.459000 1.180000  -0.3097000     1.547000  
1 1 1 19 45 16 o 6.148000 0.9330000 6.755000 0.9343000 5.541000 1.615000  1.214000       1.866000  
1 1 1 19 45 18 o 5.961000 0.8746000 6.351000 1.040000  5.572000 1.406000  0.7791000      1.749000  
1 1 1 19 45 20 o 6.580000 0.9322000 7.101000 1.061000  6.059000 1.533000  1.042000       1.864000  
1 1 1 19 45 22 o 9.158000 0.6099000 8.825000 0.7573000 9.491000 0.9563000 -0.6668000     1.220000  
1 1 1 19 45 24 o 6.186000 1.144000  4.065000 1.221000  8.308000 1.934000  -4.243000      2.287000  
1 1 1 19 45 26 o 6.884000 0.8248000 6.419000 0.9500000 7.349000 1.349000  -0.9303000     1.650000  
1 1 1 19 45 28 o 4.135000 1.049000  3.446000 1.386000  4.825000 1.575000  -1.379000      2.098000  
1 1 1 19 45 30 o 3.711000 0.9951000 4.062000 1.335000  3.360000 1.476000  0.7026000      1.990000  
1 1 1 19 45 32 o 3.950000 1.087000  3.591000 1.417000  4.309000 1.649000  -0.7179000     2.174000  
1 1 1 19 45 34 o 6.340000 1.144000  6.737000 1.515000  5.942000 1.714000  0.7951000      2.288000  
1 1 1 19 45 36 o 8.427000 0.8759000 9.524000 0.9611000 7.331000 1.465000  2.193000       1.752000  
1 1 1 19 45 38 o 5.009000 1.197000  4.155000 1.311000  5.863000 2.002000  -1.708000      2.393000  
1 1 1 19 46 1  o 4.980000 0.6566000 4.833000 0.9695000 5.128000 0.8857000 -0.2946000     1.313000  
1 1 1 19 46 3  o 9.676000 0.3791000 8.757000 0.5900000 10.59000 0.4762000 -1.838000      0.7582000 
1 1 1 19 46 5  o 6.780000 0.5635000 7.396000 0.6746000 6.165000 0.9028000 1.231000       1.127000  
1 1 1 19 46 7  o 6.159000 0.9285000 6.518000 0.8947000 5.801000 1.627000  0.7168000      1.857000  
1 1 1 19 46 9  o 16.03000 0.5035000 16.32000 0.5171000 15.74000 0.8640000 0.5809000      1.007000  
1 1 1 19 46 11 o 12.01000 0.5763000 12.09000 0.6504000 11.92000 0.9517000 0.1752000      1.153000  
1 1 1 19 46 13 o 4.592000 1.045000  3.700000 1.227000  5.484000 1.693000  -1.784000      2.091000  
1 1 1 19 46 15 o 6.267000 0.8468000 7.773000 0.7690000 4.761000 1.509000  3.012000       1.694000  
1 1 1 19 46 17 o 4.589000 0.9820000 4.388000 1.256000  4.790000 1.510000  -0.4021000     1.964000  
1 1 1 19 46 19 o 14.73000 0.4678000 14.53000 0.5152000 14.93000 0.7811000 -0.3971000     0.9357000 
1 1 1 19 46 21 o 6.007000 0.7906000 6.005000 1.066000  6.009000 1.168000  -0.4214000E-02 1.581000  
1 1 1 19 46 23 o 5.246000 1.173000  5.329000 1.267000  5.162000 1.976000  0.1667000      2.347000  
1 1 1 19 46 25 o 3.918000 1.007000  3.033000 1.194000  4.803000 1.622000  -1.770000      2.015000  
1 1 1 19 46 27 o 4.400000 1.028000  4.008000 1.300000  4.792000 1.593000  -0.7835000     2.056000  
1 1 1 19 46 29 o 3.452000 1.010000  3.131000 1.278000  3.772000 1.565000  -0.6408000     2.021000  
1 1 1 19 46 31 o 6.253000 1.070000  6.642000 1.237000  5.863000 1.746000  0.7787000      2.140000  
1 1 1 19 46 33 o 5.515000 1.056000  5.469000 1.183000  5.562000 1.749000  -0.9333000E-01 2.111000  
1 1 1 19 46 35 o 3.857000 1.062000  3.258000 1.315000  4.456000 1.668000  -1.198000      2.124000  
1 1 1 19 46 37 o 2.848000 0.9610000 2.371000 1.099000  3.326000 1.576000  -0.9557000     1.922000  
1 1 1 19 47 0  o 7.046000 0.5810000 7.046000 0.5810000 7.046000 0.5810000 0.000000       0.000000  
1 1 1 19 47 2  o 4.688000 0.7243000 4.804000 0.9754000 4.572000 1.071000  0.2321000      1.449000  
1 1 1 19 47 4  o 15.24000 0.3276000 15.35000 0.4232000 15.14000 0.5000000 0.2147000      0.6551000 
1 1 1 19 47 6  o 13.19000 0.4807000 12.93000 0.4654000 13.45000 0.8413000 -0.5173000     0.9615000 
1 1 1 19 47 8  f 2.846000 0.9093000 2.488000 1.087000  3.203000 1.458000  -0.7152000     1.819000  
1 1 1 19 47 10 o 12.16000 0.6457000 13.32000 0.6093000 11.01000 1.139000  2.302000       1.291000  
1 1 1 19 47 12 o 7.403000 0.8030000 7.329000 0.8074000 7.477000 1.388000  -0.1476000     1.606000  
1 1 1 19 47 14 o 5.785000 0.8927000 4.315000 1.194000  7.255000 1.327000  -2.940000      1.785000  
1 1 1 19 47 16 o 6.209000 0.9460000 5.565000 1.124000  6.853000 1.522000  -1.289000      1.892000  
1 1 1 19 47 18 f 6.790000 0.8489000 6.256000 1.218000  7.325000 1.182000  -1.069000      1.698000  
1 1 1 19 47 20 o 11.84000 0.8288000 12.55000 0.5717000 11.13000 1.556000  1.418000       1.658000  
1 1 1 19 47 22 o 3.739000 1.036000  3.609000 1.389000  3.868000 1.538000  -0.2594000     2.072000  
1 1 1 19 47 24 o 11.74000 0.6174000 12.11000 0.6581000 11.38000 1.045000  0.7256000      1.235000  
1 1 1 19 47 26 o 6.665000 0.8722000 7.711000 0.8181000 5.619000 1.541000  2.092000       1.744000  
1 1 1 19 47 28 o 5.311000 1.004000  5.505000 1.090000  5.116000 1.686000  0.3895000      2.008000  
1 1 1 19 47 30 o 3.089000 0.9650000 3.220000 1.375000  2.959000 1.355000  0.2602000      1.930000  
1 1 1 19 47 32 o 4.322000 1.137000  4.268000 1.480000  4.377000 1.726000  -0.1090000     2.274000  
1 1 1 19 47 34 o 6.639000 0.9879000 6.709000 0.9219000 6.570000 1.748000  0.1388000      1.976000  
1 1 1 19 47 36 o 5.313000 1.154000  5.741000 1.209000  4.885000 1.967000  0.8560000      2.309000  
1 1 1 19 48 1  o 8.398000 0.4452000 8.512000 0.5808000 8.284000 0.6749000 0.2287000      0.8904000 
1 1 1 19 48 3  o 10.05000 0.4460000 9.586000 0.5780000 10.52000 0.6794000 -0.9308000     0.8919000 
1 1 1 19 48 5  o 7.463000 0.4932000 7.758000 0.7082000 7.168000 0.6865000 0.5900000      0.9863000 
1 1 1 19 48 7  o 4.543000 1.109000  4.216000 1.359000  4.870000 1.753000  -0.6536000     2.218000  
1 1 1 19 48 9  o 4.707000 1.009000  5.127000 1.070000  4.287000 1.712000  0.8400000      2.019000  
1 1 1 19 48 11 o 10.56000 0.6762000 10.35000 0.6050000 10.77000 1.210000  -0.4200000     1.352000  
1 1 1 19 48 13 o 5.681000 0.8811000 6.510000 0.8660000 4.851000 1.535000  1.660000       1.762000  
1 1 1 19 48 15 o 13.45000 0.5315000 13.61000 0.5376000 13.29000 0.9171000 0.3213000      1.063000  
1 1 1 19 48 17 o 18.22000 0.6905000 19.33000 0.6423000 17.11000 1.223000  2.216000       1.381000  
1 1 1 19 48 19 o 6.769000 1.122000  6.162000 1.363000  7.376000 1.784000  -1.214000      2.245000  
1 1 1 19 48 21 o 5.518000 0.9598000 5.340000 1.401000  5.696000 1.312000  -0.3554000     1.920000  
1 1 1 19 48 23 o 6.852000 0.9309000 7.158000 1.088000  6.546000 1.511000  0.6120000      1.862000  
1 1 1 19 48 25 o 5.967000 0.9508000 6.120000 1.120000  5.814000 1.537000  0.3056000      1.902000  
1 1 1 19 48 27 o 8.625000 0.6712000 8.473000 0.7626000 8.776000 1.105000  -0.3038000     1.342000  
1 1 1 19 48 29 o 2.846000 0.9166000 2.589000 1.147000  3.103000 1.430000  -0.5144000     1.833000  
1 1 1 19 48 31 o 3.525000 1.019000  3.762000 1.395000  3.287000 1.487000  0.4752000      2.039000  
1 1 1 19 48 33 o 4.168000 1.075000  3.693000 1.312000  4.643000 1.704000  -0.9506000     2.151000  
1 1 1 19 49 0  o 10.61000 0.5252000 10.61000 0.5252000 10.61000 0.5252000 0.000000       0.000000  
1 1 1 19 49 2  o 11.17000 0.3557000 11.24000 0.5292000 11.10000 0.4755000 0.1375000      0.7115000 
1 1 1 19 49 4  f 2.940000 0.9142000 2.561000 1.079000  3.319000 1.476000  -0.7580000     1.828000  
1 1 1 19 49 6  o 6.328000 0.8617000 6.221000 0.8762000 6.435000 1.484000  -0.2143000     1.723000  
1 1 1 19 49 8  o 4.835000 0.9734000 5.348000 1.017000  4.321000 1.660000  1.027000       1.947000  
1 1 1 19 49 10 f 9.729000 0.7290000 10.98000 0.6737000 8.480000 1.293000  2.499000       1.458000  
1 1 1 19 49 12 o 15.51000 0.5136000 15.28000 0.5013000 15.74000 0.8966000 -0.4516000     1.027000  
1 1 1 19 49 14 o 18.43000 0.4828000 18.78000 0.6030000 18.08000 0.7542000 0.7013000      0.9657000 
1 1 1 19 49 16 o 12.30000 0.8094000 12.76000 0.5740000 11.83000 1.514000  0.9364000      1.619000  
1 1 1 19 49 18 o 3.774000 1.075000  3.366000 1.382000  4.182000 1.646000  -0.8168000     2.150000  
1 1 1 19 49 20 o 7.209000 0.7966000 6.963000 1.077000  7.456000 1.174000  -0.4932000     1.593000  
1 1 1 19 49 22 o 7.091000 0.9314000 7.402000 0.8786000 6.780000 1.643000  0.6217000      1.863000  
1 1 1 19 49 24 o 4.945000 0.9390000 5.960000 1.266000  3.930000 1.387000  2.030000       1.878000  
1 1 1 19 49 26 o 5.382000 1.056000  4.674000 1.316000  6.090000 1.652000  -1.417000      2.112000  
1 1 1 19 49 28 o 4.578000 1.041000  5.429000 1.370000  3.726000 1.568000  1.703000       2.083000  
1 1 1 19 49 30 o 5.119000 1.056000  5.350000 1.119000  4.888000 1.792000  0.4621000      2.113000  
1 1 1 19 49 32 o 3.283000 1.021000  2.569000 1.170000  3.997000 1.674000  -1.428000      2.042000  
1 1 1 19 50 1  o 5.130000 0.8900000 5.441000 0.8937000 4.819000 1.539000  0.6215000      1.780000  
1 1 1 19 50 3  o 7.611000 0.5424000 7.941000 0.6538000 7.281000 0.8657000 0.6603000      1.085000  
1 1 1 19 50 5  o 4.515000 0.7977000 3.981000 1.224000  5.050000 1.023000  -1.069000      1.595000  
1 1 1 19 50 7  o 4.393000 0.9481000 4.978000 1.098000  3.808000 1.546000  1.171000       1.896000  
1 1 1 19 50 9  o 7.130000 0.8370000 7.093000 0.9155000 7.167000 1.402000  -0.7419000E-01 1.674000  
1 1 1 19 50 11 o 5.309000 1.022000  5.174000 1.079000  5.444000 1.735000  -0.2700000     2.043000  
1 1 1 19 50 13 o 5.576000 1.336000  3.615000 1.249000  7.537000 2.361000  -3.922000      2.671000  
1 1 1 19 50 15 o 13.27000 0.5106000 12.99000 0.5540000 13.56000 0.8580000 -0.5750000     1.021000  
1 1 1 19 50 17 o 10.55000 0.6208000 9.841000 0.6802000 11.26000 1.039000  -1.415000      1.242000  
1 1 1 19 50 19 o 11.28000 0.5946000 11.23000 0.7216000 11.33000 0.9452000 -0.9775000E-01 1.189000  
1 1 1 19 50 21 o 11.13000 0.6133000 11.06000 0.7523000 11.21000 0.9689000 -0.1544000     1.227000  
1 1 1 19 50 23 o 6.289000 0.9623000 5.205000 1.256000  7.374000 1.459000  -2.168000      1.925000  
1 1 1 19 50 25 f 5.757000 0.9642000 4.587000 1.324000  6.927000 1.402000  -2.340000      1.928000  
1 1 1 19 50 27 o 5.922000 1.372000  4.719000 1.512000  7.125000 2.289000  -2.406000      2.743000  
1 1 1 19 50 29 o 3.969000 1.071000  4.492000 1.483000  3.447000 1.546000  1.046000       2.142000  
1 1 1 19 50 31 o 4.833000 1.198000  4.376000 1.235000  5.289000 2.054000  -0.9132000     2.397000  
1 1 1 19 51 0  o 9.862000 0.5549000 9.862000 0.5549000 9.862000 0.5549000 0.000000       0.000000  
1 1 1 19 51 2  o 3.780000 0.9687000 3.678000 1.140000  3.882000 1.566000  -0.2040000     1.937000  
1 1 1 19 51 4  f 3.320000 0.9310000 2.922000 1.130000  3.719000 1.480000  -0.7970000     1.862000  
1 1 1 19 51 6  o 7.965000 0.7599000 7.754000 0.9174000 8.176000 1.212000  -0.4222000     1.520000  
1 1 1 19 51 8  o 4.425000 0.9519000 5.233000 1.120000  3.618000 1.540000  1.616000       1.904000  
1 1 1 19 51 10 o 4.459000 1.172000  2.464000 1.091000  6.455000 2.073000  -3.991000      2.343000  
1 1 1 19 51 12 o 11.31000 0.7153000 10.17000 0.5824000 12.45000 1.307000  -2.280000      1.431000  
1 1 1 19 51 14 o 4.096000 1.058000  3.415000 1.231000  4.777000 1.720000  -1.362000      2.115000  
1 1 1 19 51 16 o 9.351000 0.7351000 9.024000 0.8519000 9.679000 1.198000  -0.6543000     1.470000  
1 1 1 19 51 18 f 8.727000 0.7335000 8.498000 0.8260000 8.956000 1.212000  -0.4583000     1.467000  
1 1 1 19 51 20 f 8.400000 0.7764000 8.143000 0.8776000 8.658000 1.281000  -0.5150000     1.553000  
1 1 1 19 51 22 o 3.536000 1.012000  3.144000 1.235000  3.928000 1.604000  -0.7842000     2.024000  
1 1 1 19 51 24 o 4.368000 1.013000  2.801000 1.240000  5.935000 1.603000  -3.134000      2.027000  
1 1 1 19 51 26 f 4.827000 1.069000  4.054000 1.246000  5.601000 1.738000  -1.546000      2.139000  
1 1 1 19 51 28 o 3.014000 0.9831000 2.489000 1.168000  3.540000 1.582000  -1.051000      1.966000  
1 1 1 19 52 1  o 8.702000 0.4602000 9.116000 0.5443000 8.288000 0.7422000 0.8277000      0.9204000 
1 1 1 19 52 3  o 5.766000 0.9155000 5.892000 0.8287000 5.641000 1.633000  0.2512000      1.831000  
1 1 1 19 52 5  f 4.052000 1.017000  3.388000 1.309000  4.716000 1.557000  -1.328000      2.033000  
1 1 1 19 52 7  f 3.355000 0.9758000 3.337000 1.179000  3.373000 1.555000  -0.3576000E-01 1.952000  
1 1 1 19 52 9  o 3.977000 1.099000  2.903000 1.147000  5.051000 1.876000  -2.148000      2.199000  
1 1 1 19 52 11 o 3.490000 0.9696000 3.010000 1.187000  3.970000 1.533000  -0.9596000     1.939000  
1 1 1 19 52 13 o 3.095000 0.9532000 2.552000 1.141000  3.637000 1.527000  -1.084000      1.906000  
1 1 1 19 52 15 o 4.170000 1.069000  3.567000 1.335000  4.772000 1.670000  -1.205000      2.138000  
1 1 1 19 52 17 o 3.555000 1.045000  3.091000 1.299000  4.019000 1.636000  -0.9277000     2.089000  
1 1 1 19 52 19 o 3.503000 0.9975000 3.064000 1.189000  3.942000 1.602000  -0.8776000     1.995000  
1 1 1 19 52 21 f 5.398000 1.153000  4.713000 1.383000  6.083000 1.845000  -1.370000      2.306000  
1 1 1 19 52 23 f 5.356000 0.9783000 4.174000 1.295000  6.539000 1.466000  -2.364000      1.957000  
1 1 1 19 52 25 o 3.911000 1.051000  3.693000 1.316000  4.129000 1.639000  -0.4369000     2.102000  
1 1 1 19 52 27 o 5.505000 1.273000  5.532000 1.424000  5.478000 2.110000  0.5425000E-01  2.545000  
1 1 1 19 53 0  o 4.380000 1.294000  4.380000 1.294000  4.380000 1.294000  0.000000       0.000000  
1 1 1 19 53 2  o 3.736000 1.100000  2.983000 1.238000  4.489000 1.818000  -1.505000      2.199000  
1 1 1 19 53 4  o 4.800000 1.151000  4.413000 1.310000  5.186000 1.893000  -0.7728000     2.302000  
1 1 1 19 53 6  o 8.096000 0.8282000 8.168000 0.6744000 8.024000 1.513000  0.1448000      1.656000  
1 1 1 19 53 8  o 4.920000 1.014000  5.049000 1.228000  4.790000 1.615000  0.2587000      2.029000  
1 1 1 19 53 10 o 5.283000 0.9813000 5.822000 1.159000  4.743000 1.584000  1.079000       1.963000  
1 1 1 19 53 12 o 4.365000 1.060000  4.175000 1.319000  4.554000 1.659000  -0.3781000     2.119000  
1 1 1 19 53 14 o 6.282000 0.9220000 5.595000 1.227000  6.968000 1.377000  -1.373000      1.844000  
1 1 1 19 53 16 o 4.018000 1.130000  3.137000 1.392000  4.898000 1.781000  -1.762000      2.260000  
1 1 1 19 53 18 o 3.563000 1.004000  3.175000 1.255000  3.950000 1.566000  -0.7748000     2.007000  
1 1 1 19 53 20 o 3.359000 1.008000  2.885000 1.205000  3.833000 1.615000  -0.9476000     2.015000  
1 1 1 19 53 22 f 5.095000 1.039000  5.464000 1.132000  4.726000 1.743000  0.7377000      2.079000  
1 1 1 19 53 24 o 3.643000 1.016000  3.249000 1.279000  4.037000 1.578000  -0.7889000     2.031000  
1 1 1 19 54 1  o 5.668000 1.074000  6.154000 1.267000  5.183000 1.733000  0.9711000      2.147000  
1 1 1 19 54 3  o 5.044000 1.168000  4.594000 1.554000  5.495000 1.744000  -0.9015000     2.336000  
1 1 1 19 54 5  o 14.52000 0.5681000 13.43000 0.8017000 15.62000 0.8050000 -2.192000      1.136000  
1 1 1 19 54 7  o 11.09000 0.6844000 12.34000 0.8418000 9.834000 1.079000  2.511000       1.369000  
1 1 1 19 54 9  o 3.435000 1.015000  3.062000 1.290000  3.808000 1.566000  -0.7464000     2.029000  
1 1 1 19 54 11 o 2.720000 0.8669000 2.705000 1.182000  2.736000 1.268000  -0.3103000E-01 1.734000  
1 1 1 19 54 13 o 4.092000 1.012000  3.164000 1.270000  5.021000 1.576000  -1.857000      2.024000  
1 1 1 19 54 15 o 3.455000 0.9975000 3.450000 1.276000  3.461000 1.533000  -0.1119000E-01 1.995000  
1 1 1 19 54 17 o 5.659000 1.035000  4.336000 1.343000  6.982000 1.575000  -2.646000      2.070000  
1 1 1 19 54 19 o 4.893000 1.149000  4.292000 1.391000  5.494000 1.831000  -1.201000      2.299000  
1 1 1 19 54 21 o 4.130000 1.072000  3.351000 1.262000  4.910000 1.733000  -1.559000      2.144000  
1 1 1 19 55 0  o 5.509000 1.789000  5.509000 1.789000  5.509000 1.789000  0.000000       0.000000  
1 1 1 19 55 2  o 3.958000 1.200000  4.434000 1.882000  3.481000 1.488000  0.9531000      2.399000  
1 1 1 19 55 4  o 3.843000 1.048000  3.091000 1.364000  4.595000 1.592000  -1.504000      2.096000  
1 1 1 19 55 6  o 6.379000 0.9506000 4.960000 1.220000  7.799000 1.458000  -2.839000      1.901000  
1 1 1 19 55 8  o 9.139000 0.7133000 9.730000 0.6968000 8.548000 1.245000  1.181000       1.427000  
1 1 1 19 55 10 o 8.184000 0.7407000 8.383000 0.7094000 7.985000 1.301000  0.3978000      1.481000  
1 1 1 19 55 12 o 5.591000 0.9611000 5.726000 1.071000  5.455000 1.596000  0.2704000      1.922000  
1 1 1 19 55 14 o 3.722000 1.038000  3.337000 1.262000  4.106000 1.649000  -0.7695000     2.077000  
1 1 1 19 55 16 o 3.011000 0.9566000 2.402000 1.081000  3.621000 1.579000  -1.219000      1.913000  
1 1 1 19 55 18 o 6.858000 1.212000  6.152000 1.332000  7.564000 2.024000  -1.412000      2.423000  
1 1 1 19 56 1  o 5.560000 1.276000  4.777000 1.866000  6.343000 1.742000  -1.566000      2.552000  
1 1 1 19 56 3  o 5.583000 1.297000  5.033000 1.690000  6.133000 1.967000  -1.100000      2.593000  
1 1 1 19 56 5  o 4.362000 1.252000  3.512000 1.539000  5.212000 1.975000  -1.700000      2.504000  
1 1 1 19 56 7  o 4.514000 1.254000  4.216000 1.606000  4.812000 1.927000  -0.5954000     2.508000  
1 1 1 19 56 9  o 3.486000 1.018000  2.937000 1.227000  4.036000 1.624000  -1.099000      2.035000  
1 1 1 19 56 11 o 3.357000 1.044000  2.631000 1.132000  4.082000 1.754000  -1.451000      2.088000  
1 1 1 19 56 13 o 4.320000 1.098000  3.945000 1.243000  4.695000 1.810000  -0.7497000     2.196000  
1 1 1 19 56 15 o 4.029000 1.240000  3.160000 1.424000  4.898000 2.030000  -1.738000      2.480000  
1 1 1 19 57 0  o 4.630000 1.615000  4.630000 1.615000  4.630000 1.615000  0.000000       0.000000  
1 1 1 19 57 2  o 3.869000 1.049000  4.836000 1.605000  2.902000 1.351000  1.934000       2.098000  
1 1 1 19 57 4  o 7.572000 1.010000  6.867000 1.388000  8.277000 1.468000  -1.411000      2.020000  
1 1 1 19 57 6  o 11.72000 0.7440000 12.59000 1.031000  10.85000 1.073000  1.743000       1.488000  
1 1 1 19 57 8  o 5.913000 1.207000  5.731000 1.765000  6.095000 1.647000  -0.3649000     2.414000  
1 1 1 19 57 10 o 6.947000 1.470000  8.537000 2.191000  5.356000 1.961000  3.181000       2.940000  
1 1 1 20 0  0  o 181.7000 2.474000  181.7000 2.474000  181.7000 2.474000  0.000000       0.000000  
1 1 1 20 0  2  o 149.7000 1.446000  149.7000 1.446000  149.7000 1.446000  0.000000       0.000000  
1 1 1 20 0  4  o 2.346000 1.041000  2.346000 1.041000  2.346000 1.041000  0.000000       0.000000  
1 1 1 20 0  6  o 13.81000 0.5704000 13.81000 0.5704000 13.81000 0.5704000 0.000000       0.000000  
1 1 1 20 0  8  o 2.527000 1.123000  2.527000 1.123000  2.527000 1.123000  0.000000       0.000000  
1 1 1 20 0  10 o 22.60000 0.3733000 22.60000 0.3733000 22.60000 0.3733000 0.000000       0.000000  
1 1 1 20 0  12 o 45.18000 0.4916000 45.18000 0.4916000 45.18000 0.4916000 0.000000       0.000000  
1 1 1 20 0  14 o 18.14000 0.4466000 18.14000 0.4466000 18.14000 0.4466000 0.000000       0.000000  
1 1 1 20 0  16 o 31.05000 0.4064000 31.05000 0.4064000 31.05000 0.4064000 0.000000       0.000000  
1 1 1 20 0  18 o 9.735000 0.5801000 9.735000 0.5801000 9.735000 0.5801000 0.000000       0.000000  
1 1 1 20 0  20 o 8.023000 0.7332000 8.023000 0.7332000 8.023000 0.7332000 0.000000       0.000000  
1 1 1 20 0  22 o 48.17000 0.6055000 48.17000 0.6055000 48.17000 0.6055000 0.000000       0.000000  
1 1 1 20 0  24 o 33.95000 0.4334000 33.95000 0.4334000 33.95000 0.4334000 0.000000       0.000000  
1 1 1 20 0  26 o 39.63000 0.5416000 39.63000 0.5416000 39.63000 0.5416000 0.000000       0.000000  
1 1 1 20 0  28 o 64.23000 0.7651000 64.23000 0.7651000 64.23000 0.7651000 0.000000       0.000000  
1 1 1 20 0  30 o 17.73000 0.4702000 17.73000 0.4702000 17.73000 0.4702000 0.000000       0.000000  
1 1 1 20 0  32 o 55.46000 0.5960000 55.46000 0.5960000 55.46000 0.5960000 0.000000       0.000000  
1 1 1 20 0  34 o 11.04000 0.7366000 11.04000 0.7366000 11.04000 0.7366000 0.000000       0.000000  
1 1 1 20 0  36 o 37.98000 0.4809000 37.98000 0.4809000 37.98000 0.4809000 0.000000       0.000000  
1 1 1 20 0  38 o 21.40000 0.4756000 21.40000 0.4756000 21.40000 0.4756000 0.000000       0.000000  
1 1 1 20 0  40 o 22.50000 0.5689000 22.50000 0.5689000 22.50000 0.5689000 0.000000       0.000000  
1 1 1 20 0  42 o 18.48000 0.5025000 18.48000 0.5025000 18.48000 0.5025000 0.000000       0.000000  
1 1 1 20 0  44 o 12.41000 0.6852000 12.41000 0.6852000 12.41000 0.6852000 0.000000       0.000000  
1 1 1 20 0  46 o 29.43000 0.4507000 29.43000 0.4507000 29.43000 0.4507000 0.000000       0.000000  
1 1 1 20 0  48 o 2.885000 1.242000  2.885000 1.242000  2.885000 1.242000  0.000000       0.000000  
1 1 1 20 0  50 o 3.676000 1.323000  3.676000 1.323000  3.676000 1.323000  0.000000       0.000000  
1 1 1 20 0  52 f 2.713000 1.230000  2.713000 1.230000  2.713000 1.230000  0.000000       0.000000  
1 1 1 20 0  54 o 6.960000 1.086000  6.960000 1.086000  6.960000 1.086000  0.000000       0.000000  
1 1 1 20 0  56 o 4.685000 1.424000  4.685000 1.424000  4.685000 1.424000  0.000000       0.000000  
1 1 1 20 0  58 o 9.347000 0.8795000 9.347000 0.8795000 9.347000 0.8795000 0.000000       0.000000  
1 1 1 20 0  60 o 4.078000 1.422000  4.078000 1.422000  4.078000 1.422000  0.000000       0.000000  
1 1 1 20 1  1  o 139.5000 0.9547000 138.3000 1.339000  140.7000 1.361000  -2.430000      1.909000  
1 1 1 20 1  3  o 12.07000 0.3525000 11.46000 0.4738000 12.67000 0.5220000 -1.206000      0.7050000 
1 1 1 20 1  5  f 24.28000 0.2618000 24.37000 0.3724000 24.18000 0.3681000 0.1899000      0.5236000 
1 1 1 20 1  7  o 53.14000 0.4235000 53.01000 0.6396000 53.27000 0.5553000 -0.2616000     0.8470000 
1 1 1 20 1  9  o 62.71000 0.5203000 62.39000 0.7326000 63.03000 0.7389000 -0.6402000     1.041000  
1 1 1 20 1  11 o 74.24000 0.5661000 73.78000 0.8510000 74.70000 0.7469000 -0.9261000     1.132000  
1 1 1 20 1  13 o 73.18000 0.5578000 73.01000 0.7298000 73.36000 0.8438000 -0.3447000     1.116000  
1 1 1 20 1  15 o 58.37000 0.4590000 58.83000 0.6970000 57.90000 0.5974000 0.9291000      0.9180000 
1 1 1 20 1  17 o 49.75000 0.3757000 49.60000 0.5294000 49.91000 0.5333000 -0.3059000     0.7514000 
1 1 1 20 1  19 o 44.37000 0.4033000 43.45000 0.5602000 45.28000 0.5803000 -1.829000      0.8066000 
1 1 1 20 1  21 o 72.81000 0.5186000 73.06000 0.7357000 72.57000 0.7310000 0.4891000      1.037000  
1 1 1 20 1  23 o 50.31000 0.4152000 50.72000 0.6325000 49.89000 0.5382000 0.8247000      0.8305000 
1 1 1 20 1  25 o 10.55000 0.4684000 10.60000 0.6998000 10.51000 0.6228000 0.9029000E-01  0.9368000 
1 1 1 20 1  27 o 29.29000 0.3866000 29.68000 0.4906000 28.89000 0.5975000 0.7854000      0.7732000 
1 1 1 20 1  29 o 12.18000 0.4681000 12.06000 0.6020000 12.30000 0.7169000 -0.2356000     0.9362000 
1 1 1 20 1  31 o 7.366000 0.7708000 7.041000 1.123000  7.692000 1.056000  -0.6507000     1.542000  
1 1 1 20 1  33 o 5.457000 0.8938000 5.911000 1.174000  5.004000 1.348000  0.9068000      1.788000  
1 1 1 20 1  35 o 40.92000 0.3556000 40.54000 0.4988000 41.29000 0.5070000 -0.7501000     0.7112000 
1 1 1 20 1  37 o 22.15000 0.3355000 22.20000 0.4778000 22.11000 0.4711000 0.8843000E-01  0.6710000 
1 1 1 20 1  39 o 11.60000 0.5550000 10.97000 0.7288000 12.22000 0.8373000 -1.253000      1.110000  
1 1 1 20 1  41 o 26.12000 0.4265000 26.16000 0.6516000 26.08000 0.5505000 0.7810000E-01  0.8530000 
1 1 1 20 1  43 o 10.99000 0.4819000 12.00000 0.6394000 9.980000 0.7212000 2.022000       0.9638000 
1 1 1 20 1  45 o 9.327000 0.5586000 8.783000 0.8223000 9.871000 0.7562000 -1.088000      1.117000  
1 1 1 20 1  47 o 17.09000 0.3502000 17.16000 0.5218000 17.03000 0.4672000 0.1286000      0.7004000 
1 1 1 20 1  49 o 7.721000 0.6422000 8.084000 0.8601000 7.358000 0.9538000 0.7259000      1.284000  
1 1 1 20 1  51 o 7.503000 0.7074000 6.251000 1.118000  8.754000 0.8667000 -2.504000      1.415000  
1 1 1 20 1  53 o 7.709000 0.7829000 8.114000 0.9998000 7.304000 1.205000  0.8098000      1.566000  
1 1 1 20 1  55 o 7.719000 0.9604000 8.633000 1.104000  6.805000 1.572000  1.828000       1.921000  
1 1 1 20 1  57 o 5.849000 0.9116000 5.926000 1.301000  5.772000 1.277000  0.1547000      1.823000  
1 1 1 20 1  59 f 5.168000 0.9443000 5.566000 1.279000  4.770000 1.389000  0.7953000      1.889000  
1 1 1 20 1  61 o 3.360000 1.031000  3.754000 1.627000  2.966000 1.266000  0.7877000      2.061000  
1 1 1 20 2  0  o 117.3000 1.143000  117.3000 1.143000  117.3000 1.143000  0.000000       0.000000  
1 1 1 20 2  2  o 132.1000 1.045000  133.6000 1.494000  130.6000 1.462000  2.966000       2.090000  
1 1 1 20 2  4  o 66.18000 0.4713000 66.23000 0.6667000 66.13000 0.6664000 0.1023000      0.9426000 
1 1 1 20 2  6  o 36.83000 0.3260000 36.70000 0.4923000 36.97000 0.4275000 -0.2628000     0.6520000 
1 1 1 20 2  8  o 39.48000 0.3182000 39.03000 0.4465000 39.92000 0.4535000 -0.8894000     0.6364000 
1 1 1 20 2  10 o 64.72000 0.5026000 64.20000 0.6513000 65.24000 0.7655000 -1.037000      1.005000  
1 1 1 20 2  12 o 23.48000 0.3398000 23.36000 0.4341000 23.60000 0.5230000 -0.2473000     0.6797000 
1 1 1 20 2  14 f 21.95000 0.2708000 22.25000 0.3862000 21.65000 0.3798000 0.6050000      0.5417000 
1 1 1 20 2  16 o 26.59000 0.2966000 26.49000 0.4431000 26.69000 0.3945000 -0.1985000     0.5933000 
1 1 1 20 2  18 o 68.20000 0.5277000 67.26000 0.6803000 69.13000 0.8068000 -1.868000      1.055000  
1 1 1 20 2  20 o 42.11000 0.3388000 42.12000 0.4788000 42.10000 0.4794000 0.2000000E-01  0.6776000 
1 1 1 20 2  22 o 10.57000 0.4289000 9.754000 0.6390000 11.38000 0.5723000 -1.627000      0.8578000 
1 1 1 20 2  24 o 14.97000 0.4367000 14.75000 0.7299000 15.19000 0.4796000 -0.4422000     0.8734000 
1 1 1 20 2  26 o 3.609000 0.9123000 3.621000 1.295000  3.597000 1.285000  0.2487000E-01  1.825000  
1 1 1 20 2  28 o 10.15000 0.5424000 10.23000 0.5849000 10.07000 0.9135000 0.1579000      1.085000  
1 1 1 20 2  30 o 37.28000 0.3542000 37.40000 0.4642000 37.16000 0.5351000 0.2429000      0.7084000 
1 1 1 20 2  32 o 21.35000 0.3204000 20.89000 0.4483000 21.82000 0.4580000 -0.9261000     0.6409000 
1 1 1 20 2  34 o 47.96000 0.3840000 48.32000 0.5438000 47.59000 0.5424000 0.7325000      0.7681000 
1 1 1 20 2  36 o 3.039000 0.9293000 2.743000 1.230000  3.335000 1.393000  -0.5917000     1.859000  
1 1 1 20 2  38 o 21.27000 0.3761000 21.51000 0.4803000 21.03000 0.5789000 0.4825000      0.7522000 
1 1 1 20 2  40 o 22.39000 0.3375000 22.34000 0.4689000 22.44000 0.4856000 -0.9729000E-01 0.6751000 
1 1 1 20 2  42 o 10.61000 0.6367000 9.901000 0.7850000 11.32000 1.003000  -1.414000      1.273000  
1 1 1 20 2  44 o 13.77000 0.5293000 14.41000 0.8196000 13.14000 0.6701000 1.271000       1.059000  
1 1 1 20 2  46 o 18.50000 0.3410000 18.51000 0.4872000 18.48000 0.4773000 0.3115000E-01  0.6820000 
1 1 1 20 2  48 o 8.627000 0.5521000 8.553000 0.8114000 8.700000 0.7490000 -0.1472000     1.104000  
1 1 1 20 2  50 f 5.420000 0.9354000 5.870000 1.228000  4.970000 1.412000  0.9000000      1.871000  
1 1 1 20 2  52 o 4.873000 1.012000  5.320000 1.342000  4.427000 1.515000  0.8931000      2.024000  
1 1 1 20 2  54 o 4.809000 1.069000  4.193000 1.574000  5.425000 1.445000  -1.232000      2.137000  
1 1 1 20 2  56 o 11.01000 0.5169000 10.47000 0.7658000 11.54000 0.6944000 -1.070000      1.034000  
1 1 1 20 2  58 o 5.373000 0.9582000 5.999000 1.310000  4.747000 1.399000  1.252000       1.916000  
1 1 1 20 2  60 o 4.640000 1.113000  6.118000 1.784000  3.162000 1.330000  2.956000       2.225000  
1 1 1 20 3  1  o 54.65000 0.4610000 54.44000 0.6480000 54.86000 0.6559000 -0.4106000     0.9220000 
1 1 1 20 3  3  o 23.86000 0.2622000 23.85000 0.3678000 23.87000 0.3738000 -0.2096000E-01 0.5244000 
1 1 1 20 3  5  f 44.16000 0.3672000 44.81000 0.5587000 43.52000 0.4766000 1.291000       0.7344000 
1 1 1 20 3  7  o 35.54000 0.2989000 35.60000 0.4255000 35.48000 0.4200000 0.1173000      0.5979000 
1 1 1 20 3  9  o 68.36000 0.4863000 68.39000 0.6882000 68.33000 0.6874000 0.6618000E-01  0.9727000 
1 1 1 20 3  11 o 87.88000 0.6627000 87.25000 0.8598000 88.50000 1.009000  -1.245000      1.325000  
1 1 1 20 3  13 o 68.85000 0.5658000 67.81000 0.7880000 69.88000 0.8120000 -2.071000      1.132000  
1 1 1 20 3  15 o 68.71000 0.6350000 67.79000 0.7892000 69.62000 0.9950000 -1.833000      1.270000  
1 1 1 20 3  17 o 12.82000 0.3776000 13.13000 0.4796000 12.50000 0.5833000 0.6235000      0.7552000 
1 1 1 20 3  19 o 54.85000 0.4070000 54.71000 0.5736000 54.98000 0.5775000 -0.2717000     0.8140000 
1 1 1 20 3  21 o 44.23000 0.3484000 44.10000 0.4924000 44.36000 0.4931000 -0.2611000     0.6969000 
1 1 1 20 3  23 o 16.52000 0.3331000 17.00000 0.4972000 16.04000 0.4434000 0.9647000      0.6662000 
1 1 1 20 3  25 o 18.61000 0.3322000 18.54000 0.5105000 18.69000 0.4253000 -0.1409000     0.6644000 
1 1 1 20 3  27 o 53.03000 0.4335000 53.70000 0.5750000 52.36000 0.6490000 1.341000       0.8671000 
1 1 1 20 3  29 o 58.37000 0.4501000 58.57000 0.5522000 58.18000 0.7109000 0.3976000      0.9002000 
1 1 1 20 3  31 o 44.81000 0.4186000 45.46000 0.5972000 44.17000 0.5868000 1.297000       0.8373000 
1 1 1 20 3  33 o 14.94000 0.3958000 15.18000 0.5554000 14.69000 0.5641000 0.4893000      0.7916000 
1 1 1 20 3  35 o 14.19000 0.4265000 13.72000 0.6003000 14.65000 0.6059000 -0.9342000     0.8530000 
1 1 1 20 3  37 o 20.76000 0.3758000 20.80000 0.4826000 20.73000 0.5762000 0.7217000E-01  0.7516000 
1 1 1 20 3  39 o 18.50000 0.3689000 18.04000 0.5208000 18.95000 0.5226000 -0.9092000     0.7378000 
1 1 1 20 3  41 o 20.78000 0.4352000 20.14000 0.5647000 21.42000 0.6624000 -1.284000      0.8704000 
1 1 1 20 3  43 o 15.39000 0.3856000 15.97000 0.5244000 14.81000 0.5655000 1.160000       0.7712000 
1 1 1 20 3  45 o 26.54000 0.3595000 27.35000 0.5574000 25.73000 0.4541000 1.617000       0.7189000 
1 1 1 20 3  47 o 20.55000 0.3347000 21.10000 0.4716000 20.00000 0.4751000 1.098000       0.6694000 
1 1 1 20 3  49 o 9.014000 0.5462000 8.815000 0.7861000 9.213000 0.7586000 -0.3973000     1.092000  
1 1 1 20 3  51 o 8.443000 0.6443000 8.526000 0.9026000 8.359000 0.9197000 0.1676000      1.289000  
1 1 1 20 3  53 o 10.02000 0.6142000 9.695000 0.9018000 10.35000 0.8342000 -0.6525000     1.228000  
1 1 1 20 3  55 f 6.209000 1.031000  5.192000 1.659000  7.227000 1.223000  -2.035000      2.061000  
1 1 1 20 3  57 o 5.182000 1.056000  4.511000 1.587000  5.853000 1.393000  -1.342000      2.111000  
1 1 1 20 3  59 o 10.01000 0.6123000 10.06000 0.9516000 9.968000 0.7709000 0.9107000E-01  1.225000  
1 1 1 20 3  61 o 3.368000 0.9691000 3.322000 1.350000  3.415000 1.391000  -0.9342000E-01 1.938000  
1 1 1 20 4  0  o 42.40000 0.4653000 42.40000 0.4653000 42.40000 0.4653000 0.000000       0.000000  
1 1 1 20 4  2  o 28.49000 0.2900000 28.73000 0.4373000 28.25000 0.3810000 0.4833000      0.5800000 
1 1 1 20 4  4  o 60.94000 0.5646000 61.13000 0.8750000 60.74000 0.7138000 0.3931000      1.129000  
1 1 1 20 4  6  o 49.83000 0.3719000 49.45000 0.5225000 50.20000 0.5293000 -0.7523000     0.7438000 
1 1 1 20 4  8  o 106.0000 0.7312000 105.9000 1.033000  106.1000 1.035000  -0.1391000     1.462000  
1 1 1 20 4  10 o 11.80000 0.3690000 12.35000 0.4920000 11.26000 0.5501000 1.090000       0.7381000 
1 1 1 20 4  12 o 58.08000 0.6651000 57.79000 0.5952000 58.37000 1.190000  -0.5715000     1.330000  
1 1 1 20 4  14 o 29.44000 0.3020000 28.88000 0.3935000 30.00000 0.4583000 -1.118000      0.6041000 
1 1 1 20 4  16 o 77.45000 0.6304000 77.10000 0.8854000 77.79000 0.8976000 -0.6924000     1.261000  
1 1 1 20 4  18 o 17.80000 0.2940000 17.25000 0.4246000 18.35000 0.4068000 -1.105000      0.5880000 
1 1 1 20 4  20 o 32.81000 0.2964000 32.64000 0.4188000 32.97000 0.4195000 -0.3230000     0.5928000 
1 1 1 20 4  22 f 44.18000 0.3756000 44.04000 0.5660000 44.33000 0.4939000 -0.2918000     0.7512000 
1 1 1 20 4  24 o 9.894000 0.4530000 9.825000 0.6486000 9.962000 0.6326000 -0.1373000     0.9060000 
1 1 1 20 4  26 o 18.54000 0.3635000 17.78000 0.5142000 19.30000 0.5140000 -1.516000      0.7270000 
1 1 1 20 4  28 o 15.16000 0.4130000 14.52000 0.4513000 15.81000 0.6919000 -1.296000      0.8261000 
1 1 1 20 4  30 o 33.41000 0.4774000 33.34000 0.4028000 33.49000 0.8657000 -0.1439000     0.9549000 
1 1 1 20 4  32 o 49.89000 0.4214000 50.25000 0.6344000 49.54000 0.5548000 0.7030000      0.8428000 
1 1 1 20 4  34 o 8.989000 0.6154000 9.939000 0.7460000 8.040000 0.9790000 1.899000       1.231000  
1 1 1 20 4  36 o 24.75000 0.3651000 24.39000 0.4776000 25.11000 0.5524000 -0.7287000     0.7302000 
1 1 1 20 4  38 f 13.11000 0.4622000 12.13000 0.6795000 14.09000 0.6268000 -1.954000      0.9244000 
1 1 1 20 4  40 o 5.712000 1.004000  6.103000 1.332000  5.321000 1.501000  0.7818000      2.007000  
1 1 1 20 4  42 o 12.02000 0.4966000 11.64000 0.6709000 12.41000 0.7322000 -0.7763000     0.9931000 
1 1 1 20 4  44 o 9.155000 0.6225000 9.575000 0.8543000 8.736000 0.9058000 0.8390000      1.245000  
1 1 1 20 4  46 o 10.34000 0.5851000 10.31000 0.9091000 10.36000 0.7369000 -0.5256000E-01 1.170000  
1 1 1 20 4  48 o 5.506000 0.8575000 4.082000 1.420000  6.930000 0.9611000 -2.848000      1.715000  
1 1 1 20 4  50 o 10.77000 0.5313000 11.03000 0.7056000 10.50000 0.7946000 0.5240000      1.063000  
1 1 1 20 4  52 o 7.418000 0.6901000 7.572000 0.9989000 7.264000 0.9524000 0.3076000      1.380000  
1 1 1 20 4  54 o 16.37000 0.4072000 16.86000 0.5584000 15.88000 0.5928000 0.9832000      0.8143000 
1 1 1 20 4  56 o 14.26000 0.4404000 13.63000 0.6528000 14.89000 0.5914000 -1.259000      0.8809000 
1 1 1 20 4  58 o 7.586000 0.8981000 6.693000 1.525000  8.480000 0.9487000 -1.788000      1.796000  
1 1 1 20 4  60 o 5.728000 0.9108000 5.030000 1.435000  6.425000 1.123000  -1.395000      1.822000  
1 1 1 20 5  1  o 61.39000 0.5084000 61.21000 0.7177000 61.58000 0.7203000 -0.3612000     1.017000  
1 1 1 20 5  3  o 71.34000 0.5819000 71.72000 0.8281000 70.97000 0.8179000 0.7555000      1.164000  
1 1 1 20 5  5  o 38.24000 0.3320000 38.55000 0.4371000 37.93000 0.4997000 0.6186000      0.6639000 
1 1 1 20 5  7  f 30.05000 0.2961000 30.09000 0.3928000 30.00000 0.4431000 0.8676000E-01  0.5921000 
1 1 1 20 5  9  o 72.62000 0.5542000 73.14000 0.7315000 72.10000 0.8327000 1.043000       1.108000  
1 1 1 20 5  11 o 48.28000 0.5678000 48.10000 0.5135000 48.47000 1.013000  -0.3709000     1.136000  
1 1 1 20 5  13 o 50.40000 0.4090000 50.04000 0.5309000 50.76000 0.6224000 -0.7247000     0.8180000 
1 1 1 20 5  15 o 49.19000 0.3711000 49.15000 0.5249000 49.23000 0.5246000 -0.7969000E-01 0.7422000 
1 1 1 20 5  17 o 33.61000 0.3153000 33.61000 0.4742000 33.60000 0.4156000 0.1443000E-01  0.6305000 
1 1 1 20 5  19 o 60.66000 0.5665000 59.98000 0.8672000 61.34000 0.7292000 -1.359000      1.133000  
1 1 1 20 5  21 o 33.94000 0.3243000 34.39000 0.4920000 33.49000 0.4225000 0.9044000      0.6485000 
1 1 1 20 5  23 o 28.31000 0.3109000 28.33000 0.4109000 28.29000 0.4667000 0.4182000E-01  0.6218000 
1 1 1 20 5  25 o 36.26000 0.3448000 36.22000 0.4512000 36.31000 0.5215000 -0.9566000E-01 0.6896000 
1 1 1 20 5  27 o 35.06000 0.3451000 34.67000 0.4504000 35.45000 0.5230000 -0.7885000     0.6902000 
1 1 1 20 5  29 o 27.05000 0.3093000 27.49000 0.3768000 26.62000 0.4905000 0.8698000      0.6185000 
1 1 1 20 5  31 o 24.85000 0.3401000 25.36000 0.4249000 24.35000 0.5311000 1.012000       0.6801000 
1 1 1 20 5  33 o 17.96000 0.3638000 17.76000 0.5040000 18.15000 0.5247000 -0.3863000     0.7276000 
1 1 1 20 5  35 o 15.17000 0.4512000 14.98000 0.5665000 15.37000 0.7024000 -0.3917000     0.9024000 
1 1 1 20 5  37 o 12.20000 0.4899000 11.59000 0.7086000 12.80000 0.6765000 -1.209000      0.9797000 
1 1 1 20 5  39 o 4.834000 1.052000  4.569000 1.447000  5.099000 1.526000  -0.5298000     2.103000  
1 1 1 20 5  41 o 18.58000 0.4080000 18.95000 0.5728000 18.21000 0.5811000 0.7467000      0.8159000 
1 1 1 20 5  43 o 25.73000 0.3684000 26.06000 0.5419000 25.40000 0.4994000 0.6581000      0.7369000 
1 1 1 20 5  45 o 23.77000 0.3268000 24.39000 0.4636000 23.15000 0.4607000 1.242000       0.6535000 
1 1 1 20 5  47 o 22.13000 0.3640000 22.61000 0.5616000 21.65000 0.4633000 0.9664000      0.7281000 
1 1 1 20 5  49 o 14.95000 0.3990000 14.73000 0.5760000 15.17000 0.5525000 -0.4483000     0.7981000 
1 1 1 20 5  51 o 9.063000 0.5837000 9.387000 0.7965000 8.738000 0.8535000 0.6487000      1.167000  
1 1 1 20 5  53 o 5.834000 0.9338000 5.406000 1.430000  6.261000 1.201000  -0.8554000     1.868000  
1 1 1 20 5  55 o 9.313000 0.7271000 8.659000 1.093000  9.966000 0.9592000 -1.307000      1.454000  
1 1 1 20 5  57 o 6.055000 0.8766000 6.439000 1.260000  5.671000 1.219000  0.7675000      1.753000  
1 1 1 20 5  59 o 2.911000 0.8962000 3.060000 1.319000  2.763000 1.214000  0.2967000      1.792000  
1 1 1 20 5  61 o 4.111000 1.011000  3.607000 1.348000  4.616000 1.508000  -1.009000      2.022000  
1 1 1 20 6  0  o 21.72000 0.4089000 21.72000 0.4089000 21.72000 0.4089000 0.000000       0.000000  
1 1 1 20 6  2  o 70.11000 0.5362000 69.23000 0.6939000 70.98000 0.8176000 -1.750000      1.072000  
1 1 1 20 6  4  o 76.89000 0.5831000 76.11000 0.7561000 77.66000 0.8878000 -1.547000      1.166000  
1 1 1 20 6  6  o 49.43000 0.3981000 48.94000 0.5170000 49.91000 0.6056000 -0.9675000     0.7963000 
1 1 1 20 6  8  o 26.28000 0.3365000 25.77000 0.4209000 26.79000 0.5252000 -1.024000      0.6730000 
1 1 1 20 6  10 o 33.32000 0.3479000 32.84000 0.4078000 33.79000 0.5638000 -0.9523000     0.6958000 
1 1 1 20 6  12 o 50.96000 0.4117000 50.97000 0.5389000 50.94000 0.6226000 0.2335000E-01  0.8234000 
1 1 1 20 6  14 o 47.69000 0.3636000 47.11000 0.5094000 48.27000 0.5190000 -1.166000      0.7273000 
1 1 1 20 6  16 o 47.20000 0.3887000 46.99000 0.5845000 47.40000 0.5125000 -0.4083000     0.7774000 
1 1 1 20 6  18 o 42.64000 0.3627000 42.53000 0.5454000 42.74000 0.4782000 -0.2117000     0.7254000 
1 1 1 20 6  20 o 59.11000 0.4332000 58.42000 0.6068000 59.80000 0.6184000 -1.388000      0.8664000 
1 1 1 20 6  22 o 18.58000 0.3354000 18.41000 0.4830000 18.74000 0.4656000 -0.3292000     0.6708000 
1 1 1 20 6  24 o 41.74000 0.3386000 41.70000 0.4803000 41.78000 0.4774000 -0.8054000E-01 0.6772000 
1 1 1 20 6  26 o 11.88000 0.4272000 12.31000 0.5110000 11.44000 0.6848000 0.8699000      0.8544000 
1 1 1 20 6  28 o 32.27000 0.3788000 32.47000 0.4372000 32.06000 0.6187000 0.4034000      0.7575000 
1 1 1 20 6  30 o 54.67000 0.4894000 54.74000 0.5240000 54.60000 0.8267000 0.1385000      0.9788000 
1 1 1 20 6  32 o 39.22000 0.4142000 38.91000 0.6660000 39.53000 0.4925000 -0.6174000     0.8284000 
1 1 1 20 6  34 o 33.60000 0.3561000 33.78000 0.4549000 33.43000 0.5479000 0.3514000      0.7121000 
1 1 1 20 6  36 o 31.01000 0.3282000 31.23000 0.4597000 30.80000 0.4684000 0.4273000      0.6563000 
1 1 1 20 6  38 o 34.89000 0.3654000 35.31000 0.4814000 34.46000 0.5499000 0.8542000      0.7309000 
1 1 1 20 6  40 o 8.675000 0.6146000 8.405000 0.8894000 8.945000 0.8483000 -0.5398000     1.229000  
1 1 1 20 6  42 o 4.630000 1.064000  4.574000 1.483000  4.687000 1.525000  -0.1125000     2.127000  
1 1 1 20 6  44 f 22.95000 0.4057000 22.90000 0.6584000 23.00000 0.4743000 -0.9503000E-01 0.8114000 
1 1 1 20 6  46 o 12.32000 0.4605000 12.44000 0.6745000 12.20000 0.6271000 0.2469000      0.9210000 
1 1 1 20 6  48 o 15.91000 0.3876000 15.82000 0.5762000 16.01000 0.5186000 -0.1930000     0.7752000 
1 1 1 20 6  50 o 9.079000 0.5959000 9.123000 0.8344000 9.035000 0.8509000 0.8774000E-01  1.192000  
1 1 1 20 6  52 o 3.695000 1.009000  2.980000 1.265000  4.411000 1.573000  -1.431000      2.019000  
1 1 1 20 6  54 o 7.370000 0.7376000 7.289000 1.092000  7.451000 0.9915000 -0.1624000     1.475000  
1 1 1 20 6  56 o 7.178000 0.8928000 6.107000 1.502000  8.249000 0.9653000 -2.141000      1.786000  
1 1 1 20 6  58 o 7.983000 0.6583000 8.268000 0.9142000 7.697000 0.9474000 0.5707000      1.317000  
1 1 1 20 6  60 o 3.744000 0.9554000 4.428000 1.415000  3.059000 1.284000  1.369000       1.911000  
1 1 1 20 7  1  o 26.60000 0.2625000 26.24000 0.3665000 26.96000 0.3758000 -0.7219000     0.5249000 
1 1 1 20 7  3  o 68.61000 0.4871000 68.78000 0.6898000 68.44000 0.6879000 0.3398000      0.9742000 
1 1 1 20 7  5  o 62.46000 0.4487000 62.17000 0.6320000 62.74000 0.6372000 -0.5674000     0.8974000 
1 1 1 20 7  7  f 64.26000 0.4955000 64.73000 0.6552000 63.79000 0.7434000 0.9420000      0.9909000 
1 1 1 20 7  9  o 105.1000 0.7819000 105.5000 1.030000  104.6000 1.177000  0.9314000      1.564000  
1 1 1 20 7  11 o 50.16000 0.4319000 49.91000 0.6087000 50.40000 0.6129000 -0.4908000     0.8638000 
1 1 1 20 7  13 o 45.36000 0.3782000 45.19000 0.4911000 45.53000 0.5752000 -0.3460000     0.7564000 
1 1 1 20 7  15 o 58.07000 0.4563000 57.82000 0.6855000 58.32000 0.6026000 -0.4992000     0.9127000 
1 1 1 20 7  17 o 24.06000 0.3253000 23.56000 0.5216000 24.57000 0.3887000 -1.014000      0.6505000 
1 1 1 20 7  19 o 51.07000 0.3841000 50.95000 0.5412000 51.19000 0.5451000 -0.2434000     0.7681000 
1 1 1 20 7  21 o 41.34000 0.3337000 41.59000 0.4743000 41.08000 0.4696000 0.5100000      0.6675000 
1 1 1 20 7  23 o 79.90000 0.5641000 80.32000 0.8023000 79.48000 0.7930000 0.8393000      1.128000  
1 1 1 20 7  25 o 56.38000 0.5428000 55.72000 0.6733000 57.04000 0.8516000 -1.318000      1.086000  
1 1 1 20 7  27 o 17.99000 0.3267000 18.11000 0.3910000 17.87000 0.5235000 0.2380000      0.6533000 
1 1 1 20 7  29 o 26.69000 0.4618000 27.06000 0.4308000 26.33000 0.8171000 0.7285000      0.9237000 
1 1 1 20 7  31 o 13.85000 0.4108000 13.23000 0.5078000 14.46000 0.6460000 -1.238000      0.8217000 
1 1 1 20 7  33 o 30.29000 0.3798000 30.59000 0.5233000 29.99000 0.5506000 0.6006000      0.7596000 
1 1 1 20 7  35 o 44.61000 0.3716000 44.96000 0.5228000 44.26000 0.5281000 0.6972000      0.7431000 
1 1 1 20 7  37 o 13.73000 0.4840000 13.55000 0.6383000 13.91000 0.7279000 -0.3582000     0.9681000 
1 1 1 20 7  39 o 10.46000 0.5626000 9.645000 0.8557000 11.28000 0.7307000 -1.640000      1.125000  
1 1 1 20 7  41 o 6.650000 0.8014000 6.643000 1.119000  6.657000 1.147000  -0.1468000E-01 1.603000  
1 1 1 20 7  43 f 13.46000 0.4696000 13.37000 0.6436000 13.55000 0.6841000 -0.1820000     0.9393000 
1 1 1 20 7  45 f 9.920000 0.6030000 9.326000 0.9732000 10.51000 0.7124000 -1.187000      1.206000  
1 1 1 20 7  47 o 12.98000 0.4383000 13.62000 0.6310000 12.34000 0.6084000 1.277000       0.8765000 
1 1 1 20 7  49 o 16.18000 0.3875000 16.39000 0.5623000 15.97000 0.5331000 0.4189000      0.7749000 
1 1 1 20 7  51 o 3.503000 1.001000  3.388000 1.392000  3.618000 1.438000  -0.2300000     2.001000  
1 1 1 20 7  53 o 17.64000 0.4401000 17.99000 0.6440000 17.30000 0.6000000 0.6906000      0.8802000 
1 1 1 20 7  55 o 7.881000 0.7165000 8.804000 0.9051000 6.958000 1.111000  1.846000       1.433000  
1 1 1 20 7  57 o 4.920000 1.075000  4.488000 1.609000  5.352000 1.425000  -0.8640000     2.149000  
1 1 1 20 7  59 o 5.233000 1.011000  6.355000 1.451000  4.111000 1.408000  2.244000       2.022000  
1 1 1 20 7  61 o 3.335000 0.9810000 3.303000 1.396000  3.367000 1.379000  -0.6394000E-01 1.962000  
1 1 1 20 8  0  o 19.34000 0.3697000 19.34000 0.3697000 19.34000 0.3697000 0.000000       0.000000  
1 1 1 20 8  2  o 77.20000 0.5420000 76.71000 0.7621000 77.69000 0.7710000 -0.9792000     1.084000  
1 1 1 20 8  4  o 32.14000 0.2813000 32.25000 0.3978000 32.02000 0.3979000 0.2327000      0.5626000 
1 1 1 20 8  6  o 68.99000 0.6003000 69.38000 0.6968000 68.59000 0.9777000 0.7924000      1.201000  
1 1 1 20 8  8  o 77.15000 0.6642000 76.92000 0.7647000 77.38000 1.086000  -0.4567000     1.328000  
1 1 1 20 8  10 o 44.76000 0.3743000 44.85000 0.4885000 44.66000 0.5673000 0.1897000      0.7487000 
1 1 1 20 8  12 f 86.03000 0.7745000 86.23000 0.9806000 85.83000 1.199000  0.3944000      1.549000  
1 1 1 20 8  14 o 23.70000 0.2830000 23.56000 0.4183000 23.84000 0.3812000 -0.2777000     0.5659000 
1 1 1 20 8  16 o 61.80000 0.4818000 61.30000 0.7220000 62.30000 0.6382000 -1.003000      0.9637000 
1 1 1 20 8  18 o 47.72000 0.3650000 47.29000 0.5132000 48.14000 0.5191000 -0.8505000     0.7299000 
1 1 1 20 8  20 o 20.73000 0.2788000 20.40000 0.3917000 21.05000 0.3969000 -0.6438000     0.5576000 
1 1 1 20 8  22 o 36.65000 0.3136000 36.82000 0.4462000 36.48000 0.4407000 0.3444000      0.6271000 
1 1 1 20 8  24 o 52.01000 0.4245000 52.52000 0.5590000 51.51000 0.6391000 1.006000       0.8491000 
1 1 1 20 8  26 o 8.580000 0.5545000 8.556000 0.6284000 8.604000 0.9137000 -0.4865000E-01 1.109000  
1 1 1 20 8  28 o 4.382000 0.9910000 4.611000 1.190000  4.154000 1.585000  0.4578000      1.982000  
1 1 1 20 8  30 o 6.813000 0.8325000 6.667000 1.097000  6.958000 1.253000  -0.2909000     1.665000  
1 1 1 20 8  32 o 23.77000 0.3943000 24.10000 0.4290000 23.43000 0.6616000 0.6664000      0.7885000 
1 1 1 20 8  34 o 38.54000 0.3721000 37.90000 0.5508000 39.19000 0.5006000 -1.284000      0.7443000 
1 1 1 20 8  36 o 17.49000 0.4181000 17.13000 0.5421000 17.85000 0.6368000 -0.7231000     0.8362000 
1 1 1 20 8  38 o 21.31000 0.3529000 21.34000 0.4887000 21.28000 0.5093000 0.6297000E-01  0.7059000 
1 1 1 20 8  40 o 18.95000 0.3828000 19.24000 0.5846000 18.66000 0.4942000 0.5724000      0.7655000 
1 1 1 20 8  42 o 20.51000 0.3710000 20.43000 0.4869000 20.58000 0.5599000 -0.1442000     0.7420000 
1 1 1 20 8  44 f 16.97000 0.4062000 16.56000 0.6202000 17.37000 0.5248000 -0.8109000     0.8125000 
1 1 1 20 8  46 o 11.90000 0.4625000 11.86000 0.6787000 11.95000 0.6285000 -0.9206000E-01 0.9250000 
1 1 1 20 8  48 o 7.794000 0.7828000 7.502000 1.165000  8.087000 1.046000  -0.5851000     1.566000  
1 1 1 20 8  50 o 6.517000 0.9038000 6.825000 1.194000  6.209000 1.357000  0.6166000      1.808000  
1 1 1 20 8  52 o 8.063000 1.156000  8.303000 2.113000  7.823000 0.9375000 0.4804000      2.312000  
1 1 1 20 8  54 o 3.964000 0.9998000 4.750000 1.468000  3.177000 1.357000  1.574000       2.000000  
1 1 1 20 8  56 o 13.15000 0.4775000 13.43000 0.6868000 12.88000 0.6636000 0.5430000      0.9550000 
1 1 1 20 8  58 o 4.292000 1.039000  4.562000 1.504000  4.022000 1.434000  0.5408000      2.078000  
1 1 1 20 8  60 o 4.160000 1.045000  5.269000 1.625000  3.052000 1.313000  2.217000       2.089000  
1 1 1 20 9  1  f 32.62000 0.2822000 32.62000 0.3985000 32.61000 0.3998000 0.8278000E-03  0.5645000 
1 1 1 20 9  3  o 58.81000 0.5202000 59.00000 0.6040000 58.61000 0.8472000 0.3848000      1.040000  
1 1 1 20 9  5  o 64.87000 0.5673000 64.36000 0.6511000 65.38000 0.9293000 -1.012000      1.135000  
1 1 1 20 9  7  o 59.53000 0.4663000 59.83000 0.6122000 59.24000 0.7036000 0.5845000      0.9326000 
1 1 1 20 9  9  o 82.05000 0.6651000 81.35000 0.9297000 82.76000 0.9513000 -1.411000      1.330000  
1 1 1 20 9  11 o 58.97000 0.4952000 59.24000 0.6976000 58.71000 0.7029000 0.5370000      0.9903000 
1 1 1 20 9  13 o 65.73000 0.6142000 65.03000 0.7585000 66.43000 0.9663000 -1.393000      1.228000  
1 1 1 20 9  15 o 35.96000 0.3935000 36.33000 0.4978000 35.59000 0.6096000 0.7397000      0.7870000 
1 1 1 20 9  17 o 24.66000 0.3156000 24.46000 0.4440000 24.86000 0.4487000 -0.4012000     0.6313000 
1 1 1 20 9  19 o 29.87000 0.2839000 29.76000 0.4002000 29.99000 0.4027000 -0.2348000     0.5678000 
1 1 1 20 9  21 o 49.97000 0.3786000 49.59000 0.5320000 50.35000 0.5387000 -0.7572000     0.7571000 
1 1 1 20 9  23 o 42.60000 0.3552000 42.76000 0.4328000 42.44000 0.5634000 0.3203000      0.7105000 
1 1 1 20 9  25 o 39.62000 0.3569000 39.61000 0.4613000 39.63000 0.5448000 -0.1771000E-01 0.7139000 
1 1 1 20 9  27 o 22.34000 0.3121000 22.56000 0.3690000 22.12000 0.5034000 0.4341000      0.6241000 
1 1 1 20 9  29 o 7.671000 0.8139000 6.435000 0.8720000 8.907000 1.375000  -2.473000      1.628000  
1 1 1 20 9  31 o 42.47000 0.5986000 41.27000 0.5636000 43.67000 1.056000  -2.401000      1.197000  
1 1 1 20 9  33 o 37.85000 0.3566000 37.46000 0.4320000 38.25000 0.5674000 -0.7824000     0.7131000 
1 1 1 20 9  35 o 38.33000 0.4035000 38.43000 0.5739000 38.24000 0.5674000 0.1861000      0.8071000 
1 1 1 20 9  37 o 16.28000 0.4062000 16.05000 0.5875000 16.50000 0.5611000 -0.4472000     0.8124000 
1 1 1 20 9  39 o 20.25000 0.3561000 20.02000 0.4960000 20.48000 0.5110000 -0.4556000     0.7121000 
1 1 1 20 9  41 o 20.67000 0.3802000 21.00000 0.5050000 20.35000 0.5685000 0.6529000      0.7604000 
1 1 1 20 9  43 o 16.39000 0.3992000 16.36000 0.5428000 16.42000 0.5856000 -0.5975000E-01 0.7985000 
1 1 1 20 9  45 o 22.84000 0.3353000 23.22000 0.4721000 22.46000 0.4763000 0.7589000      0.6707000 
1 1 1 20 9  47 o 22.59000 0.3610000 22.38000 0.4742000 22.81000 0.5445000 -0.4360000     0.7221000 
1 1 1 20 9  49 o 6.882000 0.8501000 7.327000 1.299000  6.436000 1.097000  0.8911000      1.700000  
1 1 1 20 9  51 o 7.397000 0.8205000 6.672000 1.325000  8.121000 0.9676000 -1.449000      1.641000  
1 1 1 20 9  53 o 7.088000 0.7918000 7.984000 1.029000  6.192000 1.203000  1.791000       1.584000  
1 1 1 20 9  55 o 8.680000 0.6224000 8.554000 0.9306000 8.806000 0.8268000 -0.2522000     1.245000  
1 1 1 20 9  57 o 7.425000 0.8132000 7.112000 1.166000  7.738000 1.134000  -0.6263000     1.626000  
1 1 1 20 9  59 o 8.238000 0.7650000 7.530000 1.107000  8.946000 1.056000  -1.415000      1.530000  
1 1 1 20 9  61 o 6.495000 1.238000  7.165000 1.530000  5.826000 1.946000  1.339000       2.476000  
1 1 1 20 10 0  o 3.298000 1.231000  3.298000 1.231000  3.298000 1.231000  0.000000       0.000000  
1 1 1 20 10 2  o 34.48000 0.3718000 34.40000 0.4644000 34.55000 0.5808000 -0.1526000     0.7436000 
1 1 1 20 10 4  o 42.62000 0.4279000 42.24000 0.5314000 43.00000 0.6708000 -0.7625000     0.8558000 
1 1 1 20 10 6  o 28.37000 0.2831000 28.40000 0.4228000 28.34000 0.3765000 0.6444000E-01  0.5662000 
1 1 1 20 10 8  o 56.38000 0.4732000 56.44000 0.6698000 56.31000 0.6685000 0.1310000      0.9463000 
1 1 1 20 10 10 o 57.73000 0.4521000 57.75000 0.6824000 57.71000 0.5934000 0.3971000E-01  0.9043000 
1 1 1 20 10 12 o 118.6000 0.8161000 118.5000 1.153000  118.7000 1.155000  -0.1794000     1.632000  
1 1 1 20 10 14 f 72.75000 0.5582000 72.93000 0.7314000 72.57000 0.8434000 0.3597000      1.116000  
1 1 1 20 10 16 o 28.93000 0.3038000 28.73000 0.3911000 29.12000 0.4651000 -0.3920000     0.6077000 
1 1 1 20 10 18 o 20.66000 0.3117000 21.32000 0.4460000 20.00000 0.4355000 1.317000       0.6234000 
1 1 1 20 10 20 o 66.92000 0.4803000 66.36000 0.6741000 67.48000 0.6844000 -1.121000      0.9607000 
1 1 1 20 10 22 o 26.35000 0.3459000 26.91000 0.3597000 25.79000 0.5909000 1.117000       0.6918000 
1 1 1 20 10 24 o 31.89000 0.3214000 32.01000 0.4106000 31.77000 0.4946000 0.2412000      0.6428000 
1 1 1 20 10 26 o 14.65000 0.3527000 14.74000 0.4042000 14.56000 0.5781000 0.1825000      0.7054000 
1 1 1 20 10 28 f 5.656000 0.8354000 6.983000 0.7661000 4.328000 1.485000  2.655000       1.671000  
1 1 1 20 10 30 o 17.91000 0.4241000 18.81000 0.4121000 17.01000 0.7412000 1.798000       0.8481000 
1 1 1 20 10 32 o 28.86000 0.3758000 28.01000 0.5242000 29.72000 0.5385000 -1.714000      0.7516000 
1 1 1 20 10 34 o 22.55000 0.3741000 22.63000 0.5003000 22.46000 0.5564000 0.1690000      0.7482000 
1 1 1 20 10 36 o 40.02000 0.3879000 39.78000 0.5827000 40.25000 0.5122000 -0.4654000     0.7758000 
1 1 1 20 10 38 o 14.53000 0.4420000 14.43000 0.6120000 14.63000 0.6378000 -0.1931000     0.8839000 
1 1 1 20 10 40 o 13.97000 0.4547000 13.93000 0.6805000 14.01000 0.6032000 -0.7314000E-01 0.9094000 
1 1 1 20 10 42 f 4.972000 0.8721000 3.503000 1.399000  6.440000 1.042000  -2.937000      1.744000  
1 1 1 20 10 44 o 12.26000 0.4925000 12.15000 0.7558000 12.37000 0.6318000 -0.2124000     0.9851000 
1 1 1 20 10 46 o 18.44000 0.3893000 18.29000 0.4952000 18.59000 0.6007000 -0.3039000     0.7785000 
1 1 1 20 10 48 o 10.30000 0.5626000 10.54000 0.8484000 10.05000 0.7390000 0.4916000      1.125000  
1 1 1 20 10 50 o 7.018000 0.8622000 6.730000 1.419000  7.305000 0.9789000 -0.5746000     1.724000  
1 1 1 20 10 52 o 5.514000 0.9984000 5.049000 1.496000  5.980000 1.323000  -0.9311000     1.997000  
1 1 1 20 10 54 o 6.310000 0.9657000 6.522000 1.364000  6.098000 1.367000  0.4245000      1.931000  
1 1 1 20 10 56 f 9.905000 0.5775000 9.890000 0.8531000 9.919000 0.7786000 -0.2931000E-01 1.155000  
1 1 1 20 10 58 o 3.231000 0.9811000 2.897000 1.278000  3.565000 1.489000  -0.6676000     1.962000  
1 1 1 20 10 60 f 4.098000 1.025000  4.528000 1.489000  3.668000 1.410000  0.8594000      2.050000  
1 1 1 20 11 1  o 71.01000 0.5793000 70.88000 0.8135000 71.14000 0.8250000 -0.2601000     1.159000  
1 1 1 20 11 3  f 34.64000 0.3122000 34.72000 0.4683000 34.56000 0.4131000 0.1635000      0.6245000 
1 1 1 20 11 5  o 78.38000 0.5923000 78.27000 0.8931000 78.49000 0.7783000 -0.2182000     1.185000  
1 1 1 20 11 7  o 48.56000 0.3914000 48.74000 0.5915000 48.38000 0.5127000 0.3643000      0.7828000 
1 1 1 20 11 9  o 49.65000 0.3726000 49.50000 0.5255000 49.80000 0.5283000 -0.2996000     0.7452000 
1 1 1 20 11 11 o 65.44000 0.4682000 65.49000 0.6619000 65.39000 0.6623000 0.9602000E-01  0.9363000 
1 1 1 20 11 13 o 47.91000 0.3940000 47.52000 0.5092000 48.29000 0.6014000 -0.7701000     0.7880000 
1 1 1 20 11 15 o 26.82000 0.2691000 26.93000 0.3816000 26.72000 0.3794000 0.2029000      0.5381000 
1 1 1 20 11 17 o 32.22000 0.3097000 32.02000 0.4660000 32.41000 0.4081000 -0.3894000     0.6194000 
1 1 1 20 11 19 o 39.08000 0.4148000 39.21000 0.5185000 38.95000 0.6477000 0.2615000      0.8297000 
1 1 1 20 11 21 o 33.30000 0.3528000 33.22000 0.3708000 33.38000 0.6004000 -0.1611000     0.7057000 
1 1 1 20 11 23 o 43.25000 0.3728000 43.10000 0.4811000 43.40000 0.5696000 -0.2993000     0.7455000 
1 1 1 20 11 25 o 4.857000 0.8374000 5.175000 0.9240000 4.540000 1.397000  0.6347000      1.675000  
1 1 1 20 11 27 o 18.33000 0.3675000 17.86000 0.3843000 18.80000 0.6265000 -0.9405000     0.7349000 
1 1 1 20 11 29 o 6.899000 1.044000  5.834000 0.9492000 7.964000 1.859000  -2.130000      2.087000  
1 1 1 20 11 31 o 31.61000 0.3274000 31.17000 0.3926000 32.05000 0.5241000 -0.8827000     0.6549000 
1 1 1 20 11 33 o 12.81000 0.4898000 12.86000 0.6433000 12.76000 0.7388000 0.9609000E-01  0.9796000 
1 1 1 20 11 35 o 15.48000 0.4103000 15.48000 0.5403000 15.48000 0.6178000 -0.3941000E-02 0.8207000 
1 1 1 20 11 37 o 35.76000 0.4445000 35.65000 0.6804000 35.87000 0.5722000 -0.2167000     0.8891000 
1 1 1 20 11 39 o 37.38000 0.3717000 37.28000 0.5546000 37.48000 0.4950000 -0.1997000     0.7434000 
1 1 1 20 11 41 o 3.745000 1.010000  4.133000 1.444000  3.357000 1.411000  0.7755000      2.019000  
1 1 1 20 11 43 o 15.01000 0.3781000 15.47000 0.5391000 14.55000 0.5303000 0.9167000      0.7562000 
1 1 1 20 11 45 o 6.432000 0.9045000 6.058000 1.287000  6.805000 1.271000  -0.7464000     1.809000  
1 1 1 20 11 47 o 7.801000 0.7194000 7.487000 1.125000  8.115000 0.8964000 -0.6277000     1.439000  
1 1 1 20 11 49 o 3.072000 0.9208000 3.407000 1.396000  2.737000 1.202000  0.6704000      1.842000  
1 1 1 20 11 51 o 3.466000 0.9432000 2.879000 1.265000  4.052000 1.399000  -1.172000      1.886000  
1 1 1 20 11 53 o 6.148000 0.8647000 5.443000 1.381000  6.852000 1.041000  -1.409000      1.729000  
1 1 1 20 11 55 o 7.610000 0.7124000 7.673000 1.000000  7.548000 1.014000  0.1244000      1.425000  
1 1 1 20 11 57 f 3.169000 0.9311000 3.766000 1.445000  2.572000 1.174000  1.194000       1.862000  
1 1 1 20 11 59 o 3.284000 0.9921000 3.453000 1.478000  3.115000 1.323000  0.3383000      1.984000  
1 1 1 20 12 0  o 12.98000 0.5435000 12.98000 0.5435000 12.98000 0.5435000 0.000000       0.000000  
1 1 1 20 12 2  o 42.33000 0.3288000 41.95000 0.4624000 42.70000 0.4676000 -0.7552000     0.6576000 
1 1 1 20 12 4  o 40.91000 0.3226000 40.74000 0.4543000 41.09000 0.4580000 -0.3578000     0.6451000 
1 1 1 20 12 6  o 42.45000 0.3296000 43.04000 0.4731000 41.86000 0.4590000 1.180000       0.6592000 
1 1 1 20 12 8  o 29.45000 0.3031000 28.87000 0.4646000 30.03000 0.3894000 -1.154000      0.6063000 
1 1 1 20 12 10 o 57.73000 0.4560000 57.36000 0.6895000 58.10000 0.5970000 -0.7426000     0.9120000 
1 1 1 20 12 12 o 36.83000 0.3779000 36.99000 0.6234000 36.67000 0.4274000 0.3157000      0.7559000 
1 1 1 20 12 14 o 61.92000 0.4845000 61.89000 0.6314000 61.94000 0.7349000 -0.5130000E-01 0.9690000 
1 1 1 20 12 16 o 37.05000 0.3072000 36.83000 0.4335000 37.27000 0.4354000 -0.4374000     0.6144000 
1 1 1 20 12 18 o 111.5000 0.8309000 111.1000 1.252000  112.0000 1.092000  -0.8754000     1.662000  
1 1 1 20 12 20 o 16.27000 0.3363000 15.69000 0.4149000 16.85000 0.5293000 -1.166000      0.6725000 
1 1 1 20 12 22 o 35.76000 0.3337000 35.85000 0.4288000 35.68000 0.5114000 0.1713000      0.6674000 
1 1 1 20 12 24 o 22.85000 0.2968000 22.59000 0.3501000 23.10000 0.4793000 -0.5158000     0.5935000 
1 1 1 20 12 26 f 8.728000 0.5281000 8.524000 0.6088000 8.933000 0.8631000 -0.4097000     1.056000  
1 1 1 20 12 28 o 12.29000 0.4768000 13.54000 0.4645000 11.04000 0.8329000 2.499000       0.9537000 
1 1 1 20 12 30 o 35.42000 0.3362000 35.16000 0.4032000 35.69000 0.5381000 -0.5230000     0.6724000 
1 1 1 20 12 32 o 13.04000 0.4488000 12.69000 0.5578000 13.39000 0.7032000 -0.6972000     0.8976000 
1 1 1 20 12 34 o 11.78000 0.5321000 11.46000 0.6785000 12.09000 0.8198000 -0.6359000     1.064000  
1 1 1 20 12 36 o 28.02000 0.3299000 27.38000 0.4491000 28.65000 0.4832000 -1.272000      0.6597000 
1 1 1 20 12 38 f 15.41000 0.4703000 15.96000 0.7138000 14.86000 0.6124000 1.095000       0.9405000 
1 1 1 20 12 40 o 15.07000 0.4743000 15.09000 0.6469000 15.04000 0.6936000 0.4993000E-01  0.9485000 
1 1 1 20 12 42 o 5.953000 0.9169000 5.032000 1.365000  6.874000 1.225000  -1.842000      1.834000  
1 1 1 20 12 44 o 7.651000 0.6816000 7.894000 1.061000  7.408000 0.8564000 0.4861000      1.363000  
1 1 1 20 12 46 f 10.03000 0.7626000 9.741000 1.343000  10.32000 0.7231000 -0.5792000     1.525000  
1 1 1 20 12 48 o 7.429000 0.7881000 7.284000 1.154000  7.574000 1.073000  -0.2897000     1.576000  
1 1 1 20 12 50 o 14.38000 0.4099000 14.75000 0.6071000 14.01000 0.5509000 0.7411000      0.8198000 
1 1 1 20 12 52 o 8.967000 0.6849000 9.525000 0.8608000 8.410000 1.066000  1.115000       1.370000  
1 1 1 20 12 54 o 4.258000 1.037000  4.943000 1.514000  3.573000 1.417000  1.370000       2.074000  
1 1 1 20 12 56 o 3.525000 0.9652000 3.407000 1.354000  3.642000 1.376000  -0.2347000     1.930000  
1 1 1 20 12 58 o 8.985000 0.6599000 9.013000 0.9297000 8.958000 0.9368000 0.5500000E-01  1.320000  
1 1 1 20 12 60 o 7.745000 0.7249000 7.708000 1.119000  7.781000 0.9223000 -0.7279000E-01 1.450000  
1 1 1 20 13 1  o 103.9000 0.7752000 104.1000 1.175000  103.6000 1.011000  0.4799000      1.550000  
1 1 1 20 13 3  o 43.80000 0.3365000 43.86000 0.4776000 43.74000 0.4741000 0.1207000      0.6730000 
1 1 1 20 13 5  o 56.24000 0.4465000 56.54000 0.6815000 55.94000 0.5772000 0.6033000      0.8931000 
1 1 1 20 13 7  o 54.59000 0.4365000 54.22000 0.6609000 54.96000 0.5704000 -0.7371000     0.8730000 
1 1 1 20 13 9  o 18.42000 0.3056000 18.25000 0.4866000 18.59000 0.3698000 -0.3344000     0.6112000 
1 1 1 20 13 11 o 9.706000 0.4225000 9.839000 0.6617000 9.573000 0.5257000 0.2665000      0.8451000 
1 1 1 20 13 13 o 57.07000 0.4531000 57.01000 0.6878000 57.13000 0.5900000 -0.1233000     0.9062000 
1 1 1 20 13 15 o 11.26000 0.3910000 11.12000 0.6296000 11.39000 0.4639000 -0.2752000     0.7820000 
1 1 1 20 13 17 o 35.78000 0.3271000 36.09000 0.4338000 35.48000 0.4898000 0.6069000      0.6543000 
1 1 1 20 13 19 o 20.84000 0.2999000 20.06000 0.3383000 21.61000 0.4954000 -1.549000      0.5999000 
1 1 1 20 13 21 o 47.73000 0.4264000 47.24000 0.5936000 48.21000 0.6125000 -0.9781000     0.8529000 
1 1 1 20 13 23 o 12.21000 0.4490000 12.50000 0.4520000 11.91000 0.7759000 0.5951000      0.8980000 
1 1 1 20 13 25 o 9.093000 0.4911000 8.535000 0.6176000 9.652000 0.7637000 -1.117000      0.9822000 
1 1 1 20 13 27 o 8.951000 0.7916000 9.360000 0.5686000 8.542000 1.478000  0.8176000      1.583000  
1 1 1 20 13 29 o 13.07000 0.4654000 12.53000 0.4667000 13.62000 0.8052000 -1.082000      0.9307000 
1 1 1 20 13 31 o 18.72000 0.3488000 18.17000 0.4051000 19.26000 0.5679000 -1.094000      0.6976000 
1 1 1 20 13 33 o 20.17000 0.3444000 20.01000 0.4096000 20.33000 0.5539000 -0.3210000     0.6889000 
1 1 1 20 13 35 o 17.72000 0.4048000 17.07000 0.6238000 18.37000 0.5161000 -1.303000      0.8097000 
1 1 1 20 13 37 o 23.37000 0.3360000 23.57000 0.4635000 23.17000 0.4866000 0.3962000      0.6720000 
1 1 1 20 13 39 o 4.050000 1.032000  3.706000 1.488000  4.394000 1.430000  -0.6879000     2.064000  
1 1 1 20 13 41 o 16.59000 0.4122000 16.56000 0.5475000 16.62000 0.6163000 -0.6027000E-01 0.8244000 
1 1 1 20 13 43 o 12.63000 0.5192000 12.81000 0.7186000 12.45000 0.7496000 0.3599000      1.038000  
1 1 1 20 13 45 o 5.190000 1.093000  5.468000 1.837000  4.913000 1.185000  0.5555000      2.186000  
1 1 1 20 13 47 o 6.278000 0.8591000 5.394000 1.272000  7.162000 1.156000  -1.768000      1.718000  
1 1 1 20 13 49 o 6.331000 0.8202000 5.723000 1.253000  6.939000 1.058000  -1.216000      1.640000  
1 1 1 20 13 51 f 7.975000 0.8688000 7.855000 1.495000  8.094000 0.8850000 -0.2398000     1.738000  
1 1 1 20 13 53 o 9.862000 0.5541000 10.22000 0.8177000 9.500000 0.7479000 0.7237000      1.108000  
1 1 1 20 13 55 o 4.325000 1.001000  5.073000 1.447000  3.577000 1.382000  1.496000       2.001000  
1 1 1 20 13 57 o 4.210000 1.009000  4.389000 1.464000  4.032000 1.389000  0.3574000      2.018000  
1 1 1 20 13 59 o 3.238000 0.9468000 3.451000 1.401000  3.024000 1.274000  0.4269000      1.894000  
1 1 1 20 14 0  o 71.86000 0.8255000 71.86000 0.8255000 71.86000 0.8255000 0.000000       0.000000  
1 1 1 20 14 2  o 49.67000 0.4505000 49.32000 0.7321000 50.02000 0.5252000 -0.7014000     0.9010000 
1 1 1 20 14 4  o 27.58000 0.3193000 26.87000 0.4498000 28.30000 0.4531000 -1.431000      0.6385000 
1 1 1 20 14 6  o 59.25000 0.4657000 59.00000 0.7054000 59.50000 0.6083000 -0.5090000     0.9315000 
1 1 1 20 14 8  o 9.518000 0.3695000 9.458000 0.5052000 9.579000 0.5395000 -0.1209000     0.7391000 
1 1 1 20 14 10 o 63.76000 0.4567000 63.58000 0.6445000 63.93000 0.6473000 -0.3498000     0.9134000 
1 1 1 20 14 12 o 11.49000 0.3251000 11.86000 0.4488000 11.13000 0.4706000 0.7368000      0.6503000 
1 1 1 20 14 14 o 63.95000 0.4967000 64.37000 0.6529000 63.52000 0.7488000 0.8469000      0.9935000 
1 1 1 20 14 16 o 25.94000 0.2993000 25.80000 0.4674000 26.07000 0.3738000 -0.2616000     0.5985000 
1 1 1 20 14 18 o 37.08000 0.3642000 36.80000 0.5067000 37.37000 0.5232000 -0.5714000     0.7283000 
1 1 1 20 14 20 o 22.93000 0.2907000 22.52000 0.3326000 23.34000 0.4768000 -0.8265000     0.5813000 
1 1 1 20 14 22 o 55.45000 0.4460000 54.65000 0.5693000 56.26000 0.6867000 -1.606000      0.8920000 
1 1 1 20 14 24 o 37.85000 0.3514000 38.00000 0.4585000 37.70000 0.5327000 0.3012000      0.7029000 
1 1 1 20 14 26 o 12.18000 0.5498000 11.89000 0.4478000 12.46000 1.004000  -0.5638000     1.100000  
1 1 1 20 14 28 o 23.10000 0.3681000 22.99000 0.3640000 23.21000 0.6398000 -0.2271000     0.7361000 
1 1 1 20 14 30 o 14.60000 0.4068000 14.75000 0.4876000 14.45000 0.6514000 0.3043000      0.8137000 
1 1 1 20 14 32 o 8.192000 0.6553000 7.414000 0.9071000 8.970000 0.9461000 -1.556000      1.311000  
1 1 1 20 14 34 o 12.96000 0.4530000 12.94000 0.5476000 12.98000 0.7216000 -0.3941000E-01 0.9059000 
1 1 1 20 14 36 o 16.91000 0.4119000 16.65000 0.6204000 17.16000 0.5419000 -0.5154000     0.8237000 
1 1 1 20 14 38 o 17.59000 0.3941000 17.20000 0.5773000 17.97000 0.5367000 -0.7659000     0.7883000 
1 1 1 20 14 40 o 23.46000 0.3326000 22.99000 0.4655000 23.93000 0.4753000 -0.9372000     0.6653000 
1 1 1 20 14 42 o 14.04000 0.4412000 13.84000 0.5887000 14.25000 0.6572000 -0.4100000     0.8823000 
1 1 1 20 14 44 o 7.428000 0.7102000 6.385000 1.138000  8.470000 0.8507000 -2.085000      1.420000  
1 1 1 20 14 46 o 4.468000 0.9688000 3.385000 1.367000  5.550000 1.373000  -2.165000      1.938000  
1 1 1 20 14 48 o 5.025000 0.9537000 5.330000 1.293000  4.720000 1.402000  0.6092000      1.907000  
1 1 1 20 14 50 o 6.583000 0.8242000 7.267000 1.118000  5.899000 1.211000  1.368000       1.648000  
1 1 1 20 14 52 o 11.11000 0.6035000 10.77000 0.9454000 11.46000 0.7503000 -0.6887000     1.207000  
1 1 1 20 14 54 f 11.78000 0.5615000 11.79000 0.8543000 11.76000 0.7289000 0.3776000E-01  1.123000  
1 1 1 20 14 56 o 7.191000 0.7457000 7.769000 1.018000  6.613000 1.089000  1.156000       1.491000  
1 1 1 20 14 58 o 8.126000 0.7822000 7.763000 1.030000  8.488000 1.177000  -0.7249000     1.564000  
1 1 1 20 15 1  o 131.9000 0.9760000 131.4000 1.472000  132.3000 1.282000  -0.9386000     1.952000  
1 1 1 20 15 3  o 57.95000 0.4569000 57.69000 0.6912000 58.20000 0.5978000 -0.5104000     0.9139000 
1 1 1 20 15 5  o 28.01000 0.2646000 28.31000 0.3783000 27.71000 0.3701000 0.6011000      0.5292000 
1 1 1 20 15 7  o 40.53000 0.3189000 40.55000 0.4528000 40.50000 0.4491000 0.4741000E-01  0.6378000 
1 1 1 20 15 9  o 19.84000 0.2567000 19.79000 0.3677000 19.90000 0.3582000 -0.1056000     0.5133000 
1 1 1 20 15 11 o 59.08000 0.4285000 59.03000 0.6042000 59.13000 0.6076000 -0.9221000E-01 0.8569000 
1 1 1 20 15 13 o 42.98000 0.3357000 42.90000 0.4740000 43.07000 0.4754000 -0.1703000     0.6714000 
1 1 1 20 15 15 o 36.16000 0.2995000 36.38000 0.4258000 35.95000 0.4214000 0.4322000      0.5990000 
1 1 1 20 15 17 o 43.00000 0.3518000 42.62000 0.4202000 43.38000 0.5643000 -0.7532000     0.7036000 
1 1 1 20 15 19 o 8.127000 0.5525000 8.033000 0.6841000 8.221000 0.8677000 -0.1876000     1.105000  
1 1 1 20 15 21 o 33.71000 0.3233000 33.36000 0.4061000 34.06000 0.5032000 -0.6973000     0.6466000 
1 1 1 20 15 23 o 24.92000 0.2920000 24.63000 0.3432000 25.20000 0.4724000 -0.5694000     0.5839000 
1 1 1 20 15 25 o 17.41000 0.4695000 16.76000 0.4239000 18.06000 0.8379000 -1.295000      0.9390000 
1 1 1 20 15 27 o 39.72000 0.4071000 40.30000 0.4600000 39.14000 0.6719000 1.166000       0.8143000 
1 1 1 20 15 29 o 9.824000 0.6228000 9.549000 0.6213000 10.10000 1.080000  -0.5490000     1.246000  
1 1 1 20 15 31 o 21.43000 0.3387000 21.85000 0.4292000 21.01000 0.5240000 0.8357000      0.6774000 
1 1 1 20 15 33 o 7.213000 0.7369000 5.945000 1.090000  8.481000 0.9918000 -2.536000      1.474000  
1 1 1 20 15 35 o 6.639000 0.8171000 7.306000 0.8712000 5.972000 1.383000  1.334000       1.634000  
1 1 1 20 15 37 o 9.548000 0.5704000 9.506000 0.8107000 9.589000 0.8027000 -0.8310000E-01 1.141000  
1 1 1 20 15 39 o 16.07000 0.4557000 16.49000 0.7233000 15.65000 0.5544000 0.8378000      0.9114000 
1 1 1 20 15 41 o 14.67000 0.5358000 13.77000 0.7471000 15.56000 0.7682000 -1.791000      1.072000  
1 1 1 20 15 43 o 7.174000 0.7637000 6.164000 1.258000  8.185000 0.8661000 -2.021000      1.527000  
1 1 1 20 15 45 o 9.852000 0.5329000 9.048000 0.7319000 10.66000 0.7747000 -1.609000      1.066000  
1 1 1 20 15 47 o 16.95000 0.3600000 16.75000 0.5281000 17.16000 0.4893000 -0.4172000     0.7199000 
1 1 1 20 15 49 o 4.277000 1.039000  4.372000 1.437000  4.181000 1.502000  0.1909000      2.078000  
1 1 1 20 15 51 o 5.822000 1.042000  5.710000 1.683000  5.934000 1.229000  -0.2236000     2.084000  
1 1 1 20 15 53 o 5.107000 1.015000  4.466000 1.474000  5.748000 1.395000  -1.282000      2.030000  
1 1 1 20 15 55 o 11.82000 0.5805000 11.29000 0.7899000 12.35000 0.8508000 -1.055000      1.161000  
1 1 1 20 15 57 o 4.242000 1.099000  3.545000 1.437000  4.940000 1.662000  -1.395000      2.197000  
1 1 1 20 15 59 o 2.896000 0.9115000 3.227000 1.404000  2.565000 1.163000  0.6619000      1.823000  
1 1 1 20 16 0  o 56.74000 0.5856000 56.74000 0.5856000 56.74000 0.5856000 0.000000       0.000000  
1 1 1 20 16 2  o 25.78000 0.4580000 26.42000 0.8218000 25.13000 0.4046000 1.295000       0.9160000 
1 1 1 20 16 4  o 36.30000 0.2971000 36.60000 0.4223000 35.99000 0.4181000 0.6094000      0.5942000 
1 1 1 20 16 6  o 37.13000 0.3014000 37.49000 0.4307000 36.76000 0.4218000 0.7330000      0.6029000 
1 1 1 20 16 8  o 62.07000 0.4794000 62.16000 0.6302000 61.99000 0.7227000 0.1785000      0.9589000 
1 1 1 20 16 10 o 33.32000 0.2854000 33.53000 0.4061000 33.11000 0.4012000 0.4202000      0.5708000 
1 1 1 20 16 12 o 27.77000 0.2683000 27.53000 0.3730000 28.00000 0.3857000 -0.4696000     0.5365000 
1 1 1 20 16 14 o 31.39000 0.3045000 31.60000 0.4011000 31.18000 0.4583000 0.4209000      0.6090000 
1 1 1 20 16 16 o 3.626000 0.7416000 4.290000 0.8148000 2.961000 1.239000  1.330000       1.483000  
1 1 1 20 16 18 o 33.39000 0.3166000 33.15000 0.3968000 33.62000 0.4933000 -0.4698000     0.6331000 
1 1 1 20 16 20 o 35.96000 0.3575000 35.63000 0.4938000 36.28000 0.5171000 -0.6571000     0.7149000 
1 1 1 20 16 22 o 10.24000 0.4117000 10.07000 0.4807000 10.41000 0.6686000 -0.3447000     0.8235000 
1 1 1 20 16 24 o 23.22000 0.4341000 22.73000 0.3428000 23.70000 0.7976000 -0.9662000     0.8681000 
1 1 1 20 16 26 o 17.93000 0.3456000 17.89000 0.4313000 17.97000 0.5403000 -0.7587000E-01 0.6913000 
1 1 1 20 16 28 o 5.936000 0.9138000 6.882000 0.8404000 4.991000 1.623000  1.891000       1.828000  
1 1 1 20 16 30 o 22.84000 0.3092000 22.69000 0.3674000 23.00000 0.4975000 -0.3072000     0.6184000 
1 1 1 20 16 32 o 15.53000 0.3886000 15.62000 0.4365000 15.44000 0.6431000 0.1853000      0.7772000 
1 1 1 20 16 34 o 22.29000 0.3383000 22.48000 0.4030000 22.09000 0.5436000 0.3885000      0.6767000 
1 1 1 20 16 36 o 4.559000 0.9441000 5.101000 1.287000  4.016000 1.382000  1.085000       1.888000  
1 1 1 20 16 38 o 7.462000 0.7120000 6.953000 1.097000  7.970000 0.9075000 -1.017000      1.424000  
1 1 1 20 16 40 o 8.264000 0.9308000 7.021000 1.693000  9.507000 0.7745000 -2.486000      1.862000  
1 1 1 20 16 42 o 4.596000 0.9517000 4.225000 1.368000  4.966000 1.323000  -0.7410000     1.903000  
1 1 1 20 16 44 o 8.160000 0.6576000 7.466000 0.9733000 8.853000 0.8846000 -1.388000      1.315000  
1 1 1 20 16 46 o 5.411000 0.8591000 5.224000 1.250000  5.597000 1.179000  -0.3734000     1.718000  
1 1 1 20 16 48 o 17.27000 0.3596000 17.64000 0.5154000 16.89000 0.5016000 0.7471000      0.7192000 
1 1 1 20 16 50 o 4.197000 0.9856000 3.332000 1.454000  5.061000 1.330000  -1.730000      1.971000  
1 1 1 20 16 52 o 6.280000 0.9060000 5.693000 1.489000  6.866000 1.033000  -1.172000      1.812000  
1 1 1 20 16 54 o 4.485000 1.155000  3.503000 1.467000  5.468000 1.783000  -1.965000      2.310000  
1 1 1 20 16 56 o 8.724000 0.7155000 7.125000 1.166000  10.32000 0.8296000 -3.197000      1.431000  
1 1 1 20 16 58 o 4.292000 1.064000  4.989000 1.555000  3.595000 1.452000  1.394000       2.127000  
1 1 1 20 17 1  o 14.33000 0.3121000 14.03000 0.4881000 14.63000 0.3889000 -0.6001000     0.6241000 
1 1 1 20 17 3  o 33.86000 0.3112000 33.89000 0.4732000 33.82000 0.4043000 0.7083000E-01  0.6224000 
1 1 1 20 17 5  f 26.69000 0.2608000 26.61000 0.3691000 26.78000 0.3685000 -0.1746000     0.5216000 
1 1 1 20 17 7  o 27.23000 0.2612000 27.34000 0.3713000 27.12000 0.3674000 0.2223000      0.5224000 
1 1 1 20 17 9  o 64.08000 0.4587000 63.89000 0.6463000 64.27000 0.6512000 -0.3785000     0.9175000 
1 1 1 20 17 11 o 25.18000 0.2568000 25.33000 0.3660000 25.03000 0.3604000 0.3038000      0.5136000 
1 1 1 20 17 13 o 45.65000 0.3482000 45.43000 0.4914000 45.87000 0.4934000 -0.4320000     0.6964000 
1 1 1 20 17 15 o 16.48000 0.2928000 17.21000 0.3039000 15.74000 0.5005000 1.464000       0.5856000 
1 1 1 20 17 17 o 26.82000 0.2895000 25.94000 0.3447000 27.70000 0.4654000 -1.760000      0.5791000 
1 1 1 20 17 19 o 13.44000 0.3405000 13.52000 0.3685000 13.35000 0.5727000 0.1708000      0.6810000 
1 1 1 20 17 21 o 29.46000 0.3527000 29.72000 0.4023000 29.21000 0.5794000 0.5107000      0.7054000 
1 1 1 20 17 23 o 40.86000 0.3618000 41.22000 0.4707000 40.50000 0.5496000 0.7179000      0.7236000 
1 1 1 20 17 25 o 30.88000 0.3098000 30.75000 0.3598000 31.01000 0.5044000 -0.2664000     0.6195000 
1 1 1 20 17 27 o 35.75000 0.3696000 36.03000 0.5165000 35.48000 0.5287000 0.5482000      0.7391000 
1 1 1 20 17 29 f 9.853000 0.5344000 10.07000 0.5551000 9.637000 0.9134000 0.4319000      1.069000  
1 1 1 20 17 31 o 16.73000 0.4392000 15.45000 0.5059000 18.02000 0.7182000 -2.565000      0.8785000 
1 1 1 20 17 33 o 21.27000 0.3437000 21.80000 0.3962000 20.75000 0.5617000 1.042000       0.6873000 
1 1 1 20 17 35 o 36.70000 0.3461000 37.09000 0.4196000 36.32000 0.5505000 0.7728000      0.6922000 
1 1 1 20 17 37 f 17.43000 0.3850000 17.76000 0.5671000 17.10000 0.5209000 0.6619000      0.7700000 
1 1 1 20 17 39 o 10.38000 0.4974000 9.965000 0.7118000 10.79000 0.6950000 -0.8244000     0.9948000 
1 1 1 20 17 41 o 20.94000 0.5805000 21.67000 0.5581000 20.20000 1.018000  1.471000       1.161000  
1 1 1 20 17 43 o 3.962000 0.9760000 3.717000 1.407000  4.207000 1.354000  -0.4908000     1.952000  
1 1 1 20 17 45 o 15.01000 0.3847000 14.71000 0.5431000 15.31000 0.5451000 -0.5980000     0.7695000 
1 1 1 20 17 47 o 5.001000 0.9002000 4.274000 1.424000  5.728000 1.102000  -1.454000      1.800000  
1 1 1 20 17 49 o 3.620000 0.9152000 4.689000 1.444000  2.551000 1.125000  2.137000       1.830000  
1 1 1 20 17 51 o 5.967000 1.053000  5.166000 1.684000  6.769000 1.265000  -1.603000      2.107000  
1 1 1 20 17 53 o 4.274000 1.216000  4.226000 1.732000  4.322000 1.706000  -0.9666000E-01 2.431000  
1 1 1 20 17 55 o 3.758000 1.045000  3.925000 1.479000  3.591000 1.478000  0.3337000      2.090000  
1 1 1 20 17 57 o 3.885000 1.044000  5.143000 1.694000  2.628000 1.222000  2.515000       2.089000  
1 1 1 20 17 59 o 4.126000 1.087000  3.653000 1.564000  4.598000 1.511000  -0.9451000     2.175000  
1 1 1 20 18 0  o 24.39000 0.3527000 24.39000 0.3527000 24.39000 0.3527000 0.000000       0.000000  
1 1 1 20 18 2  o 16.44000 0.3007000 15.71000 0.4794000 17.17000 0.3630000 -1.459000      0.6013000 
1 1 1 20 18 4  o 59.28000 0.4679000 59.84000 0.7165000 58.72000 0.6020000 1.113000       0.9358000 
1 1 1 20 18 6  o 38.47000 0.3420000 38.28000 0.5237000 38.66000 0.4398000 -0.3836000     0.6839000 
1 1 1 20 18 8  o 81.79000 0.5731000 82.02000 0.8117000 81.57000 0.8092000 0.4518000      1.146000  
1 1 1 20 18 10 o 26.06000 0.2582000 26.23000 0.3686000 25.90000 0.3618000 0.3315000      0.5164000 
1 1 1 20 18 12 o 34.69000 0.2909000 34.95000 0.4153000 34.42000 0.4075000 0.5308000      0.5818000 
1 1 1 20 18 14 o 34.19000 0.3659000 34.39000 0.3633000 33.99000 0.6352000 0.3994000      0.7317000 
1 1 1 20 18 16 o 26.48000 0.2887000 26.38000 0.3425000 26.57000 0.4649000 -0.1881000     0.5774000 
1 1 1 20 18 18 o 22.50000 0.2963000 22.55000 0.3611000 22.45000 0.4699000 0.9804000E-01  0.5927000 
1 1 1 20 18 20 o 34.20000 0.3804000 34.79000 0.4578000 33.62000 0.6076000 1.171000       0.7608000 
1 1 1 20 18 22 o 18.72000 0.3016000 18.30000 0.3268000 19.14000 0.5071000 -0.8416000     0.6033000 
1 1 1 20 18 24 o 20.04000 0.3583000 19.46000 0.4071000 20.63000 0.5897000 -1.168000      0.7165000 
1 1 1 20 18 26 o 22.93000 0.3089000 23.19000 0.3696000 22.66000 0.4950000 0.5301000      0.6178000 
1 1 1 20 18 28 o 22.80000 0.3883000 22.84000 0.4307000 22.76000 0.6462000 0.8078000E-01  0.7765000 
1 1 1 20 18 30 o 26.02000 0.3175000 25.85000 0.3656000 26.18000 0.5192000 -0.3317000     0.6350000 
1 1 1 20 18 32 o 23.91000 0.3226000 23.49000 0.3766000 24.33000 0.5240000 -0.8402000     0.6453000 
1 1 1 20 18 34 o 16.49000 0.3664000 16.66000 0.4277000 16.33000 0.5951000 0.3361000      0.7329000 
1 1 1 20 18 36 o 10.16000 0.5716000 10.01000 0.7870000 10.32000 0.8293000 -0.3111000     1.143000  
1 1 1 20 18 38 o 6.255000 0.8779000 6.385000 1.355000  6.126000 1.116000  0.2586000      1.756000  
1 1 1 20 18 40 o 8.451000 0.9129000 7.705000 0.9479000 9.198000 1.560000  -1.493000      1.826000  
1 1 1 20 18 42 o 9.358000 0.6200000 9.333000 0.9873000 9.384000 0.7502000 -0.5061000E-01 1.240000  
1 1 1 20 18 44 o 8.116000 0.6002000 8.552000 0.8292000 7.680000 0.8680000 0.8721000      1.200000  
1 1 1 20 18 46 o 8.569000 0.5665000 8.694000 0.8039000 8.444000 0.7983000 0.2501000      1.133000  
1 1 1 20 18 48 o 8.777000 0.5930000 8.349000 0.9349000 9.204000 0.7297000 -0.8543000     1.186000  
1 1 1 20 18 50 o 4.218000 1.012000  4.763000 1.503000  3.673000 1.357000  1.090000       2.025000  
1 1 1 20 18 52 o 6.438000 0.8334000 6.823000 1.228000  6.052000 1.127000  0.7707000      1.667000  
1 1 1 20 18 54 o 9.884000 0.7685000 10.32000 1.214000  9.447000 0.9424000 0.8739000      1.537000  
1 1 1 20 18 56 o 6.931000 0.8234000 6.022000 1.388000  7.840000 0.8871000 -1.818000      1.647000  
1 1 1 20 18 58 o 6.053000 0.9043000 5.236000 1.454000  6.869000 1.076000  -1.634000      1.809000  
1 1 1 20 19 1  o 61.85000 0.4827000 61.87000 0.7331000 61.84000 0.6282000 0.3056000E-01  0.9654000 
1 1 1 20 19 3  o 25.94000 0.3535000 25.81000 0.6075000 26.07000 0.3618000 -0.2643000     0.7070000 
1 1 1 20 19 5  o 46.09000 0.3504000 45.85000 0.4938000 46.33000 0.4973000 -0.4799000     0.7008000 
1 1 1 20 19 7  o 58.66000 0.4252000 58.59000 0.6009000 58.73000 0.6017000 -0.1451000     0.8504000 
1 1 1 20 19 9  o 53.57000 0.3943000 53.73000 0.5589000 53.42000 0.5564000 0.3180000      0.7886000 
1 1 1 20 19 11 o 37.58000 0.3052000 37.13000 0.4287000 38.03000 0.4345000 -0.9090000     0.6104000 
1 1 1 20 19 13 o 33.71000 0.3024000 33.90000 0.3549000 33.52000 0.4898000 0.3805000      0.6048000 
1 1 1 20 19 15 o 34.29000 0.3178000 35.08000 0.4001000 33.49000 0.4938000 1.588000       0.6355000 
1 1 1 20 19 17 o 36.99000 0.4038000 36.55000 0.4952000 37.43000 0.6381000 -0.8834000     0.8077000 
1 1 1 20 19 19 o 18.52000 0.3303000 18.70000 0.3052000 18.34000 0.5859000 0.3679000      0.6606000 
1 1 1 20 19 21 o 29.04000 0.2956000 28.77000 0.3329000 29.31000 0.4886000 -0.5446000     0.5913000 
1 1 1 20 19 23 f 8.671000 0.5751000 9.211000 0.4952000 8.130000 1.038000  1.081000       1.150000  
1 1 1 20 19 25 o 13.05000 0.4036000 12.58000 0.5276000 13.53000 0.6109000 -0.9547000     0.8072000 
1 1 1 20 19 27 o 12.70000 0.4148000 12.35000 0.4451000 13.05000 0.7001000 -0.7045000     0.8296000 
1 1 1 20 19 29 o 19.98000 0.3533000 20.16000 0.4462000 19.80000 0.5479000 0.3649000      0.7066000 
1 1 1 20 19 31 o 19.25000 0.3468000 19.40000 0.4180000 19.10000 0.5536000 0.2995000      0.6937000 
1 1 1 20 19 33 o 4.643000 0.9562000 4.682000 1.221000  4.605000 1.472000  0.7715000E-01  1.912000  
1 1 1 20 19 35 o 35.88000 0.4754000 35.89000 0.6803000 35.86000 0.6643000 0.2726000E-01  0.9508000 
1 1 1 20 19 37 o 21.01000 0.3471000 21.15000 0.5049000 20.86000 0.4765000 0.2879000      0.6942000 
1 1 1 20 19 39 o 3.929000 1.026000  4.162000 1.449000  3.696000 1.453000  0.4664000      2.052000  
1 1 1 20 19 41 o 5.056000 0.9322000 5.020000 1.289000  5.093000 1.347000  -0.7282000E-01 1.864000  
1 1 1 20 19 43 o 7.454000 0.7155000 7.570000 1.052000  7.338000 0.9700000 0.2320000      1.431000  
1 1 1 20 19 45 o 19.09000 0.3467000 19.73000 0.4878000 18.45000 0.4927000 1.283000       0.6933000 
1 1 1 20 19 47 o 4.445000 0.9533000 4.182000 1.375000  4.709000 1.321000  -0.5272000     1.907000  
1 1 1 20 19 49 f 2.645000 0.8223000 2.174000 1.048000  3.116000 1.268000  -0.9412000     1.645000  
1 1 1 20 19 51 o 11.88000 0.5658000 11.06000 0.7458000 12.69000 0.8510000 -1.638000      1.132000  
1 1 1 20 19 53 o 13.32000 0.5317000 13.80000 0.8206000 12.85000 0.6764000 0.9429000      1.063000  
1 1 1 20 19 55 o 11.02000 0.5299000 11.85000 0.7576000 10.19000 0.7410000 1.658000       1.060000  
1 1 1 20 19 57 o 4.521000 1.018000  5.044000 1.525000  3.998000 1.348000  1.046000       2.036000  
1 1 1 20 20 0  o 57.80000 0.8403000 57.80000 0.8403000 57.80000 0.8403000 0.000000       0.000000  
1 1 1 20 20 2  o 56.01000 0.4079000 56.05000 0.5766000 55.97000 0.5770000 0.7919000E-01  0.8157000 
1 1 1 20 20 4  o 89.47000 0.6729000 89.24000 1.017000  89.71000 0.8818000 -0.4628000     1.346000  
1 1 1 20 20 6  o 33.90000 0.2836000 33.90000 0.3995000 33.91000 0.4025000 -0.6023000E-02 0.5671000 
1 1 1 20 20 8  o 4.861000 0.5455000 4.910000 0.7330000 4.811000 0.8081000 0.9945000E-01  1.091000  
1 1 1 20 20 10 o 35.01000 0.2904000 35.25000 0.4125000 34.77000 0.4088000 0.4804000      0.5808000 
1 1 1 20 20 12 o 21.14000 0.3357000 21.02000 0.4878000 21.27000 0.4612000 -0.2522000     0.6713000 
1 1 1 20 20 14 f 31.07000 0.4360000 30.64000 0.6006000 31.49000 0.6320000 -0.8531000     0.8719000 
1 1 1 20 20 16 o 58.25000 0.5582000 57.44000 0.6992000 59.05000 0.8703000 -1.614000      1.116000  
1 1 1 20 20 18 o 22.35000 0.3762000 22.38000 0.3961000 22.32000 0.6397000 0.5358000E-01  0.7524000 
1 1 1 20 20 20 o 18.12000 0.2994000 17.89000 0.2897000 18.34000 0.5240000 -0.4512000     0.5988000 
1 1 1 20 20 22 o 29.56000 0.4847000 29.47000 0.3681000 29.65000 0.8968000 -0.1735000     0.9694000 
1 1 1 20 20 24 f 28.82000 0.3028000 29.00000 0.3500000 28.63000 0.4943000 0.3785000      0.6057000 
1 1 1 20 20 26 o 6.872000 0.7164000 7.224000 0.7595000 6.521000 1.215000  0.7032000      1.433000  
1 1 1 20 20 28 o 26.69000 0.3710000 26.27000 0.3620000 27.11000 0.6477000 -0.8323000     0.7420000 
1 1 1 20 20 30 o 40.02000 0.3994000 40.68000 0.5645000 39.36000 0.5653000 1.320000       0.7989000 
1 1 1 20 20 32 o 6.795000 0.7445000 6.777000 0.9052000 6.813000 1.182000  -0.3577000E-01 1.489000  
1 1 1 20 20 34 o 12.10000 0.4494000 12.05000 0.5492000 12.15000 0.7115000 -0.1006000     0.8988000 
1 1 1 20 20 36 o 18.91000 0.3721000 18.75000 0.4573000 19.07000 0.5871000 -0.3219000     0.7441000 
1 1 1 20 20 38 f 6.109000 0.8804000 6.670000 1.015000  5.548000 1.439000  1.122000       1.761000  
1 1 1 20 20 40 o 9.437000 0.6239000 9.447000 0.8533000 9.426000 0.9106000 0.2122000E-01  1.248000  
1 1 1 20 20 42 o 20.64000 0.3586000 20.79000 0.5156000 20.50000 0.4986000 0.2848000      0.7173000 
1 1 1 20 20 44 o 12.17000 0.4350000 11.92000 0.6173000 12.41000 0.6129000 -0.4909000     0.8699000 
1 1 1 20 20 46 o 7.478000 0.6547000 7.141000 1.010000  7.814000 0.8329000 -0.6734000     1.309000  
1 1 1 20 20 48 o 9.063000 0.5639000 9.879000 0.7453000 8.248000 0.8464000 1.631000       1.128000  
1 1 1 20 20 50 o 3.924000 1.047000  3.980000 1.482000  3.868000 1.478000  0.1119000      2.094000  
1 1 1 20 20 52 o 3.827000 1.035000  3.289000 1.448000  4.365000 1.479000  -1.076000      2.070000  
1 1 1 20 20 54 o 4.562000 1.018000  4.495000 1.501000  4.629000 1.377000  -0.1337000     2.037000  
1 1 1 20 20 56 f 3.822000 1.001000  4.604000 1.521000  3.040000 1.302000  1.564000       2.002000  
1 1 1 20 21 1  o 6.501000 0.4661000 6.875000 0.6015000 6.127000 0.7123000 0.7486000      0.9323000 
1 1 1 20 21 3  o 18.24000 0.2640000 18.11000 0.4015000 18.37000 0.3429000 -0.2598000     0.5280000 
1 1 1 20 21 5  o 16.47000 0.2399000 16.58000 0.3341000 16.35000 0.3444000 0.2328000      0.4799000 
1 1 1 20 21 7  o 63.05000 0.4916000 62.92000 0.6378000 63.18000 0.7484000 -0.2580000     0.9833000 
1 1 1 20 21 9  o 30.26000 0.3336000 30.71000 0.4771000 29.81000 0.4664000 0.9013000      0.6672000 
1 1 1 20 21 11 o 23.66000 0.3655000 23.36000 0.5679000 23.95000 0.4603000 -0.5816000     0.7311000 
1 1 1 20 21 13 o 34.40000 0.5535000 34.80000 0.6211000 33.99000 0.9165000 0.8150000      1.107000  
1 1 1 20 21 15 o 61.03000 0.5786000 60.61000 0.7295000 61.45000 0.8982000 -0.8381000     1.157000  
1 1 1 20 21 17 o 41.19000 0.4496000 41.45000 0.7071000 40.94000 0.5555000 0.5043000      0.8992000 
1 1 1 20 21 19 o 13.19000 0.4364000 13.35000 0.6365000 13.02000 0.5971000 0.3274000      0.8728000 
1 1 1 20 21 21 o 22.82000 0.3322000 22.54000 0.3217000 23.10000 0.5812000 -0.5638000     0.6643000 
1 1 1 20 21 23 o 12.76000 0.3743000 13.13000 0.3676000 12.39000 0.6521000 0.7434000      0.7486000 
1 1 1 20 21 25 o 23.96000 0.3015000 24.25000 0.3385000 23.66000 0.4990000 0.5869000      0.6029000 
1 1 1 20 21 27 o 28.61000 0.3241000 28.85000 0.4071000 28.37000 0.5044000 0.4788000      0.6482000 
1 1 1 20 21 29 o 17.60000 0.3591000 17.30000 0.4064000 17.91000 0.5921000 -0.6122000     0.7181000 
1 1 1 20 21 31 o 15.71000 0.5059000 15.11000 0.8243000 16.30000 0.5869000 -1.190000      1.012000  
1 1 1 20 21 33 o 4.796000 0.9301000 4.881000 1.114000  4.711000 1.490000  0.1698000      1.860000  
1 1 1 20 21 35 f 7.899000 0.6784000 7.139000 0.9008000 8.659000 1.014000  -1.520000      1.357000  
1 1 1 20 21 37 o 7.499000 0.7272000 6.126000 0.9026000 8.872000 1.140000  -2.747000      1.454000  
1 1 1 20 21 39 o 5.150000 1.172000  3.741000 1.357000  6.559000 1.912000  -2.818000      2.345000  
1 1 1 20 21 41 o 11.33000 0.4986000 10.98000 0.7677000 11.67000 0.6364000 -0.6942000     0.9972000 
1 1 1 20 21 43 o 13.77000 0.4593000 13.59000 0.7334000 13.95000 0.5531000 -0.3648000     0.9186000 
1 1 1 20 21 45 o 15.98000 0.3800000 15.91000 0.5425000 16.06000 0.5323000 -0.1462000     0.7600000 
1 1 1 20 21 47 o 2.960000 0.9107000 2.745000 1.229000  3.175000 1.344000  -0.4306000     1.821000  
1 1 1 20 21 49 o 4.038000 0.9920000 3.782000 1.416000  4.294000 1.389000  -0.5113000     1.984000  
1 1 1 20 21 51 o 4.585000 1.023000  5.031000 1.476000  4.140000 1.418000  0.8910000      2.047000  
1 1 1 20 21 53 o 4.956000 1.050000  5.886000 1.469000  4.026000 1.501000  1.860000       2.100000  
1 1 1 20 21 55 o 3.696000 1.047000  3.929000 1.591000  3.463000 1.362000  0.4657000      2.095000  
1 1 1 20 21 57 o 4.216000 1.007000  3.849000 1.487000  4.582000 1.359000  -0.7338000     2.015000  
1 1 1 20 22 0  f 28.81000 0.4529000 28.81000 0.4529000 28.81000 0.4529000 0.000000       0.000000  
1 1 1 20 22 2  o 19.02000 0.2389000 19.04000 0.3365000 19.00000 0.3393000 0.4075000E-01  0.4779000 
1 1 1 20 22 4  o 38.88000 0.3390000 38.86000 0.5150000 38.90000 0.4410000 -0.3482000E-01 0.6780000 
1 1 1 20 22 6  o 12.06000 0.2689000 12.21000 0.3788000 11.90000 0.3819000 0.3165000      0.5379000 
1 1 1 20 22 8  o 36.83000 0.3623000 36.63000 0.5111000 37.03000 0.5136000 -0.4042000     0.7245000 
1 1 1 20 22 10 o 48.75000 0.5276000 49.16000 0.7506000 48.35000 0.7417000 0.8071000      1.055000  
1 1 1 20 22 12 o 12.88000 0.5084000 12.95000 0.7716000 12.81000 0.6621000 0.1431000      1.017000  
1 1 1 20 22 14 o 31.86000 0.4017000 31.76000 0.5011000 31.97000 0.6281000 -0.2144000     0.8035000 
1 1 1 20 22 16 o 50.97000 0.4512000 50.64000 0.6342000 51.29000 0.6420000 -0.6464000     0.9024000 
1 1 1 20 22 18 o 43.54000 0.5028000 43.13000 0.7239000 43.96000 0.6982000 -0.8273000     1.006000  
1 1 1 20 22 20 o 22.02000 0.4289000 21.83000 0.6320000 22.21000 0.5798000 -0.3749000     0.8577000 
1 1 1 20 22 22 o 21.07000 0.2910000 21.30000 0.3093000 20.84000 0.4930000 0.4573000      0.5820000 
1 1 1 20 22 24 o 36.47000 0.3309000 36.05000 0.3854000 36.90000 0.5381000 -0.8474000     0.6618000 
1 1 1 20 22 26 f 16.91000 0.3636000 16.48000 0.4566000 17.34000 0.5660000 -0.8609000     0.7272000 
1 1 1 20 22 28 o 51.11000 0.4892000 50.60000 0.5474000 51.62000 0.8109000 -1.023000      0.9784000 
1 1 1 20 22 30 o 22.23000 0.3356000 22.40000 0.4130000 22.05000 0.5290000 0.3434000      0.6712000 
1 1 1 20 22 32 f 19.13000 0.3422000 18.81000 0.4008000 19.45000 0.5547000 -0.6378000     0.6844000 
1 1 1 20 22 34 o 32.12000 0.3417000 32.27000 0.4250000 31.96000 0.5351000 0.3094000      0.6833000 
1 1 1 20 22 36 o 34.17000 0.3852000 34.04000 0.3998000 34.30000 0.6586000 -0.2608000     0.7705000 
1 1 1 20 22 38 o 15.83000 0.3725000 14.97000 0.4958000 16.68000 0.5561000 -1.711000      0.7450000 
1 1 1 20 22 40 o 14.93000 0.3991000 14.80000 0.5294000 15.06000 0.5973000 -0.2545000     0.7981000 
1 1 1 20 22 42 o 5.871000 0.8703000 5.061000 1.400000  6.681000 1.034000  -1.620000      1.741000  
1 1 1 20 22 44 o 9.629000 0.5841000 9.985000 0.8548000 9.273000 0.7962000 0.7121000      1.168000  
1 1 1 20 22 46 o 3.618000 1.001000  3.858000 1.451000  3.378000 1.379000  0.4797000      2.002000  
1 1 1 20 22 48 o 6.544000 0.7918000 5.022000 1.314000  8.065000 0.8837000 -3.043000      1.584000  
1 1 1 20 22 50 o 11.51000 0.6055000 11.43000 0.7493000 11.60000 0.9514000 -0.1685000     1.211000  
1 1 1 20 22 52 o 3.837000 1.062000  4.178000 1.534000  3.496000 1.470000  0.6822000      2.125000  
1 1 1 20 22 54 o 15.14000 0.4450000 14.89000 0.6610000 15.38000 0.5960000 -0.4876000     0.8900000 
1 1 1 20 22 56 o 2.810000 0.8876000 2.542000 1.219000  3.077000 1.291000  -0.5346000     1.775000  
1 1 1 20 23 1  o 22.87000 0.2759000 22.77000 0.3477000 22.96000 0.4286000 -0.1838000     0.5519000 
1 1 1 20 23 3  o 45.11000 0.3439000 45.21000 0.4889000 45.01000 0.4839000 0.2031000      0.6879000 
1 1 1 20 23 5  o 52.87000 0.4453000 53.16000 0.6334000 52.59000 0.6261000 0.5760000      0.8906000 
1 1 1 20 23 7  o 14.22000 0.4484000 13.84000 0.6794000 14.60000 0.5854000 -0.7651000     0.8968000 
1 1 1 20 23 9  o 37.92000 0.4538000 38.24000 0.6453000 37.60000 0.6382000 0.6357000      0.9076000 
1 1 1 20 23 11 o 7.409000 0.6938000 7.242000 1.066000  7.576000 0.8878000 -0.3342000     1.388000  
1 1 1 20 23 13 o 5.900000 0.8849000 5.564000 1.372000  6.237000 1.118000  -0.6728000     1.770000  
1 1 1 20 23 15 o 18.57000 0.3627000 18.63000 0.5184000 18.51000 0.5076000 0.1175000      0.7255000 
1 1 1 20 23 17 o 16.64000 0.5897000 17.06000 0.9826000 16.21000 0.6522000 0.8492000      1.179000  
1 1 1 20 23 19 o 8.718000 0.6370000 9.496000 0.9116000 7.940000 0.8900000 1.556000       1.274000  
1 1 1 20 23 21 o 24.96000 0.3584000 24.88000 0.5200000 25.05000 0.4934000 -0.1721000     0.7168000 
1 1 1 20 23 23 o 36.49000 0.3632000 36.69000 0.4942000 36.30000 0.5323000 0.3904000      0.7264000 
1 1 1 20 23 25 f 26.25000 0.3053000 26.02000 0.3383000 26.49000 0.5083000 -0.4639000     0.6106000 
1 1 1 20 23 27 o 32.40000 0.4241000 32.80000 0.5411000 32.01000 0.6531000 0.7824000      0.8481000 
1 1 1 20 23 29 o 17.80000 0.3732000 17.26000 0.4587000 18.34000 0.5887000 -1.084000      0.7463000 
1 1 1 20 23 31 o 3.306000 0.9237000 3.153000 1.198000  3.458000 1.407000  -0.3049000     1.847000  
1 1 1 20 23 33 o 4.649000 0.9672000 3.998000 1.276000  5.300000 1.454000  -1.302000      1.934000  
1 1 1 20 23 35 o 9.397000 0.6576000 10.17000 0.6013000 8.627000 1.170000  1.540000       1.315000  
1 1 1 20 23 37 o 16.01000 0.3646000 15.85000 0.4284000 16.17000 0.5900000 -0.3268000     0.7291000 
1 1 1 20 23 39 o 4.949000 0.9709000 4.748000 1.312000  5.150000 1.432000  -0.4024000     1.942000  
1 1 1 20 23 41 o 2.505000 0.8108000 2.439000 1.131000  2.571000 1.162000  -0.1313000     1.622000  
1 1 1 20 23 43 o 16.03000 0.5809000 16.30000 0.5344000 15.77000 1.032000  0.5324000      1.162000  
1 1 1 20 23 45 o 9.148000 0.7288000 8.671000 1.239000  9.625000 0.7671000 -0.9539000     1.458000  
1 1 1 20 23 47 f 13.58000 0.4240000 12.97000 0.6336000 14.20000 0.5637000 -1.236000      0.8481000 
1 1 1 20 23 49 o 4.204000 1.052000  4.818000 1.517000  3.589000 1.458000  1.229000       2.104000  
1 1 1 20 23 51 o 7.555000 0.9475000 8.096000 0.9958000 7.014000 1.612000  1.082000       1.895000  
1 1 1 20 23 53 o 3.624000 0.9814000 3.318000 1.384000  3.929000 1.392000  -0.6104000     1.963000  
1 1 1 20 23 55 o 5.313000 1.001000  5.847000 1.425000  4.778000 1.408000  1.069000       2.003000  
1 1 1 20 24 0  o 51.90000 0.7702000 51.90000 0.7702000 51.90000 0.7702000 0.000000       0.000000  
1 1 1 20 24 2  o 34.92000 0.3729000 35.23000 0.4674000 34.62000 0.5810000 0.6165000      0.7457000 
1 1 1 20 24 4  o 28.43000 0.3253000 28.96000 0.5129000 27.91000 0.4002000 1.046000       0.6505000 
1 1 1 20 24 6  f 6.004000 0.8464000 6.478000 1.187000  5.530000 1.207000  0.9485000      1.693000  
1 1 1 20 24 8  o 31.80000 0.3871000 31.88000 0.6020000 31.71000 0.4869000 0.1646000      0.7743000 
1 1 1 20 24 10 o 33.55000 0.3541000 33.72000 0.5049000 33.38000 0.4966000 0.3442000      0.7082000 
1 1 1 20 24 12 o 8.977000 0.6038000 8.273000 0.9445000 9.680000 0.7524000 -1.407000      1.208000  
1 1 1 20 24 14 o 40.90000 0.4502000 40.01000 0.5483000 41.80000 0.7141000 -1.788000      0.9003000 
1 1 1 20 24 16 o 41.16000 0.4738000 40.90000 0.6683000 41.42000 0.6719000 -0.5283000     0.9476000 
1 1 1 20 24 18 o 50.68000 0.5137000 51.46000 0.8091000 49.89000 0.6332000 1.572000       1.027000  
1 1 1 20 24 20 o 9.456000 0.5908000 10.08000 0.8142000 8.832000 0.8562000 1.247000       1.182000  
1 1 1 20 24 22 o 21.22000 0.3771000 20.28000 0.5490000 22.16000 0.5171000 -1.885000      0.7542000 
1 1 1 20 24 24 o 21.37000 0.3882000 21.70000 0.5656000 21.03000 0.5318000 0.6707000      0.7764000 
1 1 1 20 24 26 o 13.55000 0.3877000 13.57000 0.4089000 13.53000 0.6589000 0.3961000E-01  0.7754000 
1 1 1 20 24 28 o 28.88000 0.3334000 28.95000 0.4181000 28.82000 0.5196000 0.1267000      0.6669000 
1 1 1 20 24 30 o 13.37000 0.4338000 13.20000 0.5654000 13.54000 0.6580000 -0.3407000     0.8676000 
1 1 1 20 24 32 o 11.54000 0.4565000 11.15000 0.5263000 11.93000 0.7460000 -0.7733000     0.9129000 
1 1 1 20 24 34 o 15.92000 0.3760000 15.79000 0.4599000 16.04000 0.5950000 -0.2530000     0.7520000 
1 1 1 20 24 36 o 18.84000 0.3387000 19.30000 0.3913000 18.37000 0.5530000 0.9333000      0.6774000 
1 1 1 20 24 38 o 12.53000 0.4400000 12.58000 0.5501000 12.48000 0.6869000 0.1003000      0.8800000 
1 1 1 20 24 40 o 3.337000 0.9190000 3.617000 1.328000  3.057000 1.270000  0.5602000      1.838000  
1 1 1 20 24 42 o 3.763000 0.8698000 2.600000 1.219000  4.926000 1.241000  -2.327000      1.740000  
1 1 1 20 24 44 o 4.682000 1.068000  4.013000 1.375000  5.350000 1.634000  -1.337000      2.135000  
1 1 1 20 24 46 o 3.089000 0.8844000 2.376000 1.124000  3.802000 1.366000  -1.426000      1.769000  
1 1 1 20 24 48 o 10.26000 0.6053000 9.499000 0.8376000 11.03000 0.8739000 -1.526000      1.211000  
1 1 1 20 24 50 o 10.12000 0.6748000 10.00000 0.7858000 10.24000 1.097000  -0.2432000     1.350000  
1 1 1 20 24 52 o 6.264000 0.9134000 6.535000 1.265000  5.994000 1.318000  0.5413000      1.827000  
1 1 1 20 24 54 o 10.30000 0.6506000 11.05000 0.9657000 9.546000 0.8720000 1.507000       1.301000  
1 1 1 20 24 56 o 3.851000 1.011000  4.456000 1.476000  3.246000 1.382000  1.210000       2.022000  
1 1 1 20 25 1  o 46.70000 0.3862000 46.92000 0.5025000 46.47000 0.5865000 0.4492000      0.7723000 
1 1 1 20 25 3  o 53.76000 0.3960000 54.24000 0.5648000 53.28000 0.5551000 0.9663000      0.7919000 
1 1 1 20 25 5  o 22.60000 0.2728000 23.09000 0.4490000 22.10000 0.3098000 0.9953000      0.5455000 
1 1 1 20 25 7  o 18.42000 0.3457000 18.88000 0.4993000 17.96000 0.4782000 0.9149000      0.6913000 
1 1 1 20 25 9  o 26.38000 0.3397000 25.73000 0.4775000 27.02000 0.4833000 -1.292000      0.6794000 
1 1 1 20 25 11 o 50.05000 0.4478000 49.57000 0.6289000 50.52000 0.6377000 -0.9458000     0.8957000 
1 1 1 20 25 13 o 48.13000 0.5303000 48.04000 0.7464000 48.21000 0.7535000 -0.1710000     1.061000  
1 1 1 20 25 15 o 30.30000 0.3899000 29.68000 0.5043000 30.92000 0.5947000 -1.235000      0.7797000 
1 1 1 20 25 17 o 35.81000 0.4272000 36.71000 0.6773000 34.90000 0.5208000 1.807000       0.8543000 
1 1 1 20 25 19 o 10.17000 0.5836000 9.742000 0.8857000 10.60000 0.7601000 -0.8632000     1.167000  
1 1 1 20 25 21 o 21.76000 0.3755000 21.37000 0.5437000 22.15000 0.5182000 -0.7742000     0.7511000 
1 1 1 20 25 23 f 47.13000 0.4419000 47.10000 0.6249000 47.16000 0.6251000 -0.5447000E-01 0.8838000 
1 1 1 20 25 25 o 40.98000 0.4099000 40.47000 0.5776000 41.49000 0.5818000 -1.015000      0.8198000 
1 1 1 20 25 27 o 24.96000 0.3715000 24.78000 0.3391000 25.13000 0.6611000 -0.3434000     0.7430000 
1 1 1 20 25 29 o 14.77000 0.3889000 14.18000 0.4891000 15.35000 0.6049000 -1.175000      0.7779000 
1 1 1 20 25 31 o 23.92000 0.3395000 23.52000 0.4207000 24.33000 0.5329000 -0.8112000     0.6790000 
1 1 1 20 25 33 o 21.77000 0.3627000 22.37000 0.4822000 21.17000 0.5418000 1.200000       0.7253000 
1 1 1 20 25 35 f 12.45000 0.4135000 13.06000 0.4643000 11.84000 0.6844000 1.221000       0.8271000 
1 1 1 20 25 37 o 16.31000 0.4050000 16.63000 0.4116000 16.00000 0.6976000 0.6319000      0.8100000 
1 1 1 20 25 39 o 4.968000 1.015000  4.632000 1.291000  5.304000 1.565000  -0.6723000     2.029000  
1 1 1 20 25 41 o 4.785000 0.9832000 4.858000 1.519000  4.712000 1.248000  0.1462000      1.966000  
1 1 1 20 25 43 o 7.507000 0.7570000 8.636000 1.109000  6.378000 1.031000  2.258000       1.514000  
1 1 1 20 25 45 o 5.446000 0.8925000 6.130000 1.207000  4.763000 1.315000  1.367000       1.785000  
1 1 1 20 25 47 o 3.805000 1.022000  3.317000 1.358000  4.294000 1.528000  -0.9767000     2.045000  
1 1 1 20 25 49 o 4.933000 1.108000  4.943000 1.414000  4.923000 1.705000  0.1976000E-01  2.216000  
1 1 1 20 25 51 o 9.985000 0.6181000 9.705000 0.9669000 10.27000 0.7701000 -0.5602000     1.236000  
1 1 1 20 25 53 o 11.45000 0.5471000 12.03000 0.7354000 10.87000 0.8102000 1.162000       1.094000  
1 1 1 20 25 55 o 5.342000 1.046000  5.157000 1.759000  5.527000 1.131000  -0.3702000     2.091000  
1 1 1 20 26 0  o 63.30000 0.6450000 63.30000 0.6450000 63.30000 0.6450000 0.000000       0.000000  
1 1 1 20 26 2  o 7.998000 0.4016000 9.020000 0.5233000 6.975000 0.6092000 2.044000       0.8031000 
1 1 1 20 26 4  o 5.012000 0.8500000 4.638000 1.594000  5.385000 0.5909000 -0.7470000     1.700000  
1 1 1 20 26 6  o 41.86000 0.3965000 41.49000 0.5579000 42.24000 0.5636000 -0.7528000     0.7930000 
1 1 1 20 26 8  o 32.68000 0.3496000 32.18000 0.4901000 33.19000 0.4986000 -1.016000      0.6992000 
1 1 1 20 26 10 o 21.45000 0.4682000 20.15000 0.6031000 22.76000 0.7164000 -2.610000      0.9365000 
1 1 1 20 26 12 o 31.50000 0.4221000 31.88000 0.5943000 31.12000 0.5995000 0.7674000      0.8441000 
1 1 1 20 26 14 o 41.93000 0.5740000 42.55000 0.5770000 41.30000 0.9925000 1.246000       1.148000  
1 1 1 20 26 16 o 45.81000 0.4246000 45.86000 0.5966000 45.76000 0.6044000 0.9749000E-01  0.8493000 
1 1 1 20 26 18 o 36.71000 0.3864000 36.44000 0.5451000 36.97000 0.5477000 -0.5338000     0.7727000 
1 1 1 20 26 20 o 11.19000 0.5427000 10.38000 0.8098000 12.01000 0.7228000 -1.622000      1.085000  
1 1 1 20 26 22 o 19.69000 0.4065000 20.31000 0.5801000 19.07000 0.5696000 1.241000       0.8130000 
1 1 1 20 26 24 o 20.35000 0.3968000 20.33000 0.5771000 20.38000 0.5447000 -0.5349000E-01 0.7936000 
1 1 1 20 26 26 o 24.75000 0.3799000 24.95000 0.5430000 24.54000 0.5316000 0.4028000      0.7599000 
1 1 1 20 26 28 o 8.843000 0.5059000 8.245000 0.5089000 9.441000 0.8745000 -1.196000      1.012000  
1 1 1 20 26 30 o 30.66000 0.3944000 30.02000 0.4635000 31.29000 0.6383000 -1.270000      0.7888000 
1 1 1 20 26 32 o 33.68000 0.3637000 32.84000 0.4909000 34.51000 0.5369000 -1.669000      0.7275000 
1 1 1 20 26 34 o 4.496000 0.9072000 4.887000 1.143000  4.106000 1.409000  0.7819000      1.814000  
1 1 1 20 26 36 o 21.74000 0.3632000 22.32000 0.3768000 21.16000 0.6212000 1.158000       0.7265000 
1 1 1 20 26 38 o 23.03000 0.3330000 23.06000 0.4065000 23.01000 0.5276000 0.4777000E-01  0.6660000 
1 1 1 20 26 40 o 13.43000 0.3991000 13.21000 0.5602000 13.65000 0.5686000 -0.4375000     0.7982000 
1 1 1 20 26 42 o 10.95000 0.4624000 10.81000 0.6748000 11.09000 0.6325000 -0.2799000     0.9248000 
1 1 1 20 26 44 o 4.438000 0.9716000 5.732000 1.458000  3.144000 1.285000  2.588000       1.943000  
1 1 1 20 26 46 o 8.699000 0.7320000 9.415000 0.9508000 7.984000 1.113000  1.430000       1.464000  
1 1 1 20 26 48 o 12.11000 0.6262000 12.34000 0.6620000 11.89000 1.063000  0.4571000      1.252000  
1 1 1 20 26 50 o 7.804000 0.8048000 8.299000 0.9510000 7.309000 1.299000  0.9903000      1.610000  
1 1 1 20 26 52 o 7.651000 0.7830000 7.193000 1.185000  8.109000 1.024000  -0.9160000     1.566000  
1 1 1 20 26 54 o 4.067000 1.021000  4.062000 1.505000  4.072000 1.379000  -0.1065000E-01 2.041000  
1 1 1 20 27 1  o 46.28000 0.4182000 46.54000 0.5970000 46.02000 0.5859000 0.5155000      0.8364000 
1 1 1 20 27 3  o 37.45000 0.3638000 37.46000 0.6202000 37.44000 0.3804000 0.2391000E-01  0.7276000 
1 1 1 20 27 5  o 37.76000 0.4434000 37.30000 0.6211000 38.22000 0.6331000 -0.9216000     0.8869000 
1 1 1 20 27 7  o 13.36000 0.6188000 14.11000 1.056000  12.62000 0.6457000 1.490000       1.238000  
1 1 1 20 27 9  o 6.010000 0.9766000 4.753000 1.606000  7.266000 1.111000  -2.513000      1.953000  
1 1 1 20 27 11 o 50.96000 0.5061000 49.99000 0.6293000 51.94000 0.7927000 -1.951000      1.012000  
1 1 1 20 27 13 o 44.84000 0.4773000 44.82000 0.5930000 44.86000 0.7480000 -0.3732000E-01 0.9546000 
1 1 1 20 27 15 o 25.77000 0.3554000 25.16000 0.5006000 26.39000 0.5046000 -1.232000      0.7108000 
1 1 1 20 27 17 o 30.70000 0.4127000 31.41000 0.6509000 29.98000 0.5076000 1.429000       0.8254000 
1 1 1 20 27 19 o 39.16000 0.3956000 38.47000 0.5543000 39.85000 0.5645000 -1.373000      0.7912000 
1 1 1 20 27 21 o 26.24000 0.3670000 25.74000 0.5254000 26.74000 0.5124000 -1.001000      0.7339000 
1 1 1 20 27 23 o 10.49000 0.6407000 9.753000 1.006000  11.22000 0.7938000 -1.468000      1.281000  
1 1 1 20 27 25 o 12.12000 0.5481000 11.68000 0.8263000 12.57000 0.7202000 -0.8886000     1.096000  
1 1 1 20 27 27 o 22.69000 0.3772000 23.08000 0.5482000 22.31000 0.5182000 0.7686000      0.7544000 
1 1 1 20 27 29 o 10.38000 0.5104000 9.206000 0.5197000 11.55000 0.8787000 -2.344000      1.021000  
1 1 1 20 27 31 o 8.017000 0.5707000 7.444000 0.6403000 8.590000 0.9450000 -1.147000      1.141000  
1 1 1 20 27 33 o 18.32000 0.3593000 17.73000 0.4781000 18.92000 0.5366000 -1.189000      0.7187000 
1 1 1 20 27 35 o 3.810000 0.9784000 3.756000 1.285000  3.864000 1.476000  -0.1079000     1.957000  
1 1 1 20 27 37 f 13.94000 0.3833000 13.63000 0.4403000 14.25000 0.6275000 -0.6248000     0.7665000 
1 1 1 20 27 39 o 2.822000 0.8225000 2.167000 1.021000  3.476000 1.290000  -1.309000      1.645000  
1 1 1 20 27 41 o 4.552000 0.9640000 4.253000 1.423000  4.852000 1.301000  -0.5988000     1.928000  
1 1 1 20 27 43 o 7.145000 0.6950000 7.226000 0.9695000 7.064000 0.9960000 0.1623000      1.390000  
1 1 1 20 27 45 o 4.707000 1.026000  4.293000 1.382000  5.122000 1.518000  -0.8290000     2.053000  
1 1 1 20 27 47 o 4.540000 1.012000  3.928000 1.589000  5.153000 1.252000  -1.225000      2.023000  
1 1 1 20 27 49 o 4.370000 1.123000  4.132000 1.458000  4.608000 1.708000  -0.4758000     2.246000  
1 1 1 20 27 51 o 5.057000 0.9379000 6.841000 1.306000  3.274000 1.347000  3.567000       1.876000  
1 1 1 20 27 53 o 5.824000 0.9621000 5.622000 1.488000  6.026000 1.220000  -0.4033000     1.924000  
1 1 1 20 28 0  o 14.96000 0.3973000 14.96000 0.3973000 14.96000 0.3973000 0.000000       0.000000  
1 1 1 20 28 2  o 43.71000 0.4120000 43.74000 0.6813000 43.68000 0.4634000 0.5835000E-01  0.8240000 
1 1 1 20 28 4  o 4.495000 0.9997000 5.000000 1.849000  3.990000 0.7614000 1.009000       1.999000  
1 1 1 20 28 6  o 41.76000 0.4353000 42.48000 0.5680000 41.05000 0.6597000 1.426000       0.8705000 
1 1 1 20 28 8  o 32.85000 0.3922000 33.63000 0.5085000 32.06000 0.5973000 1.574000       0.7844000 
1 1 1 20 28 10 o 15.18000 0.4092000 14.84000 0.5881000 15.52000 0.5693000 -0.6779000     0.8185000 
1 1 1 20 28 12 o 20.34000 0.3663000 20.01000 0.5242000 20.67000 0.5118000 -0.6575000     0.7326000 
1 1 1 20 28 14 o 7.388000 0.7992000 6.996000 1.209000  7.780000 1.046000  -0.7848000     1.598000  
1 1 1 20 28 16 o 18.26000 0.4534000 19.11000 0.7049000 17.41000 0.5703000 1.694000       0.9067000 
1 1 1 20 28 18 o 19.80000 0.4408000 20.50000 0.6867000 19.11000 0.5530000 1.393000       0.8817000 
1 1 1 20 28 20 o 20.63000 0.3942000 20.72000 0.5721000 20.54000 0.5425000 0.1835000      0.7884000 
1 1 1 20 28 22 o 32.64000 0.3810000 31.83000 0.5346000 33.45000 0.5431000 -1.619000      0.7620000 
1 1 1 20 28 24 o 26.60000 0.3793000 27.35000 0.5422000 25.86000 0.5306000 1.490000       0.7586000 
1 1 1 20 28 26 o 21.34000 0.4272000 21.34000 0.5504000 21.33000 0.6536000 0.9089000E-02  0.8545000 
1 1 1 20 28 28 o 13.09000 0.5551000 13.87000 0.6446000 12.32000 0.9038000 1.548000       1.110000  
1 1 1 20 28 30 o 8.003000 0.5469000 7.222000 0.6243000 8.783000 0.8980000 -1.561000      1.094000  
1 1 1 20 28 32 o 14.75000 0.3516000 14.54000 0.3999000 14.97000 0.5785000 -0.4231000     0.7033000 
1 1 1 20 28 34 o 7.517000 0.7389000 7.099000 0.8686000 7.934000 1.196000  -0.8351000     1.478000  
1 1 1 20 28 36 o 6.035000 0.8119000 5.732000 1.089000  6.338000 1.205000  -0.6058000     1.624000  
1 1 1 20 28 38 o 8.518000 0.6477000 8.250000 0.6621000 8.786000 1.113000  -0.5366000     1.295000  
1 1 1 20 28 40 o 7.561000 0.6661000 8.398000 0.8099000 6.724000 1.058000  1.674000       1.332000  
1 1 1 20 28 42 o 8.004000 0.6247000 7.110000 0.9586000 8.897000 0.8011000 -1.787000      1.249000  
1 1 1 20 28 44 o 4.873000 0.9793000 3.946000 1.379000  5.800000 1.391000  -1.854000      1.959000  
1 1 1 20 28 46 o 3.521000 0.9524000 3.244000 1.350000  3.798000 1.344000  -0.5542000     1.905000  
1 1 1 20 28 48 o 9.647000 0.6250000 9.774000 0.9605000 9.520000 0.7998000 0.2541000      1.250000  
1 1 1 20 28 50 o 5.021000 1.057000  4.687000 1.562000  5.356000 1.425000  -0.6691000     2.115000  
1 1 1 20 28 52 o 6.470000 0.8815000 6.568000 1.273000  6.371000 1.220000  0.1969000      1.763000  
1 1 1 20 29 1  o 19.51000 0.2819000 19.38000 0.4442000 19.65000 0.3470000 -0.2750000     0.5637000 
1 1 1 20 29 3  o 19.16000 0.2987000 19.05000 0.4818000 19.27000 0.3532000 -0.2133000     0.5974000 
1 1 1 20 29 5  f 28.03000 0.3425000 28.66000 0.4872000 27.39000 0.4815000 1.266000       0.6850000 
1 1 1 20 29 7  o 33.45000 0.3929000 32.68000 0.6004000 34.23000 0.5071000 -1.547000      0.7859000 
1 1 1 20 29 9  o 44.22000 0.4150000 43.65000 0.5770000 44.79000 0.5965000 -1.146000      0.8299000 
1 1 1 20 29 11 o 30.68000 0.4134000 31.05000 0.6490000 30.32000 0.5123000 0.7312000      0.8269000 
1 1 1 20 29 13 o 29.82000 0.4286000 29.19000 0.5077000 30.45000 0.6907000 -1.261000      0.8573000 
1 1 1 20 29 15 o 56.96000 0.5000000 56.65000 0.6991000 57.26000 0.7149000 -0.6063000     0.9999000 
1 1 1 20 29 17 o 17.30000 0.4044000 17.13000 0.5514000 17.47000 0.5917000 -0.3397000     0.8088000 
1 1 1 20 29 19 o 15.03000 0.4362000 14.68000 0.6370000 15.39000 0.5962000 -0.7110000     0.8725000 
1 1 1 20 29 21 o 14.22000 0.4829000 13.97000 0.7131000 14.48000 0.6513000 -0.5128000     0.9658000 
1 1 1 20 29 23 o 17.55000 0.4293000 17.85000 0.6197000 17.25000 0.5943000 0.6033000      0.8586000 
1 1 1 20 29 25 o 34.04000 0.3852000 33.95000 0.5438000 34.14000 0.5457000 -0.1914000     0.7704000 
1 1 1 20 29 27 o 18.26000 0.4558000 17.70000 0.5920000 18.83000 0.6933000 -1.129000      0.9117000 
1 1 1 20 29 29 o 9.655000 0.9685000 8.377000 1.776000  10.93000 0.7736000 -2.555000      1.937000  
1 1 1 20 29 31 o 11.16000 0.5381000 10.55000 0.6998000 11.77000 0.8175000 -1.217000      1.076000  
1 1 1 20 29 33 o 4.012000 0.8979000 3.960000 1.090000  4.064000 1.427000  -0.1040000     1.796000  
1 1 1 20 29 35 o 13.62000 0.3805000 12.70000 0.4284000 14.53000 0.6290000 -1.837000      0.7611000 
1 1 1 20 29 37 o 9.849000 0.5254000 9.773000 0.6455000 9.925000 0.8292000 -0.1525000     1.051000  
1 1 1 20 29 39 o 8.969000 0.5512000 8.255000 0.6998000 9.682000 0.8518000 -1.427000      1.102000  
1 1 1 20 29 41 o 6.566000 0.7359000 5.688000 1.137000  7.444000 0.9347000 -1.756000      1.472000  
1 1 1 20 29 43 o 3.557000 0.9425000 2.745000 1.194000  4.369000 1.459000  -1.624000      1.885000  
1 1 1 20 29 45 o 6.543000 0.7516000 6.626000 1.062000  6.459000 1.064000  0.1666000      1.503000  
1 1 1 20 29 47 o 2.847000 0.8774000 2.710000 1.224000  2.985000 1.258000  -0.2751000     1.755000  
1 1 1 20 29 49 o 4.559000 0.9843000 3.715000 1.404000  5.403000 1.380000  -1.688000      1.969000  
1 1 1 20 29 51 f 4.003000 1.007000  4.332000 1.448000  3.673000 1.398000  0.6592000      2.013000  
1 1 1 20 29 53 o 5.946000 1.026000  6.778000 1.248000  5.114000 1.628000  1.664000       2.052000  
1 1 1 20 30 0  o 17.25000 0.3781000 17.25000 0.3781000 17.25000 0.3781000 0.000000       0.000000  
1 1 1 20 30 2  o 42.73000 0.3367000 42.44000 0.4777000 43.03000 0.4745000 -0.5933000     0.6733000 
1 1 1 20 30 4  f 11.80000 0.6645000 11.29000 0.9660000 12.30000 0.9127000 -1.007000      1.329000  
1 1 1 20 30 6  o 27.45000 0.3478000 27.74000 0.4944000 27.16000 0.4893000 0.5825000      0.6956000 
1 1 1 20 30 8  o 9.216000 0.6125000 9.382000 0.8631000 9.050000 0.8693000 0.3329000      1.225000  
1 1 1 20 30 10 o 18.43000 0.3856000 18.40000 0.5409000 18.46000 0.5497000 -0.5188000E-01 0.7712000 
1 1 1 20 30 12 o 9.807000 0.6129000 9.588000 0.8725000 10.03000 0.8609000 -0.4383000     1.226000  
1 1 1 20 30 14 o 13.23000 0.5117000 13.04000 0.7313000 13.42000 0.7159000 -0.3877000     1.023000  
1 1 1 20 30 16 o 14.86000 0.5158000 15.14000 0.8002000 14.59000 0.6510000 0.5499000      1.032000  
1 1 1 20 30 18 f 24.19000 0.3798000 23.58000 0.5326000 24.80000 0.5416000 -1.219000      0.7596000 
1 1 1 20 30 20 o 24.63000 0.3727000 24.56000 0.5378000 24.71000 0.5162000 -0.1473000     0.7454000 
1 1 1 20 30 22 o 12.99000 0.5153000 12.26000 0.7775000 13.73000 0.6766000 -1.469000      1.031000  
1 1 1 20 30 24 o 19.21000 0.4197000 19.27000 0.5916000 19.15000 0.5954000 0.1162000      0.8393000 
1 1 1 20 30 26 o 16.43000 0.5970000 15.68000 0.6346000 17.17000 1.011000  -1.495000      1.194000  
1 1 1 20 30 28 o 28.26000 0.5578000 27.60000 0.9173000 28.93000 0.6348000 -1.326000      1.116000  
1 1 1 20 30 30 o 11.42000 0.8232000 11.75000 1.482000  11.08000 0.7179000 0.6693000      1.646000  
1 1 1 20 30 32 o 22.63000 0.3405000 22.84000 0.4286000 22.42000 0.5293000 0.4188000      0.6811000 
1 1 1 20 30 34 o 5.715000 0.7711000 4.951000 0.9233000 6.478000 1.235000  -1.527000      1.542000  
1 1 1 20 30 36 o 7.587000 0.6048000 7.344000 0.6953000 7.830000 0.9897000 -0.4862000     1.210000  
1 1 1 20 30 38 o 9.518000 0.4843000 8.463000 0.5561000 10.57000 0.7930000 -2.110000      0.9685000 
1 1 1 20 30 40 o 10.76000 0.4792000 10.01000 0.7130000 11.51000 0.6405000 -1.503000      0.9584000 
1 1 1 20 30 42 o 3.523000 0.9414000 3.140000 1.251000  3.905000 1.407000  -0.7643000     1.883000  
1 1 1 20 30 44 o 5.924000 0.8146000 5.841000 1.150000  6.006000 1.154000  -0.1656000     1.629000  
1 1 1 20 30 46 o 4.648000 1.006000  5.390000 1.459000  3.905000 1.385000  1.485000       2.011000  
1 1 1 20 30 48 f 6.339000 0.9411000 4.928000 1.395000  7.750000 1.263000  -2.822000      1.882000  
1 1 1 20 30 50 o 4.894000 0.9743000 3.751000 1.449000  6.037000 1.303000  -2.286000      1.949000  
1 1 1 20 30 52 f 5.685000 0.9845000 4.614000 1.663000  6.756000 1.055000  -2.142000      1.969000  
1 1 1 20 31 1  o 8.447000 0.5072000 8.155000 0.8427000 8.738000 0.5648000 -0.5833000     1.014000  
1 1 1 20 31 3  o 31.41000 0.2811000 31.85000 0.4134000 30.98000 0.3808000 0.8744000      0.5621000 
1 1 1 20 31 5  o 14.60000 0.4595000 14.94000 0.4533000 14.27000 0.7994000 0.6637000      0.9190000 
1 1 1 20 31 7  f 36.63000 0.3768000 36.35000 0.5266000 36.92000 0.5392000 -0.5672000     0.7537000 
1 1 1 20 31 9  o 47.15000 0.4973000 47.19000 0.6127000 47.11000 0.7835000 0.7375000E-01  0.9946000 
1 1 1 20 31 11 o 47.22000 0.4388000 47.53000 0.6193000 46.92000 0.6218000 0.6086000      0.8776000 
1 1 1 20 31 13 o 11.28000 0.6663000 11.69000 0.7713000 10.86000 1.087000  0.8384000      1.333000  
1 1 1 20 31 15 o 28.21000 0.3685000 28.15000 0.5064000 28.27000 0.5354000 -0.1238000     0.7370000 
1 1 1 20 31 17 o 21.12000 0.3972000 20.29000 0.5695000 21.95000 0.5539000 -1.654000      0.7944000 
1 1 1 20 31 19 o 20.46000 0.3934000 20.06000 0.5485000 20.87000 0.5640000 -0.8141000     0.7868000 
1 1 1 20 31 21 o 12.11000 0.5293000 11.83000 0.7987000 12.39000 0.6947000 -0.5554000     1.059000  
1 1 1 20 31 23 o 5.402000 1.125000  5.451000 1.502000  5.353000 1.675000  0.9777000E-01  2.250000  
1 1 1 20 31 25 o 19.36000 0.4567000 19.27000 0.5716000 19.45000 0.7125000 -0.1884000     0.9134000 
1 1 1 20 31 27 o 18.91000 0.4262000 19.51000 0.6579000 18.31000 0.5419000 1.201000       0.8523000 
1 1 1 20 31 29 o 23.10000 0.4077000 23.11000 0.6315000 23.08000 0.5158000 0.3019000E-01  0.8154000 
1 1 1 20 31 31 o 4.115000 0.9988000 4.253000 1.432000  3.977000 1.393000  0.2768000      1.998000  
1 1 1 20 31 33 o 4.502000 0.8233000 3.480000 1.052000  5.524000 1.267000  -2.044000      1.647000  
1 1 1 20 31 35 o 3.635000 0.8620000 3.902000 1.081000  3.368000 1.343000  0.5341000      1.724000  
1 1 1 20 31 37 o 11.71000 0.5230000 12.13000 0.5635000 11.29000 0.8811000 0.8414000      1.046000  
1 1 1 20 31 39 o 5.642000 0.7751000 5.406000 0.9347000 5.878000 1.237000  -0.4715000     1.550000  
1 1 1 20 31 41 o 14.11000 0.4108000 13.43000 0.5181000 14.78000 0.6376000 -1.355000      0.8216000 
1 1 1 20 31 43 o 7.709000 0.6463000 6.969000 0.9594000 8.448000 0.8662000 -1.479000      1.293000  
1 1 1 20 31 45 o 6.884000 0.8056000 6.849000 1.133000  6.920000 1.145000  -0.7129000E-01 1.611000  
1 1 1 20 31 47 o 14.36000 0.4788000 14.11000 0.6977000 14.60000 0.6559000 -0.4843000     0.9575000 
1 1 1 20 31 49 o 8.846000 0.8618000 7.619000 1.530000  10.07000 0.7931000 -2.455000      1.724000  
1 1 1 20 31 51 f 3.687000 1.026000  3.528000 1.500000  3.846000 1.400000  -0.3181000     2.052000  
1 1 1 20 32 0  o 2.259000 1.025000  2.259000 1.025000  2.259000 1.025000  0.000000       0.000000  
1 1 1 20 32 2  o 39.46000 0.3225000 39.55000 0.4637000 39.38000 0.4484000 0.1697000      0.6450000 
1 1 1 20 32 4  o 24.22000 0.4368000 23.97000 0.5695000 24.47000 0.6624000 -0.4964000     0.8736000 
1 1 1 20 32 6  o 22.50000 0.3920000 22.95000 0.4073000 22.05000 0.6700000 0.9042000      0.7841000 
1 1 1 20 32 8  o 12.32000 0.5870000 12.07000 0.7215000 12.56000 0.9263000 -0.4895000     1.174000  
1 1 1 20 32 10 o 24.44000 0.3665000 24.14000 0.5165000 24.74000 0.5200000 -0.5970000     0.7329000 
1 1 1 20 32 12 o 43.79000 0.4795000 44.69000 0.5992000 42.89000 0.7487000 1.805000       0.9590000 
1 1 1 20 32 14 o 9.543000 0.6386000 9.759000 0.9004000 9.328000 0.9059000 0.4313000      1.277000  
1 1 1 20 32 16 o 37.97000 0.4550000 38.86000 0.7151000 37.09000 0.5629000 1.766000       0.9100000 
1 1 1 20 32 18 o 4.392000 1.077000  4.091000 1.518000  4.692000 1.528000  -0.6014000     2.154000  
1 1 1 20 32 20 o 5.931000 0.9380000 4.156000 1.531000  7.707000 1.084000  -3.551000      1.876000  
1 1 1 20 32 22 o 23.51000 0.4239000 22.61000 0.5363000 24.42000 0.6566000 -1.807000      0.8478000 
1 1 1 20 32 24 o 32.70000 0.4561000 32.04000 0.6456000 33.37000 0.6445000 -1.331000      0.9123000 
1 1 1 20 32 26 o 11.72000 0.5877000 12.12000 0.8915000 11.33000 0.7659000 0.7851000      1.175000  
1 1 1 20 32 28 o 3.379000 1.005000  3.348000 1.478000  3.410000 1.361000  -0.6225000E-01 2.009000  
1 1 1 20 32 30 o 6.638000 0.8297000 7.920000 1.010000  5.356000 1.317000  2.563000       1.659000  
1 1 1 20 32 32 o 20.11000 0.4141000 20.20000 0.5197000 20.02000 0.6448000 0.1719000      0.8282000 
1 1 1 20 32 34 o 23.85000 0.3639000 23.64000 0.5097000 24.05000 0.5195000 -0.4152000     0.7278000 
1 1 1 20 32 36 o 16.08000 0.3753000 15.83000 0.4984000 16.32000 0.5614000 -0.4892000     0.7507000 
1 1 1 20 32 38 o 11.83000 0.4434000 11.75000 0.5788000 11.92000 0.6717000 -0.1764000     0.8867000 
1 1 1 20 32 40 o 4.207000 0.9957000 3.753000 1.398000  4.660000 1.418000  -0.9071000     1.991000  
1 1 1 20 32 42 o 5.911000 0.8221000 5.538000 1.192000  6.283000 1.133000  -0.7454000     1.644000  
1 1 1 20 32 44 o 9.372000 0.5891000 8.721000 0.8700000 10.02000 0.7945000 -1.303000      1.178000  
1 1 1 20 32 46 o 12.19000 0.4551000 11.54000 0.6152000 12.83000 0.6708000 -1.287000      0.9102000 
1 1 1 20 32 48 o 10.56000 0.5851000 10.27000 0.9157000 10.86000 0.7285000 -0.5939000     1.170000  
1 1 1 20 32 50 o 4.731000 1.197000  5.315000 1.930000  4.147000 1.417000  1.168000       2.394000  
1 1 1 20 33 1  f 24.82000 0.3053000 24.79000 0.4799000 24.85000 0.3776000 -0.5092000E-01 0.6106000 
1 1 1 20 33 3  o 22.73000 0.4760000 22.58000 0.6669000 22.88000 0.6795000 -0.2969000     0.9521000 
1 1 1 20 33 5  o 31.42000 0.3984000 31.65000 0.4271000 31.20000 0.6726000 0.4466000      0.7968000 
1 1 1 20 33 7  o 45.83000 0.4630000 45.35000 0.5089000 46.32000 0.7736000 -0.9731000     0.9260000 
1 1 1 20 33 9  o 26.32000 0.3966000 26.07000 0.4192000 26.57000 0.6733000 -0.4995000     0.7931000 
1 1 1 20 33 11 o 22.48000 0.3779000 22.20000 0.5325000 22.75000 0.5365000 -0.5587000     0.7559000 
1 1 1 20 33 13 o 37.01000 0.3937000 37.03000 0.5485000 37.00000 0.5650000 0.2868000E-01  0.7874000 
1 1 1 20 33 15 o 33.34000 0.4406000 34.16000 0.6950000 32.52000 0.5417000 1.645000       0.8811000 
1 1 1 20 33 17 o 29.51000 0.3744000 29.93000 0.5283000 29.09000 0.5307000 0.8403000      0.7488000 
1 1 1 20 33 19 o 12.47000 0.5254000 11.79000 0.7567000 13.15000 0.7290000 -1.358000      1.051000  
1 1 1 20 33 21 o 40.37000 0.5760000 40.08000 0.5774000 40.67000 0.9968000 -0.5908000     1.152000  
1 1 1 20 33 23 o 22.42000 0.4315000 22.91000 0.6792000 21.93000 0.5324000 0.9806000      0.8630000 
1 1 1 20 33 25 o 3.617000 1.107000  4.516000 1.795000  2.718000 1.294000  1.798000       2.213000  
1 1 1 20 33 27 o 7.646000 0.7405000 6.848000 1.193000  8.444000 0.8770000 -1.595000      1.481000  
1 1 1 20 33 29 o 9.155000 0.6124000 8.957000 0.8735000 9.353000 0.8585000 -0.3958000     1.225000  
1 1 1 20 33 31 o 9.825000 0.6645000 10.35000 0.7790000 9.297000 1.077000  1.055000       1.329000  
1 1 1 20 33 33 o 10.72000 0.5396000 10.53000 0.7713000 10.90000 0.7548000 -0.3652000     1.079000  
1 1 1 20 33 35 o 11.98000 0.5058000 11.71000 0.7397000 12.26000 0.6902000 -0.5479000     1.012000  
1 1 1 20 33 37 o 15.38000 0.3913000 14.79000 0.4989000 15.97000 0.6031000 -1.182000      0.7827000 
1 1 1 20 33 39 o 7.835000 0.7648000 7.731000 0.8966000 7.940000 1.239000  -0.2088000     1.530000  
1 1 1 20 33 41 o 3.299000 0.8717000 2.691000 1.126000  3.907000 1.331000  -1.215000      1.743000  
1 1 1 20 33 43 o 3.505000 0.8994000 4.313000 1.331000  2.696000 1.210000  1.616000       1.799000  
1 1 1 20 33 45 f 7.372000 0.7762000 7.832000 1.043000  6.912000 1.150000  0.9198000      1.552000  
1 1 1 20 33 47 o 5.973000 0.8962000 6.059000 1.137000  5.886000 1.386000  0.1725000      1.792000  
1 1 1 20 33 49 o 5.810000 0.9896000 4.522000 1.716000  7.098000 0.9857000 -2.576000      1.979000  
1 1 1 20 34 0  o 52.09000 0.6529000 52.09000 0.6529000 52.09000 0.6529000 0.000000       0.000000  
1 1 1 20 34 2  o 44.95000 0.3903000 44.52000 0.5016000 45.37000 0.5980000 -0.8500000     0.7805000 
1 1 1 20 34 4  o 13.15000 0.5301000 13.82000 0.4808000 12.48000 0.9450000 1.333000       1.060000  
1 1 1 20 34 6  o 44.01000 0.4729000 44.48000 0.5755000 43.53000 0.7505000 0.9436000      0.9458000 
1 1 1 20 34 8  o 29.01000 0.3982000 29.02000 0.4232000 29.00000 0.6746000 0.1755000E-01  0.7963000 
1 1 1 20 34 10 o 17.20000 0.4581000 17.02000 0.4746000 17.39000 0.7836000 -0.3622000     0.9162000 
1 1 1 20 34 12 o 15.18000 0.5233000 15.18000 0.6305000 15.18000 0.8354000 0.2854000E-02  1.047000  
1 1 1 20 34 14 o 29.88000 0.3738000 29.50000 0.5228000 30.25000 0.5344000 -0.7514000     0.7476000 
1 1 1 20 34 16 o 30.49000 0.3830000 30.73000 0.5368000 30.25000 0.5464000 0.4819000      0.7660000 
1 1 1 20 34 18 o 36.25000 0.5740000 35.94000 0.6513000 36.55000 0.9453000 -0.6115000     1.148000  
1 1 1 20 34 20 o 17.36000 0.4911000 16.59000 0.7547000 18.14000 0.6286000 -1.546000      0.9822000 
1 1 1 20 34 22 o 12.45000 0.5081000 12.60000 0.7130000 12.30000 0.7241000 0.3037000      1.016000  
1 1 1 20 34 24 o 15.07000 0.6781000 14.78000 1.128000  15.37000 0.7537000 -0.5904000     1.356000  
1 1 1 20 34 26 o 19.87000 0.3931000 20.17000 0.5561000 19.56000 0.5558000 0.6171000      0.7862000 
1 1 1 20 34 28 o 17.87000 0.3821000 18.30000 0.5331000 17.44000 0.5475000 0.8637000      0.7642000 
1 1 1 20 34 30 o 3.521000 1.002000  3.172000 1.315000  3.871000 1.512000  -0.6991000     2.004000  
1 1 1 20 34 32 o 5.435000 0.9389000 4.927000 1.357000  5.942000 1.298000  -1.015000      1.878000  
1 1 1 20 34 34 o 5.199000 0.9383000 4.336000 1.459000  6.063000 1.180000  -1.726000      1.877000  
1 1 1 20 34 36 o 8.965000 0.6026000 8.243000 0.5338000 9.686000 1.081000  -1.443000      1.205000  
1 1 1 20 34 38 f 14.81000 0.4824000 14.33000 0.5506000 15.30000 0.7923000 -0.9725000     0.9648000 
1 1 1 20 34 40 f 6.191000 0.7696000 6.074000 1.142000  6.307000 1.031000  -0.2326000     1.539000  
1 1 1 20 34 42 o 7.156000 0.6661000 7.640000 0.7661000 6.672000 1.090000  0.9680000      1.332000  
1 1 1 20 34 44 o 5.726000 0.8498000 5.830000 1.080000  5.623000 1.313000  0.2063000      1.700000  
1 1 1 20 34 46 o 8.538000 0.8859000 8.876000 1.512000  8.201000 0.9233000 0.6757000      1.772000  
1 1 1 20 34 48 o 5.058000 1.353000  5.712000 2.368000  4.403000 1.311000  1.309000       2.707000  
1 1 1 20 35 1  o 15.60000 0.3054000 14.88000 0.4645000 16.33000 0.3967000 -1.448000      0.6109000 
1 1 1 20 35 3  o 32.50000 0.3356000 32.34000 0.5117000 32.66000 0.4344000 -0.3242000     0.6712000 
1 1 1 20 35 5  o 25.61000 0.3958000 25.97000 0.4136000 25.25000 0.6750000 0.7165000      0.7917000 
1 1 1 20 35 7  o 29.03000 0.4006000 29.31000 0.4277000 28.75000 0.6774000 0.5548000      0.8011000 
1 1 1 20 35 9  o 17.46000 0.4663000 18.03000 0.4520000 16.89000 0.8157000 1.134000       0.9326000 
1 1 1 20 35 11 o 17.51000 0.4600000 17.12000 0.4865000 17.90000 0.7807000 -0.7775000     0.9199000 
1 1 1 20 35 13 o 27.92000 0.4098000 28.04000 0.4320000 27.80000 0.6966000 0.2363000      0.8197000 
1 1 1 20 35 15 o 24.95000 0.6321000 25.55000 0.6923000 24.35000 1.058000  1.203000       1.264000  
1 1 1 20 35 17 o 31.78000 0.5518000 31.99000 0.6490000 31.57000 0.8925000 0.4153000      1.104000  
1 1 1 20 35 19 o 21.75000 0.3923000 21.80000 0.5469000 21.70000 0.5627000 0.1062000      0.7847000 
1 1 1 20 35 21 o 15.85000 0.5054000 15.84000 0.8136000 15.87000 0.5999000 -0.3112000E-01 1.011000  
1 1 1 20 35 23 o 4.380000 1.162000  5.650000 1.905000  3.110000 1.333000  2.540000       2.325000  
1 1 1 20 35 25 o 13.02000 0.4703000 13.23000 0.6616000 12.80000 0.6685000 0.4390000      0.9405000 
1 1 1 20 35 27 o 6.792000 0.7707000 7.641000 1.106000  5.943000 1.073000  1.698000       1.541000  
1 1 1 20 35 29 o 6.848000 0.7818000 7.034000 1.048000  6.661000 1.160000  0.3723000      1.564000  
1 1 1 20 35 31 o 20.09000 0.3779000 19.69000 0.5325000 20.49000 0.5364000 -0.7999000     0.7558000 
1 1 1 20 35 33 o 7.114000 0.7602000 7.326000 1.009000  6.901000 1.137000  0.4257000      1.520000  
1 1 1 20 35 35 o 15.34000 0.4292000 15.30000 0.5926000 15.39000 0.6210000 -0.9042000E-01 0.8584000 
1 1 1 20 35 37 o 5.438000 0.8471000 4.367000 0.9470000 6.509000 1.405000  -2.142000      1.694000  
1 1 1 20 35 39 o 10.47000 0.4656000 9.570000 0.5617000 11.37000 0.7427000 -1.796000      0.9312000 
1 1 1 20 35 41 o 4.698000 1.017000  3.778000 1.626000  5.618000 1.221000  -1.840000      2.033000  
1 1 1 20 35 43 o 4.991000 1.122000  5.709000 1.794000  4.274000 1.348000  1.435000       2.245000  
1 1 1 20 35 45 o 4.312000 1.043000  3.286000 1.517000  5.338000 1.432000  -2.052000      2.086000  
1 1 1 20 35 47 o 5.144000 1.004000  4.058000 1.697000  6.229000 1.074000  -2.172000      2.008000  
1 1 1 20 36 0  o 29.00000 0.4870000 29.00000 0.4870000 29.00000 0.4870000 0.000000       0.000000  
1 1 1 20 36 2  o 28.12000 0.2816000 28.15000 0.4102000 28.09000 0.3860000 0.5574000E-01  0.5632000 
1 1 1 20 36 4  o 13.41000 0.5059000 13.12000 0.5377000 13.69000 0.8572000 -0.5747000     1.012000  
1 1 1 20 36 6  o 22.66000 0.4769000 23.05000 0.6625000 22.27000 0.6861000 0.7741000      0.9538000 
1 1 1 20 36 8  o 27.01000 0.3981000 27.38000 0.4311000 26.65000 0.6695000 0.7239000      0.7963000 
1 1 1 20 36 10 o 4.785000 1.074000  4.534000 1.282000  5.036000 1.724000  -0.5027000     2.149000  
1 1 1 20 36 12 o 19.38000 0.4385000 19.69000 0.4592000 19.08000 0.7471000 0.6151000      0.8769000 
1 1 1 20 36 14 o 26.84000 0.5065000 26.84000 0.5065000 ?        ?         ?              ?         
1 1 1 20 36 16 o 13.74000 0.4994000 13.05000 0.5633000 14.44000 0.8248000 -1.391000      0.9988000 
1 1 1 20 36 18 o 6.261000 0.9507000 5.968000 1.350000  6.554000 1.339000  -0.5855000     1.901000  
1 1 1 20 36 20 o 3.628000 1.093000  4.401000 1.771000  2.856000 1.280000  1.545000       2.185000  
1 1 1 20 36 22 o 13.85000 0.4857000 13.93000 0.6943000 13.77000 0.6794000 0.1564000      0.9714000 
1 1 1 20 36 24 o 10.77000 0.6189000 10.94000 0.7105000 10.60000 1.014000  0.3385000      1.238000  
1 1 1 20 36 26 o 14.01000 0.4772000 14.35000 0.6009000 13.66000 0.7415000 0.6919000      0.9544000 
1 1 1 20 36 28 o 12.64000 0.4606000 12.46000 0.6331000 12.81000 0.6690000 -0.3571000     0.9211000 
1 1 1 20 36 30 f 12.57000 0.4783000 12.60000 0.6493000 12.54000 0.7026000 0.6159000E-01  0.9567000 
1 1 1 20 36 32 o 19.91000 0.3882000 19.78000 0.5522000 20.04000 0.5458000 -0.2605000     0.7764000 
1 1 1 20 36 34 o 4.084000 0.9931000 4.788000 1.466000  3.381000 1.341000  1.406000       1.986000  
1 1 1 20 36 36 o 4.315000 1.048000  5.142000 1.472000  3.487000 1.492000  1.655000       2.096000  
1 1 1 20 36 38 o 8.143000 1.147000  6.204000 2.111000  10.08000 0.8997000 -3.878000      2.295000  
1 1 1 20 36 40 o 9.797000 0.6811000 9.686000 1.167000  9.909000 0.7021000 -0.2235000     1.362000  
1 1 1 20 36 42 o 12.93000 0.5492000 12.53000 0.8925000 13.33000 0.6402000 -0.8068000     1.098000  
1 1 1 20 36 44 o 11.04000 0.7217000 11.10000 1.187000  10.99000 0.8217000 0.1179000      1.443000  
1 1 1 20 36 46 o 5.303000 1.215000  5.550000 1.939000  5.057000 1.465000  0.4931000      2.430000  
1 1 1 20 36 48 o 5.120000 1.710000  5.120000 1.710000  ?        ?         ?              ?         
1 1 1 20 37 1  o 11.27000 0.3550000 12.00000 0.5075000 10.54000 0.4965000 1.452000       0.7100000 
1 1 1 20 37 3  o 6.221000 0.6492000 6.139000 1.138000  6.303000 0.6249000 -0.1632000     1.298000  
1 1 1 20 37 5  o 11.94000 0.5441000 11.78000 0.5601000 12.11000 0.9331000 -0.3276000     1.088000  
1 1 1 20 37 7  o 32.72000 0.4093000 32.63000 0.4442000 32.81000 0.6877000 -0.1845000     0.8187000 
1 1 1 20 37 9  o 9.383000 0.8749000 9.904000 1.045000  8.861000 1.403000  1.043000       1.750000  
1 1 1 20 37 11 o 16.98000 0.5921000 16.98000 0.5921000 ?        ?         ?              ?         
1 1 1 20 37 13 o 9.014000 0.7878000 9.296000 0.7919000 8.731000 1.362000  0.5649000      1.576000  
1 1 1 20 37 15 o 24.85000 0.3999000 25.13000 0.4475000 24.57000 0.6629000 0.5637000      0.7998000 
1 1 1 20 37 17 o 19.37000 0.4515000 19.36000 0.6069000 19.37000 0.6687000 -0.1168000E-01 0.9030000 
1 1 1 20 37 19 o 16.92000 0.4863000 16.53000 0.6372000 17.31000 0.7348000 -0.7850000     0.9726000 
1 1 1 20 37 21 o 12.05000 0.5992000 11.87000 0.6994000 12.22000 0.9733000 -0.3515000     1.198000  
1 1 1 20 37 23 o 13.52000 0.5536000 13.91000 0.6060000 13.13000 0.9267000 0.7893000      1.107000  
1 1 1 20 37 25 f 3.102000 0.9231000 2.249000 1.066000  3.956000 1.508000  -1.707000      1.846000  
1 1 1 20 37 27 o 6.286000 0.8508000 5.973000 1.170000  6.599000 1.236000  -0.6266000     1.702000  
1 1 1 20 37 29 o 7.049000 0.7400000 7.436000 0.9515000 6.662000 1.134000  0.7740000      1.480000  
1 1 1 20 37 31 o 3.921000 0.9649000 3.050000 1.264000  4.793000 1.458000  -1.742000      1.930000  
1 1 1 20 37 33 o 7.858000 0.7072000 7.425000 1.054000  8.291000 0.9433000 -0.8656000     1.414000  
1 1 1 20 37 35 o 10.33000 0.7238000 10.69000 0.7704000 9.960000 1.226000  0.7349000      1.448000  
1 1 1 20 37 37 o 13.27000 0.7606000 12.21000 1.379000  14.34000 0.6419000 -2.133000      1.521000  
1 1 1 20 37 39 o 9.888000 0.6204000 9.949000 0.8591000 9.828000 0.8952000 0.1207000      1.241000  
1 1 1 20 37 41 o 16.04000 0.6428000 16.23000 1.147000  15.86000 0.5805000 0.3689000      1.286000  
1 1 1 20 37 43 o 8.216000 0.8739000 9.232000 1.250000  7.199000 1.222000  2.032000       1.748000  
1 1 1 20 37 45 o 7.441000 0.9273000 7.337000 1.599000  7.544000 0.9394000 -0.2071000     1.855000  
1 1 1 20 37 47 o 4.321000 1.318000  4.733000 2.137000  3.909000 1.544000  0.8237000      2.636000  
1 1 1 20 38 0  o 29.46000 0.4845000 29.46000 0.4845000 29.46000 0.4845000 0.000000       0.000000  
1 1 1 20 38 2  o 21.63000 0.3247000 21.81000 0.4769000 21.45000 0.4406000 0.3692000      0.6493000 
1 1 1 20 38 4  o 14.81000 0.5134000 14.82000 0.4668000 14.80000 0.9145000 0.1771000E-01  1.027000  
1 1 1 20 38 6  o 8.926000 1.159000  10.34000 0.6390000 7.513000 2.229000  2.826000       2.319000  
1 1 1 20 38 8  o 3.371000 1.069000  2.730000 1.184000  4.012000 1.780000  -1.282000      2.138000  
1 1 1 20 38 10 f 17.98000 0.4526000 17.90000 0.5331000 18.06000 0.7315000 -0.1641000     0.9051000 
1 1 1 20 38 12 o 15.03000 0.5585000 15.34000 0.7679000 14.73000 0.8113000 0.6116000      1.117000  
1 1 1 20 38 14 o 18.83000 0.4767000 18.99000 0.6295000 18.68000 0.7159000 0.3073000      0.9533000 
1 1 1 20 38 16 o 3.803000 1.086000  3.663000 1.463000  3.942000 1.606000  -0.2788000     2.172000  
1 1 1 20 38 18 f 15.44000 0.4527000 15.10000 0.5000000 15.79000 0.7548000 -0.6830000     0.9054000 
1 1 1 20 38 20 o 10.84000 0.5299000 10.68000 0.6482000 10.99000 0.8384000 -0.3178000     1.060000  
1 1 1 20 38 22 o 8.091000 0.8482000 8.784000 0.7546000 7.398000 1.519000  1.386000       1.696000  
1 1 1 20 38 24 f 15.48000 0.5299000 15.70000 0.4871000 15.26000 0.9411000 0.4395000      1.060000  
1 1 1 20 38 26 o 8.464000 0.6959000 8.643000 1.041000  8.286000 0.9238000 0.3579000      1.392000  
1 1 1 20 38 28 o 19.15000 0.4373000 19.17000 0.5367000 19.13000 0.6907000 0.3495000E-01  0.8747000 
1 1 1 20 38 30 o 11.39000 0.5167000 11.68000 0.6893000 11.11000 0.7698000 0.5657000      1.033000  
1 1 1 20 38 32 o 4.657000 0.9502000 4.381000 1.341000  4.932000 1.346000  -0.5512000     1.900000  
1 1 1 20 38 34 o 9.063000 0.6309000 9.281000 0.8410000 8.846000 0.9406000 0.4343000      1.262000  
1 1 1 20 38 36 o 5.314000 0.9411000 3.537000 1.502000  7.092000 1.134000  -3.555000      1.882000  
1 1 1 20 38 38 f 9.048000 0.6371000 9.009000 0.9133000 9.087000 0.8885000 -0.7782000E-01 1.274000  
1 1 1 20 38 40 o 9.079000 0.7725000 9.632000 1.288000  8.525000 0.8525000 1.107000       1.545000  
1 1 1 20 38 42 o 4.383000 1.107000  4.288000 1.719000  4.478000 1.394000  -0.1895000     2.214000  
1 1 1 20 38 44 o 4.185000 1.078000  4.043000 1.754000  4.327000 1.253000  -0.2842000     2.156000  
1 1 1 20 38 46 o 3.379000 1.061000  3.313000 1.519000  3.446000 1.481000  -0.1332000     2.121000  
1 1 1 20 39 1  o 12.91000 0.3444000 13.15000 0.4989000 12.67000 0.4748000 0.4795000      0.6887000 
1 1 1 20 39 3  o 9.020000 0.3759000 9.275000 0.5745000 8.765000 0.4850000 0.5098000      0.7518000 
1 1 1 20 39 5  o 41.75000 0.6400000 40.72000 0.5456000 42.79000 1.158000  -2.065000      1.280000  
1 1 1 20 39 7  o 20.38000 0.5481000 19.54000 0.4826000 21.22000 0.9842000 -1.678000      1.096000  
1 1 1 20 39 9  o 15.42000 0.4730000 14.47000 0.5598000 16.37000 0.7627000 -1.898000      0.9460000 
1 1 1 20 39 11 o 15.65000 0.4966000 16.63000 0.5339000 14.68000 0.8376000 1.954000       0.9933000 
1 1 1 20 39 13 o 20.58000 0.4579000 20.42000 0.5764000 20.75000 0.7117000 -0.3312000     0.9158000 
1 1 1 20 39 15 o 6.252000 0.9613000 6.683000 1.034000  5.820000 1.621000  0.8631000      1.923000  
1 1 1 20 39 17 f 5.528000 0.9455000 4.686000 1.171000  6.370000 1.485000  -1.684000      1.891000  
1 1 1 20 39 19 o 10.66000 0.5298000 10.31000 0.6589000 11.01000 0.8297000 -0.7037000     1.060000  
1 1 1 20 39 21 o 11.88000 0.6523000 11.45000 0.6081000 12.30000 1.154000  -0.8515000     1.305000  
1 1 1 20 39 23 o 12.58000 0.5244000 12.33000 0.5665000 12.83000 0.8828000 -0.4924000     1.049000  
1 1 1 20 39 25 o 5.955000 0.9357000 6.956000 0.8346000 4.954000 1.675000  2.002000       1.871000  
1 1 1 20 39 27 o 7.796000 0.7597000 7.051000 0.8795000 8.540000 1.239000  -1.489000      1.519000  
1 1 1 20 39 29 o 6.631000 0.8477000 5.534000 1.233000  7.728000 1.164000  -2.193000      1.695000  
1 1 1 20 39 31 o 6.149000 0.9463000 6.238000 1.167000  6.059000 1.490000  0.1792000      1.893000  
1 1 1 20 39 33 o 7.911000 0.7128000 7.528000 1.063000  8.294000 0.9497000 -0.7651000     1.426000  
1 1 1 20 39 35 o 11.10000 0.6044000 10.72000 0.9423000 11.47000 0.7571000 -0.7505000     1.209000  
1 1 1 20 39 37 o 7.961000 0.7285000 7.472000 1.058000  8.451000 1.002000  -0.9789000     1.457000  
1 1 1 20 39 39 o 11.02000 0.6185000 11.29000 0.9363000 10.75000 0.8085000 0.5457000      1.237000  
1 1 1 20 39 41 o 14.28000 0.5451000 13.90000 0.8970000 14.66000 0.6195000 -0.7648000     1.090000  
1 1 1 20 39 43 o 6.277000 1.018000  7.151000 1.614000  5.403000 1.241000  1.748000       2.036000  
1 1 1 20 39 45 o 3.898000 1.091000  3.453000 1.608000  4.343000 1.476000  -0.8901000     2.183000  
1 1 1 20 40 0  o 13.19000 0.6459000 13.19000 0.6459000 13.19000 0.6459000 0.000000       0.000000  
1 1 1 20 40 2  o 14.45000 0.3386000 14.49000 0.5701000 14.41000 0.3654000 0.8256000E-01  0.6772000 
1 1 1 20 40 4  o 6.079000 1.121000  5.919000 1.005000  6.240000 2.003000  -0.3210000     2.241000  
1 1 1 20 40 6  o 21.86000 0.4317000 21.52000 0.4719000 22.21000 0.7229000 -0.6918000     0.8633000 
1 1 1 20 40 8  f 12.59000 0.5374000 12.21000 0.6140000 12.96000 0.8822000 -0.7579000     1.075000  
1 1 1 20 40 10 o 15.69000 0.5216000 15.92000 0.6735000 15.46000 0.7965000 0.4544000      1.043000  
1 1 1 20 40 12 o 19.80000 0.4233000 19.90000 0.4902000 19.70000 0.6902000 0.1982000      0.8466000 
1 1 1 20 40 14 o 9.443000 0.6222000 9.356000 0.6625000 9.530000 1.053000  -0.1739000     1.244000  
1 1 1 20 40 16 o 8.337000 0.6959000 8.419000 0.7666000 8.255000 1.162000  0.1646000      1.392000  
1 1 1 20 40 18 o 20.19000 0.4875000 19.96000 0.4411000 20.43000 0.8695000 -0.4647000     0.9750000 
1 1 1 20 40 20 o 14.10000 0.6368000 14.95000 0.6373000 13.25000 1.103000  1.704000       1.274000  
1 1 1 20 40 22 o 20.10000 0.4821000 19.71000 0.6932000 20.50000 0.6701000 -0.7802000     0.9641000 
1 1 1 20 40 24 f 4.262000 1.033000  4.361000 1.275000  4.163000 1.626000  0.1972000      2.066000  
1 1 1 20 40 26 o 14.28000 0.5086000 14.60000 0.5235000 13.96000 0.8721000 0.6447000      1.017000  
1 1 1 20 40 28 o 15.41000 0.5083000 16.18000 0.5084000 14.65000 0.8804000 1.535000       1.017000  
1 1 1 20 40 30 o 13.45000 0.5555000 13.45000 0.5555000 ?        ?         ?              ?         
1 1 1 20 40 32 o 15.80000 0.4693000 16.44000 0.4934000 15.16000 0.7984000 1.281000       0.9386000 
1 1 1 20 40 34 o 12.86000 0.5685000 12.97000 0.6573000 12.76000 0.9277000 0.2147000      1.137000  
1 1 1 20 40 36 o 11.81000 0.7033000 11.09000 1.085000  12.53000 0.8956000 -1.443000      1.407000  
1 1 1 20 40 38 o 6.701000 0.8768000 6.061000 1.448000  7.340000 0.9892000 -1.280000      1.754000  
1 1 1 20 40 40 o 4.703000 1.082000  4.707000 1.771000  4.698000 1.242000  0.8874000E-02  2.163000  
1 1 1 20 40 42 o 4.430000 1.134000  5.843000 1.899000  3.017000 1.241000  2.826000       2.269000  
1 1 1 20 40 44 f 6.148000 1.172000  6.905000 1.670000  5.390000 1.645000  1.515000       2.344000  
1 1 1 20 41 1  f 10.20000 0.3449000 10.78000 0.4902000 9.611000 0.4854000 1.171000       0.6898000 
1 1 1 20 41 3  o 9.509000 0.3968000 8.991000 0.6602000 10.03000 0.4402000 -1.036000      0.7935000 
1 1 1 20 41 5  o 23.46000 0.4226000 23.85000 0.4090000 23.08000 0.7396000 0.7705000      0.8452000 
1 1 1 20 41 7  o 24.37000 0.4566000 23.85000 0.5401000 24.90000 0.7364000 -1.048000      0.9132000 
1 1 1 20 41 9  o 8.627000 0.8128000 9.581000 0.7575000 7.674000 1.438000  1.907000       1.626000  
1 1 1 20 41 11 o 17.28000 0.4387000 17.76000 0.4432000 16.81000 0.7573000 0.9518000      0.8775000 
1 1 1 20 41 13 o 11.32000 0.5822000 11.84000 0.6204000 10.79000 0.9854000 1.048000       1.164000  
1 1 1 20 41 15 o 9.973000 0.6826000 9.945000 0.6092000 10.00000 1.222000  -0.5581000E-01 1.365000  
1 1 1 20 41 17 o 7.548000 0.9816000 7.797000 0.7458000 7.299000 1.816000  0.4979000      1.963000  
1 1 1 20 41 19 o 3.620000 0.9717000 3.915000 1.285000  3.325000 1.458000  0.5895000      1.943000  
1 1 1 20 41 21 o 9.559000 0.6080000 9.704000 0.6937000 9.414000 0.9986000 0.2900000      1.216000  
1 1 1 20 41 23 f 5.052000 0.9992000 4.617000 1.235000  5.487000 1.571000  -0.8700000     1.998000  
1 1 1 20 41 25 o 4.572000 1.074000  3.132000 1.377000  6.012000 1.649000  -2.881000      2.148000  
1 1 1 20 41 27 o 9.454000 0.7069000 10.03000 0.7902000 8.882000 1.172000  1.144000       1.414000  
1 1 1 20 41 29 o 6.276000 1.349000  4.693000 1.295000  7.860000 2.368000  -3.167000      2.699000  
1 1 1 20 41 31 o 6.587000 0.9080000 8.392000 0.7622000 4.782000 1.648000  3.609000       1.816000  
1 1 1 20 41 33 o 12.72000 0.5362000 12.08000 0.7059000 13.35000 0.8074000 -1.266000      1.072000  
1 1 1 20 41 35 o 10.68000 0.6595000 11.08000 0.7068000 10.27000 1.114000  0.8027000      1.319000  
1 1 1 20 41 37 o 11.33000 0.6698000 12.05000 0.7914000 10.60000 1.081000  1.450000       1.340000  
1 1 1 20 41 39 o 9.632000 0.6764000 9.776000 0.7167000 9.489000 1.147000  0.2870000      1.353000  
1 1 1 20 41 41 o 8.837000 0.7903000 10.11000 0.8159000 7.561000 1.354000  2.552000       1.581000  
1 1 1 20 41 43 o 6.811000 1.903000  6.811000 1.903000  ?        ?         ?              ?         
1 1 1 20 42 0  o 5.987000 0.8050000 5.987000 0.8050000 5.987000 0.8050000 0.000000       0.000000  
1 1 1 20 42 2  o 15.32000 0.3282000 14.71000 0.5410000 15.94000 0.3718000 -1.228000      0.6564000 
1 1 1 20 42 4  o 16.51000 0.4541000 16.91000 0.4495000 16.10000 0.7891000 0.8097000      0.9082000 
1 1 1 20 42 6  o 25.24000 0.5339000 24.46000 0.4492000 26.03000 0.9687000 -1.570000      1.068000  
1 1 1 20 42 8  o 5.707000 1.003000  5.518000 1.074000  5.897000 1.696000  -0.3791000     2.007000  
1 1 1 20 42 10 o 15.83000 0.6447000 15.64000 0.5664000 16.02000 1.158000  -0.3853000     1.289000  
1 1 1 20 42 12 o 3.323000 0.9823000 2.696000 1.148000  3.950000 1.595000  -1.254000      1.965000  
1 1 1 20 42 14 o 5.944000 1.070000  4.996000 1.195000  6.892000 1.775000  -1.896000      2.140000  
1 1 1 20 42 16 o 3.544000 0.9888000 3.531000 1.265000  3.556000 1.521000  -0.2566000E-01 1.978000  
1 1 1 20 42 18 o 13.99000 0.4562000 13.64000 0.5120000 14.33000 0.7551000 -0.6947000     0.9123000 
1 1 1 20 42 20 o 9.247000 0.6290000 9.263000 0.6769000 9.232000 1.060000  0.3104000E-01  1.258000  
1 1 1 20 42 22 o 8.139000 0.7197000 8.438000 0.7479000 7.840000 1.230000  0.5973000      1.439000  
1 1 1 20 42 24 o 7.667000 0.8202000 8.121000 0.8389000 7.214000 1.410000  0.9071000      1.640000  
1 1 1 20 42 26 o 7.488000 0.8679000 8.739000 0.7637000 6.236000 1.559000  2.503000       1.736000  
1 1 1 20 42 28 o 14.27000 0.9650000 15.90000 0.5216000 12.64000 1.858000  3.266000       1.930000  
1 1 1 20 42 30 o 9.955000 0.7721000 9.766000 0.8449000 10.14000 1.292000  -0.3768000     1.544000  
1 1 1 20 42 32 o 4.793000 1.126000  5.424000 1.472000  4.162000 1.703000  1.262000       2.251000  
1 1 1 20 42 34 o 4.437000 1.054000  3.665000 1.360000  5.209000 1.610000  -1.544000      2.107000  
1 1 1 20 42 36 o 4.547000 1.093000  4.651000 1.549000  4.443000 1.541000  0.2081000      2.185000  
1 1 1 20 42 38 o 7.752000 0.7939000 8.302000 0.8760000 7.202000 1.324000  1.100000       1.588000  
1 1 1 20 42 40 o 3.928000 1.020000  4.540000 1.504000  3.315000 1.378000  1.225000       2.040000  
1 1 1 20 42 42 o 8.289000 1.766000  8.289000 1.766000  ?        ?         ?              ?         
1 1 1 20 43 1  o 26.93000 0.3704000 26.72000 0.4929000 27.13000 0.5530000 -0.4102000     0.7407000 
1 1 1 20 43 3  o 3.800000 0.8921000 4.235000 1.115000  3.365000 1.393000  0.8706000      1.784000  
1 1 1 20 43 5  f 15.69000 0.5312000 15.38000 0.4346000 15.99000 0.9694000 -0.6128000     1.062000  
1 1 1 20 43 7  o 6.670000 1.058000  5.983000 0.9558000 7.356000 1.887000  -1.372000      2.115000  
1 1 1 20 43 9  o 7.227000 1.038000  6.992000 1.043000  7.462000 1.794000  -0.4702000     2.075000  
1 1 1 20 43 11 o 11.87000 0.5135000 12.27000 0.5430000 11.46000 0.8717000 0.8080000      1.027000  
1 1 1 20 43 13 o 6.223000 0.9546000 5.867000 1.087000  6.579000 1.570000  -0.7123000     1.909000  
1 1 1 20 43 15 o 3.266000 0.9760000 2.724000 1.162000  3.808000 1.569000  -1.084000      1.952000  
1 1 1 20 43 17 o 14.29000 0.4655000 13.37000 0.5446000 15.22000 0.7550000 -1.850000      0.9310000 
1 1 1 20 43 19 o 8.889000 0.6296000 8.366000 0.7605000 9.413000 1.004000  -1.048000      1.259000  
1 1 1 20 43 21 o 8.836000 0.6730000 9.022000 0.8701000 8.649000 1.027000  0.3738000      1.346000  
1 1 1 20 43 23 o 11.35000 0.5580000 11.13000 0.6035000 11.58000 0.9388000 -0.4579000     1.116000  
1 1 1 20 43 25 o 3.867000 1.124000  2.676000 1.146000  5.058000 1.933000  -2.382000      2.248000  
1 1 1 20 43 27 o 6.591000 0.9596000 7.589000 0.8575000 5.593000 1.717000  1.995000       1.919000  
1 1 1 20 43 29 o 7.779000 0.9565000 8.564000 0.9474000 6.993000 1.662000  1.571000       1.913000  
1 1 1 20 43 31 o 8.943000 0.7691000 8.931000 0.8190000 8.956000 1.302000  -0.2530000E-01 1.538000  
1 1 1 20 43 33 o 4.706000 1.097000  4.198000 1.317000  5.215000 1.754000  -1.017000      2.193000  
1 1 1 20 43 35 o 3.956000 1.074000  4.338000 1.544000  3.574000 1.493000  0.7640000      2.148000  
1 1 1 20 43 37 o 4.758000 1.110000  4.898000 1.504000  4.618000 1.633000  0.2798000      2.220000  
1 1 1 20 43 39 o 3.903000 1.137000  3.619000 1.415000  4.187000 1.781000  -0.5680000     2.274000  
1 1 1 20 44 0  o 17.89000 0.3939000 17.89000 0.3939000 17.89000 0.3939000 0.000000       0.000000  
1 1 1 20 44 2  o 20.83000 0.2735000 20.69000 0.3900000 20.98000 0.3835000 -0.2870000     0.5469000 
1 1 1 20 44 4  o 22.95000 0.4245000 23.94000 0.4449000 21.96000 0.7230000 1.975000       0.8489000 
1 1 1 20 44 6  o 20.22000 0.6382000 20.22000 0.4125000 20.22000 1.208000  0.2573000E-02  1.276000  
1 1 1 20 44 8  o 16.08000 0.5013000 15.70000 0.4538000 16.45000 0.8940000 -0.7536000     1.003000  
1 1 1 20 44 10 o 7.445000 0.8707000 7.734000 0.7110000 7.156000 1.590000  0.5776000      1.741000  
1 1 1 20 44 12 o 6.182000 0.9021000 7.439000 0.8688000 4.925000 1.581000  2.515000       1.804000  
1 1 1 20 44 14 o 14.55000 0.4507000 14.68000 0.4852000 14.43000 0.7598000 0.2462000      0.9015000 
1 1 1 20 44 16 o 16.70000 0.4433000 16.23000 0.4692000 17.17000 0.7523000 -0.9419000     0.8866000 
1 1 1 20 44 18 o 11.68000 0.5769000 11.78000 0.5780000 11.59000 0.9986000 0.1865000      1.154000  
1 1 1 20 44 20 o 3.070000 0.9126000 3.023000 1.258000  3.118000 1.323000  -0.9510000E-01 1.825000  
1 1 1 20 44 22 o 10.22000 0.6440000 11.54000 0.5747000 8.904000 1.153000  2.637000       1.288000  
1 1 1 20 44 24 o 11.71000 0.7410000 12.20000 0.6658000 11.21000 1.324000  0.9944000      1.482000  
1 1 1 20 44 26 f 6.033000 0.9275000 6.122000 1.017000  5.943000 1.551000  0.1785000      1.855000  
1 1 1 20 44 28 o 3.256000 0.9870000 2.919000 1.272000  3.594000 1.510000  -0.6752000     1.974000  
1 1 1 20 44 30 o 5.771000 1.005000  6.541000 1.046000  5.001000 1.717000  1.540000       2.011000  
1 1 1 20 44 32 o 4.989000 0.9960000 3.138000 1.363000  6.839000 1.453000  -3.701000      1.992000  
1 1 1 20 44 34 o 2.944000 0.9346000 3.037000 1.329000  2.851000 1.314000  0.1867000      1.869000  
1 1 1 20 44 36 o 4.634000 1.006000  5.088000 1.276000  4.181000 1.555000  0.9070000      2.011000  
1 1 1 20 44 38 o 3.708000 1.039000  3.196000 1.314000  4.220000 1.610000  -1.024000      2.078000  
1 1 1 20 45 1  o 13.19000 0.3892000 13.19000 0.5049000 13.20000 0.5925000 -0.1534000E-01 0.7784000 
1 1 1 20 45 3  o 12.82000 0.3026000 12.82000 0.4704000 12.82000 0.3808000 0.4422000E-02  0.6053000 
1 1 1 20 45 5  o 13.60000 0.5078000 14.22000 0.4636000 12.97000 0.9037000 1.242000       1.016000  
1 1 1 20 45 7  o 15.19000 0.5116000 15.64000 0.4576000 14.74000 0.9152000 0.9015000      1.023000  
1 1 1 20 45 9  o 15.33000 0.8079000 15.08000 0.5195000 15.58000 1.530000  -0.5056000     1.616000  
1 1 1 20 45 11 o 9.551000 0.7474000 9.693000 0.7089000 9.409000 1.316000  0.2841000      1.495000  
1 1 1 20 45 13 o 9.706000 0.5904000 8.835000 0.7402000 10.58000 0.9200000 -1.742000      1.181000  
1 1 1 20 45 15 o 10.07000 0.5848000 10.17000 0.6232000 9.961000 0.9897000 0.2105000      1.170000  
1 1 1 20 45 17 o 8.752000 0.7075000 8.646000 0.7473000 8.859000 1.202000  -0.2128000     1.415000  
1 1 1 20 45 19 o 4.147000 0.9994000 3.804000 1.273000  4.490000 1.541000  -0.6859000     1.999000  
1 1 1 20 45 21 o 4.225000 0.8828000 5.272000 1.176000  3.179000 1.317000  2.093000       1.766000  
1 1 1 20 45 23 o 4.286000 1.177000  3.941000 1.366000  4.631000 1.916000  -0.6906000     2.354000  
1 1 1 20 45 25 o 4.053000 0.9617000 4.597000 1.288000  3.509000 1.428000  1.088000       1.923000  
1 1 1 20 45 27 o 6.844000 0.8618000 5.887000 1.105000  7.802000 1.323000  -1.915000      1.724000  
1 1 1 20 45 29 o 3.952000 1.014000  4.035000 1.303000  3.869000 1.553000  0.1669000      2.027000  
1 1 1 20 45 31 f 5.279000 1.170000  5.022000 1.652000  5.535000 1.658000  -0.5129000     2.340000  
1 1 1 20 45 33 o 3.414000 0.9994000 3.192000 1.288000  3.636000 1.529000  -0.4445000     1.999000  
1 1 1 20 45 35 o 4.342000 1.084000  4.066000 1.355000  4.618000 1.692000  -0.5522000     2.168000  
1 1 1 20 45 37 o 3.353000 0.9412000 2.317000 1.085000  4.389000 1.538000  -2.072000      1.882000  
1 1 1 20 46 0  o 3.765000 1.084000  3.765000 1.084000  3.765000 1.084000  0.000000       0.000000  
1 1 1 20 46 2  o 6.750000 0.5267000 6.903000 0.7558000 6.598000 0.7337000 0.3043000      1.053000  
1 1 1 20 46 4  o 5.041000 0.6682000 5.852000 0.8889000 4.230000 0.9978000 1.622000       1.336000  
1 1 1 20 46 6  o 8.404000 0.8442000 8.907000 0.6217000 7.900000 1.570000  1.006000       1.688000  
1 1 1 20 46 8  o 8.070000 0.8244000 7.751000 0.9030000 8.389000 1.379000  -0.6380000     1.649000  
1 1 1 20 46 10 o 5.767000 0.9999000 4.470000 1.098000  7.065000 1.672000  -2.595000      2.000000  
1 1 1 20 46 12 o 5.279000 1.223000  4.486000 1.213000  6.071000 2.125000  -1.585000      2.447000  
1 1 1 20 46 14 o 8.075000 0.7638000 7.934000 0.7755000 8.216000 1.316000  -0.2824000     1.528000  
1 1 1 20 46 16 f 13.67000 0.4858000 13.53000 0.5704000 13.80000 0.7865000 -0.2736000     0.9716000 
1 1 1 20 46 18 o 10.04000 0.6246000 10.27000 0.6984000 9.809000 1.036000  0.4584000      1.249000  
1 1 1 20 46 20 o 3.862000 1.161000  3.396000 1.352000  4.328000 1.887000  -0.9325000     2.321000  
1 1 1 20 46 22 o 10.18000 0.5682000 10.54000 0.6311000 9.818000 0.9450000 0.7261000      1.136000  
1 1 1 20 46 24 o 11.33000 0.5897000 11.08000 0.7317000 11.57000 0.9250000 -0.4828000     1.179000  
1 1 1 20 46 26 f 4.074000 1.036000  3.510000 1.329000  4.638000 1.589000  -1.129000      2.072000  
1 1 1 20 46 28 o 5.207000 1.053000  4.537000 1.284000  5.877000 1.669000  -1.340000      2.106000  
1 1 1 20 46 30 o 4.148000 1.005000  4.892000 1.351000  3.403000 1.489000  1.490000       2.010000  
1 1 1 20 46 32 o 9.878000 0.6718000 10.05000 0.7797000 9.710000 1.094000  0.3376000      1.344000  
1 1 1 20 46 34 o 13.75000 0.6888000 13.34000 0.5766000 14.16000 1.251000  -0.8239000     1.378000  
1 1 1 20 46 36 o 4.424000 0.9734000 5.432000 1.217000  3.416000 1.519000  2.015000       1.947000  
1 1 1 20 47 1  o 2.036000 0.6529000 1.885000 0.8861000 2.186000 0.9590000 -0.3005000     1.306000  
1 1 1 20 47 3  o 5.697000 0.7597000 6.018000 0.9479000 5.375000 1.188000  0.6428000      1.519000  
1 1 1 20 47 5  o 8.175000 0.6774000 7.636000 0.7244000 8.713000 1.145000  -1.078000      1.355000  
1 1 1 20 47 7  o 9.057000 0.7358000 9.151000 0.6321000 8.962000 1.329000  0.1890000      1.472000  
1 1 1 20 47 9  o 10.43000 0.6981000 11.89000 0.5241000 8.970000 1.294000  2.919000       1.396000  
1 1 1 20 47 11 o 3.321000 0.9926000 3.010000 1.221000  3.632000 1.565000  -0.6216000     1.985000  
1 1 1 20 47 13 o 4.443000 1.023000  3.738000 1.216000  5.147000 1.644000  -1.408000      2.045000  
1 1 1 20 47 15 o 3.706000 1.067000  3.914000 1.359000  3.497000 1.646000  0.4171000      2.134000  
1 1 1 20 47 17 o 7.839000 1.081000  9.132000 0.7668000 6.547000 2.021000  2.584000       2.162000  
1 1 1 20 47 19 o 15.72000 0.6817000 16.13000 0.6183000 15.32000 1.215000  0.8079000      1.363000  
1 1 1 20 47 21 o 3.862000 0.9629000 4.680000 1.322000  3.045000 1.400000  1.634000       1.926000  
1 1 1 20 47 23 o 5.323000 0.9797000 5.352000 1.333000  5.294000 1.437000  0.5841000E-01  1.959000  
1 1 1 20 47 25 o 3.055000 0.9548000 2.641000 1.144000  3.470000 1.529000  -0.8281000     1.910000  
1 1 1 20 47 27 o 6.124000 1.138000  4.781000 1.272000  7.467000 1.888000  -2.685000      2.276000  
1 1 1 20 47 29 o 4.131000 1.059000  3.710000 1.361000  4.552000 1.624000  -0.8420000     2.119000  
1 1 1 20 47 31 o 3.246000 0.9486000 3.271000 1.266000  3.222000 1.413000  0.4872000E-01  1.897000  
1 1 1 20 47 33 o 8.874000 0.9491000 8.044000 1.004000  9.704000 1.611000  -1.660000      1.898000  
1 1 1 20 47 35 o 3.789000 1.145000  4.091000 1.628000  3.486000 1.609000  0.6045000      2.289000  
1 1 1 20 48 0  o 10.08000 0.6040000 10.08000 0.6040000 10.08000 0.6040000 0.000000       0.000000  
1 1 1 20 48 2  o 5.222000 0.7842000 5.029000 0.9699000 5.414000 1.232000  -0.3846000     1.568000  
1 1 1 20 48 4  o 9.450000 0.6482000 10.12000 0.5364000 8.781000 1.180000  1.338000       1.296000  
1 1 1 20 48 6  o 7.552000 0.6480000 7.602000 0.6809000 7.501000 1.103000  0.1013000      1.296000  
1 1 1 20 48 8  o 3.844000 0.9383000 4.386000 1.169000  3.302000 1.468000  1.083000       1.877000  
1 1 1 20 48 10 o 2.876000 0.9215000 2.675000 1.168000  3.077000 1.426000  -0.4021000     1.843000  
1 1 1 20 48 12 o 9.537000 0.8115000 9.538000 0.6552000 9.536000 1.485000  0.2074000E-02  1.623000  
1 1 1 20 48 14 o 5.695000 0.8887000 5.461000 1.148000  5.929000 1.357000  -0.4689000     1.777000  
1 1 1 20 48 16 o 9.576000 0.9638000 9.284000 0.7359000 9.869000 1.782000  -0.5853000     1.928000  
1 1 1 20 48 18 o 3.745000 1.009000  3.870000 1.441000  3.620000 1.413000  0.2501000      2.019000  
1 1 1 20 48 20 o 4.686000 1.041000  3.187000 1.349000  6.185000 1.587000  -2.998000      2.083000  
1 1 1 20 48 22 o 4.616000 1.057000  4.254000 1.425000  4.977000 1.561000  -0.7222000     2.114000  
1 1 1 20 48 24 o 6.320000 0.9497000 6.221000 1.051000  6.419000 1.582000  -0.1977000     1.899000  
1 1 1 20 48 26 o 5.775000 1.027000  6.348000 1.126000  5.201000 1.718000  1.147000       2.054000  
1 1 1 20 48 28 f 4.802000 1.057000  4.427000 1.416000  5.177000 1.570000  -0.7501000     2.114000  
1 1 1 20 48 30 o 4.251000 1.017000  3.363000 1.344000  5.138000 1.528000  -1.775000      2.035000  
1 1 1 20 48 32 o 4.966000 1.134000  4.618000 1.186000  5.314000 1.932000  -0.6955000     2.268000  
1 1 1 20 49 1  o 9.013000 0.4616000 9.265000 0.5346000 8.762000 0.7528000 0.5030000      0.9233000 
1 1 1 20 49 3  o 11.69000 0.5294000 11.51000 0.4945000 11.87000 0.9361000 -0.3561000     1.059000  
1 1 1 20 49 5  o 9.094000 0.6185000 8.871000 0.6090000 9.316000 1.077000  -0.4453000     1.237000  
1 1 1 20 49 7  o 3.822000 1.032000  2.861000 1.212000  4.784000 1.670000  -1.923000      2.064000  
1 1 1 20 49 9  o 4.010000 0.9783000 4.108000 1.147000  3.911000 1.585000  0.1967000      1.957000  
1 1 1 20 49 11 o 14.19000 0.5809000 15.87000 0.4818000 12.51000 1.057000  3.354000       1.162000  
1 1 1 20 49 13 o 11.56000 1.098000  12.08000 0.5614000 11.04000 2.123000  1.036000       2.196000  
1 1 1 20 49 15 o 3.155000 0.9444000 2.817000 1.187000  3.494000 1.470000  -0.6776000     1.889000  
1 1 1 20 49 17 o 4.191000 1.007000  4.584000 1.362000  3.799000 1.483000  0.7846000      2.013000  
1 1 1 20 49 19 o 4.145000 1.088000  4.248000 1.447000  4.042000 1.626000  0.2064000      2.176000  
1 1 1 20 49 21 o 3.650000 1.120000  3.710000 1.483000  3.590000 1.680000  0.1206000      2.241000  
1 1 1 20 49 23 o 4.527000 1.058000  3.193000 1.303000  5.860000 1.666000  -2.667000      2.115000  
1 1 1 20 49 25 o 4.972000 1.113000  3.855000 1.374000  6.088000 1.753000  -2.233000      2.227000  
1 1 1 20 49 27 o 4.517000 1.028000  4.020000 1.307000  5.013000 1.587000  -0.9933000     2.056000  
1 1 1 20 49 29 o 4.639000 1.085000  3.510000 1.422000  5.767000 1.639000  -2.257000      2.170000  
1 1 1 20 49 31 o 9.372000 0.8800000 8.941000 0.7402000 9.803000 1.597000  -0.8616000     1.760000  
1 1 1 20 50 0  o 5.662000 0.9942000 5.662000 0.9942000 5.662000 0.9942000 0.000000       0.000000  
1 1 1 20 50 2  o 5.360000 0.9314000 5.263000 0.8319000 5.458000 1.667000  -0.1952000     1.863000  
1 1 1 20 50 4  o 4.261000 0.7901000 4.444000 1.041000  4.078000 1.189000  0.3651000      1.580000  
1 1 1 20 50 6  o 6.007000 0.9121000 5.345000 0.9102000 6.669000 1.581000  -1.325000      1.824000  
1 1 1 20 50 8  o 3.360000 0.9063000 3.769000 1.198000  2.951000 1.361000  0.8180000      1.813000  
1 1 1 20 50 10 o 7.572000 1.121000  8.779000 0.7940000 6.366000 2.096000  2.413000       2.241000  
1 1 1 20 50 12 o 4.245000 1.061000  3.624000 1.267000  4.866000 1.703000  -1.243000      2.123000  
1 1 1 20 50 14 o 4.736000 0.9743000 5.566000 1.051000  3.907000 1.641000  1.659000       1.949000  
1 1 1 20 50 16 o 4.457000 0.9733000 3.349000 1.321000  5.564000 1.430000  -2.214000      1.947000  
1 1 1 20 50 18 o 8.404000 0.8395000 7.409000 1.146000  9.399000 1.227000  -1.990000      1.679000  
1 1 1 20 50 20 o 8.637000 0.7412000 8.766000 0.7481000 8.509000 1.280000  0.2571000      1.482000  
1 1 1 20 50 22 o 3.353000 0.9865000 3.331000 1.294000  3.376000 1.489000  -0.4468000E-01 1.973000  
1 1 1 20 50 24 o 8.073000 1.209000  9.128000 0.8229000 7.018000 2.274000  2.110000       2.418000  
1 1 1 20 50 26 o 3.471000 1.009000  3.221000 1.280000  3.721000 1.561000  -0.4998000     2.019000  
1 1 1 20 50 28 o 6.810000 1.016000  5.639000 1.153000  7.980000 1.674000  -2.341000      2.033000  
1 1 1 20 50 30 o 6.173000 2.003000  6.173000 2.003000  ?        ?         ?              ?         
1 1 1 20 51 1  o 10.19000 0.4277000 10.13000 0.5027000 10.26000 0.6921000 -0.1299000     0.8554000 
1 1 1 20 51 3  o 6.725000 0.8799000 7.088000 0.6729000 6.361000 1.626000  0.7267000      1.760000  
1 1 1 20 51 5  o 4.084000 1.149000  3.526000 1.162000  4.642000 1.981000  -1.116000      2.297000  
1 1 1 20 51 7  o 10.32000 0.8570000 11.85000 0.5101000 8.790000 1.636000  3.062000       1.714000  
1 1 1 20 51 9  o 9.018000 0.7427000 9.469000 0.7180000 8.566000 1.300000  0.9027000      1.485000  
1 1 1 20 51 11 o 11.06000 0.6380000 12.33000 0.5471000 9.794000 1.153000  2.532000       1.276000  
1 1 1 20 51 13 o 5.479000 0.9922000 5.849000 1.165000  5.110000 1.607000  0.7395000      1.984000  
1 1 1 20 51 15 o 8.295000 0.7511000 7.346000 0.9324000 9.244000 1.178000  -1.898000      1.502000  
1 1 1 20 51 17 o 5.859000 1.017000  4.147000 1.553000  7.571000 1.313000  -3.425000      2.034000  
1 1 1 20 51 19 o 3.743000 1.066000  3.085000 1.280000  4.402000 1.705000  -1.317000      2.132000  
1 1 1 20 51 21 o 2.959000 0.9341000 2.834000 1.238000  3.084000 1.399000  -0.2502000     1.868000  
1 1 1 20 51 23 o 5.051000 1.091000  4.591000 1.245000  5.511000 1.792000  -0.9198000     2.182000  
1 1 1 20 51 25 f 6.676000 0.9028000 6.328000 1.036000  7.024000 1.479000  -0.6956000     1.806000  
1 1 1 20 51 27 o 6.782000 1.200000  6.782000 1.200000  ?        ?         ?              ?         
1 1 1 20 52 0  f 2.937000 1.237000  2.937000 1.237000  2.937000 1.237000  0.000000       0.000000  
1 1 1 20 52 2  o 3.834000 1.069000  3.058000 1.163000  4.609000 1.795000  -1.551000      2.138000  
1 1 1 20 52 4  o 7.711000 1.075000  7.337000 0.6814000 8.085000 2.039000  -0.7481000     2.150000  
1 1 1 20 52 6  o 4.270000 1.006000  4.485000 1.282000  4.055000 1.551000  0.4304000      2.012000  
1 1 1 20 52 8  o 3.957000 0.9572000 4.439000 1.205000  3.475000 1.488000  0.9640000      1.914000  
1 1 1 20 52 10 o 8.009000 0.7974000 8.507000 0.7427000 7.511000 1.411000  0.9960000      1.595000  
1 1 1 20 52 12 f 9.346000 0.7778000 10.52000 0.8478000 8.175000 1.304000  2.342000       1.556000  
1 1 1 20 52 14 o 3.678000 0.9203000 4.769000 1.364000  2.588000 1.235000  2.181000       1.841000  
1 1 1 20 52 16 o 6.328000 1.004000  5.295000 1.316000  7.361000 1.517000  -2.065000      2.008000  
1 1 1 20 52 18 o 4.874000 1.085000  4.388000 1.273000  5.361000 1.758000  -0.9724000     2.170000  
1 1 1 20 52 20 o 5.278000 1.063000  5.475000 1.300000  5.082000 1.682000  0.3934000      2.126000  
1 1 1 20 52 22 o 4.258000 1.097000  3.862000 1.323000  4.654000 1.750000  -0.7921000     2.194000  
1 1 1 20 52 24 o 6.434000 1.077000  5.301000 1.142000  7.567000 1.826000  -2.266000      2.154000  
1 1 1 20 53 1  o 8.135000 0.9309000 7.044000 1.396000  9.226000 1.232000  -2.182000      1.862000  
1 1 1 20 53 3  o 3.085000 0.9599000 2.231000 1.086000  3.940000 1.583000  -1.708000      1.920000  
1 1 1 20 53 5  o 5.339000 1.104000  5.965000 1.484000  4.713000 1.636000  1.252000       2.209000  
1 1 1 20 53 7  o 9.612000 0.7637000 8.947000 0.8618000 10.28000 1.261000  -1.331000      1.527000  
1 1 1 20 53 9  o 4.279000 1.042000  4.513000 1.315000  4.045000 1.616000  0.4687000      2.083000  
1 1 1 20 53 11 o 4.187000 1.014000  4.180000 1.372000  4.194000 1.492000  -0.1337000E-01 2.027000  
1 1 1 20 53 13 o 4.816000 0.9779000 5.563000 1.076000  4.068000 1.633000  1.495000       1.956000  
1 1 1 20 53 15 o 3.258000 0.9181000 3.595000 1.264000  2.921000 1.332000  0.6743000      1.836000  
1 1 1 20 53 17 o 4.665000 1.022000  5.444000 1.214000  3.886000 1.645000  1.557000       2.045000  
1 1 1 20 53 19 o 3.548000 1.004000  3.606000 1.352000  3.489000 1.485000  0.1169000      2.009000  
1 1 1 20 53 21 o 3.874000 1.160000  2.624000 1.138000  5.123000 2.021000  -2.499000      2.319000  
1 1 1 20 53 23 o 5.660000 1.199000  5.192000 1.754000  6.127000 1.635000  -0.9351000     2.397000  
1 1 1 20 54 0  o 2.712000 1.268000  2.712000 1.268000  2.712000 1.268000  0.000000       0.000000  
1 1 1 20 54 2  o 4.700000 1.171000  4.317000 1.802000  5.083000 1.496000  -0.7659000     2.342000  
1 1 1 20 54 4  o 7.755000 0.9332000 7.037000 1.285000  8.472000 1.353000  -1.434000      1.866000  
1 1 1 20 54 6  o 3.146000 0.9646000 3.291000 1.336000  3.000000 1.392000  0.2902000      1.929000  
1 1 1 20 54 8  o 3.654000 1.012000  3.188000 1.293000  4.119000 1.557000  -0.9315000     2.024000  
1 1 1 20 54 10 o 6.100000 0.9369000 6.148000 1.020000  6.053000 1.572000  0.9474000E-01  1.874000  
1 1 1 20 54 12 o 7.516000 0.7983000 7.131000 0.8513000 7.901000 1.351000  -0.7699000     1.597000  
1 1 1 20 54 14 o 3.501000 0.9759000 3.269000 1.268000  3.732000 1.484000  -0.4626000     1.952000  
1 1 1 20 54 16 f 4.367000 1.219000  2.656000 1.206000  6.079000 2.119000  -3.423000      2.438000  
1 1 1 20 54 18 o 3.171000 1.007000  2.592000 1.158000  3.751000 1.647000  -1.159000      2.013000  
1 1 1 20 54 20 o 5.065000 1.308000  3.505000 1.502000  6.626000 2.141000  -3.121000      2.616000  
1 1 1 20 55 1  o 3.273000 1.009000  3.785000 1.498000  2.761000 1.351000  1.024000       2.017000  
1 1 1 20 55 3  o 3.313000 1.065000  2.981000 1.340000  3.644000 1.657000  -0.6629000     2.131000  
1 1 1 20 55 5  o 7.669000 1.196000  6.994000 1.576000  8.344000 1.801000  -1.351000      2.393000  
1 1 1 20 55 7  o 3.594000 1.020000  3.796000 1.384000  3.392000 1.499000  0.4044000      2.040000  
1 1 1 20 55 9  o 5.134000 1.141000  3.718000 1.265000  6.550000 1.899000  -2.831000      2.282000  
1 1 1 20 55 11 o 5.134000 1.135000  3.816000 1.242000  6.451000 1.901000  -2.635000      2.271000  
1 1 1 20 55 13 o 3.214000 0.9824000 2.448000 1.079000  3.980000 1.642000  -1.532000      1.965000  
1 1 1 20 55 15 o 3.983000 1.079000  3.253000 1.244000  4.713000 1.763000  -1.460000      2.157000  
1 1 1 20 55 17 o 4.267000 1.691000  4.267000 1.691000  ?        ?         ?              ?         
1 1 1 20 56 0  o 4.308000 1.633000  4.308000 1.633000  4.308000 1.633000  0.000000       0.000000  
1 1 1 20 56 2  o 4.792000 1.167000  3.923000 1.612000  5.662000 1.687000  -1.739000      2.333000  
1 1 1 20 56 4  f 5.035000 1.172000  4.419000 1.549000  5.651000 1.760000  -1.233000      2.344000  
1 1 1 20 56 6  o 3.720000 1.055000  3.735000 1.510000  3.705000 1.473000  0.2999000E-01  2.110000  
1 1 1 20 56 8  o 4.095000 1.173000  4.020000 1.608000  4.170000 1.709000  -0.1508000     2.347000  
1 1 1 20 56 10 o 4.031000 1.077000  3.626000 1.442000  4.436000 1.599000  -0.8099000     2.153000  
1 1 1 20 56 12 o 3.906000 1.198000  3.894000 1.794000  3.918000 1.587000  -0.2438000E-01 2.395000  
1 1 1 20 57 1  o 6.314000 1.463000  6.682000 2.090000  5.946000 2.047000  0.7358000      2.926000  
1 1 1 20 57 3  o 5.374000 1.412000  5.731000 2.174000  5.017000 1.804000  0.7138000      2.825000  
1 1 1 21 0  1  o 69.20000 0.6942000 69.20000 0.6942000 69.20000 0.6942000 0.000000       0.000000  
1 1 1 21 0  3  o 3.882000 1.156000  3.882000 1.156000  3.882000 1.156000  0.000000       0.000000  
1 1 1 21 0  5  o 28.56000 0.4474000 28.56000 0.4474000 28.56000 0.4474000 0.000000       0.000000  
1 1 1 21 0  7  o 27.70000 0.4413000 27.70000 0.4413000 27.70000 0.4413000 0.000000       0.000000  
1 1 1 21 0  9  o 21.59000 0.5241000 21.59000 0.5241000 21.59000 0.5241000 0.000000       0.000000  
1 1 1 21 0  11 o 15.15000 0.4251000 15.15000 0.4251000 15.15000 0.4251000 0.000000       0.000000  
1 1 1 21 0  13 o 8.157000 0.7442000 8.157000 0.7442000 8.157000 0.7442000 0.000000       0.000000  
1 1 1 21 0  15 o 3.193000 1.173000  3.193000 1.173000  3.193000 1.173000  0.000000       0.000000  
1 1 1 21 0  17 o 10.68000 0.5620000 10.68000 0.5620000 10.68000 0.5620000 0.000000       0.000000  
1 1 1 21 0  19 o 8.343000 0.8572000 8.343000 0.8572000 8.343000 0.8572000 0.000000       0.000000  
1 1 1 21 0  21 o 96.45000 0.9492000 96.45000 0.9492000 96.45000 0.9492000 0.000000       0.000000  
1 1 1 21 0  23 o 17.62000 0.4374000 17.62000 0.4374000 17.62000 0.4374000 0.000000       0.000000  
1 1 1 21 0  25 o 30.79000 0.5007000 30.79000 0.5007000 30.79000 0.5007000 0.000000       0.000000  
1 1 1 21 0  27 o 32.68000 0.5004000 32.68000 0.5004000 32.68000 0.5004000 0.000000       0.000000  
1 1 1 21 0  29 f 15.78000 0.4978000 15.78000 0.4978000 15.78000 0.4978000 0.000000       0.000000  
1 1 1 21 0  31 o 6.081000 1.241000  6.081000 1.241000  6.081000 1.241000  0.000000       0.000000  
1 1 1 21 0  33 o 25.64000 0.4454000 25.64000 0.4454000 25.64000 0.4454000 0.000000       0.000000  
1 1 1 21 0  35 o 33.69000 0.4757000 33.69000 0.4757000 33.69000 0.4757000 0.000000       0.000000  
1 1 1 21 0  37 o 3.106000 1.341000  3.106000 1.341000  3.106000 1.341000  0.000000       0.000000  
1 1 1 21 0  39 o 5.156000 1.548000  5.156000 1.548000  5.156000 1.548000  0.000000       0.000000  
1 1 1 21 0  41 o 3.186000 1.310000  3.186000 1.310000  3.186000 1.310000  0.000000       0.000000  
1 1 1 21 0  43 o 19.72000 0.6751000 19.72000 0.6751000 19.72000 0.6751000 0.000000       0.000000  
1 1 1 21 0  45 o 22.21000 0.4749000 22.21000 0.4749000 22.21000 0.4749000 0.000000       0.000000  
1 1 1 21 0  47 o 21.64000 0.4521000 21.64000 0.4521000 21.64000 0.4521000 0.000000       0.000000  
1 1 1 21 0  49 o 2.062000 0.9930000 2.062000 0.9930000 2.062000 0.9930000 0.000000       0.000000  
1 1 1 21 0  51 f 9.978000 0.7329000 9.978000 0.7329000 9.978000 0.7329000 0.000000       0.000000  
1 1 1 21 0  53 o 14.20000 0.7151000 14.20000 0.7151000 14.20000 0.7151000 0.000000       0.000000  
1 1 1 21 0  55 o 6.043000 1.536000  6.043000 1.536000  6.043000 1.536000  0.000000       0.000000  
1 1 1 21 0  57 o 3.247000 1.351000  3.247000 1.351000  3.247000 1.351000  0.000000       0.000000  
1 1 1 21 0  59 o 3.314000 1.353000  3.314000 1.353000  3.314000 1.353000  0.000000       0.000000  
1 1 1 21 0  61 o 3.335000 1.489000  3.335000 1.489000  3.335000 1.489000  0.000000       0.000000  
1 1 1 21 1  0  o 20.03000 0.3818000 20.03000 0.3818000 20.03000 0.3818000 0.000000       0.000000  
1 1 1 21 1  2  o 27.99000 0.2685000 28.12000 0.3836000 27.85000 0.3760000 0.2740000      0.5371000 
1 1 1 21 1  4  o 77.19000 0.5854000 76.43000 0.8778000 77.94000 0.7749000 -1.509000      1.171000  
1 1 1 21 1  6  o 105.3000 0.9382000 105.5000 1.189000  105.1000 1.451000  0.3583000      1.876000  
1 1 1 21 1  8  o 63.53000 0.5280000 63.87000 0.7495000 63.18000 0.7440000 0.6884000      1.056000  
1 1 1 21 1  10 o 63.38000 0.4560000 63.18000 0.6434000 63.58000 0.6464000 -0.4028000     0.9120000 
1 1 1 21 1  12 o 14.89000 0.3932000 14.85000 0.4924000 14.92000 0.6131000 -0.7528000E-01 0.7864000 
1 1 1 21 1  14 o 23.46000 0.2713000 23.48000 0.3816000 23.43000 0.3857000 0.5595000E-01  0.5426000 
1 1 1 21 1  16 o 38.14000 0.3156000 37.97000 0.4431000 38.32000 0.4495000 -0.3516000     0.6312000 
1 1 1 21 1  18 o 19.36000 0.3107000 19.74000 0.4007000 18.98000 0.4749000 0.7645000      0.6213000 
1 1 1 21 1  20 o 34.71000 0.3322000 34.31000 0.5026000 35.12000 0.4345000 -0.8076000     0.6643000 
1 1 1 21 1  22 o 36.92000 0.3459000 37.32000 0.5285000 36.53000 0.4465000 0.7957000      0.6919000 
1 1 1 21 1  24 o 11.81000 0.4282000 12.52000 0.6388000 11.11000 0.5704000 1.406000       0.8565000 
1 1 1 21 1  26 o 23.49000 0.3802000 23.00000 0.4761000 23.97000 0.5931000 -0.9733000     0.7605000 
1 1 1 21 1  28 f 8.266000 0.5795000 8.497000 0.8047000 8.034000 0.8341000 0.4637000      1.159000  
1 1 1 21 1  30 o 34.38000 0.3673000 34.97000 0.5245000 33.78000 0.5143000 1.192000       0.7346000 
1 1 1 21 1  32 o 18.97000 0.3502000 18.76000 0.4896000 19.18000 0.5009000 -0.4143000     0.7005000 
1 1 1 21 1  34 o 40.61000 0.3515000 40.37000 0.4949000 40.84000 0.4992000 -0.4693000     0.7029000 
1 1 1 21 1  36 o 17.88000 0.3804000 17.73000 0.5386000 18.03000 0.5373000 -0.3039000     0.7608000 
1 1 1 21 1  38 o 17.65000 0.4075000 17.81000 0.5243000 17.49000 0.6238000 0.3168000      0.8149000 
1 1 1 21 1  40 o 13.11000 0.5155000 13.99000 0.7878000 12.23000 0.6651000 1.761000       1.031000  
1 1 1 21 1  42 o 8.322000 0.6433000 7.865000 0.9194000 8.779000 0.9000000 -0.9144000     1.287000  
1 1 1 21 1  44 o 7.498000 0.6731000 7.101000 0.9969000 7.895000 0.9047000 -0.7938000     1.346000  
1 1 1 21 1  46 o 8.094000 0.6096000 8.635000 0.7478000 7.552000 0.9629000 1.084000       1.219000  
1 1 1 21 1  48 o 9.830000 0.4743000 9.797000 0.7153000 9.862000 0.6231000 -0.6453000E-01 0.9487000 
1 1 1 21 1  50 o 6.029000 0.8320000 6.672000 1.111000  5.386000 1.238000  1.286000       1.664000  
1 1 1 21 1  52 o 3.313000 0.9996000 3.385000 1.367000  3.242000 1.459000  0.1427000      1.999000  
1 1 1 21 1  54 o 3.878000 0.9593000 2.692000 1.258000  5.063000 1.449000  -2.371000      1.919000  
1 1 1 21 1  56 o 7.771000 0.7862000 6.822000 1.281000  8.720000 0.9124000 -1.897000      1.572000  
1 1 1 21 1  58 o 7.997000 0.6490000 8.541000 0.8656000 7.454000 0.9672000 1.087000       1.298000  
1 1 1 21 1  60 o 3.823000 0.9804000 4.074000 1.386000  3.572000 1.387000  0.5017000      1.961000  
1 1 1 21 2  1  o 38.68000 0.3122000 38.79000 0.4422000 38.57000 0.4407000 0.2178000      0.6244000 
1 1 1 21 2  3  o 63.07000 0.4896000 62.81000 0.7381000 63.33000 0.6435000 -0.5216000     0.9792000 
1 1 1 21 2  5  o 84.24000 0.6792000 84.70000 0.9670000 83.78000 0.9539000 0.9177000      1.358000  
1 1 1 21 2  7  o 10.73000 0.4035000 10.20000 0.6325000 11.26000 0.5012000 -1.067000      0.8071000 
1 1 1 21 2  9  o 55.10000 0.4379000 55.15000 0.5740000 55.04000 0.6615000 0.1058000      0.8758000 
1 1 1 21 2  11 o 37.39000 0.3324000 37.00000 0.4368000 37.79000 0.5011000 -0.7894000     0.6647000 
1 1 1 21 2  13 o 58.46000 0.4628000 59.64000 0.7107000 57.29000 0.5931000 2.347000       0.9257000 
1 1 1 21 2  15 o 47.52000 0.4681000 47.49000 0.5892000 47.55000 0.7275000 -0.5524000E-01 0.9362000 
1 1 1 21 2  17 o 37.91000 0.3422000 38.17000 0.4483000 37.66000 0.5172000 0.5084000      0.6844000 
1 1 1 21 2  19 o 18.92000 0.2901000 19.03000 0.4112000 18.81000 0.4093000 0.2235000      0.5802000 
1 1 1 21 2  21 o 75.71000 0.5373000 76.30000 0.7649000 75.11000 0.7546000 1.187000       1.075000  
1 1 1 21 2  23 o 51.41000 0.4822000 51.62000 0.7919000 51.20000 0.5503000 0.4195000      0.9643000 
1 1 1 21 2  25 o 59.00000 0.4722000 59.57000 0.7188000 58.43000 0.6128000 1.148000       0.9445000 
1 1 1 21 2  27 o 13.15000 0.4092000 13.23000 0.5455000 13.07000 0.6102000 0.1601000      0.8185000 
1 1 1 21 2  29 o 21.89000 0.3538000 21.44000 0.4005000 22.33000 0.5834000 -0.8923000     0.7077000 
1 1 1 21 2  31 o 51.48000 0.4012000 50.99000 0.5635000 51.97000 0.5712000 -0.9799000     0.8024000 
1 1 1 21 2  33 o 34.89000 0.3311000 35.02000 0.4657000 34.75000 0.4707000 0.2716000      0.6621000 
1 1 1 21 2  35 o 11.11000 0.5366000 9.978000 0.7856000 12.23000 0.7311000 -2.255000      1.073000  
1 1 1 21 2  37 o 13.59000 0.4944000 14.29000 0.5852000 12.89000 0.7971000 1.403000       0.9889000 
1 1 1 21 2  39 o 9.433000 0.5909000 10.24000 0.7338000 8.622000 0.9265000 1.623000       1.182000  
1 1 1 21 2  41 o 12.52000 0.5529000 13.24000 0.6829000 11.81000 0.8698000 1.430000       1.106000  
1 1 1 21 2  43 o 10.88000 0.5530000 10.64000 0.7948000 11.12000 0.7691000 -0.4743000     1.106000  
1 1 1 21 2  45 o 27.01000 0.3220000 27.09000 0.4529000 26.92000 0.4580000 0.1694000      0.6441000 
1 1 1 21 2  47 o 16.88000 0.3372000 16.53000 0.4788000 17.24000 0.4749000 -0.7154000     0.6743000 
1 1 1 21 2  49 f 6.348000 0.7742000 5.801000 1.228000  6.895000 0.9427000 -1.093000      1.548000  
1 1 1 21 2  51 o 5.473000 0.9925000 5.385000 1.298000  5.562000 1.502000  -0.1766000     1.985000  
1 1 1 21 2  53 o 3.940000 0.9860000 4.409000 1.430000  3.472000 1.358000  0.9374000      1.972000  
1 1 1 21 2  55 o 4.689000 0.9492000 4.162000 1.427000  5.215000 1.252000  -1.052000      1.898000  
1 1 1 21 2  57 o 2.880000 0.8865000 2.374000 1.132000  3.385000 1.365000  -1.011000      1.773000  
1 1 1 21 2  59 o 3.696000 0.9670000 4.223000 1.414000  3.170000 1.320000  1.052000       1.934000  
1 1 1 21 2  61 o 3.119000 0.9579000 2.742000 1.255000  3.496000 1.448000  -0.7538000     1.916000  
1 1 1 21 3  0  o 70.44000 0.8158000 70.44000 0.8158000 70.44000 0.8158000 0.000000       0.000000  
1 1 1 21 3  2  o 51.95000 0.4435000 52.13000 0.6302000 51.77000 0.6243000 0.3515000      0.8871000 
1 1 1 21 3  4  o 29.61000 0.2777000 29.03000 0.3904000 30.19000 0.3952000 -1.161000      0.5555000 
1 1 1 21 3  6  o 43.86000 0.3661000 43.84000 0.4779000 43.88000 0.5547000 -0.3743000E-01 0.7322000 
1 1 1 21 3  8  o 49.62000 0.4051000 49.13000 0.5235000 50.11000 0.6184000 -0.9845000     0.8102000 
1 1 1 21 3  10 o 23.04000 0.3207000 22.91000 0.3834000 23.18000 0.5143000 -0.2748000     0.6415000 
1 1 1 21 3  12 o 78.97000 0.5999000 78.88000 0.7851000 79.06000 0.9073000 -0.1819000     1.200000  
1 1 1 21 3  14 o 30.89000 0.3288000 31.27000 0.4677000 30.51000 0.4625000 0.7607000      0.6577000 
1 1 1 21 3  16 o 76.27000 0.5393000 75.12000 0.7515000 77.42000 0.7738000 -2.298000      1.079000  
1 1 1 21 3  18 o 38.37000 0.3663000 38.28000 0.5131000 38.47000 0.5229000 -0.1847000     0.7326000 
1 1 1 21 3  20 o 29.13000 0.2893000 28.91000 0.4093000 29.34000 0.4088000 -0.4293000     0.5785000 
1 1 1 21 3  22 o 38.20000 0.3488000 38.24000 0.5254000 38.15000 0.4588000 0.8679000E-01  0.6975000 
1 1 1 21 3  24 o 16.57000 0.3613000 16.75000 0.5617000 16.38000 0.4545000 0.3680000      0.7226000 
1 1 1 21 3  26 o 36.48000 0.3465000 36.59000 0.5248000 36.37000 0.4527000 0.2244000      0.6931000 
1 1 1 21 3  28 o 17.56000 0.3456000 17.33000 0.4262000 17.79000 0.5441000 -0.4628000     0.6912000 
1 1 1 21 3  30 o 13.23000 0.4507000 13.70000 0.5238000 12.75000 0.7335000 0.9581000      0.9013000 
1 1 1 21 3  32 o 60.63000 0.4525000 60.91000 0.6408000 60.35000 0.6390000 0.5558000      0.9049000 
1 1 1 21 3  34 o 15.60000 0.4029000 15.39000 0.5584000 15.80000 0.5810000 -0.4043000     0.8058000 
1 1 1 21 3  36 o 14.83000 0.4721000 14.75000 0.5943000 14.91000 0.7338000 -0.1548000     0.9443000 
1 1 1 21 3  38 o 7.917000 0.6908000 7.566000 0.9621000 8.269000 0.9916000 -0.7032000     1.382000  
1 1 1 21 3  40 o 15.46000 0.4524000 15.99000 0.6190000 14.92000 0.6598000 1.073000       0.9047000 
1 1 1 21 3  42 o 15.96000 0.4074000 15.87000 0.6070000 16.05000 0.5435000 -0.1823000     0.8147000 
1 1 1 21 3  44 o 7.749000 0.6599000 7.296000 0.9846000 8.203000 0.8790000 -0.9067000     1.320000  
1 1 1 21 3  46 o 19.82000 0.3319000 20.33000 0.4695000 19.30000 0.4691000 1.032000       0.6637000 
1 1 1 21 3  48 o 10.70000 0.4771000 10.06000 0.7103000 11.34000 0.6370000 -1.278000      0.9541000 
1 1 1 21 3  50 o 4.125000 0.9438000 3.825000 1.355000  4.426000 1.314000  -0.6014000     1.888000  
1 1 1 21 3  52 o 3.700000 0.9798000 3.185000 1.348000  4.216000 1.422000  -1.032000      1.960000  
1 1 1 21 3  54 o 6.748000 0.8985000 6.669000 1.237000  6.827000 1.304000  -0.1576000     1.797000  
1 1 1 21 3  56 o 7.069000 0.7947000 7.420000 1.095000  6.719000 1.152000  0.7003000      1.589000  
1 1 1 21 3  58 o 4.526000 0.9990000 4.835000 1.396000  4.217000 1.429000  0.6183000      1.998000  
1 1 1 21 3  60 o 5.853000 0.9077000 5.388000 1.334000  6.317000 1.231000  -0.9290000     1.815000  
1 1 1 21 4  1  o 73.23000 0.6649000 72.48000 1.020000  73.98000 0.8531000 -1.499000      1.330000  
1 1 1 21 4  3  o 19.20000 0.2897000 19.02000 0.3761000 19.37000 0.4408000 -0.3508000     0.5794000 
1 1 1 21 4  5  o 45.91000 0.3783000 45.60000 0.4916000 46.21000 0.5752000 -0.6118000     0.7566000 
1 1 1 21 4  7  o 51.36000 0.4131000 51.61000 0.5461000 51.10000 0.6200000 0.5115000      0.8262000 
1 1 1 21 4  9  o 90.18000 0.9886000 90.52000 0.8919000 89.83000 1.765000  0.6919000      1.977000  
1 1 1 21 4  11 o 58.67000 0.4616000 58.93000 0.6064000 58.42000 0.6960000 0.5035000      0.9231000 
1 1 1 21 4  13 f 38.64000 0.3154000 38.80000 0.4471000 38.49000 0.4448000 0.3066000      0.6307000 
1 1 1 21 4  15 o 65.33000 0.5054000 65.01000 0.7606000 65.65000 0.6657000 -0.6409000     1.011000  
1 1 1 21 4  17 f 50.71000 0.3825000 50.79000 0.5417000 50.63000 0.5400000 0.1574000      0.7649000 
1 1 1 21 4  19 o 30.44000 0.3499000 30.45000 0.5662000 30.43000 0.4113000 0.2255000E-01  0.6999000 
1 1 1 21 4  21 o 33.86000 0.3486000 33.83000 0.4907000 33.90000 0.4951000 -0.7206000E-01 0.6971000 
1 1 1 21 4  23 o 58.69000 0.4333000 58.44000 0.6111000 58.94000 0.6144000 -0.5027000     0.8666000 
1 1 1 21 4  25 o 20.10000 0.3874000 20.54000 0.6440000 19.66000 0.4309000 0.8792000      0.7748000 
1 1 1 21 4  27 o 20.87000 0.3641000 20.87000 0.3859000 20.87000 0.6176000 -0.3593000E-02 0.7283000 
1 1 1 21 4  29 o 31.77000 0.3654000 31.66000 0.3955000 31.87000 0.6145000 -0.2169000     0.7308000 
1 1 1 21 4  31 o 46.90000 0.4344000 46.23000 0.6041000 47.56000 0.6243000 -1.338000      0.8688000 
1 1 1 21 4  33 o 20.36000 0.3515000 20.56000 0.4837000 20.16000 0.5103000 0.3921000      0.7031000 
1 1 1 21 4  35 o 37.94000 0.3717000 38.22000 0.4753000 37.65000 0.5717000 0.5711000      0.7435000 
1 1 1 21 4  37 o 16.14000 0.4036000 16.38000 0.5475000 15.89000 0.5930000 0.4882000      0.8071000 
1 1 1 21 4  39 o 7.846000 0.8055000 9.564000 0.7998000 6.127000 1.398000  3.438000       1.611000  
1 1 1 21 4  41 o 7.273000 0.7890000 6.140000 1.229000  8.405000 0.9897000 -2.265000      1.578000  
1 1 1 21 4  43 o 15.27000 0.4232000 14.59000 0.6121000 15.94000 0.5847000 -1.354000      0.8465000 
1 1 1 21 4  45 o 8.384000 0.5779000 9.261000 0.7078000 7.507000 0.9138000 1.754000       1.156000  
1 1 1 21 4  47 o 20.44000 0.3348000 20.75000 0.4765000 20.14000 0.4703000 0.6026000      0.6695000 
1 1 1 21 4  49 o 19.54000 0.3491000 19.58000 0.4900000 19.50000 0.4974000 0.7612000E-01  0.6982000 
1 1 1 21 4  51 o 8.403000 0.5978000 8.414000 0.8375000 8.393000 0.8533000 0.2135000E-01  1.196000  
1 1 1 21 4  53 o 6.571000 0.8961000 7.582000 0.9922000 5.559000 1.492000  2.023000       1.792000  
1 1 1 21 4  55 o 5.719000 1.149000  5.790000 1.845000  5.647000 1.369000  0.1429000      2.298000  
1 1 1 21 4  57 o 2.773000 0.8617000 2.499000 1.141000  3.047000 1.292000  -0.5478000     1.723000  
1 1 1 21 4  59 o 3.375000 0.9347000 2.763000 1.235000  3.987000 1.403000  -1.224000      1.869000  
1 1 1 21 4  61 o 4.508000 1.806000  ?        ?         4.508000 1.806000  ?              ?         
1 1 1 21 5  0  o 65.99000 0.6660000 65.99000 0.6660000 65.99000 0.6660000 0.000000       0.000000  
1 1 1 21 5  2  o 37.54000 0.3337000 37.37000 0.4335000 37.72000 0.5074000 -0.3490000     0.6674000 
1 1 1 21 5  4  o 40.72000 0.3702000 40.79000 0.5225000 40.66000 0.5246000 0.1334000      0.7404000 
1 1 1 21 5  6  o 47.67000 0.3883000 47.70000 0.5091000 47.65000 0.5866000 0.5338000E-01  0.7767000 
1 1 1 21 5  8  o 83.16000 0.6288000 82.93000 0.8215000 83.40000 0.9523000 -0.4797000     1.258000  
1 1 1 21 5  10 o 53.70000 0.4303000 53.41000 0.5598000 53.99000 0.6537000 -0.5779000     0.8606000 
1 1 1 21 5  12 o 71.58000 0.5075000 71.73000 0.7194000 71.43000 0.7161000 0.3016000      1.015000  
1 1 1 21 5  14 o 23.92000 0.2700000 24.06000 0.3840000 23.78000 0.3796000 0.2736000      0.5400000 
1 1 1 21 5  16 o 24.04000 0.3073000 24.09000 0.4346000 23.99000 0.4345000 0.9766000E-01  0.6145000 
1 1 1 21 5  18 o 23.88000 0.2928000 23.96000 0.4380000 23.80000 0.3887000 0.1585000      0.5856000 
1 1 1 21 5  20 o 50.03000 0.3815000 50.03000 0.5397000 50.04000 0.5394000 -0.1011000E-01 0.7630000 
1 1 1 21 5  22 o 10.76000 0.4599000 10.78000 0.6456000 10.74000 0.6551000 0.4038000E-01  0.9198000 
1 1 1 21 5  24 o 30.38000 0.3370000 30.28000 0.4746000 30.48000 0.4785000 -0.1975000     0.6739000 
1 1 1 21 5  26 o 37.30000 0.3567000 37.64000 0.4706000 36.97000 0.5361000 0.6636000      0.7134000 
1 1 1 21 5  28 o 34.14000 0.3651000 34.71000 0.4024000 33.57000 0.6093000 1.134000       0.7302000 
1 1 1 21 5  30 o 65.30000 0.4943000 65.34000 0.6061000 65.26000 0.7811000 0.7851000E-01  0.9887000 
1 1 1 21 5  32 o 20.93000 0.4131000 20.53000 0.4589000 21.32000 0.6872000 -0.7927000     0.8263000 
1 1 1 21 5  34 o 19.89000 0.3856000 20.03000 0.4846000 19.74000 0.5999000 0.2929000      0.7712000 
1 1 1 21 5  36 o 20.98000 0.3445000 20.98000 0.4639000 20.99000 0.5094000 -0.2081000E-02 0.6890000 
1 1 1 21 5  38 o 10.50000 0.5014000 10.66000 0.7122000 10.33000 0.7060000 0.3355000      1.003000  
1 1 1 21 5  40 o 17.09000 0.3971000 17.36000 0.5772000 16.82000 0.5453000 0.5414000      0.7941000 
1 1 1 21 5  42 f 27.68000 0.3358000 27.58000 0.4489000 27.78000 0.4995000 -0.1995000     0.6716000 
1 1 1 21 5  44 o 8.639000 0.5944000 9.089000 0.8147000 8.188000 0.8658000 0.9010000      1.189000  
1 1 1 21 5  46 o 14.15000 0.4253000 14.23000 0.6509000 14.07000 0.5475000 0.1539000      0.8505000 
1 1 1 21 5  48 o 14.44000 0.3993000 15.22000 0.5670000 13.66000 0.5623000 1.558000       0.7986000 
1 1 1 21 5  50 o 8.892000 0.5997000 9.305000 0.8216000 8.480000 0.8738000 0.8248000      1.199000  
1 1 1 21 5  52 o 4.336000 1.124000  4.291000 1.523000  4.382000 1.655000  -0.9056000E-01 2.249000  
1 1 1 21 5  54 o 8.021000 1.173000  7.851000 2.143000  8.191000 0.9516000 -0.3396000     2.345000  
1 1 1 21 5  56 o 9.677000 0.7049000 8.972000 1.166000  10.38000 0.7929000 -1.409000      1.410000  
1 1 1 21 5  58 o 3.485000 0.9766000 3.203000 1.427000  3.767000 1.334000  -0.5642000     1.953000  
1 1 1 21 5  60 o 3.172000 0.9375000 3.214000 1.337000  3.129000 1.314000  0.8521000E-01  1.875000  
1 1 1 21 6  1  o 47.99000 0.3620000 47.94000 0.5119000 48.03000 0.5120000 -0.8948000E-01 0.7240000 
1 1 1 21 6  3  o 41.33000 0.3259000 41.54000 0.4617000 41.11000 0.4601000 0.4276000      0.6518000 
1 1 1 21 6  5  o 43.52000 0.4292000 43.59000 0.5470000 43.46000 0.6616000 0.1298000      0.8584000 
1 1 1 21 6  7  o 82.67000 0.6238000 83.15000 0.8240000 82.19000 0.9368000 0.9524000      1.248000  
1 1 1 21 6  9  o 66.13000 0.4734000 65.78000 0.6659000 66.49000 0.6731000 -0.7163000     0.9468000 
1 1 1 21 6  11 o 7.742000 0.5230000 8.232000 0.6533000 7.253000 0.8167000 0.9789000      1.046000  
1 1 1 21 6  13 o 65.71000 0.4707000 65.88000 0.6673000 65.55000 0.6642000 0.3236000      0.9415000 
1 1 1 21 6  15 o 16.67000 0.3959000 16.09000 0.6762000 17.25000 0.4118000 -1.162000      0.7918000 
1 1 1 21 6  17 o 53.55000 0.4290000 53.13000 0.6438000 53.96000 0.5670000 -0.8277000     0.8579000 
1 1 1 21 6  19 f 38.94000 0.3474000 38.98000 0.4541000 38.90000 0.5260000 0.7845000E-01  0.6949000 
1 1 1 21 6  21 o 71.37000 0.5101000 71.37000 0.7213000 71.37000 0.7214000 0.2037000E-02  1.020000  
1 1 1 21 6  23 o 67.46000 0.4868000 67.30000 0.6879000 67.63000 0.6889000 -0.3256000     0.9735000 
1 1 1 21 6  25 o 45.44000 0.4606000 45.33000 0.7094000 45.56000 0.5877000 -0.2254000     0.9212000 
1 1 1 21 6  27 o 34.77000 0.4135000 34.87000 0.5212000 34.67000 0.6421000 0.1947000      0.8270000 
1 1 1 21 6  29 o 13.34000 0.4265000 13.06000 0.5206000 13.61000 0.6756000 -0.5458000     0.8529000 
1 1 1 21 6  31 o 26.27000 0.3435000 26.03000 0.4338000 26.51000 0.5326000 -0.4776000     0.6870000 
1 1 1 21 6  33 o 48.90000 0.4520000 48.92000 0.6315000 48.87000 0.6469000 0.5518000E-01  0.9040000 
1 1 1 21 6  35 o 42.21000 0.3608000 42.30000 0.5067000 42.11000 0.5139000 0.1890000      0.7217000 
1 1 1 21 6  37 o 17.59000 0.3928000 16.74000 0.5086000 18.44000 0.5987000 -1.697000      0.7856000 
1 1 1 21 6  39 o 8.764000 0.6371000 8.022000 0.9576000 9.507000 0.8405000 -1.485000      1.274000  
1 1 1 21 6  41 o 28.06000 0.3471000 28.35000 0.4459000 27.76000 0.5320000 0.5869000      0.6942000 
1 1 1 21 6  43 o 26.00000 0.3426000 26.19000 0.5147000 25.81000 0.4522000 0.3796000      0.6852000 
1 1 1 21 6  45 o 11.03000 0.4915000 10.77000 0.7435000 11.28000 0.6431000 -0.5157000     0.9831000 
1 1 1 21 6  47 o 4.610000 1.028000  5.131000 1.546000  4.089000 1.355000  1.042000       2.056000  
1 1 1 21 6  49 o 13.39000 0.4748000 13.28000 0.6586000 13.51000 0.6842000 -0.2350000     0.9497000 
1 1 1 21 6  51 f 16.71000 0.4487000 16.96000 0.6336000 16.45000 0.6356000 0.5118000      0.8974000 
1 1 1 21 6  53 o 15.23000 0.5393000 15.24000 0.9105000 15.21000 0.5783000 0.2601000E-01  1.079000  
1 1 1 21 6  55 o 4.207000 0.9912000 4.252000 1.456000  4.162000 1.346000  0.8997000E-01  1.982000  
1 1 1 21 6  57 o 5.785000 0.9459000 5.583000 1.393000  5.987000 1.280000  -0.4043000     1.892000  
1 1 1 21 6  59 o 3.440000 0.9331000 2.863000 1.256000  4.016000 1.380000  -1.153000      1.866000  
1 1 1 21 7  0  o 49.96000 0.5281000 49.96000 0.5281000 49.96000 0.5281000 0.000000       0.000000  
1 1 1 21 7  2  f 42.35000 0.3333000 43.05000 0.4755000 41.64000 0.4670000 1.417000       0.6665000 
1 1 1 21 7  4  o 61.22000 0.4758000 60.89000 0.6219000 61.56000 0.7203000 -0.6701000     0.9517000 
1 1 1 21 7  6  o 60.24000 0.4694000 60.38000 0.6182000 60.09000 0.7065000 0.2880000      0.9388000 
1 1 1 21 7  8  o 31.83000 0.3268000 31.27000 0.4564000 32.39000 0.4679000 -1.117000      0.6536000 
1 1 1 21 7  10 o 32.07000 0.2876000 31.98000 0.4052000 32.16000 0.4083000 -0.1726000     0.5753000 
1 1 1 21 7  12 o 31.88000 0.3298000 31.82000 0.4622000 31.94000 0.4707000 -0.1283000     0.6597000 
1 1 1 21 7  14 o 33.03000 0.3125000 32.89000 0.4699000 33.16000 0.4121000 -0.2708000     0.6251000 
1 1 1 21 7  16 o 30.86000 0.3055000 30.49000 0.4575000 31.23000 0.4051000 -0.7448000     0.6111000 
1 1 1 21 7  18 o 45.41000 0.3534000 45.04000 0.4969000 45.79000 0.5026000 -0.7502000     0.7068000 
1 1 1 21 7  20 o 55.52000 0.4121000 55.50000 0.5831000 55.53000 0.5825000 -0.2937000E-01 0.8242000 
1 1 1 21 7  22 o 18.50000 0.2982000 18.17000 0.4326000 18.83000 0.4105000 -0.6544000     0.5964000 
1 1 1 21 7  24 o 45.53000 0.3870000 45.41000 0.5860000 45.64000 0.5056000 -0.2353000     0.7740000 
1 1 1 21 7  26 o 29.66000 0.3164000 29.35000 0.3784000 29.98000 0.5071000 -0.6359000     0.6327000 
1 1 1 21 7  28 o 17.93000 0.5171000 17.77000 0.5515000 18.08000 0.8748000 -0.3080000     1.034000  
1 1 1 21 7  30 o 26.36000 0.3247000 26.31000 0.3929000 26.41000 0.5171000 -0.1025000     0.6495000 
1 1 1 21 7  32 o 34.55000 0.3942000 34.37000 0.4098000 34.73000 0.6735000 -0.3562000     0.7884000 
1 1 1 21 7  34 o 33.85000 0.3331000 33.84000 0.4625000 33.85000 0.4795000 -0.1451000E-01 0.6661000 
1 1 1 21 7  36 o 31.48000 0.3322000 31.43000 0.4623000 31.53000 0.4773000 -0.9435000E-01 0.6645000 
1 1 1 21 7  38 o 18.08000 0.3741000 19.06000 0.5079000 17.10000 0.5494000 1.959000       0.7482000 
1 1 1 21 7  40 o 5.637000 0.9524000 5.875000 1.314000  5.400000 1.379000  0.4748000      1.905000  
1 1 1 21 7  42 o 10.57000 0.5438000 10.26000 0.7591000 10.88000 0.7789000 -0.6233000     1.088000  
1 1 1 21 7  44 o 8.596000 0.6657000 7.880000 1.093000  9.313000 0.7600000 -1.433000      1.331000  
1 1 1 21 7  46 o 16.88000 0.3665000 16.58000 0.5332000 17.17000 0.5029000 -0.5823000     0.7329000 
1 1 1 21 7  48 o 11.30000 0.6070000 11.09000 0.9096000 11.51000 0.8040000 -0.4201000     1.214000  
1 1 1 21 7  50 o 7.087000 0.7558000 7.183000 1.086000  6.991000 1.052000  0.1923000      1.512000  
1 1 1 21 7  52 o 3.456000 0.9859000 4.121000 1.522000  2.790000 1.253000  1.331000       1.972000  
1 1 1 21 7  54 o 7.447000 0.8640000 6.389000 1.419000  8.504000 0.9863000 -2.115000      1.728000  
1 1 1 21 7  56 o 4.782000 1.026000  4.773000 1.518000  4.790000 1.379000  -0.1717000E-01 2.051000  
1 1 1 21 7  58 o 4.570000 1.010000  3.956000 1.433000  5.183000 1.422000  -1.227000      2.019000  
1 1 1 21 7  60 o 3.623000 1.026000  3.069000 1.326000  4.178000 1.566000  -1.109000      2.052000  
1 1 1 21 8  1  o 59.47000 0.4945000 58.54000 0.6891000 60.40000 0.7095000 -1.858000      0.9891000 
1 1 1 21 8  3  o 89.33000 0.7166000 88.93000 1.009000  89.74000 1.017000  -0.8021000     1.433000  
1 1 1 21 8  5  o 42.78000 0.3596000 43.29000 0.5454000 42.28000 0.4687000 1.008000       0.7192000 
1 1 1 21 8  7  o 75.99000 0.5780000 76.16000 0.8741000 75.82000 0.7564000 0.3455000      1.156000  
1 1 1 21 8  9  o 69.69000 0.5708000 69.82000 0.8086000 69.55000 0.8059000 0.2757000      1.142000  
1 1 1 21 8  11 o 60.13000 0.5039000 59.87000 0.7063000 60.40000 0.7189000 -0.5316000     1.008000  
1 1 1 21 8  13 o 28.27000 0.2969000 28.78000 0.4475000 27.76000 0.3902000 1.025000       0.5938000 
1 1 1 21 8  15 o 35.38000 0.3029000 35.41000 0.4302000 35.35000 0.4266000 0.5818000E-01  0.6059000 
1 1 1 21 8  17 o 28.68000 0.2803000 28.65000 0.3955000 28.72000 0.3974000 -0.6461000E-01 0.5607000 
1 1 1 21 8  19 f 54.67000 0.4058000 54.36000 0.5714000 54.99000 0.5764000 -0.6347000     0.8116000 
1 1 1 21 8  21 o 7.776000 0.5039000 7.686000 0.6979000 7.865000 0.7270000 -0.1796000     1.008000  
1 1 1 21 8  23 f 27.16000 0.3085000 27.37000 0.4693000 26.95000 0.4007000 0.4167000      0.6171000 
1 1 1 21 8  25 o 56.13000 0.4336000 56.03000 0.5281000 56.22000 0.6879000 -0.1896000     0.8672000 
1 1 1 21 8  27 o 56.70000 0.6567000 57.20000 0.5380000 56.20000 1.198000  1.002000       1.313000  
1 1 1 21 8  29 o 13.53000 0.4453000 13.57000 0.5687000 13.50000 0.6854000 0.6744000E-01  0.8906000 
1 1 1 21 8  31 o 16.56000 0.6459000 16.09000 0.5087000 17.02000 1.188000  -0.9301000     1.292000  
1 1 1 21 8  33 o 27.05000 0.3349000 26.76000 0.4038000 27.33000 0.5344000 -0.5696000     0.6698000 
1 1 1 21 8  35 o 14.84000 0.4210000 14.48000 0.5922000 15.19000 0.5984000 -0.7082000     0.8419000 
1 1 1 21 8  37 o 22.93000 0.3408000 22.75000 0.4702000 23.10000 0.4935000 -0.3508000     0.6816000 
1 1 1 21 8  39 o 31.91000 0.3510000 32.29000 0.5206000 31.52000 0.4710000 0.7667000      0.7021000 
1 1 1 21 8  41 o 14.45000 0.4334000 15.34000 0.5602000 13.56000 0.6615000 1.773000       0.8669000 
1 1 1 21 8  43 o 4.867000 0.9611000 4.353000 1.485000  5.381000 1.221000  -1.028000      1.922000  
1 1 1 21 8  45 o 10.47000 0.5396000 11.18000 0.8023000 9.751000 0.7216000 1.433000       1.079000  
1 1 1 21 8  47 o 15.91000 0.4178000 15.95000 0.5712000 15.88000 0.6099000 0.7257000E-01  0.8356000 
1 1 1 21 8  49 o 5.866000 0.8892000 6.325000 1.225000  5.407000 1.289000  0.9174000      1.778000  
1 1 1 21 8  51 o 10.70000 0.5769000 12.02000 0.7570000 9.378000 0.8708000 2.644000       1.154000  
1 1 1 21 8  53 o 8.237000 0.6696000 8.279000 1.066000  8.194000 0.8106000 0.8531000E-01  1.339000  
1 1 1 21 8  55 o 6.619000 0.8358000 7.278000 1.156000  5.960000 1.208000  1.317000       1.672000  
1 1 1 21 8  57 o 5.435000 1.037000  6.317000 1.468000  4.553000 1.466000  1.764000       2.075000  
1 1 1 21 8  59 o 7.858000 0.7764000 7.379000 1.098000  8.337000 1.098000  -0.9580000     1.553000  
1 1 1 21 9  0  o 3.572000 1.249000  3.572000 1.249000  3.572000 1.249000  0.000000       0.000000  
1 1 1 21 9  2  o 40.67000 0.3458000 40.99000 0.5200000 40.34000 0.4560000 0.6451000      0.6916000 
1 1 1 21 9  4  o 20.23000 0.2811000 20.44000 0.4187000 20.02000 0.3753000 0.4142000      0.5623000 
1 1 1 21 9  6  o 22.62000 0.2842000 22.42000 0.4260000 22.83000 0.3763000 -0.4163000     0.5685000 
1 1 1 21 9  8  o 51.06000 0.4399000 50.82000 0.6154000 51.31000 0.6289000 -0.4934000     0.8799000 
1 1 1 21 9  10 o 74.39000 0.5716000 73.46000 0.7360000 75.33000 0.8747000 -1.869000      1.143000  
1 1 1 21 9  12 o 81.16000 0.7334000 82.00000 0.9373000 80.33000 1.128000  1.668000       1.467000  
1 1 1 21 9  14 o 43.40000 0.3412000 43.36000 0.4818000 43.44000 0.4832000 -0.8213000E-01 0.6824000 
1 1 1 21 9  16 o 21.35000 0.2908000 21.43000 0.4426000 21.27000 0.3774000 0.1542000      0.5817000 
1 1 1 21 9  18 o 13.27000 0.3248000 13.00000 0.4750000 13.53000 0.4430000 -0.5382000     0.6495000 
1 1 1 21 9  20 o 45.08000 0.3828000 45.18000 0.5022000 44.97000 0.5778000 0.2087000      0.7655000 
1 1 1 21 9  22 o 36.08000 0.3356000 36.22000 0.5086000 35.93000 0.4381000 0.2936000      0.6712000 
1 1 1 21 9  24 f 16.17000 0.3365000 15.95000 0.3965000 16.40000 0.5437000 -0.4530000     0.6730000 
1 1 1 21 9  26 o 18.94000 0.3278000 18.45000 0.3880000 19.42000 0.5283000 -0.9738000     0.6555000 
1 1 1 21 9  28 o 35.32000 0.3877000 35.26000 0.4027000 35.37000 0.6627000 -0.1097000     0.7755000 
1 1 1 21 9  30 o 26.08000 0.3944000 26.22000 0.4508000 25.94000 0.6472000 0.2787000      0.7887000 
1 1 1 21 9  32 o 15.91000 0.4047000 15.81000 0.4696000 16.02000 0.6593000 -0.2133000     0.8094000 
1 1 1 21 9  34 f 32.31000 0.4253000 32.67000 0.5176000 31.96000 0.6751000 0.7051000      0.8507000 
1 1 1 21 9  36 o 56.60000 0.4690000 56.31000 0.7024000 56.88000 0.6217000 -0.5733000     0.9380000 
1 1 1 21 9  38 o 20.55000 0.3558000 21.07000 0.5041000 20.03000 0.5022000 1.044000       0.7115000 
1 1 1 21 9  40 o 25.41000 0.3252000 25.88000 0.4493000 24.94000 0.4703000 0.9415000      0.6504000 
1 1 1 21 9  42 o 14.44000 0.4154000 15.14000 0.5283000 13.74000 0.6413000 1.397000       0.8308000 
1 1 1 21 9  44 o 13.19000 0.4365000 12.58000 0.6559000 13.79000 0.5762000 -1.207000      0.8731000 
1 1 1 21 9  46 f 20.20000 0.4067000 20.13000 0.5782000 20.26000 0.5719000 -0.1280000     0.8133000 
1 1 1 21 9  48 o 9.106000 0.6182000 8.299000 0.9970000 9.912000 0.7313000 -1.613000      1.236000  
1 1 1 21 9  50 o 8.130000 0.6841000 7.989000 1.000000  8.270000 0.9334000 -0.2812000     1.368000  
1 1 1 21 9  52 o 4.884000 1.024000  5.606000 1.408000  4.162000 1.488000  1.444000       2.049000  
1 1 1 21 9  54 o 6.233000 0.9100000 6.089000 1.368000  6.377000 1.200000  -0.2881000     1.820000  
1 1 1 21 9  56 o 3.295000 0.9455000 3.324000 1.382000  3.266000 1.290000  0.5735000E-01  1.891000  
1 1 1 21 9  58 o 10.11000 0.6997000 10.71000 0.9301000 9.509000 1.046000  1.200000       1.399000  
1 1 1 21 9  60 o 4.530000 1.078000  5.556000 1.613000  3.505000 1.430000  2.052000       2.156000  
1 1 1 21 10 1  f 19.64000 0.2647000 19.45000 0.3749000 19.83000 0.3738000 -0.3809000     0.5294000 
1 1 1 21 10 3  o 77.51000 0.5453000 76.56000 0.7620000 78.46000 0.7801000 -1.900000      1.091000  
1 1 1 21 10 5  o 52.17000 0.4207000 52.70000 0.5524000 51.64000 0.6346000 1.060000       0.8414000 
1 1 1 21 10 7  o 60.76000 0.4758000 60.84000 0.6227000 60.68000 0.7196000 0.1633000      0.9516000 
1 1 1 21 10 9  o 49.84000 0.4848000 49.98000 0.6196000 49.69000 0.7458000 0.2966000      0.9695000 
1 1 1 21 10 11 o 41.80000 0.3617000 42.17000 0.4703000 41.44000 0.5497000 0.7260000      0.7235000 
1 1 1 21 10 13 o 59.89000 0.5364000 60.93000 0.6238000 58.84000 0.8729000 2.096000       1.073000  
1 1 1 21 10 15 o 57.33000 0.4858000 57.91000 0.6876000 56.74000 0.6864000 1.167000       0.9715000 
1 1 1 21 10 17 o 25.39000 0.2913000 25.13000 0.4367000 25.65000 0.3857000 -0.5176000     0.5827000 
1 1 1 21 10 19 o 36.09000 0.3087000 35.59000 0.4359000 36.58000 0.4371000 -0.9849000     0.6173000 
1 1 1 21 10 21 o 67.92000 0.4878000 67.49000 0.6868000 68.35000 0.6927000 -0.8581000     0.9755000 
1 1 1 21 10 23 o 39.60000 0.3548000 39.87000 0.4598000 39.34000 0.5405000 0.5359000      0.7096000 
1 1 1 21 10 25 o 40.99000 0.3513000 40.41000 0.4205000 41.56000 0.5630000 -1.145000      0.7027000 
1 1 1 21 10 27 o 39.08000 0.3923000 38.76000 0.4144000 39.39000 0.6664000 -0.6344000     0.7847000 
1 1 1 21 10 29 o 22.61000 0.3807000 22.24000 0.3866000 22.98000 0.6559000 -0.7443000     0.7613000 
1 1 1 21 10 31 o 38.50000 0.3939000 38.65000 0.5487000 38.34000 0.5653000 0.3035000      0.7878000 
1 1 1 21 10 33 o 29.63000 0.3301000 29.39000 0.3984000 29.88000 0.5265000 -0.4886000     0.6602000 
1 1 1 21 10 35 o 29.39000 0.3621000 29.38000 0.5471000 29.40000 0.4746000 -0.2638000E-01 0.7243000 
1 1 1 21 10 37 o 19.94000 0.4046000 20.04000 0.5454000 19.83000 0.5976000 0.2045000      0.8091000 
1 1 1 21 10 39 o 29.65000 0.3500000 30.18000 0.5172000 29.12000 0.4718000 1.054000       0.7001000 
1 1 1 21 10 41 o 8.686000 0.6219000 8.708000 0.8473000 8.664000 0.9104000 0.4479000E-01  1.244000  
1 1 1 21 10 43 o 10.84000 0.5115000 11.14000 0.7606000 10.54000 0.6839000 0.6009000      1.023000  
1 1 1 21 10 45 o 7.672000 0.6574000 7.201000 1.048000  8.144000 0.7942000 -0.9436000     1.315000  
1 1 1 21 10 47 o 8.590000 0.7734000 9.653000 1.238000  7.527000 0.9275000 2.126000       1.547000  
1 1 1 21 10 49 o 8.094000 0.8477000 7.222000 1.445000  8.967000 0.8865000 -1.745000      1.695000  
1 1 1 21 10 51 o 9.026000 0.7287000 7.574000 1.259000  10.48000 0.7338000 -2.904000      1.457000  
1 1 1 21 10 53 o 13.50000 0.4651000 13.32000 0.6695000 13.69000 0.6457000 -0.3768000     0.9302000 
1 1 1 21 10 55 o 6.237000 0.8629000 5.142000 1.388000  7.333000 1.025000  -2.191000      1.726000  
1 1 1 21 10 57 o 4.533000 1.030000  4.601000 1.487000  4.465000 1.425000  0.1354000      2.059000  
1 1 1 21 10 59 o 3.135000 0.9458000 3.372000 1.407000  2.899000 1.264000  0.4730000      1.892000  
1 1 1 21 11 0  o 55.66000 0.5779000 55.66000 0.5779000 55.66000 0.5779000 0.000000       0.000000  
1 1 1 21 11 2  o 30.45000 0.2798000 30.44000 0.3944000 30.46000 0.3970000 -0.2259000E-01 0.5596000 
1 1 1 21 11 4  o 33.44000 0.3160000 33.25000 0.4079000 33.63000 0.4827000 -0.3766000     0.6320000 
1 1 1 21 11 6  o 77.03000 0.5863000 77.29000 0.7696000 76.76000 0.8848000 0.5332000      1.173000  
1 1 1 21 11 8  o 32.75000 0.2864000 32.26000 0.3993000 33.25000 0.4107000 -0.9889000     0.5728000 
1 1 1 21 11 10 o 45.82000 0.3514000 45.86000 0.4981000 45.78000 0.4958000 0.8683000E-01  0.7028000 
1 1 1 21 11 12 o 21.23000 0.2864000 20.83000 0.3812000 21.63000 0.4275000 -0.8053000     0.5728000 
1 1 1 21 11 14 o 47.19000 0.3602000 47.09000 0.5086000 47.29000 0.5101000 -0.1973000     0.7203000 
1 1 1 21 11 16 o 27.51000 0.3860000 27.15000 0.5209000 27.86000 0.5699000 -0.7136000     0.7721000 
1 1 1 21 11 18 o 44.36000 0.3802000 44.15000 0.4931000 44.56000 0.5790000 -0.4092000     0.7605000 
1 1 1 21 11 20 o 32.76000 0.2960000 32.78000 0.4206000 32.74000 0.4167000 0.4176000E-01  0.5921000 
1 1 1 21 11 22 o 44.03000 0.3780000 44.30000 0.4903000 43.75000 0.5754000 0.5458000      0.7560000 
1 1 1 21 11 24 o 31.99000 0.3138000 31.88000 0.3733000 32.11000 0.5044000 -0.2364000     0.6275000 
1 1 1 21 11 26 o 18.87000 0.3602000 18.55000 0.3700000 19.19000 0.6182000 -0.6404000     0.7205000 
1 1 1 21 11 28 o 33.19000 0.5090000 33.32000 0.3888000 33.06000 0.9408000 0.2575000      1.018000  
1 1 1 21 11 30 o 26.01000 0.3237000 25.51000 0.3874000 26.51000 0.5187000 -0.9985000     0.6474000 
1 1 1 21 11 32 o 28.47000 0.3489000 27.91000 0.4571000 29.02000 0.5271000 -1.106000      0.6977000 
1 1 1 21 11 34 o 37.80000 0.3560000 38.13000 0.4317000 37.48000 0.5662000 0.6512000      0.7120000 
1 1 1 21 11 36 o 20.45000 0.3913000 21.06000 0.6026000 19.85000 0.4994000 1.213000       0.7827000 
1 1 1 21 11 38 o 18.07000 0.3876000 17.76000 0.5723000 18.38000 0.5228000 -0.6258000     0.7752000 
1 1 1 21 11 40 o 18.99000 0.4056000 18.41000 0.5677000 19.57000 0.5794000 -1.154000      0.8112000 
1 1 1 21 11 42 o 7.475000 0.6936000 7.308000 1.024000  7.642000 0.9352000 -0.3336000     1.387000  
1 1 1 21 11 44 o 6.231000 0.8224000 5.503000 1.282000  6.960000 1.030000  -1.457000      1.645000  
1 1 1 21 11 46 o 5.649000 1.092000  6.955000 1.721000  4.343000 1.345000  2.612000       2.184000  
1 1 1 21 11 48 o 3.478000 0.9856000 3.665000 1.411000  3.291000 1.376000  0.3739000      1.971000  
1 1 1 21 11 50 o 4.424000 0.9892000 3.737000 1.541000  5.111000 1.241000  -1.375000      1.978000  
1 1 1 21 11 52 o 3.243000 0.9654000 3.210000 1.341000  3.276000 1.390000  -0.6589000E-01 1.931000  
1 1 1 21 11 54 o 4.508000 0.9649000 5.282000 1.388000  3.734000 1.341000  1.548000       1.930000  
1 1 1 21 11 56 o 3.199000 0.9457000 3.221000 1.349000  3.177000 1.326000  0.4369000E-01  1.891000  
1 1 1 21 11 58 o 5.915000 0.9287000 6.011000 1.286000  5.820000 1.341000  0.1907000      1.857000  
1 1 1 21 11 60 o 4.396000 1.463000  ?        ?         4.396000 1.463000  ?              ?         
1 1 1 21 12 1  o 141.8000 0.9703000 140.7000 1.362000  142.9000 1.382000  -2.231000      1.941000  
1 1 1 21 12 3  o 47.76000 0.3918000 47.34000 0.5053000 48.18000 0.5990000 -0.8452000     0.7837000 
1 1 1 21 12 5  o 50.63000 0.4109000 49.91000 0.5271000 51.35000 0.6306000 -1.441000      0.8219000 
1 1 1 21 12 7  o 30.44000 0.2765000 30.55000 0.3902000 30.34000 0.3918000 0.2143000      0.5530000 
1 1 1 21 12 9  o 48.09000 0.3627000 47.69000 0.5100000 48.49000 0.5159000 -0.7993000     0.7254000 
1 1 1 21 12 11 o 36.55000 0.3040000 36.97000 0.4329000 36.13000 0.4270000 0.8415000      0.6080000 
1 1 1 21 12 13 o 12.49000 0.3319000 12.25000 0.4369000 12.73000 0.4997000 -0.4734000     0.6638000 
1 1 1 21 12 15 o 42.79000 0.3641000 42.47000 0.5483000 43.11000 0.4794000 -0.6377000     0.7283000 
1 1 1 21 12 17 f 78.21000 0.5956000 78.12000 0.8991000 78.30000 0.7814000 -0.1879000     1.191000  
1 1 1 21 12 19 o 57.00000 0.5441000 56.66000 0.6780000 57.35000 0.8511000 -0.6971000     1.088000  
1 1 1 21 12 21 o 42.06000 0.3673000 41.89000 0.4690000 42.24000 0.5653000 -0.3514000     0.7345000 
1 1 1 21 12 23 o 39.87000 0.3421000 39.36000 0.4089000 40.37000 0.5485000 -1.007000      0.6841000 
1 1 1 21 12 25 o 11.92000 0.4606000 12.15000 0.4568000 11.70000 0.7999000 0.4496000      0.9212000 
1 1 1 21 12 27 o 12.01000 0.5094000 12.38000 0.4756000 11.63000 0.9010000 0.7528000      1.019000  
1 1 1 21 12 29 o 9.709000 0.5397000 9.552000 0.6227000 9.866000 0.8816000 -0.3141000     1.079000  
1 1 1 21 12 31 o 10.18000 0.5304000 9.547000 0.7029000 10.81000 0.7946000 -1.265000      1.061000  
1 1 1 21 12 33 o 5.113000 1.051000  5.402000 1.426000  4.824000 1.544000  0.5786000      2.102000  
1 1 1 21 12 35 o 44.22000 0.3824000 44.81000 0.4672000 43.64000 0.6056000 1.164000       0.7648000 
1 1 1 21 12 37 o 5.354000 1.082000  5.402000 1.638000  5.305000 1.413000  0.9674000E-01  2.163000  
1 1 1 21 12 39 o 15.53000 0.4008000 14.36000 0.5955000 16.71000 0.5367000 -2.354000      0.8017000 
1 1 1 21 12 41 f 22.49000 0.4017000 22.50000 0.4633000 22.49000 0.6564000 0.1731000E-01  0.8034000 
1 1 1 21 12 43 o 6.446000 0.9168000 6.396000 1.316000  6.497000 1.277000  -0.1013000     1.834000  
1 1 1 21 12 45 o 14.00000 0.4371000 14.05000 0.6648000 13.95000 0.5679000 0.1074000      0.8743000 
1 1 1 21 12 47 o 6.725000 0.8582000 6.405000 1.249000  7.046000 1.177000  -0.6406000     1.716000  
1 1 1 21 12 49 o 6.601000 0.7904000 6.571000 1.148000  6.631000 1.087000  -0.5970000E-01 1.581000  
1 1 1 21 12 51 o 4.821000 1.106000  5.549000 1.791000  4.092000 1.296000  1.457000       2.211000  
1 1 1 21 12 53 f 4.263000 1.036000  3.679000 1.483000  4.847000 1.447000  -1.168000      2.072000  
1 1 1 21 12 55 o 10.36000 0.5672000 10.89000 0.7744000 9.831000 0.8289000 1.058000       1.134000  
1 1 1 21 12 57 o 3.310000 0.9164000 4.088000 1.410000  2.531000 1.171000  1.557000       1.833000  
1 1 1 21 12 59 o 3.941000 1.058000  3.836000 1.560000  4.047000 1.430000  -0.2112000     2.116000  
1 1 1 21 13 0  o 24.32000 0.4945000 24.32000 0.4945000 24.32000 0.4945000 0.000000       0.000000  
1 1 1 21 13 2  o 48.22000 0.3952000 48.41000 0.5164000 48.04000 0.5983000 0.3680000      0.7903000 
1 1 1 21 13 4  o 30.05000 0.2762000 29.79000 0.3853000 30.31000 0.3957000 -0.5215000     0.5523000 
1 1 1 21 13 6  o 44.41000 0.3430000 44.63000 0.4888000 44.20000 0.4814000 0.4385000      0.6861000 
1 1 1 21 13 8  o 14.58000 0.2951000 14.82000 0.4176000 14.33000 0.4170000 0.4904000      0.5901000 
1 1 1 21 13 10 o 47.27000 0.3922000 47.51000 0.6003000 47.02000 0.5048000 0.4879000      0.7843000 
1 1 1 21 13 12 o 26.42000 0.2958000 26.70000 0.4584000 26.14000 0.3739000 0.5579000      0.5915000 
1 1 1 21 13 14 o 37.46000 0.3079000 37.05000 0.4314000 37.86000 0.4395000 -0.8101000     0.6158000 
1 1 1 21 13 16 o 11.14000 0.5215000 12.31000 0.4566000 9.964000 0.9378000 2.342000       1.043000  
1 1 1 21 13 18 o 30.85000 0.2891000 31.37000 0.4197000 30.34000 0.3977000 1.031000       0.5782000 
1 1 1 21 13 20 o 46.93000 0.5102000 45.84000 0.6952000 48.01000 0.7469000 -2.172000      1.020000  
1 1 1 21 13 22 o 44.37000 0.3650000 44.85000 0.4446000 43.89000 0.5790000 0.9626000      0.7300000 
1 1 1 21 13 24 o 35.75000 0.3263000 35.75000 0.3892000 35.76000 0.5238000 -0.1206000E-01 0.6526000 
1 1 1 21 13 26 o 30.83000 0.3635000 31.03000 0.3739000 30.63000 0.6236000 0.3961000      0.7271000 
1 1 1 21 13 28 o 37.96000 0.4055000 37.38000 0.4122000 38.53000 0.6984000 -1.151000      0.8109000 
1 1 1 21 13 30 o 46.48000 0.4010000 46.45000 0.5177000 46.51000 0.6127000 -0.5609000E-01 0.8021000 
1 1 1 21 13 32 o 26.33000 0.3269000 25.77000 0.3952000 26.89000 0.5207000 -1.124000      0.6537000 
1 1 1 21 13 34 o 18.92000 0.3868000 18.64000 0.5193000 19.21000 0.5734000 -0.5727000     0.7736000 
1 1 1 21 13 36 o 30.15000 0.3238000 29.94000 0.4472000 30.36000 0.4685000 -0.4160000     0.6477000 
1 1 1 21 13 38 o 5.326000 1.091000  5.660000 1.668000  4.992000 1.406000  0.6685000      2.182000  
1 1 1 21 13 40 o 14.14000 0.4582000 13.53000 0.6122000 14.74000 0.6820000 -1.210000      0.9165000 
1 1 1 21 13 42 o 15.21000 0.3962000 14.17000 0.5703000 16.25000 0.5502000 -2.079000      0.7925000 
1 1 1 21 13 44 o 3.536000 0.9581000 3.881000 1.394000  3.190000 1.315000  0.6903000      1.916000  
1 1 1 21 13 46 o 20.60000 0.3812000 20.95000 0.5388000 20.24000 0.5394000 0.7071000      0.7624000 
1 1 1 21 13 48 o 14.27000 0.4572000 14.89000 0.7301000 13.65000 0.5504000 1.244000       0.9143000 
1 1 1 21 13 50 o 2.957000 0.9179000 3.133000 1.372000  2.781000 1.220000  0.3520000      1.836000  
1 1 1 21 13 52 o 7.513000 0.7163000 8.175000 0.9398000 6.851000 1.081000  1.324000       1.433000  
1 1 1 21 13 54 o 5.596000 0.9221000 6.275000 1.296000  4.918000 1.312000  1.357000       1.844000  
1 1 1 21 13 56 o 3.123000 0.9364000 3.413000 1.371000  2.832000 1.276000  0.5811000      1.873000  
1 1 1 21 13 58 o 4.574000 1.038000  5.049000 1.433000  4.099000 1.502000  0.9497000      2.076000  
1 1 1 21 14 1  o 49.79000 0.4960000 50.87000 0.6323000 48.71000 0.7645000 2.159000       0.9921000 
1 1 1 21 14 3  o 79.85000 0.5605000 79.83000 0.7932000 79.88000 0.7921000 -0.4298000E-01 1.121000  
1 1 1 21 14 5  o 37.19000 0.3068000 37.57000 0.4388000 36.80000 0.4290000 0.7705000      0.6137000 
1 1 1 21 14 7  o 41.53000 0.3568000 41.62000 0.5458000 41.43000 0.4596000 0.1922000      0.7135000 
1 1 1 21 14 9  o 15.36000 0.3433000 14.64000 0.5610000 16.08000 0.3958000 -1.444000      0.6865000 
1 1 1 21 14 11 o 12.57000 0.3718000 12.75000 0.6027000 12.40000 0.4357000 0.3524000      0.7437000 
1 1 1 21 14 13 o 43.97000 0.4005000 44.32000 0.5734000 43.62000 0.5591000 0.7037000      0.8009000 
1 1 1 21 14 15 o 43.86000 0.3743000 43.39000 0.5689000 44.33000 0.4864000 -0.9398000     0.7485000 
1 1 1 21 14 17 o 55.58000 0.4426000 55.23000 0.6654000 55.94000 0.5838000 -0.7110000     0.8853000 
1 1 1 21 14 19 o 36.43000 0.3367000 36.43000 0.4258000 36.43000 0.5217000 0.2285000E-02  0.6734000 
1 1 1 21 14 21 o 57.59000 0.4416000 57.75000 0.5369000 57.42000 0.7013000 0.3248000      0.8832000 
1 1 1 21 14 23 o 34.12000 0.3941000 33.41000 0.4807000 34.84000 0.6246000 -1.429000      0.7882000 
1 1 1 21 14 25 f 34.41000 0.4740000 33.48000 0.3806000 35.33000 0.8682000 -1.848000      0.9479000 
1 1 1 21 14 27 o 24.78000 0.3360000 24.42000 0.4352000 25.15000 0.5120000 -0.7320000     0.6720000 
1 1 1 21 14 29 f 19.89000 0.3410000 19.96000 0.4169000 19.81000 0.5398000 0.1556000      0.6821000 
1 1 1 21 14 31 o 14.89000 0.4050000 14.49000 0.5031000 15.29000 0.6349000 -0.7934000     0.8101000 
1 1 1 21 14 33 o 33.23000 0.3340000 33.27000 0.4011000 33.19000 0.5343000 0.8034000E-01  0.6681000 
1 1 1 21 14 35 o 33.25000 0.3557000 33.66000 0.4685000 32.84000 0.5354000 0.8197000      0.7114000 
1 1 1 21 14 37 o 10.53000 0.5318000 9.974000 0.7945000 11.08000 0.7071000 -1.110000      1.064000  
1 1 1 21 14 39 o 17.62000 0.3936000 17.54000 0.6141000 17.71000 0.4924000 -0.1733000     0.7871000 
1 1 1 21 14 41 o 23.16000 0.4590000 24.00000 0.7386000 22.31000 0.5451000 1.685000       0.9179000 
1 1 1 21 14 43 o 11.60000 0.4870000 11.10000 0.7536000 12.10000 0.6172000 -1.000000      0.9741000 
1 1 1 21 14 45 o 6.082000 0.8457000 5.240000 1.250000  6.925000 1.140000  -1.685000      1.691000  
1 1 1 21 14 47 o 6.453000 0.8327000 7.335000 1.055000  5.572000 1.289000  1.762000       1.665000  
1 1 1 21 14 49 o 11.02000 0.5353000 11.56000 0.7785000 10.48000 0.7348000 1.078000       1.071000  
1 1 1 21 14 51 o 7.284000 0.7853000 6.784000 1.231000  7.785000 0.9756000 -1.001000      1.571000  
1 1 1 21 14 53 o 8.375000 0.7560000 7.735000 1.227000  9.014000 0.8828000 -1.279000      1.512000  
1 1 1 21 14 55 o 4.168000 1.061000  3.481000 1.380000  4.854000 1.613000  -1.374000      2.122000  
1 1 1 21 14 57 o 4.116000 1.058000  3.533000 1.387000  4.698000 1.598000  -1.166000      2.116000  
1 1 1 21 14 59 o 3.636000 0.9873000 4.364000 1.481000  2.907000 1.306000  1.457000       1.975000  
1 1 1 21 15 0  o 59.94000 0.7102000 59.94000 0.7102000 59.94000 0.7102000 0.000000       0.000000  
1 1 1 21 15 2  f 35.94000 0.2970000 35.47000 0.4172000 36.40000 0.4228000 -0.9318000     0.5940000 
1 1 1 21 15 4  o 17.00000 0.2757000 17.10000 0.3821000 16.91000 0.3974000 0.1841000      0.5513000 
1 1 1 21 15 6  o 6.477000 0.6264000 6.270000 1.041000  6.685000 0.6967000 -0.4144000     1.253000  
1 1 1 21 15 8  o 62.21000 0.4472000 62.17000 0.6317000 62.26000 0.6331000 -0.9127000E-01 0.8944000 
1 1 1 21 15 10 o 20.95000 0.2541000 21.11000 0.3638000 20.79000 0.3549000 0.3195000      0.5083000 
1 1 1 21 15 12 o 68.99000 0.4915000 68.46000 0.6894000 69.52000 0.7006000 -1.058000      0.9830000 
1 1 1 21 15 14 f 58.64000 0.4625000 58.10000 0.5987000 59.18000 0.7051000 -1.083000      0.9250000 
1 1 1 21 15 16 o 46.55000 0.3913000 46.01000 0.5950000 47.09000 0.5082000 -1.078000      0.7825000 
1 1 1 21 15 18 o 9.638000 0.4871000 10.04000 0.6256000 9.234000 0.7468000 0.8086000      0.9742000 
1 1 1 21 15 20 o 15.44000 0.3222000 15.02000 0.3708000 15.86000 0.5271000 -0.8357000     0.6445000 
1 1 1 21 15 22 o 26.93000 0.4790000 26.66000 0.3480000 27.20000 0.8925000 -0.5347000     0.9579000 
1 1 1 21 15 24 o 25.10000 0.4504000 25.10000 0.4504000 ?        ?         ?              ?         
1 1 1 21 15 26 o 30.94000 0.3154000 30.60000 0.3728000 31.27000 0.5088000 -0.6720000     0.6307000 
1 1 1 21 15 28 o 11.03000 0.5514000 10.42000 0.6123000 11.64000 0.9173000 -1.216000      1.103000  
1 1 1 21 15 30 o 32.56000 0.3292000 32.86000 0.3938000 32.26000 0.5276000 0.6031000      0.6584000 
1 1 1 21 15 32 f 11.22000 0.4920000 11.29000 0.5796000 11.14000 0.7953000 0.1432000      0.9841000 
1 1 1 21 15 34 o 37.14000 0.3474000 37.15000 0.4189000 37.12000 0.5542000 0.2982000E-01  0.6948000 
1 1 1 21 15 36 o 4.151000 0.9569000 5.019000 1.315000  3.282000 1.390000  1.737000       1.914000  
1 1 1 21 15 38 o 14.59000 0.3900000 15.74000 0.5071000 13.45000 0.5928000 2.289000       0.7801000 
1 1 1 21 15 40 o 15.74000 0.5033000 15.13000 0.6510000 16.36000 0.7679000 -1.224000      1.007000  
1 1 1 21 15 42 o 7.309000 0.7764000 7.917000 0.8504000 6.702000 1.299000  1.215000       1.553000  
1 1 1 21 15 44 o 6.643000 0.7333000 6.528000 1.060000  6.758000 1.014000  -0.2301000     1.467000  
1 1 1 21 15 46 o 5.762000 0.8553000 6.947000 1.074000  4.577000 1.331000  2.370000       1.711000  
1 1 1 21 15 48 o 5.293000 0.9137000 5.465000 1.328000  5.121000 1.255000  0.3433000      1.827000  
1 1 1 21 15 50 f 11.70000 0.5533000 11.78000 0.8987000 11.63000 0.6458000 0.1475000      1.107000  
1 1 1 21 15 52 o 2.748000 0.8954000 2.710000 1.295000  2.785000 1.236000  -0.7548000E-01 1.791000  
1 1 1 21 15 54 o 5.888000 1.110000  6.064000 1.409000  5.711000 1.717000  0.3533000      2.221000  
1 1 1 21 15 56 o 3.575000 0.9602000 3.220000 1.348000  3.930000 1.368000  -0.7098000     1.920000  
1 1 1 21 15 58 o 3.637000 1.003000  3.651000 1.428000  3.622000 1.407000  0.2856000E-01  2.005000  
1 1 1 21 16 1  o 68.97000 0.5662000 67.88000 0.7943000 70.06000 0.8070000 -2.179000      1.132000  
1 1 1 21 16 3  f 47.62000 0.3591000 47.24000 0.5040000 47.99000 0.5117000 -0.7567000     0.7182000 
1 1 1 21 16 5  o 13.69000 0.3410000 13.21000 0.5559000 14.17000 0.3952000 -0.9567000     0.6820000 
1 1 1 21 16 7  o 32.31000 0.2808000 32.65000 0.3994000 31.98000 0.3948000 0.6695000      0.5616000 
1 1 1 21 16 9  o 50.82000 0.3805000 51.04000 0.5398000 50.59000 0.5363000 0.4431000      0.7610000 
1 1 1 21 16 11 o 29.58000 0.2718000 29.50000 0.3847000 29.65000 0.3840000 -0.1529000     0.5436000 
1 1 1 21 16 13 o 68.82000 0.5323000 68.69000 0.6929000 68.94000 0.8083000 -0.2507000     1.065000  
1 1 1 21 16 15 o 59.43000 0.4326000 59.29000 0.6101000 59.56000 0.6135000 -0.2699000     0.8652000 
1 1 1 21 16 17 o 16.32000 0.3197000 16.16000 0.3901000 16.47000 0.5067000 -0.3098000     0.6394000 
1 1 1 21 16 19 f 49.81000 0.4123000 50.02000 0.5396000 49.60000 0.6234000 0.4241000      0.8245000 
1 1 1 21 16 21 o 63.07000 0.5430000 62.91000 0.5754000 63.23000 0.9211000 -0.3171000     1.086000  
1 1 1 21 16 23 o 37.45000 0.3803000 37.35000 0.3966000 37.55000 0.6491000 -0.1926000     0.7606000 
1 1 1 21 16 25 o 41.78000 0.3768000 40.98000 0.4783000 42.59000 0.5824000 -1.606000      0.7536000 
1 1 1 21 16 27 o 17.28000 0.3936000 17.58000 0.4117000 16.97000 0.6710000 0.6089000      0.7872000 
1 1 1 21 16 29 o 26.09000 0.3211000 25.92000 0.3777000 26.26000 0.5194000 -0.3391000     0.6422000 
1 1 1 21 16 31 o 11.05000 0.4942000 11.57000 0.5813000 10.54000 0.7994000 1.027000       0.9884000 
1 1 1 21 16 33 o 8.082000 0.6744000 8.394000 0.7734000 7.770000 1.105000  0.6235000      1.349000  
1 1 1 21 16 35 o 17.00000 0.3764000 17.37000 0.4442000 16.63000 0.6077000 0.7435000      0.7527000 
1 1 1 21 16 37 o 14.42000 0.4185000 14.15000 0.6494000 14.69000 0.5281000 -0.5440000     0.8370000 
1 1 1 21 16 39 o 11.26000 0.4592000 11.06000 0.6642000 11.46000 0.6342000 -0.3950000     0.9183000 
1 1 1 21 16 41 o 15.77000 0.4002000 15.32000 0.5287000 16.22000 0.6010000 -0.9022000     0.8004000 
1 1 1 21 16 43 o 17.16000 0.3466000 16.50000 0.4718000 17.82000 0.5078000 -1.316000      0.6931000 
1 1 1 21 16 45 o 14.08000 0.3924000 14.09000 0.5511000 14.07000 0.5587000 0.2064000E-01  0.7848000 
1 1 1 21 16 47 o 8.269000 0.6059000 8.801000 0.8172000 7.737000 0.8947000 1.064000       1.212000  
1 1 1 21 16 49 o 7.411000 0.7113000 6.984000 1.072000  7.838000 0.9351000 -0.8542000     1.423000  
1 1 1 21 16 51 o 4.026000 1.045000  4.026000 1.469000  4.026000 1.487000  -0.5226000E-03 2.090000  
1 1 1 21 16 53 o 9.817000 0.7468000 9.110000 1.332000  10.52000 0.6748000 -1.413000      1.494000  
1 1 1 21 16 55 o 7.113000 0.7651000 6.880000 1.113000  7.346000 1.050000  -0.4660000     1.530000  
1 1 1 21 16 57 o 3.962000 1.029000  4.034000 1.503000  3.890000 1.406000  0.1449000      2.058000  
1 1 1 21 17 0  o 52.60000 0.5504000 52.60000 0.5504000 52.60000 0.5504000 0.000000       0.000000  
1 1 1 21 17 2  o 11.35000 0.3570000 11.14000 0.5633000 11.56000 0.4387000 -0.4213000     0.7140000 
1 1 1 21 17 4  o 30.76000 0.3067000 30.98000 0.4737000 30.53000 0.3898000 0.4483000      0.6134000 
1 1 1 21 17 6  o 16.62000 0.2668000 16.71000 0.3910000 16.53000 0.3630000 0.1811000      0.5335000 
1 1 1 21 17 8  o 53.14000 0.4286000 53.14000 0.6532000 53.14000 0.5551000 -0.1919000E-02 0.8572000 
1 1 1 21 17 10 o 66.13000 0.4726000 65.90000 0.6667000 66.36000 0.6700000 -0.4601000     0.9453000 
1 1 1 21 17 12 o 33.62000 0.3197000 34.12000 0.4105000 33.12000 0.4901000 1.001000       0.6393000 
1 1 1 21 17 14 o 59.86000 0.4716000 59.78000 0.6149000 59.95000 0.7153000 -0.1605000     0.9432000 
1 1 1 21 17 16 o 17.24000 0.3184000 16.89000 0.4026000 17.60000 0.4934000 -0.7071000     0.6368000 
1 1 1 21 17 18 f 43.39000 0.3552000 43.77000 0.4289000 43.00000 0.5665000 0.7712000      0.7105000 
1 1 1 21 17 20 o 24.34000 0.3447000 23.60000 0.3868000 25.07000 0.5706000 -1.468000      0.6894000 
1 1 1 21 17 22 o 33.96000 0.3805000 33.20000 0.4294000 34.72000 0.6282000 -1.521000      0.7609000 
1 1 1 21 17 24 o 49.28000 0.3948000 49.81000 0.4812000 48.74000 0.6261000 1.072000       0.7897000 
1 1 1 21 17 26 o 10.37000 0.5316000 9.848000 0.7288000 10.88000 0.7741000 -1.035000      1.063000  
1 1 1 21 17 28 o 25.61000 0.4936000 25.91000 0.3595000 25.32000 0.9195000 0.5906000      0.9873000 
1 1 1 21 17 30 o 8.331000 0.5675000 7.717000 0.6997000 8.946000 0.8938000 -1.228000      1.135000  
1 1 1 21 17 32 o 20.44000 0.3365000 20.66000 0.3883000 20.22000 0.5498000 0.4368000      0.6731000 
1 1 1 21 17 34 o 17.78000 0.3614000 17.97000 0.4308000 17.59000 0.5804000 0.3878000      0.7227000 
1 1 1 21 17 36 o 4.619000 1.050000  3.645000 1.563000  5.593000 1.401000  -1.948000      2.099000  
1 1 1 21 17 38 o 11.93000 0.4695000 11.93000 0.7059000 11.93000 0.6191000 -0.4495000E-02 0.9390000 
1 1 1 21 17 40 o 18.84000 0.4357000 19.82000 0.4586000 17.85000 0.7410000 1.974000       0.8714000 
1 1 1 21 17 42 o 13.60000 0.4235000 14.21000 0.6066000 13.00000 0.5912000 1.208000       0.8471000 
1 1 1 21 17 44 o 11.39000 0.4609000 11.71000 0.6151000 11.06000 0.6866000 0.6456000      0.9218000 
1 1 1 21 17 46 o 4.263000 0.9387000 4.782000 1.310000  3.745000 1.345000  1.036000       1.877000  
1 1 1 21 17 48 o 2.805000 0.8575000 2.687000 1.214000  2.923000 1.211000  -0.2359000     1.715000  
1 1 1 21 17 50 o 11.98000 0.4827000 12.60000 0.6542000 11.37000 0.7101000 1.224000       0.9655000 
1 1 1 21 17 52 o 6.900000 0.8675000 6.304000 1.244000  7.496000 1.210000  -1.192000      1.735000  
1 1 1 21 17 54 o 7.594000 0.7410000 7.963000 1.020000  7.226000 1.075000  0.7373000      1.482000  
1 1 1 21 17 56 o 10.18000 0.5477000 9.941000 0.8057000 10.42000 0.7421000 -0.4775000     1.095000  
1 1 1 21 17 58 f 7.706000 0.8203000 9.162000 1.072000  6.249000 1.242000  2.913000       1.641000  
1 1 1 21 18 1  o 24.55000 0.2534000 24.38000 0.3583000 24.73000 0.3585000 -0.3515000     0.5069000 
1 1 1 21 18 3  o 46.06000 0.3832000 46.24000 0.5860000 45.88000 0.4940000 0.3664000      0.7664000 
1 1 1 21 18 5  o 11.95000 0.3087000 12.28000 0.4371000 11.62000 0.4360000 0.6636000      0.6174000 
1 1 1 21 18 7  o 81.77000 0.5727000 81.64000 0.8087000 81.90000 0.8110000 -0.2540000     1.145000  
1 1 1 21 18 9  o 58.13000 0.4231000 58.09000 0.5979000 58.17000 0.5988000 -0.7727000E-01 0.8462000 
1 1 1 21 18 11 o 5.300000 0.5922000 5.344000 0.8592000 5.256000 0.8153000 0.8764000E-01  1.184000  
1 1 1 21 18 13 f 18.18000 0.2834000 18.38000 0.3960000 17.98000 0.4056000 0.4038000      0.5669000 
1 1 1 21 18 15 o 31.54000 0.3079000 31.49000 0.3808000 31.60000 0.4841000 -0.1077000     0.6159000 
1 1 1 21 18 17 f 16.18000 0.3568000 16.76000 0.3225000 15.60000 0.6365000 1.157000       0.7135000 
1 1 1 21 18 19 o 22.04000 0.2913000 21.84000 0.3185000 22.25000 0.4879000 -0.4116000     0.5827000 
1 1 1 21 18 21 o 56.19000 0.5138000 56.29000 0.5940000 56.10000 0.8384000 0.1843000      1.028000  
1 1 1 21 18 23 o 24.08000 0.3283000 23.49000 0.4292000 24.67000 0.4968000 -1.177000      0.6566000 
1 1 1 21 18 25 o 12.39000 0.4166000 12.03000 0.4750000 12.75000 0.6844000 -0.7189000     0.8331000 
1 1 1 21 18 27 o 10.94000 0.5805000 11.12000 0.5860000 10.77000 1.002000  0.3509000      1.161000  
1 1 1 21 18 29 o 11.92000 0.4536000 11.57000 0.5225000 12.28000 0.7417000 -0.7105000     0.9073000 
1 1 1 21 18 31 o 17.17000 0.4131000 17.34000 0.4189000 16.99000 0.7121000 0.3523000      0.8262000 
1 1 1 21 18 33 o 8.800000 0.5931000 8.852000 0.6822000 8.748000 0.9705000 0.1036000      1.186000  
1 1 1 21 18 35 o 17.29000 0.3678000 16.84000 0.4702000 17.73000 0.5658000 -0.8954000     0.7356000 
1 1 1 21 18 37 o 10.96000 0.4724000 11.17000 0.5386000 10.75000 0.7762000 0.4214000      0.9448000 
1 1 1 21 18 39 o 7.742000 0.8205000 7.151000 1.081000  8.334000 1.234000  -1.183000      1.641000  
1 1 1 21 18 41 o 10.70000 0.5270000 10.19000 0.8322000 11.20000 0.6469000 -1.011000      1.054000  
1 1 1 21 18 43 o 4.868000 0.9234000 5.657000 1.246000  4.080000 1.363000  1.577000       1.847000  
1 1 1 21 18 45 o 6.831000 0.7289000 7.164000 1.034000  6.499000 1.027000  0.6651000      1.458000  
1 1 1 21 18 47 o 3.069000 0.9002000 3.671000 1.408000  2.467000 1.122000  1.204000       1.800000  
1 1 1 21 18 49 o 4.286000 0.9500000 3.406000 1.395000  5.166000 1.290000  -1.760000      1.900000  
1 1 1 21 18 51 o 7.077000 1.017000  7.906000 1.204000  6.248000 1.640000  1.658000       2.035000  
1 1 1 21 18 53 o 5.849000 0.9248000 6.115000 1.310000  5.583000 1.305000  0.5328000      1.850000  
1 1 1 21 18 55 f 6.044000 0.9579000 5.462000 1.356000  6.627000 1.354000  -1.166000      1.916000  
1 1 1 21 18 57 o 9.373000 0.6045000 10.22000 0.8916000 8.525000 0.8165000 1.697000       1.209000  
1 1 1 21 19 0  o 46.73000 0.5012000 46.73000 0.5012000 46.73000 0.5012000 0.000000       0.000000  
1 1 1 21 19 2  o 19.26000 0.3647000 18.93000 0.6348000 19.59000 0.3593000 -0.6512000     0.7294000 
1 1 1 21 19 4  o 65.09000 0.4665000 65.31000 0.6619000 64.87000 0.6575000 0.4407000      0.9330000 
1 1 1 21 19 6  o 19.71000 0.2487000 19.44000 0.3525000 19.97000 0.3508000 -0.5233000     0.4973000 
1 1 1 21 19 8  o 29.00000 0.2674000 29.30000 0.3800000 28.70000 0.3762000 0.5997000      0.5348000 
1 1 1 21 19 10 o 39.71000 0.3439000 39.40000 0.4438000 40.01000 0.5255000 -0.6049000     0.6878000 
1 1 1 21 19 12 o 11.35000 0.3210000 10.94000 0.4744000 11.76000 0.4326000 -0.8191000     0.6421000 
1 1 1 21 19 14 o 46.36000 0.6022000 45.63000 0.5680000 47.08000 1.062000  -1.449000      1.204000  
1 1 1 21 19 16 o 55.07000 0.5025000 55.21000 0.5793000 54.93000 0.8213000 0.2743000      1.005000  
1 1 1 21 19 18 o 16.85000 0.2964000 16.15000 0.3033000 17.56000 0.5093000 -1.410000      0.5927000 
1 1 1 21 19 20 o 19.51000 0.3558000 19.60000 0.3824000 19.42000 0.6001000 0.1809000      0.7116000 
1 1 1 21 19 22 f 20.76000 0.3103000 20.94000 0.3546000 20.57000 0.5093000 0.3694000      0.6206000 
1 1 1 21 19 24 o 38.38000 0.3554000 38.40000 0.4558000 38.35000 0.5454000 0.4548000E-01  0.7108000 
1 1 1 21 19 26 o 35.09000 0.3303000 34.89000 0.3840000 35.29000 0.5376000 -0.3987000     0.6607000 
1 1 1 21 19 28 o 14.57000 0.4079000 14.88000 0.5255000 14.26000 0.6240000 0.6181000      0.8158000 
1 1 1 21 19 30 o 42.44000 0.3814000 43.15000 0.4910000 41.73000 0.5836000 1.428000       0.7627000 
1 1 1 21 19 32 o 9.705000 0.6269000 9.264000 0.6755000 10.15000 1.056000  -0.8818000     1.254000  
1 1 1 21 19 34 f 16.06000 0.3674000 16.24000 0.4401000 15.87000 0.5884000 0.3632000      0.7348000 
1 1 1 21 19 36 o 17.58000 0.3598000 17.66000 0.4168000 17.50000 0.5865000 0.1607000      0.7195000 
1 1 1 21 19 38 o 4.936000 0.9781000 3.558000 1.357000  6.314000 1.409000  -2.756000      1.956000  
1 1 1 21 19 40 o 9.244000 0.5981000 8.633000 0.8072000 9.854000 0.8827000 -1.220000      1.196000  
1 1 1 21 19 42 o 6.410000 0.9223000 6.940000 1.422000  5.880000 1.175000  1.060000       1.845000  
1 1 1 21 19 44 o 4.789000 0.9147000 4.527000 1.336000  5.050000 1.249000  -0.5227000     1.829000  
1 1 1 21 19 46 o 9.235000 0.5457000 9.252000 0.7905000 9.217000 0.7525000 0.3458000E-01  1.091000  
1 1 1 21 19 48 o 3.976000 0.9700000 4.033000 1.405000  3.919000 1.337000  0.1139000      1.940000  
1 1 1 21 19 50 o 4.130000 1.018000  4.456000 1.435000  3.804000 1.444000  0.6517000      2.036000  
1 1 1 21 19 52 o 5.944000 1.082000  5.522000 1.787000  6.366000 1.222000  -0.8435000     2.165000  
1 1 1 21 19 54 o 12.25000 0.6846000 12.17000 1.050000  12.34000 0.8793000 -0.1742000     1.369000  
1 1 1 21 19 56 o 3.080000 0.8990000 4.017000 1.474000  2.143000 1.029000  1.875000       1.798000  
1 1 1 21 20 1  o 35.34000 0.3250000 35.21000 0.4992000 35.47000 0.4163000 -0.2652000     0.6500000 
1 1 1 21 20 3  o 46.57000 0.3839000 46.68000 0.5827000 46.46000 0.5000000 0.2285000      0.7678000 
1 1 1 21 20 5  o 35.37000 0.2940000 35.69000 0.4176000 35.06000 0.4139000 0.6328000      0.5879000 
1 1 1 21 20 7  o 50.50000 0.3777000 50.44000 0.5339000 50.56000 0.5345000 -0.1272000     0.7554000 
1 1 1 21 20 9  o 6.724000 0.4250000 6.189000 0.6331000 7.259000 0.5672000 -1.070000      0.8500000 
1 1 1 21 20 11 o 34.95000 0.3122000 35.29000 0.4697000 34.61000 0.4115000 0.6840000      0.6245000 
1 1 1 21 20 13 o 24.20000 0.4825000 23.99000 0.3574000 24.42000 0.8965000 -0.4247000     0.9651000 
1 1 1 21 20 15 f 19.99000 0.2802000 20.04000 0.2867000 19.94000 0.4816000 0.9916000E-01  0.5605000 
1 1 1 21 20 17 o 12.86000 0.3531000 13.42000 0.3033000 12.31000 0.6378000 1.116000       0.7062000 
1 1 1 21 20 19 o 25.49000 0.3461000 24.65000 0.3805000 26.33000 0.5782000 -1.682000      0.6921000 
1 1 1 21 20 21 o 24.47000 0.2963000 23.91000 0.3429000 25.02000 0.4833000 -1.110000      0.5926000 
1 1 1 21 20 23 o 21.41000 0.3014000 21.49000 0.3228000 21.33000 0.5091000 0.1621000      0.6028000 
1 1 1 21 20 25 o 35.35000 0.3448000 35.07000 0.4368000 35.63000 0.5336000 -0.5601000     0.6896000 
1 1 1 21 20 27 o 30.51000 0.3719000 30.76000 0.3683000 30.27000 0.6462000 0.4888000      0.7438000 
1 1 1 21 20 29 o 19.16000 0.3599000 20.11000 0.4548000 18.21000 0.5579000 1.896000       0.7198000 
1 1 1 21 20 31 o 16.76000 0.4249000 16.87000 0.6130000 16.65000 0.5885000 0.2164000      0.8498000 
1 1 1 21 20 33 o 10.53000 0.4884000 9.810000 0.6272000 11.26000 0.7488000 -1.447000      0.9768000 
1 1 1 21 20 35 o 15.63000 0.3905000 16.26000 0.5022000 15.00000 0.5982000 1.264000       0.7810000 
1 1 1 21 20 37 o 6.198000 0.9014000 7.129000 0.7760000 5.267000 1.627000  1.862000       1.803000  
1 1 1 21 20 39 o 5.427000 0.8358000 4.913000 1.273000  5.941000 1.084000  -1.028000      1.672000  
1 1 1 21 20 41 o 10.95000 0.4685000 10.44000 0.6571000 11.46000 0.6679000 -1.026000      0.9369000 
1 1 1 21 20 43 o 7.255000 0.7757000 7.005000 1.245000  7.506000 0.9253000 -0.5010000     1.551000  
1 1 1 21 20 45 o 5.209000 0.9192000 6.048000 1.244000  4.371000 1.353000  1.677000       1.838000  
1 1 1 21 20 47 o 2.712000 0.8506000 2.801000 1.235000  2.623000 1.170000  0.1788000      1.701000  
1 1 1 21 20 49 f 3.232000 0.9357000 3.698000 1.441000  2.765000 1.194000  0.9330000      1.871000  
1 1 1 21 20 51 o 9.703000 0.7001000 9.991000 0.8008000 9.414000 1.148000  0.5771000      1.400000  
1 1 1 21 20 53 o 7.547000 0.8743000 7.826000 1.134000  7.268000 1.331000  0.5578000      1.749000  
1 1 1 21 20 55 o 2.993000 0.9423000 3.519000 1.496000  2.468000 1.147000  1.050000       1.885000  
1 1 1 21 20 57 o 4.025000 1.031000  4.718000 1.492000  3.331000 1.425000  1.386000       2.063000  
1 1 1 21 21 0  o 27.02000 0.3680000 27.02000 0.3680000 27.02000 0.3680000 0.000000       0.000000  
1 1 1 21 21 2  o 21.12000 0.2556000 20.80000 0.3732000 21.44000 0.3493000 -0.6361000     0.5112000 
1 1 1 21 21 4  o 18.18000 0.3354000 19.02000 0.5462000 17.34000 0.3892000 1.685000       0.6707000 
1 1 1 21 21 6  o 40.58000 0.3406000 40.37000 0.5073000 40.78000 0.4545000 -0.4068000     0.6812000 
1 1 1 21 21 8  o 7.312000 0.4045000 6.920000 0.5814000 7.703000 0.5626000 -0.7830000     0.8090000 
1 1 1 21 21 10 o 75.34000 0.7564000 75.94000 1.077000  74.74000 1.062000  1.203000       1.513000  
1 1 1 21 21 12 o 40.51000 0.4257000 41.05000 0.5534000 39.97000 0.6470000 1.083000       0.8513000 
1 1 1 21 21 14 o 23.96000 0.3990000 23.90000 0.4984000 24.01000 0.6232000 -0.1048000     0.7980000 
1 1 1 21 21 16 o 14.74000 0.4165000 14.56000 0.6144000 14.93000 0.5624000 -0.3737000     0.8330000 
1 1 1 21 21 18 o 26.01000 0.4893000 26.68000 0.6113000 25.33000 0.7641000 1.347000       0.9785000 
1 1 1 21 21 20 o 28.56000 0.3016000 28.15000 0.3483000 28.97000 0.4925000 -0.8182000     0.6032000 
1 1 1 21 21 22 o 31.74000 0.3105000 31.85000 0.3561000 31.63000 0.5087000 0.2232000      0.6209000 
1 1 1 21 21 24 o 10.81000 0.4180000 10.36000 0.4381000 11.25000 0.7121000 -0.8827000     0.8361000 
1 1 1 21 21 26 f 28.22000 0.3141000 28.50000 0.3544000 27.93000 0.5186000 0.5697000      0.6281000 
1 1 1 21 21 28 o 21.50000 0.3388000 21.46000 0.4210000 21.54000 0.5309000 -0.8040000E-01 0.6775000 
1 1 1 21 21 30 o 17.51000 0.3992000 17.48000 0.5437000 17.54000 0.5846000 -0.6433000E-01 0.7984000 
1 1 1 21 21 32 o 3.641000 0.9074000 4.079000 1.207000  3.202000 1.355000  0.8760000      1.815000  
1 1 1 21 21 34 o 38.68000 0.3668000 38.65000 0.4649000 38.71000 0.5674000 -0.6537000E-01 0.7335000 
1 1 1 21 21 36 o 20.86000 0.3890000 20.90000 0.4189000 20.82000 0.6556000 0.7556000E-01  0.7780000 
1 1 1 21 21 38 o 4.288000 1.007000  3.601000 1.281000  4.975000 1.554000  -1.374000      2.014000  
1 1 1 21 21 40 o 24.10000 0.3204000 24.04000 0.4372000 24.17000 0.4685000 -0.1318000     0.6408000 
1 1 1 21 21 42 o 11.44000 0.4655000 11.83000 0.6666000 11.05000 0.6498000 0.7757000      0.9309000 
1 1 1 21 21 44 o 15.22000 0.4287000 15.23000 0.6661000 15.21000 0.5400000 0.1672000E-01  0.8574000 
1 1 1 21 21 46 o 3.308000 0.9219000 3.454000 1.357000  3.163000 1.248000  0.2906000      1.844000  
1 1 1 21 21 48 o 6.135000 0.8726000 6.741000 1.159000  5.529000 1.305000  1.212000       1.745000  
1 1 1 21 21 50 o 6.821000 1.211000  6.696000 1.330000  6.947000 2.024000  -0.2505000     2.422000  
1 1 1 21 21 52 o 12.80000 0.5402000 11.95000 0.7933000 13.65000 0.7336000 -1.700000      1.080000  
1 1 1 21 21 54 o 10.05000 0.6053000 10.37000 0.8237000 9.742000 0.8872000 0.6242000      1.211000  
1 1 1 21 21 56 o 3.491000 0.9803000 3.874000 1.445000  3.108000 1.325000  0.7663000      1.961000  
1 1 1 21 22 1  o 15.59000 0.3405000 15.16000 0.5625000 16.02000 0.3839000 -0.8595000     0.6810000 
1 1 1 21 22 3  o 42.30000 0.4228000 43.01000 0.6666000 41.60000 0.5203000 1.406000       0.8456000 
1 1 1 21 22 5  o 28.77000 0.3146000 29.48000 0.4772000 28.05000 0.4100000 1.425000       0.6291000 
1 1 1 21 22 7  o 16.43000 0.2606000 16.62000 0.3601000 16.24000 0.3768000 0.3720000      0.5212000 
1 1 1 21 22 9  o 34.70000 0.5301000 35.23000 0.5130000 34.18000 0.9278000 1.048000       1.060000  
1 1 1 21 22 11 o 42.82000 0.4027000 42.64000 0.5671000 43.01000 0.5721000 -0.3706000     0.8055000 
1 1 1 21 22 13 o 24.33000 0.3994000 24.23000 0.4937000 24.44000 0.6280000 -0.2107000     0.7988000 
1 1 1 21 22 15 o 19.89000 0.3866000 20.10000 0.5194000 19.68000 0.5727000 0.4134000      0.7731000 
1 1 1 21 22 17 o 36.06000 0.5529000 35.36000 0.9080000 36.76000 0.6309000 -1.404000      1.106000  
1 1 1 21 22 19 o 32.99000 0.3612000 33.38000 0.5197000 32.60000 0.5017000 0.7804000      0.7223000 
1 1 1 21 22 21 o 30.67000 0.3210000 30.46000 0.4013000 30.89000 0.5012000 -0.4292000     0.6421000 
1 1 1 21 22 23 o 25.79000 0.3009000 25.83000 0.3280000 25.76000 0.5046000 0.7004000E-01  0.6019000 
1 1 1 21 22 25 o 28.06000 0.3295000 27.90000 0.4155000 28.21000 0.5116000 -0.3133000     0.6591000 
1 1 1 21 22 27 o 26.33000 0.4139000 25.67000 0.5228000 26.99000 0.6417000 -1.311000      0.8277000 
1 1 1 21 22 29 o 23.78000 0.3165000 24.40000 0.3561000 23.15000 0.5233000 1.244000       0.6330000 
1 1 1 21 22 31 o 26.33000 0.3417000 25.95000 0.4389000 26.70000 0.5237000 -0.7522000     0.6833000 
1 1 1 21 22 33 o 7.991000 0.6287000 8.032000 0.6866000 7.951000 1.053000  0.8130000E-01  1.257000  
1 1 1 21 22 35 o 7.011000 0.8657000 7.861000 0.6822000 6.161000 1.591000  1.700000       1.731000  
1 1 1 21 22 37 o 2.941000 0.8963000 2.450000 1.069000  3.433000 1.439000  -0.9834000     1.793000  
1 1 1 21 22 39 o 14.04000 0.4049000 14.10000 0.5013000 13.98000 0.6360000 0.1222000      0.8098000 
1 1 1 21 22 41 o 4.356000 0.9582000 3.987000 1.446000  4.724000 1.258000  -0.7368000     1.916000  
1 1 1 21 22 43 o 9.183000 0.5559000 8.945000 0.8252000 9.421000 0.7450000 -0.4763000     1.112000  
1 1 1 21 22 45 o 9.022000 0.5740000 9.329000 0.8076000 8.716000 0.8159000 0.6131000      1.148000  
1 1 1 21 22 47 o 9.358000 0.6191000 8.186000 0.8764000 10.53000 0.8746000 -2.344000      1.238000  
1 1 1 21 22 49 o 4.117000 1.049000  3.512000 1.460000  4.723000 1.508000  -1.211000      2.099000  
1 1 1 21 22 51 o 7.217000 0.8449000 7.064000 1.153000  7.369000 1.235000  -0.3053000     1.690000  
1 1 1 21 22 53 o 6.622000 0.8661000 6.746000 1.201000  6.499000 1.248000  0.2471000      1.732000  
1 1 1 21 22 55 o 3.168000 0.9357000 3.425000 1.410000  2.910000 1.230000  0.5147000      1.871000  
1 1 1 21 23 0  f 28.46000 0.5328000 28.46000 0.5328000 28.46000 0.5328000 0.000000       0.000000  
1 1 1 21 23 2  o 30.09000 0.3018000 30.95000 0.4331000 29.22000 0.4205000 1.727000       0.6037000 
1 1 1 21 23 4  o 35.74000 0.2956000 36.02000 0.4217000 35.46000 0.4142000 0.5596000      0.5911000 
1 1 1 21 23 6  o 19.25000 0.2418000 19.51000 0.3490000 18.99000 0.3346000 0.5213000      0.4835000 
1 1 1 21 23 8  o 29.21000 0.3365000 29.53000 0.4835000 28.89000 0.4682000 0.6416000      0.6730000 
1 1 1 21 23 10 o 39.15000 0.3818000 39.11000 0.5385000 39.20000 0.5415000 -0.8201000E-01 0.7637000 
1 1 1 21 23 12 o 43.45000 0.4071000 43.45000 0.5762000 43.45000 0.5753000 0.6603000E-02  0.8142000 
1 1 1 21 23 14 o 41.12000 0.6022000 41.02000 0.6752000 41.22000 0.9972000 -0.1971000     1.204000  
1 1 1 21 23 16 o 15.49000 0.4524000 15.42000 0.7271000 15.57000 0.5386000 -0.1509000     0.9048000 
1 1 1 21 23 18 o 26.16000 0.3538000 25.97000 0.5184000 26.36000 0.4817000 -0.3927000     0.7077000 
1 1 1 21 23 20 o 23.92000 0.3528000 23.45000 0.5016000 24.39000 0.4964000 -0.9413000     0.7057000 
1 1 1 21 23 22 o 34.76000 0.4324000 34.66000 0.5349000 34.85000 0.6795000 -0.1844000     0.8647000 
1 1 1 21 23 24 o 44.38000 0.3726000 44.25000 0.4417000 44.50000 0.6002000 -0.2429000     0.7452000 
1 1 1 21 23 26 o 26.76000 0.3121000 26.84000 0.3465000 26.67000 0.5191000 0.1645000      0.6241000 
1 1 1 21 23 28 o 9.253000 0.5258000 8.789000 0.5950000 9.717000 0.8672000 -0.9284000     1.052000  
1 1 1 21 23 30 o 17.34000 0.3480000 17.29000 0.4182000 17.39000 0.5563000 -0.1018000     0.6959000 
1 1 1 21 23 32 o 23.57000 0.3602000 23.40000 0.4945000 23.73000 0.5238000 -0.3331000     0.7203000 
1 1 1 21 23 34 f 17.32000 0.3365000 17.68000 0.3862000 16.96000 0.5512000 0.7154000      0.6731000 
1 1 1 21 23 36 o 13.94000 0.4249000 13.65000 0.4508000 14.22000 0.7203000 -0.5684000     0.8497000 
1 1 1 21 23 38 o 9.033000 0.5481000 8.834000 0.6494000 9.233000 0.8830000 -0.3986000     1.096000  
1 1 1 21 23 40 o 16.17000 0.4277000 15.96000 0.4792000 16.38000 0.7086000 -0.4157000     0.8554000 
1 1 1 21 23 42 o 11.34000 0.4951000 11.46000 0.7501000 11.22000 0.6464000 0.2369000      0.9902000 
1 1 1 21 23 44 o 2.421000 0.7924000 2.600000 1.182000  2.241000 1.056000  0.3593000      1.585000  
1 1 1 21 23 46 o 10.39000 0.5928000 10.49000 0.8462000 10.29000 0.8305000 0.1976000      1.186000  
1 1 1 21 23 48 o 11.10000 0.5627000 10.97000 0.7306000 11.23000 0.8560000 -0.2609000     1.125000  
1 1 1 21 23 50 o 7.658000 0.8931000 6.855000 1.200000  8.462000 1.323000  -1.607000      1.786000  
1 1 1 21 23 52 o 10.27000 0.5550000 9.578000 0.8226000 10.97000 0.7452000 -1.388000      1.110000  
1 1 1 21 23 54 o 6.880000 0.9350000 7.326000 1.433000  6.433000 1.201000  0.8930000      1.870000  
1 1 1 21 24 1  o 14.30000 0.2671000 14.47000 0.3709000 14.14000 0.3843000 0.3210000      0.5341000 
1 1 1 21 24 3  o 20.50000 0.2731000 20.60000 0.4282000 20.41000 0.3392000 0.1884000      0.5463000 
1 1 1 21 24 5  o 9.427000 0.3246000 9.273000 0.4712000 9.580000 0.4465000 -0.3065000     0.6491000 
1 1 1 21 24 7  o 17.04000 0.3582000 17.17000 0.5166000 16.92000 0.4964000 0.2423000      0.7164000 
1 1 1 21 24 9  o 23.07000 0.3424000 23.24000 0.4895000 22.91000 0.4790000 0.3339000      0.6849000 
1 1 1 21 24 11 o 39.04000 0.4589000 39.11000 0.6524000 38.98000 0.6455000 0.1244000      0.9178000 
1 1 1 21 24 13 o 56.56000 0.7390000 56.48000 0.8408000 56.63000 1.215000  -0.1534000     1.478000  
1 1 1 21 24 15 o 47.48000 0.4322000 47.44000 0.6119000 47.53000 0.6106000 -0.8992000E-01 0.8644000 
1 1 1 21 24 17 o 31.89000 0.4161000 32.04000 0.6598000 31.74000 0.5070000 0.2995000      0.8321000 
1 1 1 21 24 19 o 42.25000 0.4069000 42.03000 0.5762000 42.48000 0.5748000 -0.4536000     0.8139000 
1 1 1 21 24 21 o 34.22000 0.4306000 33.70000 0.5437000 34.75000 0.6680000 -1.051000      0.8612000 
1 1 1 21 24 23 o 10.11000 0.6334000 9.931000 0.9314000 10.29000 0.8587000 -0.3543000     1.267000  
1 1 1 21 24 25 o 17.75000 0.3544000 17.84000 0.4195000 17.66000 0.5715000 0.1797000      0.7089000 
1 1 1 21 24 27 o 36.30000 0.3918000 36.76000 0.3910000 35.83000 0.6790000 0.9291000      0.7835000 
1 1 1 21 24 29 o 13.67000 0.3837000 13.72000 0.4095000 13.62000 0.6490000 0.9501000E-01  0.7674000 
1 1 1 21 24 31 o 7.783000 0.6898000 8.829000 0.5746000 6.736000 1.254000  2.093000       1.380000  
1 1 1 21 24 33 f 12.88000 0.4297000 12.98000 0.5649000 12.78000 0.6478000 0.1999000      0.8595000 
1 1 1 21 24 35 o 22.63000 0.3538000 23.13000 0.3684000 22.13000 0.6042000 0.9939000      0.7077000 
1 1 1 21 24 37 f 4.295000 0.9242000 4.519000 1.165000  4.070000 1.435000  0.4494000      1.848000  
1 1 1 21 24 39 o 10.96000 0.4828000 10.65000 0.6343000 11.26000 0.7280000 -0.6122000     0.9656000 
1 1 1 21 24 41 o 8.217000 0.6133000 8.177000 0.9021000 8.257000 0.8311000 -0.8045000E-01 1.227000  
1 1 1 21 24 43 o 7.127000 0.8049000 7.109000 1.156000  7.145000 1.121000  -0.3618000E-01 1.610000  
1 1 1 21 24 45 o 3.034000 0.9027000 2.841000 1.253000  3.227000 1.299000  -0.3860000     1.805000  
1 1 1 21 24 47 o 8.988000 0.6559000 9.110000 0.9094000 8.865000 0.9455000 0.2452000      1.312000  
1 1 1 21 24 49 o 5.218000 1.087000  4.543000 1.438000  5.894000 1.631000  -1.351000      2.175000  
1 1 1 21 24 51 o 6.067000 0.9700000 5.074000 1.529000  7.061000 1.195000  -1.987000      1.940000  
1 1 1 21 24 53 o 6.930000 0.8093000 6.004000 1.334000  7.855000 0.9170000 -1.851000      1.619000  
1 1 1 21 24 55 o 3.787000 1.037000  4.904000 1.677000  2.670000 1.220000  2.233000       2.073000  
1 1 1 21 25 0  o 29.49000 0.4648000 29.49000 0.4648000 29.49000 0.4648000 0.000000       0.000000  
1 1 1 21 25 2  o 30.37000 0.2742000 30.58000 0.3899000 30.17000 0.3856000 0.4098000      0.5484000 
1 1 1 21 25 4  o 28.31000 0.2877000 27.97000 0.4380000 28.65000 0.3731000 -0.6825000     0.5753000 
1 1 1 21 25 6  o 14.31000 0.3850000 13.87000 0.5715000 14.75000 0.5162000 -0.8806000     0.7701000 
1 1 1 21 25 8  o 11.53000 0.5254000 11.45000 0.7871000 11.61000 0.6963000 -0.1682000     1.051000  
1 1 1 21 25 10 o 5.440000 0.9918000 4.315000 1.572000  6.565000 1.210000  -2.249000      1.984000  
1 1 1 21 25 12 o 12.76000 0.4672000 12.44000 0.7037000 13.09000 0.6147000 -0.6464000     0.9343000 
1 1 1 21 25 14 o 20.83000 0.3651000 20.88000 0.5287000 20.78000 0.5037000 0.9730000E-01  0.7302000 
1 1 1 21 25 16 o 41.66000 0.4520000 41.56000 0.7048000 41.75000 0.5659000 -0.1887000     0.9039000 
1 1 1 21 25 18 o 11.43000 0.5348000 11.26000 0.8165000 11.61000 0.6908000 -0.3426000     1.070000  
1 1 1 21 25 20 o 11.10000 0.5421000 10.92000 0.8060000 11.28000 0.7252000 -0.3644000     1.084000  
1 1 1 21 25 22 o 27.86000 0.3685000 27.86000 0.5382000 27.87000 0.5036000 -0.1025000E-01 0.7371000 
1 1 1 21 25 24 o 22.32000 0.3844000 21.91000 0.5584000 22.73000 0.5285000 -0.8163000     0.7688000 
1 1 1 21 25 26 o 36.61000 0.4113000 35.92000 0.4472000 37.29000 0.6904000 -1.373000      0.8226000 
1 1 1 21 25 28 o 36.16000 0.3355000 36.28000 0.3884000 36.04000 0.5472000 0.2388000      0.6710000 
1 1 1 21 25 30 f 31.19000 0.3712000 30.43000 0.3693000 31.95000 0.6439000 -1.518000      0.7423000 
1 1 1 21 25 32 o 9.429000 0.5388000 9.788000 0.5622000 9.071000 0.9194000 0.7171000      1.078000  
1 1 1 21 25 34 o 2.573000 0.8092000 2.776000 1.173000  2.370000 1.115000  0.4057000      1.618000  
1 1 1 21 25 36 o 25.17000 0.3243000 25.07000 0.3731000 25.28000 0.5306000 -0.2107000     0.6486000 
1 1 1 21 25 38 o 16.41000 0.4189000 15.89000 0.4293000 16.92000 0.7194000 -1.029000      0.8378000 
1 1 1 21 25 40 o 3.254000 0.9070000 3.008000 1.247000  3.499000 1.318000  -0.4907000     1.814000  
1 1 1 21 25 42 o 3.631000 0.9390000 3.993000 1.383000  3.269000 1.271000  0.7234000      1.878000  
1 1 1 21 25 44 o 5.210000 1.119000  4.893000 1.513000  5.526000 1.649000  -0.6326000     2.238000  
1 1 1 21 25 46 o 8.241000 0.8239000 8.609000 1.279000  7.874000 1.039000  0.7348000      1.648000  
1 1 1 21 25 48 o 10.08000 0.5578000 10.45000 0.7573000 9.717000 0.8193000 0.7281000      1.116000  
1 1 1 21 25 50 o 10.29000 0.5638000 9.450000 0.8389000 11.13000 0.7536000 -1.681000      1.128000  
1 1 1 21 25 52 o 5.120000 0.9688000 4.202000 1.458000  6.039000 1.276000  -1.837000      1.938000  
1 1 1 21 25 54 o 3.328000 0.9773000 3.580000 1.446000  3.076000 1.315000  0.5046000      1.955000  
1 1 1 21 26 1  o 26.19000 0.3619000 26.30000 0.5159000 26.08000 0.5076000 0.2158000      0.7237000 
1 1 1 21 26 3  o 20.17000 0.3350000 20.61000 0.4827000 19.73000 0.4645000 0.8789000      0.6699000 
1 1 1 21 26 5  o 28.91000 0.3397000 29.88000 0.5632000 27.93000 0.3801000 1.945000       0.6794000 
1 1 1 21 26 7  o 27.76000 0.3979000 27.18000 0.5565000 28.35000 0.5687000 -1.163000      0.7957000 
1 1 1 21 26 9  o 39.91000 0.4294000 39.86000 0.5469000 39.96000 0.6621000 -0.9268000E-01 0.8588000 
1 1 1 21 26 11 o 45.89000 0.4874000 46.46000 0.6048000 45.32000 0.7644000 1.144000       0.9747000 
1 1 1 21 26 13 o 68.28000 0.6513000 68.03000 0.8092000 68.53000 1.021000  -0.4977000     1.303000  
1 1 1 21 26 15 o 27.15000 0.3585000 27.54000 0.5030000 26.75000 0.5111000 0.7885000      0.7171000 
1 1 1 21 26 17 o 43.72000 0.4739000 43.53000 0.7414000 43.92000 0.5905000 -0.3877000     0.9478000 
1 1 1 21 26 19 o 22.63000 0.3688000 21.57000 0.5283000 23.69000 0.5148000 -2.115000      0.7376000 
1 1 1 21 26 21 o 22.17000 0.3737000 22.07000 0.5417000 22.27000 0.5151000 -0.2029000     0.7475000 
1 1 1 21 26 23 o 17.99000 0.4230000 18.23000 0.6158000 17.76000 0.5801000 0.4673000      0.8460000 
1 1 1 21 26 25 o 17.68000 0.4255000 17.23000 0.6207000 18.12000 0.5820000 -0.8852000     0.8509000 
1 1 1 21 26 27 o 13.22000 0.4837000 12.83000 0.7127000 13.60000 0.6540000 -0.7695000     0.9673000 
1 1 1 21 26 29 o 20.50000 0.3933000 20.33000 0.4301000 20.66000 0.6586000 -0.3278000     0.7866000 
1 1 1 21 26 31 o 36.07000 0.3545000 35.71000 0.4480000 36.42000 0.5494000 -0.7125000     0.7089000 
1 1 1 21 26 33 o 15.27000 0.3680000 15.06000 0.4361000 15.47000 0.5929000 -0.4077000     0.7360000 
1 1 1 21 26 35 o 8.683000 0.6479000 8.136000 0.7899000 9.230000 1.027000  -1.094000      1.296000  
1 1 1 21 26 37 o 8.623000 0.5564000 8.593000 0.6233000 8.652000 0.9217000 -0.5881000E-01 1.113000  
1 1 1 21 26 39 o 10.89000 0.5253000 10.79000 0.5256000 11.00000 0.9096000 -0.2119000     1.051000  
1 1 1 21 26 41 o 3.556000 0.8594000 4.651000 1.305000  2.461000 1.118000  2.191000       1.719000  
1 1 1 21 26 43 o 10.98000 0.4786000 10.83000 0.6911000 11.13000 0.6624000 -0.3082000     0.9573000 
1 1 1 21 26 45 o 13.73000 0.4400000 13.63000 0.6120000 13.83000 0.6323000 -0.2009000     0.8800000 
1 1 1 21 26 47 o 3.464000 0.9768000 2.940000 1.339000  3.989000 1.422000  -1.048000      1.954000  
1 1 1 21 26 49 o 6.382000 1.039000  5.441000 1.402000  7.324000 1.532000  -1.882000      2.077000  
1 1 1 21 26 51 o 12.71000 0.4724000 12.38000 0.6555000 13.03000 0.6805000 -0.6436000     0.9449000 
1 1 1 21 26 53 o 8.589000 0.6448000 8.074000 0.9852000 9.104000 0.8323000 -1.030000      1.290000  
1 1 1 21 27 0  o 21.23000 0.4993000 21.23000 0.4993000 21.23000 0.4993000 0.000000       0.000000  
1 1 1 21 27 2  o 9.664000 0.3756000 10.22000 0.5067000 9.109000 0.5547000 1.110000       0.7512000 
1 1 1 21 27 4  o 19.24000 0.3665000 18.79000 0.6742000 19.69000 0.2875000 -0.9040000     0.7329000 
1 1 1 21 27 6  o 33.10000 0.3539000 33.10000 0.5040000 33.10000 0.4971000 -0.1717000E-02 0.7079000 
1 1 1 21 27 8  o 13.77000 0.4258000 13.88000 0.6195000 13.67000 0.5844000 0.2078000      0.8517000 
1 1 1 21 27 10 o 51.63000 0.4604000 51.84000 0.6520000 51.42000 0.6503000 0.4121000      0.9209000 
1 1 1 21 27 12 o 6.596000 0.9130000 6.014000 1.462000  7.177000 1.095000  -1.163000      1.826000  
1 1 1 21 27 14 o 4.738000 1.041000  5.698000 1.478000  3.779000 1.465000  1.920000       2.081000  
1 1 1 21 27 16 o 51.72000 0.5207000 50.87000 0.7980000 52.57000 0.6691000 -1.700000      1.041000  
1 1 1 21 27 18 o 60.72000 0.5253000 60.39000 0.7415000 61.05000 0.7442000 -0.6563000     1.051000  
1 1 1 21 27 20 o 19.67000 0.4340000 19.11000 0.6927000 20.23000 0.5230000 -1.116000      0.8680000 
1 1 1 21 27 22 o 20.93000 0.3864000 20.34000 0.5681000 21.53000 0.5240000 -1.187000      0.7728000 
1 1 1 21 27 24 o 35.46000 0.4371000 34.81000 0.5590000 36.11000 0.6722000 -1.307000      0.8742000 
1 1 1 21 27 26 o 33.78000 0.4276000 34.06000 0.5364000 33.49000 0.6660000 0.5672000      0.8551000 
1 1 1 21 27 28 o 9.441000 0.6775000 9.377000 0.8697000 9.506000 1.039000  -0.1292000     1.355000  
1 1 1 21 27 30 o 24.51000 0.4058000 25.16000 0.6313000 23.86000 0.5101000 1.294000       0.8116000 
1 1 1 21 27 32 o 21.63000 0.3152000 21.31000 0.3662000 21.96000 0.5132000 -0.6591000     0.6304000 
1 1 1 21 27 34 o 9.856000 0.5454000 9.786000 0.5266000 9.926000 0.9554000 -0.1399000     1.091000  
1 1 1 21 27 36 o 12.89000 0.4141000 12.85000 0.5354000 12.92000 0.6317000 -0.6430000E-01 0.8281000 
1 1 1 21 27 38 o 7.150000 0.7635000 6.923000 0.8049000 7.378000 1.298000  -0.4555000     1.527000  
1 1 1 21 27 40 o 6.257000 0.7540000 5.874000 1.140000  6.641000 0.9869000 -0.7666000     1.508000  
1 1 1 21 27 42 o 9.709000 0.5093000 9.529000 0.7182000 9.889000 0.7223000 -0.3600000     1.019000  
1 1 1 21 27 44 o 7.862000 0.7280000 7.744000 0.9496000 7.979000 1.104000  -0.2351000     1.456000  
1 1 1 21 27 46 o 5.728000 0.9276000 6.649000 1.236000  4.806000 1.383000  1.843000       1.855000  
1 1 1 21 27 48 o 12.79000 0.5826000 12.74000 0.7680000 12.85000 0.8764000 -0.1094000     1.165000  
1 1 1 21 27 50 o 5.110000 1.006000  4.611000 1.520000  5.609000 1.320000  -0.9987000     2.013000  
1 1 1 21 27 52 o 3.995000 0.9770000 3.428000 1.373000  4.561000 1.390000  -1.133000      1.954000  
1 1 1 21 28 1  o 18.62000 0.3187000 18.34000 0.4628000 18.89000 0.4383000 -0.5529000     0.6374000 
1 1 1 21 28 3  o 9.086000 0.4263000 8.363000 0.7649000 9.809000 0.3764000 -1.446000      0.8525000 
1 1 1 21 28 5  o 3.819000 0.8847000 2.751000 1.229000  4.886000 1.273000  -2.135000      1.769000  
1 1 1 21 28 7  o 29.76000 0.3519000 30.15000 0.5005000 29.37000 0.4949000 0.7849000      0.7038000 
1 1 1 21 28 9  o 14.61000 0.4364000 14.46000 0.6368000 14.77000 0.5968000 -0.3148000     0.8728000 
1 1 1 21 28 11 o 50.83000 0.4574000 50.73000 0.6419000 50.93000 0.6517000 -0.2005000     0.9148000 
1 1 1 21 28 13 o 8.679000 0.8111000 8.506000 1.025000  8.852000 1.258000  -0.3455000     1.622000  
1 1 1 21 28 15 o 22.43000 0.3708000 22.50000 0.5298000 22.35000 0.5190000 0.1467000      0.7417000 
1 1 1 21 28 17 o 6.480000 0.9233000 6.094000 1.418000  6.865000 1.182000  -0.7708000     1.847000  
1 1 1 21 28 19 o 37.63000 0.3949000 37.75000 0.5665000 37.52000 0.5502000 0.2289000      0.7897000 
1 1 1 21 28 21 f 6.584000 0.9350000 7.844000 1.188000  5.325000 1.444000  2.519000       1.870000  
1 1 1 21 28 23 f 28.81000 0.3701000 28.59000 0.5347000 29.04000 0.5118000 -0.4473000     0.7402000 
1 1 1 21 28 25 o 15.15000 0.4634000 15.16000 0.6735000 15.13000 0.6368000 0.2873000E-01  0.9269000 
1 1 1 21 28 27 o 10.61000 0.6144000 10.92000 0.7635000 10.31000 0.9629000 0.6018000      1.229000  
1 1 1 21 28 29 o 11.90000 0.5990000 12.52000 0.9567000 11.28000 0.7211000 1.240000       1.198000  
1 1 1 21 28 31 o 18.14000 0.4380000 18.74000 0.6969000 17.55000 0.5308000 1.190000       0.8760000 
1 1 1 21 28 33 o 15.25000 0.4019000 15.09000 0.3823000 15.40000 0.7071000 -0.3122000     0.8038000 
1 1 1 21 28 35 o 12.01000 0.4471000 11.44000 0.4637000 12.58000 0.7645000 -1.137000      0.8942000 
1 1 1 21 28 37 o 9.818000 0.5128000 9.174000 0.6476000 10.46000 0.7953000 -1.290000      1.026000  
1 1 1 21 28 39 o 4.939000 0.8353000 3.575000 1.143000  6.304000 1.218000  -2.729000      1.671000  
1 1 1 21 28 41 o 14.06000 0.3906000 13.70000 0.5333000 14.43000 0.5709000 -0.7284000     0.7813000 
1 1 1 21 28 43 o 3.598000 0.9635000 3.905000 1.321000  3.291000 1.403000  0.6134000      1.927000  
1 1 1 21 28 45 o 9.801000 0.5541000 10.01000 0.7907000 9.595000 0.7763000 0.4127000      1.108000  
1 1 1 21 28 47 o 5.217000 0.8903000 3.814000 1.421000  6.621000 1.074000  -2.807000      1.781000  
1 1 1 21 28 49 o 8.494000 0.8323000 7.661000 1.008000  9.328000 1.325000  -1.667000      1.665000  
1 1 1 21 28 51 o 5.081000 0.9689000 5.512000 1.304000  4.649000 1.434000  0.8631000      1.938000  
1 1 1 21 28 53 o 3.775000 1.074000  4.386000 1.661000  3.163000 1.364000  1.223000       2.149000  
1 1 1 21 29 0  o 23.55000 0.3863000 23.55000 0.3863000 23.55000 0.3863000 0.000000       0.000000  
1 1 1 21 29 2  o 26.03000 0.2839000 26.26000 0.4686000 25.80000 0.3205000 0.4647000      0.5678000 
1 1 1 21 29 4  o 8.474000 0.7540000 7.814000 1.290000  9.134000 0.7806000 -1.320000      1.508000  
1 1 1 21 29 6  o 35.31000 0.3709000 35.66000 0.5268000 34.95000 0.5222000 0.7089000      0.7418000 
1 1 1 21 29 8  f 14.27000 0.4235000 15.06000 0.5922000 13.48000 0.6056000 1.578000       0.8470000 
1 1 1 21 29 10 o 30.63000 0.3632000 30.71000 0.5134000 30.56000 0.5138000 0.1491000      0.7263000 
1 1 1 21 29 12 o 52.81000 0.4704000 52.44000 0.6577000 53.19000 0.6728000 -0.7536000     0.9409000 
1 1 1 21 29 14 o 32.25000 0.3716000 32.72000 0.5246000 31.77000 0.5264000 0.9534000      0.7432000 
1 1 1 21 29 16 o 9.093000 0.7392000 9.038000 1.169000  9.148000 0.9046000 -0.1106000     1.478000  
1 1 1 21 29 18 o 38.05000 0.4007000 38.41000 0.5621000 37.69000 0.5713000 0.7289000      0.8015000 
1 1 1 21 29 20 o 8.902000 0.6867000 8.308000 1.029000  9.496000 0.9101000 -1.188000      1.373000  
1 1 1 21 29 22 o 17.60000 0.4284000 16.23000 0.6520000 18.96000 0.5558000 -2.737000      0.8567000 
1 1 1 21 29 24 o 30.72000 0.3790000 30.62000 0.5425000 30.82000 0.5294000 -0.1980000     0.7580000 
1 1 1 21 29 26 o 10.61000 0.8063000 10.36000 0.8273000 10.87000 1.384000  -0.5095000     1.613000  
1 1 1 21 29 28 o 19.73000 0.4956000 19.91000 0.8317000 19.56000 0.5392000 0.3511000      0.9912000 
1 1 1 21 29 30 o 4.586000 1.075000  4.817000 1.625000  4.355000 1.408000  0.4622000      2.150000  
1 1 1 21 29 32 o 3.708000 0.9125000 3.059000 1.016000  4.357000 1.516000  -1.298000      1.825000  
1 1 1 21 29 34 o 12.09000 0.4110000 11.44000 0.4735000 12.75000 0.6719000 -1.313000      0.8220000 
1 1 1 21 29 36 o 12.59000 0.3965000 12.24000 0.4569000 12.94000 0.6481000 -0.7040000     0.7929000 
1 1 1 21 29 38 o 7.064000 0.6343000 6.439000 0.7316000 7.689000 1.036000  -1.249000      1.269000  
1 1 1 21 29 40 f 11.65000 0.4419000 10.76000 0.6737000 12.53000 0.5721000 -1.771000      0.8838000 
1 1 1 21 29 42 o 3.590000 0.9579000 2.832000 1.200000  4.349000 1.493000  -1.517000      1.916000  
1 1 1 21 29 44 o 6.419000 0.8207000 7.108000 1.044000  5.730000 1.266000  1.377000       1.641000  
1 1 1 21 29 46 o 9.534000 0.6192000 8.635000 1.019000  10.43000 0.7042000 -1.798000      1.238000  
1 1 1 21 29 48 o 8.832000 0.6619000 8.593000 0.8567000 9.071000 1.009000  -0.4775000     1.324000  
1 1 1 21 29 50 o 3.734000 0.9584000 3.145000 1.277000  4.324000 1.430000  -1.180000      1.917000  
1 1 1 21 29 52 o 4.790000 1.027000  4.193000 1.667000  5.387000 1.200000  -1.195000      2.054000  
1 1 1 21 30 1  o 31.93000 0.3156000 31.43000 0.4859000 32.44000 0.4028000 -1.011000      0.6312000 
1 1 1 21 30 3  o 9.094000 0.4305000 9.241000 0.7541000 8.947000 0.4158000 0.2935000      0.8611000 
1 1 1 21 30 5  o 30.34000 0.3532000 30.59000 0.5003000 30.09000 0.4987000 0.4984000      0.7064000 
1 1 1 21 30 7  o 19.52000 0.3687000 19.87000 0.5273000 19.17000 0.5153000 0.7002000      0.7373000 
1 1 1 21 30 9  o 27.62000 0.3620000 27.25000 0.5088000 27.99000 0.5152000 -0.7356000     0.7241000 
1 1 1 21 30 11 o 31.59000 0.3695000 31.95000 0.5158000 31.23000 0.5292000 0.7171000      0.7389000 
1 1 1 21 30 13 o 12.40000 0.6362000 12.99000 0.7220000 11.80000 1.048000  1.190000       1.272000  
1 1 1 21 30 15 o 30.89000 0.3744000 30.75000 0.5196000 31.03000 0.5393000 -0.2820000     0.7489000 
1 1 1 21 30 17 o 28.98000 0.3771000 29.79000 0.5320000 28.17000 0.5345000 1.621000       0.7541000 
1 1 1 21 30 19 o 23.78000 0.3808000 22.71000 0.5258000 24.86000 0.5510000 -2.150000      0.7616000 
1 1 1 21 30 21 o 46.18000 0.4389000 46.43000 0.6243000 45.94000 0.6171000 0.4852000      0.8778000 
1 1 1 21 30 23 o 19.05000 0.4557000 18.92000 0.5953000 19.18000 0.6902000 -0.2686000     0.9114000 
1 1 1 21 30 25 f 18.24000 0.4621000 17.30000 0.5820000 19.17000 0.7181000 -1.874000      0.9243000 
1 1 1 21 30 27 o 8.617000 0.7165000 8.418000 1.080000  8.816000 0.9424000 -0.3976000     1.433000  
1 1 1 21 30 29 o 4.627000 1.082000  5.108000 1.647000  4.146000 1.405000  0.9617000      2.165000  
1 1 1 21 30 31 o 16.99000 0.4839000 17.56000 0.6626000 16.43000 0.7054000 1.127000       0.9678000 
1 1 1 21 30 33 o 16.54000 0.3693000 16.77000 0.4322000 16.30000 0.5989000 0.4657000      0.7386000 
1 1 1 21 30 35 o 2.486000 0.7586000 2.665000 1.051000  2.307000 1.094000  0.3587000      1.517000  
1 1 1 21 30 37 o 16.53000 0.4201000 15.81000 0.4708000 17.25000 0.6960000 -1.436000      0.8403000 
1 1 1 21 30 39 o 5.867000 0.7850000 6.431000 0.8628000 5.303000 1.312000  1.127000       1.570000  
1 1 1 21 30 41 o 8.865000 0.5976000 7.910000 0.8049000 9.819000 0.8835000 -1.908000      1.195000  
1 1 1 21 30 43 o 3.640000 0.9194000 3.978000 1.285000  3.303000 1.316000  0.6758000      1.839000  
1 1 1 21 30 45 o 3.372000 0.9326000 3.204000 1.303000  3.541000 1.334000  -0.3366000     1.865000  
1 1 1 21 30 47 o 8.142000 0.7464000 7.540000 1.194000  8.743000 0.8960000 -1.203000      1.493000  
1 1 1 21 30 49 o 4.695000 1.001000  3.435000 1.490000  5.955000 1.336000  -2.520000      2.001000  
1 1 1 21 30 51 o 4.666000 1.006000  5.275000 1.550000  4.057000 1.283000  1.219000       2.012000  
1 1 1 21 31 0  o 11.70000 0.4719000 11.70000 0.4719000 11.70000 0.4719000 0.000000       0.000000  
1 1 1 21 31 2  o 6.415000 0.5639000 5.822000 0.9308000 7.008000 0.6370000 -1.185000      1.128000  
1 1 1 21 31 4  o 24.55000 0.4062000 24.35000 0.4819000 24.74000 0.6540000 -0.3867000     0.8124000 
1 1 1 21 31 6  o 22.52000 0.3538000 22.41000 0.5036000 22.63000 0.4970000 -0.2195000     0.7076000 
1 1 1 21 31 8  o 12.54000 0.4917000 12.40000 0.7054000 12.69000 0.6851000 -0.2887000     0.9834000 
1 1 1 21 31 10 o 4.579000 1.036000  4.050000 1.484000  5.108000 1.445000  -1.057000      2.072000  
1 1 1 21 31 12 o 22.96000 0.4411000 23.71000 0.5316000 22.20000 0.7040000 1.506000       0.8822000 
1 1 1 21 31 14 o 38.62000 0.3977000 38.57000 0.5611000 38.68000 0.5637000 -0.1103000     0.7953000 
1 1 1 21 31 16 o 41.31000 0.4705000 41.34000 0.7317000 41.29000 0.5919000 0.4870000E-01  0.9411000 
1 1 1 21 31 18 o 6.867000 0.8777000 7.240000 1.215000  6.494000 1.267000  0.7455000      1.755000  
1 1 1 21 31 20 o 12.49000 0.5080000 12.14000 0.7441000 12.85000 0.6918000 -0.7047000     1.016000  
1 1 1 21 31 22 o 11.30000 0.6199000 11.33000 0.7917000 11.27000 0.9541000 0.5313000E-01  1.240000  
1 1 1 21 31 24 o 15.62000 0.5097000 16.31000 0.8275000 14.93000 0.5952000 1.378000       1.019000  
1 1 1 21 31 26 o 15.50000 0.4738000 14.75000 0.7376000 16.25000 0.5948000 -1.501000      0.9476000 
1 1 1 21 31 28 o 11.28000 0.5958000 11.92000 0.7844000 10.64000 0.8970000 1.276000       1.192000  
1 1 1 21 31 30 o 19.23000 0.4598000 19.17000 0.6403000 19.30000 0.6600000 -0.1341000     0.9196000 
1 1 1 21 31 32 o 9.036000 0.5839000 8.808000 0.7981000 9.265000 0.8525000 -0.4567000     1.168000  
1 1 1 21 31 34 o 15.09000 0.4086000 15.33000 0.5695000 14.84000 0.5860000 0.4842000      0.8172000 
1 1 1 21 31 36 o 12.57000 0.4394000 13.17000 0.4936000 11.98000 0.7271000 1.186000       0.8788000 
1 1 1 21 31 38 o 16.13000 0.3769000 15.53000 0.4943000 16.73000 0.5691000 -1.204000      0.7538000 
1 1 1 21 31 40 o 5.544000 1.006000  6.373000 1.193000  4.715000 1.620000  1.658000       2.012000  
1 1 1 21 31 42 o 9.008000 0.5387000 8.004000 0.7925000 10.01000 0.7300000 -2.006000      1.077000  
1 1 1 21 31 44 o 9.708000 0.5234000 8.759000 0.7656000 10.66000 0.7140000 -1.898000      1.047000  
1 1 1 21 31 46 o 8.216000 0.6618000 8.213000 0.8064000 8.218000 1.049000  -0.4972000E-02 1.324000  
1 1 1 21 31 48 o 9.231000 0.6612000 9.808000 0.9429000 8.654000 0.9271000 1.154000       1.322000  
1 1 1 21 31 50 o 5.323000 1.187000  5.779000 2.008000  4.868000 1.266000  0.9102000      2.374000  
1 1 1 21 32 1  o 9.717000 0.4337000 9.886000 0.6918000 9.548000 0.5233000 0.3381000      0.8674000 
1 1 1 21 32 3  o 36.24000 0.4347000 36.11000 0.5285000 36.37000 0.6902000 -0.2557000     0.8694000 
1 1 1 21 32 5  o 31.71000 0.3983000 31.01000 0.4170000 32.40000 0.6788000 -1.385000      0.7966000 
1 1 1 21 32 7  o 12.62000 0.4808000 12.15000 0.7141000 13.09000 0.6439000 -0.9444000     0.9615000 
1 1 1 21 32 9  o 9.259000 0.6351000 9.377000 0.8532000 9.142000 0.9409000 0.2352000      1.270000  
1 1 1 21 32 11 o 17.36000 0.4174000 17.56000 0.5898000 17.16000 0.5908000 0.4005000      0.8348000 
1 1 1 21 32 13 o 20.70000 0.3943000 20.43000 0.5591000 20.97000 0.5560000 -0.5366000     0.7885000 
1 1 1 21 32 15 o 24.78000 0.4179000 24.59000 0.6479000 24.96000 0.5281000 -0.3741000     0.8359000 
1 1 1 21 32 17 o 30.27000 0.3766000 30.15000 0.5274000 30.39000 0.5377000 -0.2410000     0.7531000 
1 1 1 21 32 19 o 17.07000 0.4767000 17.19000 0.5875000 16.96000 0.7507000 0.2317000      0.9533000 
1 1 1 21 32 21 o 15.19000 0.5092000 15.57000 0.6597000 14.82000 0.7759000 0.7510000      1.018000  
1 1 1 21 32 23 o 14.91000 0.5123000 14.63000 0.8239000 15.19000 0.6090000 -0.5513000     1.025000  
1 1 1 21 32 25 o 5.931000 1.054000  6.220000 1.589000  5.643000 1.387000  0.5768000      2.109000  
1 1 1 21 32 27 o 4.884000 1.044000  4.924000 1.539000  4.843000 1.411000  0.8133000E-01  2.088000  
1 1 1 21 32 29 o 8.438000 0.6926000 8.219000 0.9132000 8.658000 1.042000  -0.4391000     1.385000  
1 1 1 21 32 31 o 15.08000 0.4228000 15.27000 0.5787000 14.89000 0.6165000 0.3842000      0.8455000 
1 1 1 21 32 33 o 5.615000 0.8379000 4.259000 1.327000  6.972000 1.023000  -2.713000      1.676000  
1 1 1 21 32 35 o 4.944000 0.7886000 3.855000 1.072000  6.034000 1.157000  -2.179000      1.577000  
1 1 1 21 32 37 f 14.02000 0.4109000 13.67000 0.5089000 14.37000 0.6452000 -0.7060000     0.8217000 
1 1 1 21 32 39 o 9.107000 0.6630000 8.263000 0.8622000 9.951000 1.007000  -1.687000      1.326000  
1 1 1 21 32 41 o 3.930000 0.9100000 3.525000 1.228000  4.335000 1.343000  -0.8100000     1.820000  
1 1 1 21 32 43 o 4.513000 0.9262000 4.579000 1.300000  4.446000 1.320000  0.1330000      1.852000  
1 1 1 21 32 45 f 7.479000 0.7914000 6.348000 1.250000  8.611000 0.9709000 -2.263000      1.583000  
1 1 1 21 32 47 o 2.834000 0.8881000 2.670000 1.169000  2.999000 1.337000  -0.3293000     1.776000  
1 1 1 21 32 49 o 3.431000 0.9588000 3.427000 1.399000  3.434000 1.312000  -0.6694000E-02 1.918000  
1 1 1 21 33 0  o 22.09000 0.6910000 22.09000 0.6910000 22.09000 0.6910000 0.000000       0.000000  
1 1 1 21 33 2  o 24.01000 0.2720000 24.17000 0.3968000 23.84000 0.3721000 0.3279000      0.5440000 
1 1 1 21 33 4  o 10.49000 0.6390000 10.58000 0.5849000 10.40000 1.136000  0.1785000      1.278000  
1 1 1 21 33 6  o 14.02000 0.5028000 14.44000 0.4979000 13.59000 0.8736000 0.8475000      1.006000  
1 1 1 21 33 8  o 19.05000 0.4211000 18.84000 0.4501000 19.26000 0.7118000 -0.4183000     0.8421000 
1 1 1 21 33 10 o 12.30000 0.5002000 11.07000 0.7393000 13.53000 0.6738000 -2.462000      1.000000  
1 1 1 21 33 12 o 11.70000 0.6426000 11.76000 0.7877000 11.65000 1.016000  0.1017000      1.285000  
1 1 1 21 33 14 o 21.36000 0.3849000 22.00000 0.5312000 20.72000 0.5570000 1.279000       0.7697000 
1 1 1 21 33 16 o 11.09000 0.5615000 11.68000 0.7851000 10.49000 0.8029000 1.185000       1.123000  
1 1 1 21 33 18 o 17.74000 0.4735000 17.51000 0.5910000 17.97000 0.7399000 -0.4537000     0.9469000 
1 1 1 21 33 20 o 5.576000 1.020000  4.446000 1.562000  6.706000 1.314000  -2.261000      2.041000  
1 1 1 21 33 22 f 30.33000 0.4222000 31.22000 0.6609000 29.44000 0.5255000 1.775000       0.8443000 
1 1 1 21 33 24 o 17.17000 0.7226000 17.13000 1.102000  17.21000 0.9346000 -0.7694000E-01 1.445000  
1 1 1 21 33 26 f 11.65000 0.4828000 11.72000 0.6940000 11.57000 0.6714000 0.1520000      0.9656000 
1 1 1 21 33 28 o 8.623000 0.6772000 8.026000 0.8650000 9.220000 1.042000  -1.194000      1.354000  
1 1 1 21 33 30 o 14.02000 0.4386000 14.06000 0.5934000 13.99000 0.6461000 0.6830000E-01  0.8772000 
1 1 1 21 33 32 o 14.26000 0.4248000 14.44000 0.5717000 14.08000 0.6285000 0.3508000      0.8496000 
1 1 1 21 33 34 o 6.495000 0.7754000 6.759000 1.006000  6.232000 1.181000  0.5261000      1.551000  
1 1 1 21 33 36 o 8.436000 0.5802000 7.705000 0.5609000 9.167000 1.016000  -1.462000      1.160000  
1 1 1 21 33 38 o 11.28000 0.5669000 10.41000 0.6898000 12.15000 0.8999000 -1.745000      1.134000  
1 1 1 21 33 40 o 3.025000 0.8973000 3.033000 1.237000  3.017000 1.300000  0.1606000E-01  1.795000  
1 1 1 21 33 42 o 4.340000 0.9064000 4.100000 1.255000  4.580000 1.308000  -0.4799000     1.813000  
1 1 1 21 33 44 o 7.656000 0.7095000 6.953000 1.027000  8.358000 0.9792000 -1.405000      1.419000  
1 1 1 21 33 46 o 5.407000 1.119000  6.557000 1.832000  4.256000 1.286000  2.302000       2.238000  
1 1 1 21 33 48 o 4.093000 1.216000  4.286000 2.009000  3.900000 1.371000  0.3863000      2.432000  
1 1 1 21 34 1  o 2.575000 0.7871000 2.490000 1.150000  2.660000 1.075000  -0.1704000     1.574000  
1 1 1 21 34 3  o 15.72000 0.5468000 16.70000 1.037000  14.74000 0.3464000 1.963000       1.094000  
1 1 1 21 34 5  o 15.93000 0.4645000 16.12000 0.4685000 15.73000 0.8022000 0.3848000      0.9290000 
1 1 1 21 34 7  o 32.56000 0.4071000 32.03000 0.4335000 33.09000 0.6891000 -1.069000      0.8141000 
1 1 1 21 34 9  f 20.28000 0.4143000 19.25000 0.4558000 21.31000 0.6919000 -2.059000      0.8285000 
1 1 1 21 34 11 o 10.95000 0.5783000 9.385000 0.9147000 12.52000 0.7079000 -3.139000      1.157000  
1 1 1 21 34 13 o 5.596000 1.006000  6.352000 1.351000  4.840000 1.492000  1.512000       2.012000  
1 1 1 21 34 15 o 11.03000 0.7257000 10.96000 1.046000  11.10000 1.006000  -0.1387000     1.451000  
1 1 1 21 34 17 o 19.99000 0.4403000 19.70000 0.5690000 20.27000 0.6720000 -0.5646000     0.8806000 
1 1 1 21 34 19 o 11.18000 0.5133000 10.81000 0.7074000 11.56000 0.7440000 -0.7540000     1.027000  
1 1 1 21 34 21 o 13.26000 0.7383000 13.18000 1.273000  13.34000 0.7487000 -0.1614000     1.477000  
1 1 1 21 34 23 o 17.12000 0.5846000 17.08000 0.9508000 17.15000 0.6804000 -0.6690000E-01 1.169000  
1 1 1 21 34 25 o 13.26000 0.4573000 13.88000 0.6299000 12.63000 0.6631000 1.241000       0.9146000 
1 1 1 21 34 27 o 7.352000 0.8626000 7.941000 1.081000  6.763000 1.344000  1.178000       1.725000  
1 1 1 21 34 29 o 3.517000 0.9600000 3.033000 1.275000  4.000000 1.435000  -0.9669000     1.920000  
1 1 1 21 34 31 o 6.133000 0.8200000 7.052000 0.9092000 5.215000 1.365000  1.837000       1.640000  
1 1 1 21 34 33 o 15.61000 0.4046000 15.98000 0.5232000 15.24000 0.6172000 0.7396000      0.8092000 
1 1 1 21 34 35 o 6.994000 0.7315000 6.504000 1.051000  7.483000 1.018000  -0.9787000     1.463000  
1 1 1 21 34 37 o 8.870000 0.5776000 7.400000 0.5284000 10.34000 1.027000  -2.940000      1.155000  
1 1 1 21 34 39 o 6.269000 0.8447000 6.748000 0.9331000 5.791000 1.408000  0.9567000      1.689000  
1 1 1 21 34 41 o 8.764000 1.049000  9.521000 1.890000  8.008000 0.9129000 1.513000       2.099000  
1 1 1 21 34 43 o 6.823000 0.7931000 6.095000 1.263000  7.551000 0.9602000 -1.456000      1.586000  
1 1 1 21 34 45 o 8.120000 0.8709000 8.783000 1.470000  7.457000 0.9337000 1.326000       1.742000  
1 1 1 21 34 47 f 14.19000 0.7170000 14.56000 1.317000  13.82000 0.5677000 0.7401000      1.434000  
1 1 1 21 35 0  o 31.26000 0.4106000 31.26000 0.4106000 31.26000 0.4106000 0.000000       0.000000  
1 1 1 21 35 2  o 31.32000 0.3249000 31.35000 0.5096000 31.29000 0.4033000 0.5168000E-01  0.6498000 
1 1 1 21 35 4  o 11.00000 0.6017000 10.28000 0.6372000 11.73000 1.021000  -1.450000      1.203000  
1 1 1 21 35 6  o 21.36000 0.4907000 21.67000 0.6737000 21.06000 0.7135000 0.6113000      0.9814000 
1 1 1 21 35 8  o 31.81000 0.4072000 31.90000 0.4384000 31.71000 0.6864000 0.1880000      0.8144000 
1 1 1 21 35 10 o 18.79000 0.4400000 19.08000 0.4596000 18.50000 0.7504000 0.5812000      0.8800000 
1 1 1 21 35 12 o 22.55000 0.6048000 22.44000 0.5260000 22.67000 1.089000  -0.2304000     1.210000  
1 1 1 21 35 14 o 11.05000 0.6228000 10.44000 0.8561000 11.65000 0.9048000 -1.204000      1.246000  
1 1 1 21 35 16 o 16.41000 0.4460000 16.69000 0.6447000 16.13000 0.6163000 0.5620000      0.8919000 
1 1 1 21 35 18 o 26.59000 0.4354000 26.34000 0.6237000 26.83000 0.6077000 -0.4895000     0.8708000 
1 1 1 21 35 20 o 9.901000 0.8603000 8.867000 1.555000  10.94000 0.7365000 -2.068000      1.721000  
1 1 1 21 35 22 o 31.18000 0.3950000 31.42000 0.5472000 30.94000 0.5697000 0.4861000      0.7899000 
1 1 1 21 35 24 o 25.29000 0.5029000 26.03000 0.5343000 24.54000 0.8520000 1.484000       1.006000  
1 1 1 21 35 26 o 7.237000 0.7967000 5.918000 1.235000  8.556000 1.007000  -2.638000      1.593000  
1 1 1 21 35 28 o 5.111000 0.9725000 4.666000 1.378000  5.557000 1.373000  -0.8913000     1.945000  
1 1 1 21 35 30 o 7.250000 0.6993000 7.639000 0.9385000 6.861000 1.037000  0.7780000      1.399000  
1 1 1 21 35 32 o 14.80000 0.4371000 14.88000 0.5930000 14.71000 0.6423000 0.1697000      0.8742000 
1 1 1 21 35 34 o 3.998000 0.9702000 3.199000 1.294000  4.798000 1.446000  -1.600000      1.940000  
1 1 1 21 35 36 f 5.082000 1.086000  4.926000 1.476000  5.238000 1.594000  -0.3124000     2.172000  
1 1 1 21 35 38 o 6.828000 1.209000  7.281000 2.074000  6.375000 1.242000  0.9055000      2.417000  
1 1 1 21 35 40 o 8.121000 0.7824000 8.340000 1.169000  7.902000 1.040000  0.4389000      1.565000  
1 1 1 21 35 42 o 3.679000 1.006000  3.301000 1.496000  4.057000 1.345000  -0.7556000     2.012000  
1 1 1 21 35 44 o 4.320000 1.117000  4.977000 1.792000  3.664000 1.333000  1.313000       2.234000  
1 1 1 21 35 46 o 7.256000 1.079000  6.372000 1.947000  8.140000 0.9295000 -1.768000      2.158000  
1 1 1 21 35 48 o 4.706000 1.826000  4.706000 1.826000  ?        ?         ?              ?         
1 1 1 21 36 1  o 9.729000 0.3814000 9.325000 0.5925000 10.13000 0.4803000 -0.8085000     0.7627000 
1 1 1 21 36 3  o 28.33000 0.4262000 28.89000 0.4993000 27.78000 0.6909000 1.110000       0.8525000 
1 1 1 21 36 5  o 31.74000 0.4082000 32.26000 0.4343000 31.22000 0.6912000 1.045000       0.8163000 
1 1 1 21 36 7  f 38.35000 0.4296000 38.56000 0.4693000 38.13000 0.7197000 0.4318000      0.8592000 
1 1 1 21 36 9  f 27.68000 0.5865000 26.67000 0.6524000 28.68000 0.9748000 -2.005000      1.173000  
1 1 1 21 36 11 o 13.88000 0.7378000 13.94000 0.6957000 13.81000 1.301000  0.1309000      1.476000  
1 1 1 21 36 13 o 11.15000 0.5877000 10.94000 0.6187000 11.37000 0.9994000 -0.4292000     1.175000  
1 1 1 21 36 15 o 8.491000 0.7874000 9.386000 0.7566000 7.595000 1.381000  1.791000       1.575000  
1 1 1 21 36 17 o 5.021000 1.282000  5.719000 2.060000  4.322000 1.526000  1.397000       2.563000  
1 1 1 21 36 19 o 19.26000 0.4243000 20.08000 0.6498000 18.44000 0.5457000 1.643000       0.8485000 
1 1 1 21 36 21 o 14.00000 0.4802000 14.15000 0.6715000 13.85000 0.6866000 0.3004000      0.9604000 
1 1 1 21 36 23 o 7.880000 0.7145000 7.877000 1.049000  7.882000 0.9709000 -0.4212000E-02 1.429000  
1 1 1 21 36 25 o 10.97000 0.5673000 11.34000 0.7588000 10.60000 0.8435000 0.7379000      1.135000  
1 1 1 21 36 27 o 3.699000 0.9295000 4.599000 1.406000  2.800000 1.216000  1.799000       1.859000  
1 1 1 21 36 29 o 6.483000 0.8220000 5.991000 1.199000  6.975000 1.125000  -0.9834000     1.644000  
1 1 1 21 36 31 o 6.022000 0.8382000 4.920000 1.299000  7.124000 1.059000  -2.204000      1.676000  
1 1 1 21 36 33 f 6.405000 0.8085000 6.068000 1.139000  6.742000 1.148000  -0.6748000     1.617000  
1 1 1 21 36 35 o 9.046000 0.9794000 9.521000 0.7707000 8.571000 1.801000  0.9499000      1.959000  
1 1 1 21 36 37 o 11.37000 0.8525000 10.99000 1.533000  11.74000 0.7453000 -0.7434000     1.705000  
1 1 1 21 36 39 f 9.824000 0.7318000 9.165000 1.216000  10.48000 0.8140000 -1.316000      1.464000  
1 1 1 21 36 41 o 7.867000 0.8635000 8.898000 1.391000  6.836000 1.023000  2.062000       1.727000  
1 1 1 21 36 43 o 4.442000 1.143000  5.226000 1.768000  3.658000 1.447000  1.569000       2.285000  
1 1 1 21 36 45 o 10.06000 0.8102000 9.409000 1.410000  10.71000 0.7988000 -1.302000      1.620000  
1 1 1 21 36 47 o 5.387000 1.194000  4.311000 2.024000  6.462000 1.267000  -2.151000      2.388000  
1 1 1 21 37 0  o 4.093000 1.327000  4.093000 1.327000  4.093000 1.327000  0.000000       0.000000  
1 1 1 21 37 2  o 9.108000 0.3904000 8.985000 0.6224000 9.231000 0.4714000 -0.2463000     0.7808000 
1 1 1 21 37 4  o 8.125000 0.7062000 9.403000 0.6528000 6.847000 1.252000  2.556000       1.412000  
1 1 1 21 37 6  o 6.172000 1.149000  6.878000 0.9100000 5.466000 2.109000  1.412000       2.297000  
1 1 1 21 37 8  o 7.799000 1.171000  8.380000 0.7560000 7.218000 2.217000  1.162000       2.342000  
1 1 1 21 37 10 o 21.35000 0.4491000 21.46000 0.4897000 21.25000 0.7530000 0.2083000      0.8982000 
1 1 1 21 37 12 o 11.26000 0.6833000 11.21000 0.9195000 11.32000 1.011000  -0.1169000     1.367000  
1 1 1 21 37 14 o 9.570000 0.8827000 9.460000 0.9355000 9.679000 1.497000  -0.2195000     1.765000  
1 1 1 21 37 16 o 15.99000 0.4487000 15.59000 0.5541000 16.40000 0.7058000 -0.8110000     0.8974000 
1 1 1 21 37 18 o 29.14000 0.4207000 29.51000 0.5018000 28.78000 0.6754000 0.7262000      0.8414000 
1 1 1 21 37 20 o 4.060000 0.9519000 5.088000 1.391000  3.032000 1.300000  2.056000       1.904000  
1 1 1 21 37 22 o 8.447000 0.6938000 8.886000 0.9082000 8.009000 1.049000  0.8765000      1.388000  
1 1 1 21 37 24 o 10.97000 0.5463000 11.11000 0.7431000 10.84000 0.8009000 0.2700000      1.093000  
1 1 1 21 37 26 o 13.96000 0.5165000 14.65000 0.7625000 13.28000 0.6969000 1.363000       1.033000  
1 1 1 21 37 28 o 11.75000 0.5002000 12.15000 0.7138000 11.35000 0.7010000 0.7992000      1.000000  
1 1 1 21 37 30 o 11.07000 0.5395000 11.52000 0.7183000 10.63000 0.8053000 0.8864000      1.079000  
1 1 1 21 37 32 o 4.887000 0.9789000 5.227000 1.260000  4.548000 1.498000  0.6792000      1.958000  
1 1 1 21 37 34 o 9.460000 0.5856000 9.875000 0.7421000 9.045000 0.9062000 0.8305000      1.171000  
1 1 1 21 37 36 o 10.55000 0.6386000 10.48000 1.004000  10.61000 0.7898000 -0.1309000     1.277000  
1 1 1 21 37 38 o 6.869000 0.9473000 7.320000 1.455000  6.419000 1.213000  0.9010000      1.895000  
1 1 1 21 37 40 o 9.271000 0.6264000 9.318000 0.8601000 9.225000 0.9110000 0.9348000E-01  1.253000  
1 1 1 21 37 42 o 6.140000 1.091000  6.651000 1.684000  5.628000 1.389000  1.023000       2.183000  
1 1 1 21 37 44 o 9.534000 0.7977000 10.81000 1.378000  8.256000 0.8042000 2.556000       1.595000  
1 1 1 21 37 46 o 3.000000 0.9995000 3.543000 1.629000  2.458000 1.159000  1.085000       1.999000  
1 1 1 21 38 1  o 7.200000 0.5025000 7.514000 0.7430000 6.887000 0.6767000 0.6275000      1.005000  
1 1 1 21 38 3  o 6.375000 1.235000  5.560000 1.304000  7.190000 2.098000  -1.629000      2.470000  
1 1 1 21 38 5  o 28.83000 0.6031000 28.26000 0.4588000 29.39000 1.116000  -1.127000      1.206000  
1 1 1 21 38 7  o 21.29000 0.4449000 20.44000 0.5360000 22.13000 0.7101000 -1.688000      0.8897000 
1 1 1 21 38 9  o 6.023000 1.013000  6.046000 1.150000  5.999000 1.668000  0.4678000E-01  2.026000  
1 1 1 21 38 11 f 17.11000 0.6088000 18.18000 0.6707000 16.04000 1.016000  2.138000       1.218000  
1 1 1 21 38 13 o 21.01000 0.4530000 21.60000 0.5738000 20.42000 0.7011000 1.177000       0.9060000 
1 1 1 21 38 15 o 8.820000 0.6698000 8.542000 0.7514000 9.097000 1.109000  -0.5556000     1.340000  
1 1 1 21 38 17 o 17.99000 0.5334000 16.80000 0.7893000 19.19000 0.7178000 -2.388000      1.067000  
1 1 1 21 38 19 o 16.61000 0.5520000 16.50000 0.5771000 16.73000 0.9412000 -0.2281000     1.104000  
1 1 1 21 38 21 o 5.822000 0.9321000 5.825000 1.068000  5.819000 1.528000  0.6005000E-02  1.864000  
1 1 1 21 38 23 f 10.47000 0.7045000 11.27000 0.7163000 9.668000 1.213000  1.604000       1.409000  
1 1 1 21 38 25 o 11.43000 0.5382000 11.85000 0.7287000 11.00000 0.7921000 0.8479000      1.076000  
1 1 1 21 38 27 o 9.389000 0.6415000 9.387000 0.9093000 9.391000 0.9053000 -0.3710000E-02 1.283000  
1 1 1 21 38 29 o 9.844000 0.6183000 10.10000 0.8548000 9.584000 0.8936000 0.5199000      1.237000  
1 1 1 21 38 31 o 9.170000 0.6988000 8.632000 1.006000  9.707000 0.9703000 -1.075000      1.398000  
1 1 1 21 38 33 o 5.179000 0.9648000 5.850000 1.216000  4.508000 1.498000  1.342000       1.930000  
1 1 1 21 38 35 o 8.611000 0.7575000 8.594000 1.106000  8.627000 1.036000  -0.3285000E-01 1.515000  
1 1 1 21 38 37 o 5.140000 1.222000  5.435000 1.998000  4.845000 1.410000  0.5901000      2.445000  
1 1 1 21 38 39 o 6.953000 0.9016000 6.273000 1.485000  7.633000 1.023000  -1.359000      1.803000  
1 1 1 21 38 41 o 4.342000 1.117000  5.069000 1.770000  3.616000 1.365000  1.453000       2.235000  
1 1 1 21 38 43 o 2.905000 0.9365000 3.247000 1.482000  2.564000 1.146000  0.6830000      1.873000  
1 1 1 21 38 45 o 5.187000 1.185000  6.744000 1.916000  3.631000 1.395000  3.113000       2.370000  
1 1 1 21 39 0  o 7.125000 0.8789000 7.125000 0.8789000 7.125000 0.8789000 0.000000       0.000000  
1 1 1 21 39 2  o 8.350000 0.4038000 8.537000 0.6368000 8.162000 0.4967000 0.3755000      0.8076000 
1 1 1 21 39 4  o 23.07000 0.3884000 22.73000 0.4041000 23.41000 0.6633000 -0.6771000     0.7767000 
1 1 1 21 39 6  o 19.82000 0.4067000 19.08000 0.4280000 20.55000 0.6916000 -1.474000      0.8133000 
1 1 1 21 39 8  o 5.055000 0.9738000 5.183000 1.133000  4.926000 1.584000  0.2576000      1.948000  
1 1 1 21 39 10 o 9.493000 0.6291000 8.643000 0.7900000 10.34000 0.9792000 -1.699000      1.258000  
1 1 1 21 39 12 o 10.12000 0.6143000 9.857000 0.7513000 10.38000 0.9721000 -0.5254000     1.229000  
1 1 1 21 39 14 o 9.004000 0.8138000 10.72000 0.7024000 7.292000 1.468000  3.424000       1.628000  
1 1 1 21 39 16 o 11.00000 0.6737000 10.45000 0.6030000 11.55000 1.205000  -1.098000      1.347000  
1 1 1 21 39 18 o 16.53000 0.5266000 16.06000 0.5300000 17.01000 0.9102000 -0.9482000     1.053000  
1 1 1 21 39 20 o 12.48000 0.5485000 12.27000 0.7152000 12.70000 0.8318000 -0.4287000     1.097000  
1 1 1 21 39 22 f 8.475000 0.8759000 7.503000 1.267000  9.447000 1.210000  -1.945000      1.752000  
1 1 1 21 39 24 o 6.071000 0.8922000 7.554000 0.7837000 4.587000 1.603000  2.967000       1.784000  
1 1 1 21 39 26 f 3.723000 1.037000  3.584000 1.381000  3.861000 1.549000  -0.2766000     2.075000  
1 1 1 21 39 28 o 5.601000 0.9580000 6.202000 1.266000  4.999000 1.438000  1.203000       1.916000  
1 1 1 21 39 30 o 3.936000 1.076000  3.742000 1.456000  4.130000 1.586000  -0.3887000     2.153000  
1 1 1 21 39 32 o 9.851000 0.5872000 10.03000 0.7989000 9.675000 0.8607000 0.3531000      1.174000  
1 1 1 21 39 34 o 11.21000 0.6789000 10.29000 1.024000  12.13000 0.8913000 -1.844000      1.358000  
1 1 1 21 39 36 o 9.807000 0.8864000 10.35000 1.512000  9.264000 0.9260000 1.087000       1.773000  
1 1 1 21 39 38 o 7.688000 0.7890000 7.936000 1.109000  7.440000 1.122000  0.4955000      1.578000  
1 1 1 21 39 40 o 4.986000 1.081000  4.674000 1.445000  5.298000 1.608000  -0.6234000     2.161000  
1 1 1 21 39 42 o 4.107000 1.136000  4.710000 1.865000  3.505000 1.296000  1.205000       2.271000  
1 1 1 21 39 44 o 6.129000 1.243000  5.863000 1.892000  6.395000 1.614000  -0.5323000     2.487000  
1 1 1 21 40 1  o 5.433000 0.6106000 5.506000 0.8941000 5.359000 0.8317000 0.1470000      1.221000  
1 1 1 21 40 3  o 9.262000 0.6957000 9.721000 0.5376000 8.803000 1.283000  0.9183000      1.391000  
1 1 1 21 40 5  o 20.92000 0.4227000 21.52000 0.4545000 20.31000 0.7128000 1.211000       0.8454000 
1 1 1 21 40 7  o 9.113000 0.8107000 8.942000 0.8937000 9.283000 1.353000  -0.3409000     1.621000  
1 1 1 21 40 9  o 8.032000 0.7936000 8.948000 0.6858000 7.116000 1.431000  1.832000       1.587000  
1 1 1 21 40 11 o 4.620000 0.9948000 5.072000 1.189000  4.169000 1.595000  0.9031000      1.990000  
1 1 1 21 40 13 f 13.80000 0.6264000 14.48000 0.5598000 13.12000 1.121000  1.355000       1.253000  
1 1 1 21 40 15 o 9.168000 0.8081000 9.388000 0.6483000 8.948000 1.481000  0.4398000      1.616000  
1 1 1 21 40 17 f 14.19000 0.5189000 13.20000 0.5100000 15.19000 0.9038000 -1.989000      1.038000  
1 1 1 21 40 19 o 10.51000 0.6107000 10.63000 0.6123000 10.40000 1.057000  0.2270000      1.221000  
1 1 1 21 40 21 o 16.38000 0.4393000 15.95000 0.5013000 16.81000 0.7217000 -0.8613000     0.8787000 
1 1 1 21 40 23 o 15.04000 0.4792000 15.68000 0.5043000 14.40000 0.8151000 1.281000       0.9584000 
1 1 1 21 40 25 o 9.221000 0.7332000 9.106000 0.9295000 9.336000 1.134000  -0.2304000     1.466000  
1 1 1 21 40 27 o 11.44000 0.7046000 12.09000 0.8293000 10.79000 1.139000  1.301000       1.409000  
1 1 1 21 40 29 o 12.13000 0.9729000 13.49000 0.6268000 10.77000 1.842000  2.722000       1.946000  
1 1 1 21 40 31 o 9.543000 0.7928000 10.53000 0.8626000 8.561000 1.330000  1.965000       1.586000  
1 1 1 21 40 33 o 3.873000 0.9650000 4.007000 1.388000  3.738000 1.341000  0.2686000      1.930000  
1 1 1 21 40 35 o 4.028000 1.044000  4.306000 1.539000  3.751000 1.412000  0.5546000      2.089000  
1 1 1 21 40 37 o 5.701000 0.9882000 4.895000 1.560000  6.507000 1.213000  -1.612000      1.976000  
1 1 1 21 40 39 o 4.419000 1.132000  4.359000 1.544000  4.478000 1.655000  -0.1190000     2.264000  
1 1 1 21 40 41 o 3.570000 1.013000  3.823000 1.596000  3.318000 1.250000  0.5047000      2.027000  
1 1 1 21 40 43 o 5.099000 1.196000  6.307000 1.918000  3.891000 1.429000  2.416000       2.392000  
1 1 1 21 41 0  o 5.417000 1.222000  5.417000 1.222000  5.417000 1.222000  0.000000       0.000000  
1 1 1 21 41 2  o 21.31000 0.3157000 21.52000 0.5140000 21.10000 0.3667000 0.4162000      0.6314000 
1 1 1 21 41 4  o 26.21000 0.4987000 26.57000 0.5033000 25.85000 0.8610000 0.7124000      0.9973000 
1 1 1 21 41 6  o 17.45000 0.5576000 16.31000 0.4497000 18.59000 1.021000  -2.278000      1.115000  
1 1 1 21 41 8  o 19.70000 0.5642000 20.66000 0.4340000 18.74000 1.042000  1.923000       1.128000  
1 1 1 21 41 10 o 6.823000 1.118000  6.996000 1.059000  6.650000 1.969000  0.3456000      2.235000  
1 1 1 21 41 12 o 7.507000 0.9267000 7.385000 0.8047000 7.630000 1.670000  -0.2453000     1.853000  
1 1 1 21 41 14 o 17.74000 0.4416000 17.44000 0.4662000 18.04000 0.7501000 -0.6031000     0.8831000 
1 1 1 21 41 16 o 13.75000 0.4722000 13.87000 0.5154000 13.63000 0.7914000 0.2391000      0.9444000 
1 1 1 21 41 18 o 4.059000 1.013000  3.857000 1.202000  4.261000 1.631000  -0.4035000     2.027000  
1 1 1 21 41 20 o 9.183000 0.6200000 9.031000 0.7446000 9.335000 0.9916000 -0.3037000     1.240000  
1 1 1 21 41 22 o 4.895000 1.083000  5.053000 1.502000  4.737000 1.560000  0.3163000      2.165000  
1 1 1 21 41 24 o 6.456000 0.8339000 6.725000 0.9036000 6.186000 1.402000  0.5391000      1.668000  
1 1 1 21 41 26 o 10.28000 0.6803000 11.44000 0.5998000 9.123000 1.221000  2.315000       1.361000  
1 1 1 21 41 28 o 5.836000 1.220000  6.306000 0.9754000 5.366000 2.236000  0.9398000      2.440000  
1 1 1 21 41 30 o 6.391000 0.9731000 5.838000 1.134000  6.943000 1.582000  -1.106000      1.946000  
1 1 1 21 41 32 o 5.709000 0.9542000 7.194000 1.110000  4.223000 1.552000  2.970000       1.908000  
1 1 1 21 41 34 o 6.677000 0.9895000 7.335000 1.198000  6.020000 1.575000  1.314000       1.979000  
1 1 1 21 41 36 o 4.287000 1.055000  3.273000 1.328000  5.301000 1.640000  -2.027000      2.110000  
1 1 1 21 41 38 o 4.024000 1.159000  3.649000 1.475000  4.399000 1.788000  -0.7494000     2.318000  
1 1 1 21 41 40 o 6.120000 0.9198000 6.471000 1.237000  5.770000 1.362000  0.7011000      1.840000  
1 1 1 21 41 42 o 3.841000 1.680000  3.841000 1.680000  ?        ?         ?              ?         
1 1 1 21 42 1  f 8.116000 0.4335000 7.690000 0.6782000 8.542000 0.5402000 -0.8513000     0.8670000 
1 1 1 21 42 3  o 8.832000 0.6316000 7.590000 0.6607000 10.07000 1.077000  -2.484000      1.263000  
1 1 1 21 42 5  o 12.64000 0.5279000 12.26000 0.5003000 13.01000 0.9297000 -0.7562000     1.056000  
1 1 1 21 42 7  o 24.01000 0.4328000 24.16000 0.4080000 23.87000 0.7635000 0.2902000      0.8657000 
1 1 1 21 42 9  f 8.429000 0.8266000 8.888000 0.6675000 7.969000 1.512000  0.9192000      1.653000  
1 1 1 21 42 11 o 11.41000 0.6778000 12.20000 0.5396000 10.62000 1.244000  1.579000       1.356000  
1 1 1 21 42 13 o 10.64000 0.6286000 11.98000 0.6442000 9.298000 1.080000  2.679000       1.257000  
1 1 1 21 42 15 o 8.998000 0.6995000 9.453000 0.6767000 8.543000 1.224000  0.9097000      1.399000  
1 1 1 21 42 17 o 7.442000 0.7429000 7.434000 0.7974000 7.451000 1.254000  -0.1708000E-01 1.486000  
1 1 1 21 42 19 o 12.82000 0.4699000 12.83000 0.5457000 12.80000 0.7652000 0.3045000E-01  0.9399000 
1 1 1 21 42 21 o 15.53000 0.4945000 15.05000 0.6180000 16.01000 0.7722000 -0.9633000     0.9891000 
1 1 1 21 42 23 o 14.93000 0.4393000 15.22000 0.5235000 14.64000 0.7057000 0.5809000      0.8787000 
1 1 1 21 42 25 o 5.049000 1.172000  3.631000 1.306000  6.466000 1.946000  -2.834000      2.344000  
1 1 1 21 42 27 o 5.338000 1.045000  5.313000 1.143000  5.362000 1.750000  -0.4882000E-01 2.090000  
1 1 1 21 42 29 o 5.549000 1.026000  6.077000 1.254000  5.021000 1.625000  1.056000       2.052000  
1 1 1 21 42 31 o 8.692000 0.8244000 9.985000 0.7106000 7.399000 1.488000  2.585000       1.649000  
1 1 1 21 42 33 o 5.437000 1.044000  5.125000 1.437000  5.748000 1.515000  -0.6228000     2.088000  
1 1 1 21 42 35 o 8.211000 0.8099000 9.598000 0.8459000 6.825000 1.381000  2.773000       1.620000  
1 1 1 21 42 37 o 5.116000 1.221000  4.012000 1.472000  6.220000 1.949000  -2.208000      2.442000  
1 1 1 21 42 39 o 6.069000 1.147000  5.471000 1.618000  6.667000 1.625000  -1.196000      2.293000  
1 1 1 21 43 0  o 8.418000 0.9793000 8.418000 0.9793000 8.418000 0.9793000 0.000000       0.000000  
1 1 1 21 43 2  o 14.99000 0.3320000 15.31000 0.5579000 14.67000 0.3599000 0.6348000      0.6639000 
1 1 1 21 43 4  o 9.821000 0.6660000 10.11000 0.5613000 9.533000 1.208000  0.5749000      1.332000  
1 1 1 21 43 6  o 18.15000 0.4746000 17.41000 0.4270000 18.89000 0.8478000 -1.479000      0.9492000 
1 1 1 21 43 8  o 21.79000 0.4320000 21.19000 0.4101000 22.39000 0.7604000 -1.196000      0.8640000 
1 1 1 21 43 10 o 7.311000 0.8404000 7.924000 0.7989000 6.699000 1.479000  1.224000       1.681000  
1 1 1 21 43 12 o 4.517000 0.9713000 4.979000 1.314000  4.055000 1.431000  0.9238000      1.943000  
1 1 1 21 43 14 o 6.022000 0.9437000 6.370000 0.9227000 5.675000 1.647000  0.6954000      1.887000  
1 1 1 21 43 16 o 8.799000 0.6607000 8.469000 0.6653000 9.130000 1.142000  -0.6615000     1.321000  
1 1 1 21 43 18 o 7.041000 0.7866000 7.867000 0.8001000 6.215000 1.355000  1.652000       1.573000  
1 1 1 21 43 20 o 3.451000 0.9835000 3.067000 1.211000  3.835000 1.550000  -0.7679000     1.967000  
1 1 1 21 43 22 o 2.269000 0.7633000 1.678000 0.8389000 2.860000 1.275000  -1.182000      1.527000  
1 1 1 21 43 24 o 9.075000 0.9232000 8.319000 0.9262000 9.831000 1.597000  -1.512000      1.846000  
1 1 1 21 43 26 o 11.28000 0.6106000 12.11000 0.6221000 10.46000 1.051000  1.652000       1.221000  
1 1 1 21 43 28 o 10.18000 0.7038000 10.90000 0.7903000 9.462000 1.165000  1.437000       1.408000  
1 1 1 21 43 30 o 4.217000 1.039000  3.876000 1.318000  4.559000 1.607000  -0.6822000     2.079000  
1 1 1 21 43 32 o 6.661000 1.140000  6.098000 1.665000  7.223000 1.558000  -1.125000      2.280000  
1 1 1 21 43 34 o 3.236000 0.9847000 2.942000 1.268000  3.529000 1.507000  -0.5872000     1.969000  
1 1 1 21 43 36 o 7.848000 1.072000  9.405000 0.7565000 6.292000 2.006000  3.113000       2.144000  
1 1 1 21 43 38 o 5.676000 1.008000  4.565000 1.397000  6.787000 1.455000  -2.222000      2.017000  
1 1 1 21 44 1  o 14.96000 0.3184000 14.92000 0.5090000 15.00000 0.3826000 -0.8149000E-01 0.6367000 
1 1 1 21 44 3  o 7.036000 0.5399000 7.234000 0.6873000 6.839000 0.8327000 0.3945000      1.080000  
1 1 1 21 44 5  f 19.95000 0.4256000 20.28000 0.4483000 19.62000 0.7236000 0.6637000      0.8512000 
1 1 1 21 44 7  o 16.81000 0.4567000 16.42000 0.4422000 17.20000 0.7992000 -0.7826000     0.9133000 
1 1 1 21 44 9  o 14.06000 0.5495000 14.16000 0.5933000 13.96000 0.9251000 0.1988000      1.099000  
1 1 1 21 44 11 o 17.37000 0.4486000 16.88000 0.4716000 17.85000 0.7632000 -0.9711000     0.8971000 
1 1 1 21 44 13 o 14.99000 0.4749000 15.64000 0.5086000 14.35000 0.8022000 1.296000       0.9499000 
1 1 1 21 44 15 o 3.637000 0.9761000 3.842000 1.275000  3.432000 1.479000  0.4099000      1.952000  
1 1 1 21 44 17 o 9.314000 0.6473000 9.242000 0.6522000 9.387000 1.118000  -0.1449000     1.295000  
1 1 1 21 44 19 o 8.502000 0.6926000 8.820000 0.7304000 8.184000 1.177000  0.6356000      1.385000  
1 1 1 21 44 21 o 6.004000 1.067000  7.060000 0.8350000 4.948000 1.963000  2.112000       2.133000  
1 1 1 21 44 23 o 5.625000 0.9834000 6.038000 1.118000  5.212000 1.618000  0.8256000      1.967000  
1 1 1 21 44 25 o 6.078000 0.9364000 5.379000 1.145000  6.777000 1.482000  -1.398000      1.873000  
1 1 1 21 44 27 o 4.689000 0.9995000 4.215000 1.336000  5.164000 1.487000  -0.9491000     1.999000  
1 1 1 21 44 29 o 3.754000 0.9726000 4.172000 1.283000  3.336000 1.462000  0.8361000      1.945000  
1 1 1 21 44 31 o 5.726000 1.024000  5.100000 1.346000  6.352000 1.543000  -1.252000      2.047000  
1 1 1 21 44 33 o 8.555000 0.9031000 10.03000 0.7284000 7.077000 1.653000  2.956000       1.806000  
1 1 1 21 44 35 o 5.211000 1.242000  4.457000 1.427000  5.965000 2.035000  -1.508000      2.485000  
1 1 1 21 44 37 o 3.763000 1.030000  2.489000 1.128000  5.037000 1.723000  -2.547000      2.059000  
1 1 1 21 45 0  o 21.94000 0.3858000 21.94000 0.3858000 21.94000 0.3858000 0.000000       0.000000  
1 1 1 21 45 2  o 14.28000 0.2905000 14.13000 0.4315000 14.42000 0.3892000 -0.2958000     0.5810000 
1 1 1 21 45 4  o 6.000000 0.8934000 6.748000 0.7609000 5.251000 1.617000  1.497000       1.787000  
1 1 1 21 45 6  o 6.398000 1.063000  7.442000 0.6844000 5.354000 2.013000  2.088000       2.126000  
1 1 1 21 45 8  o 6.873000 0.7869000 6.027000 0.8600000 7.719000 1.318000  -1.692000      1.574000  
1 1 1 21 45 10 o 8.699000 0.7424000 8.601000 0.6417000 8.797000 1.339000  -0.1955000     1.485000  
1 1 1 21 45 12 o 6.083000 0.9732000 6.962000 0.9473000 5.203000 1.700000  1.759000       1.946000  
1 1 1 21 45 14 o 7.279000 0.7515000 6.906000 0.9002000 7.652000 1.204000  -0.7468000     1.503000  
1 1 1 21 45 16 o 3.116000 0.9296000 3.183000 1.253000  3.049000 1.374000  0.1334000      1.859000  
1 1 1 21 45 18 o 3.836000 1.044000  3.662000 1.327000  4.010000 1.612000  -0.3480000     2.088000  
1 1 1 21 45 20 o 10.10000 0.8685000 10.77000 0.7313000 9.434000 1.576000  1.337000       1.737000  
1 1 1 21 45 22 o 14.02000 0.5104000 14.50000 0.5162000 13.54000 0.8806000 0.9562000      1.021000  
1 1 1 21 45 24 o 13.78000 0.5285000 13.81000 0.6056000 13.74000 0.8664000 0.7740000E-01  1.057000  
1 1 1 21 45 26 o 3.929000 0.9292000 4.766000 1.273000  3.093000 1.354000  1.673000       1.858000  
1 1 1 21 45 28 o 11.86000 0.5807000 11.82000 0.7252000 11.90000 0.9071000 -0.7923000E-01 1.161000  
1 1 1 21 45 30 o 4.481000 1.000000  5.413000 1.286000  3.550000 1.533000  1.863000       2.001000  
1 1 1 21 45 32 o 8.020000 0.8876000 8.609000 0.8209000 7.431000 1.574000  1.178000       1.775000  
1 1 1 21 45 34 o 7.353000 1.222000  5.915000 1.456000  8.792000 1.962000  -2.877000      2.443000  
1 1 1 21 45 36 o 7.178000 0.9705000 8.691000 0.7701000 5.664000 1.782000  3.027000       1.941000  
1 1 1 21 46 1  o 9.116000 0.4631000 9.351000 0.5601000 8.880000 0.7378000 0.4712000      0.9263000 
1 1 1 21 46 3  o 3.586000 0.7381000 4.576000 1.052000  2.596000 1.035000  1.980000       1.476000  
1 1 1 21 46 5  o 19.23000 0.4117000 19.23000 0.4117000 ?        ?         ?              ?         
1 1 1 21 46 7  o 20.14000 0.4683000 20.16000 0.4174000 20.13000 0.8384000 0.2536000E-01  0.9365000 
1 1 1 21 46 9  o 3.797000 1.091000  3.655000 1.211000  3.939000 1.816000  -0.2838000     2.183000  
1 1 1 21 46 11 o 3.304000 0.9762000 2.819000 1.204000  3.789000 1.537000  -0.9707000     1.952000  
1 1 1 21 46 13 o 3.860000 0.9682000 3.902000 1.286000  3.818000 1.448000  0.8379000E-01  1.936000  
1 1 1 21 46 15 o 8.207000 0.7540000 8.239000 0.7612000 8.175000 1.302000  0.6429000E-01  1.508000  
1 1 1 21 46 17 o 6.882000 1.012000  6.384000 1.021000  7.380000 1.749000  -0.9951000     2.025000  
1 1 1 21 46 19 o 3.716000 0.9680000 4.241000 1.294000  3.192000 1.440000  1.049000       1.936000  
1 1 1 21 46 21 o 4.624000 0.9351000 5.648000 1.188000  3.601000 1.444000  2.047000       1.870000  
1 1 1 21 46 23 o 7.211000 0.9969000 8.689000 0.9948000 5.732000 1.728000  2.956000       1.994000  
1 1 1 21 46 25 o 3.542000 0.9460000 3.273000 1.238000  3.812000 1.431000  -0.5392000     1.892000  
1 1 1 21 46 27 o 7.422000 0.8898000 7.676000 1.010000  7.168000 1.465000  0.5083000      1.780000  
1 1 1 21 46 29 o 2.833000 0.9083000 2.171000 1.046000  3.495000 1.486000  -1.324000      1.817000  
1 1 1 21 46 31 o 5.187000 1.027000  6.287000 1.215000  4.088000 1.655000  2.199000       2.054000  
1 1 1 21 46 33 o 8.189000 1.084000  7.497000 0.9515000 8.881000 1.948000  -1.383000      2.168000  
1 1 1 21 46 35 o 3.222000 1.080000  2.203000 1.047000  4.241000 1.890000  -2.037000      2.160000  
1 1 1 21 47 0  o 11.66000 0.4278000 11.66000 0.4278000 11.66000 0.4278000 0.000000       0.000000  
1 1 1 21 47 2  o 6.875000 0.8069000 6.632000 0.7122000 7.117000 1.448000  -0.4856000     1.614000  
1 1 1 21 47 4  o 3.979000 0.8974000 4.489000 1.071000  3.469000 1.440000  1.020000       1.795000  
1 1 1 21 47 6  o 2.987000 0.9246000 2.013000 0.9402000 3.962000 1.592000  -1.950000      1.849000  
1 1 1 21 47 8  o 7.527000 0.9013000 7.258000 0.9505000 7.796000 1.532000  -0.5380000     1.803000  
1 1 1 21 47 10 o 5.833000 1.056000  5.466000 0.9999000 6.200000 1.860000  -0.7335000     2.112000  
1 1 1 21 47 12 o 9.591000 0.8316000 9.602000 0.6863000 9.579000 1.515000  0.2223000E-01  1.663000  
1 1 1 21 47 14 o 4.567000 0.9526000 4.838000 1.243000  4.296000 1.444000  0.5422000      1.905000  
1 1 1 21 47 16 o 9.553000 1.015000  9.201000 0.7578000 9.906000 1.883000  -0.7048000     2.030000  
1 1 1 21 47 18 o 9.796000 0.6613000 10.47000 0.6693000 9.119000 1.141000  1.354000       1.323000  
1 1 1 21 47 20 o 6.906000 0.9031000 7.119000 1.076000  6.694000 1.451000  0.4252000      1.806000  
1 1 1 21 47 22 o 6.905000 0.9280000 6.509000 1.252000  7.302000 1.370000  -0.7923000     1.856000  
1 1 1 21 47 24 o 5.496000 0.9402000 4.971000 1.138000  6.021000 1.497000  -1.050000      1.880000  
1 1 1 21 47 26 o 3.131000 0.9319000 3.150000 1.274000  3.111000 1.361000  0.3908000E-01  1.864000  
1 1 1 21 47 28 o 4.970000 1.094000  4.108000 1.286000  5.832000 1.770000  -1.725000      2.188000  
1 1 1 21 47 30 o 5.688000 1.223000  5.807000 1.388000  5.569000 2.014000  0.2379000      2.446000  
1 1 1 21 47 32 o 2.927000 0.9201000 2.640000 1.134000  3.213000 1.449000  -0.5736000     1.840000  
1 1 1 21 47 34 o 5.404000 1.307000  6.251000 1.727000  4.556000 1.961000  1.694000       2.613000  
1 1 1 21 48 1  o 3.554000 0.8639000 3.606000 1.138000  3.501000 1.300000  0.1049000      1.728000  
1 1 1 21 48 3  o 8.554000 0.4184000 9.452000 0.5642000 7.655000 0.6179000 1.797000       0.8367000 
1 1 1 21 48 5  o 6.877000 0.8654000 8.213000 0.6480000 5.542000 1.605000  2.671000       1.731000  
1 1 1 21 48 7  o 4.669000 0.9400000 5.102000 1.066000  4.236000 1.549000  0.8656000      1.880000  
1 1 1 21 48 9  o 5.241000 0.9798000 5.650000 1.009000  4.832000 1.680000  0.8179000      1.960000  
1 1 1 21 48 11 o 8.415000 0.9179000 10.35000 0.6974000 6.483000 1.698000  3.865000       1.836000  
1 1 1 21 48 13 o 6.037000 1.174000  6.118000 0.9491000 5.955000 2.147000  0.1633000      2.347000  
1 1 1 21 48 15 o 6.026000 1.139000  6.320000 1.144000  5.732000 1.969000  0.5872000      2.278000  
1 1 1 21 48 17 o 2.695000 0.8972000 2.134000 1.029000  3.255000 1.470000  -1.122000      1.794000  
1 1 1 21 48 19 o 2.941000 0.9329000 2.910000 1.325000  2.972000 1.313000  -0.6156000E-01 1.866000  
1 1 1 21 48 21 o 4.371000 1.077000  4.021000 1.286000  4.720000 1.729000  -0.6995000     2.155000  
1 1 1 21 48 23 f 3.311000 0.9475000 3.687000 1.366000  2.934000 1.313000  0.7532000      1.895000  
1 1 1 21 48 25 o 2.849000 0.9134000 2.327000 1.089000  3.372000 1.467000  -1.044000      1.827000  
1 1 1 21 48 27 o 3.851000 1.026000  3.820000 1.304000  3.881000 1.585000  -0.6056000E-01 2.052000  
1 1 1 21 48 29 o 7.029000 1.165000  5.242000 1.193000  8.816000 2.001000  -3.574000      2.330000  
1 1 1 21 48 31 o 3.321000 1.025000  2.984000 1.262000  3.659000 1.616000  -0.6751000     2.050000  
1 1 1 21 49 0  o 5.522000 1.216000  5.522000 1.216000  5.522000 1.216000  0.000000       0.000000  
1 1 1 21 49 2  o 6.459000 0.9142000 6.709000 1.073000  6.208000 1.480000  0.5006000      1.828000  
1 1 1 21 49 4  o 7.533000 0.7518000 7.073000 0.8055000 7.993000 1.270000  -0.9200000     1.504000  
1 1 1 21 49 6  f 11.01000 0.5596000 11.31000 0.5228000 10.71000 0.9895000 0.6003000      1.119000  
1 1 1 21 49 8  o 4.064000 1.208000  3.217000 1.296000  4.912000 2.039000  -1.695000      2.416000  
1 1 1 21 49 10 o 5.256000 1.184000  5.324000 1.315000  5.188000 1.970000  0.1364000      2.369000  
1 1 1 21 49 12 o 3.828000 1.043000  3.760000 1.255000  3.896000 1.666000  -0.1355000     2.086000  
1 1 1 21 49 14 o 4.162000 0.9823000 2.963000 1.188000  5.361000 1.565000  -2.398000      1.965000  
1 1 1 21 49 16 o 3.508000 1.007000  3.186000 1.305000  3.830000 1.534000  -0.6444000     2.014000  
1 1 1 21 49 18 o 4.514000 1.295000  2.994000 1.357000  6.035000 2.205000  -3.041000      2.590000  
1 1 1 21 49 20 o 6.129000 1.023000  6.193000 1.314000  6.065000 1.568000  0.1286000      2.046000  
1 1 1 21 49 22 o 5.779000 1.057000  5.423000 1.337000  6.136000 1.637000  -0.7129000     2.114000  
1 1 1 21 49 24 o 5.096000 1.020000  4.964000 1.282000  5.228000 1.586000  -0.2640000     2.039000  
1 1 1 21 49 26 o 4.035000 1.082000  3.246000 1.316000  4.823000 1.718000  -1.576000      2.164000  
1 1 1 21 49 28 o 4.113000 1.087000  4.363000 1.266000  3.863000 1.768000  0.5002000      2.175000  
1 1 1 21 49 30 o 3.495000 1.004000  3.224000 1.280000  3.766000 1.548000  -0.5424000     2.009000  
1 1 1 21 50 1  o 13.64000 0.5228000 13.60000 0.5938000 13.68000 0.8607000 -0.7679000E-01 1.046000  
1 1 1 21 50 3  o 5.886000 0.8370000 7.030000 0.6955000 4.741000 1.523000  2.289000       1.674000  
1 1 1 21 50 5  o 9.905000 0.9341000 10.50000 0.5512000 9.305000 1.785000  1.200000       1.868000  
1 1 1 21 50 7  o 3.643000 1.084000  3.389000 1.337000  3.896000 1.706000  -0.5066000     2.167000  
1 1 1 21 50 9  o 5.118000 1.049000  4.919000 1.119000  5.317000 1.773000  -0.3980000     2.097000  
1 1 1 21 50 11 f 4.875000 1.070000  4.312000 1.264000  5.437000 1.727000  -1.125000      2.141000  
1 1 1 21 50 13 o 5.001000 1.022000  4.853000 1.271000  5.149000 1.602000  -0.2959000     2.045000  
1 1 1 21 50 15 o 3.881000 1.020000  4.219000 1.331000  3.543000 1.548000  0.6760000      2.041000  
1 1 1 21 50 17 o 4.906000 1.006000  4.045000 1.329000  5.768000 1.509000  -1.723000      2.011000  
1 1 1 21 50 19 o 3.630000 0.9982000 4.187000 1.388000  3.072000 1.435000  1.115000       1.996000  
1 1 1 21 50 21 f 3.344000 1.072000  3.128000 1.385000  3.560000 1.636000  -0.4324000     2.144000  
1 1 1 21 50 23 o 4.388000 1.066000  3.601000 1.295000  5.175000 1.693000  -1.573000      2.132000  
1 1 1 21 50 25 o 4.336000 1.178000  2.232000 1.036000  6.440000 2.116000  -4.208000      2.356000  
1 1 1 21 50 27 o 4.159000 1.118000  3.074000 1.286000  5.244000 1.829000  -2.169000      2.236000  
1 1 1 21 51 0  o 7.873000 2.026000  7.873000 2.026000  7.873000 2.026000  0.000000       0.000000  
1 1 1 21 51 2  o 7.499000 0.9087000 6.686000 0.8218000 8.313000 1.621000  -1.627000      1.817000  
1 1 1 21 51 4  o 9.820000 0.6895000 10.36000 0.6035000 9.277000 1.240000  1.086000       1.379000  
1 1 1 21 51 6  o 4.701000 0.9081000 5.788000 0.9154000 3.613000 1.569000  2.175000       1.816000  
1 1 1 21 51 8  o 8.659000 0.7172000 9.143000 0.7349000 8.175000 1.232000  0.9674000      1.434000  
1 1 1 21 51 10 o 5.621000 1.063000  6.979000 1.446000  4.263000 1.558000  2.716000       2.126000  
1 1 1 21 51 12 o 8.190000 0.8231000 8.354000 0.8856000 8.026000 1.388000  0.3278000      1.646000  
1 1 1 21 51 14 o 3.584000 0.9622000 4.056000 1.305000  3.112000 1.414000  0.9441000      1.924000  
1 1 1 21 51 16 o 3.221000 0.9852000 2.824000 1.190000  3.618000 1.570000  -0.7934000     1.970000  
1 1 1 21 51 18 o 4.032000 0.9934000 4.294000 1.235000  3.771000 1.556000  0.5224000      1.987000  
1 1 1 21 51 20 o 6.662000 0.9915000 6.806000 0.8999000 6.517000 1.767000  0.2889000      1.983000  
1 1 1 21 51 22 o 6.512000 1.045000  7.051000 0.9210000 5.973000 1.876000  1.078000       2.090000  
1 1 1 21 51 24 o 4.399000 1.432000  4.399000 1.432000  ?        ?         ?              ?         
1 1 1 21 51 26 o 6.258000 1.033000  6.862000 0.9664000 5.654000 1.825000  1.208000       2.065000  
1 1 1 21 52 1  o 4.469000 1.039000  5.215000 1.472000  3.723000 1.469000  1.492000       2.079000  
1 1 1 21 52 3  o 7.041000 0.9489000 7.665000 0.9106000 6.418000 1.665000  1.247000       1.898000  
1 1 1 21 52 5  o 6.199000 1.051000  6.268000 1.334000  6.129000 1.625000  0.1386000      2.102000  
1 1 1 21 52 7  o 4.740000 1.083000  5.710000 1.468000  3.770000 1.593000  1.940000       2.166000  
1 1 1 21 52 9  o 3.834000 1.006000  3.100000 1.265000  4.568000 1.565000  -1.467000      2.012000  
1 1 1 21 52 11 o 6.473000 0.9398000 7.636000 0.8540000 5.311000 1.674000  2.325000       1.880000  
1 1 1 21 52 13 o 3.350000 0.9944000 2.801000 1.191000  3.899000 1.593000  -1.097000      1.989000  
1 1 1 21 52 15 f 5.125000 1.075000  3.883000 1.284000  6.366000 1.724000  -2.483000      2.150000  
1 1 1 21 52 17 o 4.344000 1.108000  3.550000 1.401000  5.139000 1.716000  -1.588000      2.215000  
1 1 1 21 52 19 o 4.275000 1.163000  2.554000 1.131000  5.996000 2.033000  -3.442000      2.327000  
1 1 1 21 52 21 o 3.999000 1.084000  2.702000 1.149000  5.297000 1.837000  -2.595000      2.167000  
1 1 1 21 52 23 o 3.223000 0.9871000 2.616000 1.149000  3.830000 1.605000  -1.214000      1.974000  
1 1 1 21 53 0  o 4.826000 1.707000  4.826000 1.707000  4.826000 1.707000  0.000000       0.000000  
1 1 1 21 53 2  o 3.751000 1.150000  3.625000 1.541000  3.877000 1.707000  -0.2525000     2.300000  
1 1 1 21 53 4  o 10.49000 0.8840000 12.44000 1.122000  8.540000 1.366000  3.896000       1.768000  
1 1 1 21 53 6  o 3.406000 1.000000  3.099000 1.270000  3.712000 1.545000  -0.6132000     2.000000  
1 1 1 21 53 8  o 3.582000 0.8166000 4.859000 1.181000  2.305000 1.128000  2.554000       1.633000  
1 1 1 21 53 10 o 5.655000 0.9564000 6.382000 0.9729000 4.929000 1.647000  1.453000       1.913000  
1 1 1 21 53 12 o 3.817000 1.046000  3.390000 1.236000  4.245000 1.687000  -0.8557000     2.092000  
1 1 1 21 53 14 f 3.886000 1.122000  2.995000 1.223000  4.778000 1.881000  -1.782000      2.244000  
1 1 1 21 53 16 o 5.448000 1.142000  4.727000 1.270000  6.169000 1.899000  -1.442000      2.284000  
1 1 1 21 53 18 o 4.541000 1.107000  4.415000 1.249000  4.668000 1.829000  -0.2536000     2.215000  
1 1 1 21 53 20 o 4.577000 1.033000  5.285000 1.359000  3.868000 1.555000  1.416000       2.065000  
1 1 1 21 54 1  o 4.324000 1.178000  4.692000 1.691000  3.956000 1.639000  0.7355000      2.355000  
1 1 1 21 54 3  o 3.430000 1.010000  3.823000 1.484000  3.037000 1.371000  0.7857000      2.020000  
1 1 1 21 54 5  o 5.196000 1.044000  6.752000 1.404000  3.641000 1.546000  3.111000       2.088000  
1 1 1 21 54 7  o 7.059000 1.100000  6.803000 1.062000  7.315000 1.928000  -0.5117000     2.201000  
1 1 1 21 54 9  o 3.266000 1.018000  2.996000 1.238000  3.537000 1.617000  -0.5417000     2.037000  
1 1 1 21 54 11 o 3.543000 0.9442000 3.808000 1.280000  3.279000 1.388000  0.5291000      1.888000  
1 1 1 21 54 13 o 2.989000 0.9096000 3.086000 1.219000  2.891000 1.350000  0.1951000      1.819000  
1 1 1 21 54 15 o 5.538000 0.9476000 5.866000 0.9938000 5.210000 1.614000  0.6560000      1.895000  
1 1 1 21 54 17 o 6.884000 0.9586000 5.839000 1.105000  7.928000 1.567000  -2.089000      1.917000  
1 1 1 21 55 0  o 4.107000 1.576000  4.107000 1.576000  4.107000 1.576000  0.000000       0.000000  
1 1 1 21 55 2  o 4.996000 1.184000  3.783000 1.635000  6.208000 1.714000  -2.425000      2.369000  
1 1 1 21 55 4  o 9.465000 0.8141000 10.45000 1.067000  8.476000 1.230000  1.977000       1.628000  
1 1 1 21 55 6  f 4.534000 1.095000  5.110000 1.497000  3.958000 1.598000  1.152000       2.190000  
1 1 1 21 55 8  f 3.971000 1.131000  3.587000 1.495000  4.354000 1.697000  -0.7669000     2.262000  
1 1 1 21 55 10 o 4.278000 1.045000  4.374000 1.440000  4.183000 1.515000  0.1912000      2.090000  
1 1 1 21 55 12 o 2.903000 0.9336000 2.179000 1.020000  3.627000 1.564000  -1.447000      1.867000  
1 1 1 21 55 14 o 3.469000 1.004000  4.197000 1.516000  2.741000 1.317000  1.457000       2.009000  
1 1 1 21 56 1  o 4.757000 1.175000  4.365000 1.711000  5.148000 1.611000  -0.7829000     2.350000  
1 1 1 21 56 3  o 3.860000 1.097000  3.601000 1.552000  4.119000 1.552000  -0.5179000     2.195000  
1 1 1 21 56 5  o 4.672000 1.212000  5.008000 1.721000  4.336000 1.707000  0.6715000      2.423000  
1 1 1 21 56 7  o 3.693000 1.183000  3.433000 1.603000  3.954000 1.739000  -0.5207000     2.365000  
1 1 1 22 0  0  o 34.71000 0.6003000 34.71000 0.6003000 34.71000 0.6003000 0.000000       0.000000  
1 1 1 22 0  2  o 10.64000 0.6366000 10.64000 0.6366000 10.64000 0.6366000 0.000000       0.000000  
1 1 1 22 0  4  o 92.40000 1.050000  92.40000 1.050000  92.40000 1.050000  0.000000       0.000000  
1 1 1 22 0  6  o 95.70000 0.9396000 95.70000 0.9396000 95.70000 0.9396000 0.000000       0.000000  
1 1 1 22 0  8  o 50.79000 0.5410000 50.79000 0.5410000 50.79000 0.5410000 0.000000       0.000000  
1 1 1 22 0  10 o 27.34000 0.4394000 27.34000 0.4394000 27.34000 0.4394000 0.000000       0.000000  
1 1 1 22 0  12 o 43.23000 0.6741000 43.23000 0.6741000 43.23000 0.6741000 0.000000       0.000000  
1 1 1 22 0  14 o 31.82000 0.4121000 31.82000 0.4121000 31.82000 0.4121000 0.000000       0.000000  
1 1 1 22 0  16 o 22.00000 0.4454000 22.00000 0.4454000 22.00000 0.4454000 0.000000       0.000000  
1 1 1 22 0  18 o 4.685000 1.311000  4.685000 1.311000  4.685000 1.311000  0.000000       0.000000  
1 1 1 22 0  20 o 20.65000 0.4073000 20.65000 0.4073000 20.65000 0.4073000 0.000000       0.000000  
1 1 1 22 0  22 o 42.86000 0.4867000 42.86000 0.4867000 42.86000 0.4867000 0.000000       0.000000  
1 1 1 22 0  24 o 26.11000 0.4813000 26.11000 0.4813000 26.11000 0.4813000 0.000000       0.000000  
1 1 1 22 0  26 o 7.163000 0.9094000 7.163000 0.9094000 7.163000 0.9094000 0.000000       0.000000  
1 1 1 22 0  28 o 13.46000 0.5530000 13.46000 0.5530000 13.46000 0.5530000 0.000000       0.000000  
1 1 1 22 0  30 o 27.68000 0.5031000 27.68000 0.5031000 27.68000 0.5031000 0.000000       0.000000  
1 1 1 22 0  32 o 41.62000 0.5044000 41.62000 0.5044000 41.62000 0.5044000 0.000000       0.000000  
1 1 1 22 0  34 o 7.252000 1.111000  7.252000 1.111000  7.252000 1.111000  0.000000       0.000000  
1 1 1 22 0  36 o 37.24000 0.4878000 37.24000 0.4878000 37.24000 0.4878000 0.000000       0.000000  
1 1 1 22 0  38 o 2.913000 1.335000  2.913000 1.335000  2.913000 1.335000  0.000000       0.000000  
1 1 1 22 0  40 o 5.844000 1.362000  5.844000 1.362000  5.844000 1.362000  0.000000       0.000000  
1 1 1 22 0  42 o 11.99000 0.8606000 11.99000 0.8606000 11.99000 0.8606000 0.000000       0.000000  
1 1 1 22 0  44 o 19.30000 0.4823000 19.30000 0.4823000 19.30000 0.4823000 0.000000       0.000000  
1 1 1 22 0  46 o 4.231000 1.341000  4.231000 1.341000  4.231000 1.341000  0.000000       0.000000  
1 1 1 22 0  48 o 11.73000 0.5983000 11.73000 0.5983000 11.73000 0.5983000 0.000000       0.000000  
1 1 1 22 0  50 o 2.530000 1.154000  2.530000 1.154000  2.530000 1.154000  0.000000       0.000000  
1 1 1 22 0  52 o 6.091000 1.352000  6.091000 1.352000  6.091000 1.352000  0.000000       0.000000  
1 1 1 22 0  54 o 9.298000 0.8242000 9.298000 0.8242000 9.298000 0.8242000 0.000000       0.000000  
1 1 1 22 0  56 o 9.669000 0.8369000 9.669000 0.8369000 9.669000 0.8369000 0.000000       0.000000  
1 1 1 22 0  58 o 2.874000 1.273000  2.874000 1.273000  2.874000 1.273000  0.000000       0.000000  
1 1 1 22 0  60 o 8.652000 1.106000  8.652000 1.106000  8.652000 1.106000  0.000000       0.000000  
1 1 1 22 1  1  o 28.55000 0.2956000 28.48000 0.4454000 28.62000 0.3886000 -0.1413000     0.5911000 
1 1 1 22 1  3  o 62.71000 0.4889000 63.07000 0.7427000 62.34000 0.6360000 0.7254000      0.9778000 
1 1 1 22 1  5  o 62.15000 0.4854000 62.01000 0.6331000 62.29000 0.7359000 -0.2801000     0.9708000 
1 1 1 22 1  7  o 22.44000 0.2679000 22.52000 0.3787000 22.36000 0.3790000 0.1589000      0.5357000 
1 1 1 22 1  9  o 10.39000 0.4170000 10.19000 0.5713000 10.58000 0.6076000 -0.3967000     0.8339000 
1 1 1 22 1  11 o 64.18000 0.5652000 64.02000 0.9193000 64.34000 0.6577000 -0.3208000     1.130000  
1 1 1 22 1  13 o 51.28000 0.4163000 51.56000 0.5480000 51.00000 0.6268000 0.5540000      0.8326000 
1 1 1 22 1  15 o 4.085000 0.9779000 3.329000 1.258000  4.841000 1.497000  -1.512000      1.956000  
1 1 1 22 1  17 o 28.48000 0.2831000 28.89000 0.4011000 28.07000 0.3997000 0.8167000      0.5663000 
1 1 1 22 1  19 o 11.25000 0.4226000 11.15000 0.6592000 11.36000 0.5290000 -0.2122000     0.8452000 
1 1 1 22 1  21 o 38.25000 0.3227000 38.33000 0.4587000 38.16000 0.4541000 0.1738000      0.6454000 
1 1 1 22 1  23 o 40.85000 0.3642000 40.78000 0.5519000 40.93000 0.4755000 -0.1515000     0.7285000 
1 1 1 22 1  25 o 31.64000 0.3968000 31.94000 0.5023000 31.34000 0.6144000 0.5917000      0.7936000 
1 1 1 22 1  27 o 26.01000 0.3057000 26.31000 0.4306000 25.71000 0.4340000 0.5986000      0.6114000 
1 1 1 22 1  29 o 12.47000 0.4653000 12.74000 0.6538000 12.19000 0.6622000 0.5484000      0.9306000 
1 1 1 22 1  31 o 16.52000 0.3789000 16.11000 0.5441000 16.93000 0.5273000 -0.8168000     0.7578000 
1 1 1 22 1  33 o 26.61000 0.3511000 27.26000 0.4539000 25.97000 0.5357000 1.285000       0.7021000 
1 1 1 22 1  35 o 15.99000 0.3961000 16.18000 0.5500000 15.79000 0.5701000 0.3843000      0.7922000 
1 1 1 22 1  37 o 15.72000 0.4070000 16.33000 0.5734000 15.11000 0.5777000 1.218000       0.8139000 
1 1 1 22 1  39 o 7.852000 0.8509000 7.652000 1.458000  8.052000 0.8783000 -0.4001000     1.702000  
1 1 1 22 1  41 o 4.438000 0.9209000 3.076000 1.266000  5.801000 1.338000  -2.726000      1.842000  
1 1 1 22 1  43 o 8.254000 0.6489000 8.188000 0.9945000 8.320000 0.8339000 -0.1322000     1.298000  
1 1 1 22 1  45 o 5.328000 0.8930000 5.167000 1.274000  5.489000 1.251000  -0.3219000     1.786000  
1 1 1 22 1  47 o 10.62000 0.4432000 10.18000 0.6080000 11.07000 0.6450000 -0.8975000     0.8864000 
1 1 1 22 1  49 o 9.061000 0.5387000 8.415000 0.8582000 9.707000 0.6512000 -1.292000      1.077000  
1 1 1 22 1  51 o 15.67000 0.4515000 15.01000 0.6517000 16.33000 0.6252000 -1.316000      0.9031000 
1 1 1 22 1  53 o 7.325000 0.8793000 7.549000 1.294000  7.101000 1.191000  0.4476000      1.759000  
1 1 1 22 1  55 o 6.016000 0.8755000 6.217000 1.064000  5.815000 1.391000  0.4014000      1.751000  
1 1 1 22 1  57 o 7.995000 0.7514000 7.672000 1.207000  8.317000 0.8958000 -0.6443000     1.503000  
1 1 1 22 1  59 o 4.389000 0.9981000 4.343000 1.407000  4.436000 1.416000  -0.9252000E-01 1.996000  
1 1 1 22 2  0  o 15.09000 0.4933000 15.09000 0.4933000 15.09000 0.4933000 0.000000       0.000000  
1 1 1 22 2  2  o 28.77000 0.2993000 29.31000 0.3941000 28.23000 0.4507000 1.076000       0.5987000 
1 1 1 22 2  4  f 53.33000 0.4266000 53.61000 0.5609000 53.06000 0.6429000 0.5456000      0.8533000 
1 1 1 22 2  6  o 54.97000 0.4988000 54.61000 0.5700000 55.33000 0.8188000 -0.7193000     0.9977000 
1 1 1 22 2  8  o 71.26000 0.6531000 70.83000 0.8229000 71.68000 1.014000  -0.8464000     1.306000  
1 1 1 22 2  10 o 44.43000 0.3737000 45.01000 0.4971000 43.84000 0.5580000 1.176000       0.7473000 
1 1 1 22 2  12 o 29.72000 0.3256000 29.87000 0.4612000 29.57000 0.4598000 0.3008000      0.6513000 
1 1 1 22 2  14 o 53.59000 0.4314000 53.76000 0.5684000 53.42000 0.6492000 0.3333000      0.8629000 
1 1 1 22 2  16 o 18.91000 0.2830000 18.83000 0.3902000 18.98000 0.4099000 -0.1566000     0.5660000 
1 1 1 22 2  18 o 67.18000 0.5570000 67.61000 0.7908000 66.76000 0.7847000 0.8417000      1.114000  
1 1 1 22 2  20 o 14.93000 0.3576000 15.03000 0.5576000 14.82000 0.4479000 0.2122000      0.7152000 
1 1 1 22 2  22 o 30.54000 0.3722000 30.08000 0.6110000 30.99000 0.4252000 -0.9125000     0.7444000 
1 1 1 22 2  24 o 27.25000 0.3187000 27.50000 0.4806000 27.00000 0.4188000 0.5066000      0.6374000 
1 1 1 22 2  26 o 36.37000 0.3970000 36.24000 0.4566000 36.49000 0.6496000 -0.2446000     0.7940000 
1 1 1 22 2  28 o 33.73000 0.3854000 33.90000 0.4467000 33.57000 0.6282000 0.3291000      0.7708000 
1 1 1 22 2  30 o 37.46000 0.3458000 37.00000 0.4195000 37.91000 0.5498000 -0.9110000     0.6915000 
1 1 1 22 2  32 o 50.18000 0.3976000 49.81000 0.5569000 50.55000 0.5675000 -0.7341000     0.7951000 
1 1 1 22 2  34 o 23.20000 0.3390000 23.36000 0.4708000 23.04000 0.4877000 0.3187000      0.6779000 
1 1 1 22 2  36 o 20.68000 0.3450000 20.81000 0.4884000 20.54000 0.4872000 0.2719000      0.6899000 
1 1 1 22 2  38 o 16.66000 0.3782000 16.75000 0.5256000 16.56000 0.5439000 0.1820000      0.7563000 
1 1 1 22 2  40 o 8.954000 0.7559000 9.176000 1.000000  8.731000 1.133000  0.4449000      1.512000  
1 1 1 22 2  42 o 8.765000 0.6288000 8.481000 0.8979000 9.049000 0.8806000 -0.5681000     1.258000  
1 1 1 22 2  44 o 4.691000 0.9831000 5.089000 1.446000  4.294000 1.332000  0.7949000      1.966000  
1 1 1 22 2  46 o 4.252000 0.9205000 4.075000 1.270000  4.430000 1.333000  -0.3555000     1.841000  
1 1 1 22 2  48 o 9.853000 0.5002000 10.51000 0.6508000 9.198000 0.7599000 1.311000       1.000000  
1 1 1 22 2  50 o 3.389000 0.9264000 3.440000 1.337000  3.339000 1.283000  0.1007000      1.853000  
1 1 1 22 2  52 o 3.811000 0.9838000 4.084000 1.402000  3.539000 1.380000  0.5452000      1.968000  
1 1 1 22 2  54 o 6.575000 0.9343000 6.211000 1.443000  6.940000 1.187000  -0.7288000     1.869000  
1 1 1 22 2  56 o 5.536000 1.122000  5.731000 1.815000  5.341000 1.319000  0.3898000      2.244000  
1 1 1 22 2  58 f 5.690000 0.9009000 4.752000 1.403000  6.628000 1.130000  -1.876000      1.802000  
1 1 1 22 2  60 o 3.703000 1.028000  3.510000 1.408000  3.897000 1.497000  -0.3872000     2.055000  
1 1 1 22 3  1  o 19.81000 0.2739000 20.10000 0.3850000 19.52000 0.3898000 0.5788000      0.5478000 
1 1 1 22 3  3  o 32.80000 0.3121000 32.60000 0.4082000 33.01000 0.4722000 -0.4039000     0.6242000 
1 1 1 22 3  5  o 21.92000 0.3463000 22.46000 0.4271000 21.38000 0.5454000 1.078000       0.6927000 
1 1 1 22 3  7  o 33.99000 0.4566000 34.36000 0.4193000 33.62000 0.8113000 0.7442000      0.9132000 
1 1 1 22 3  9  o 21.29000 0.2913000 21.54000 0.3806000 21.05000 0.4412000 0.4876000      0.5827000 
1 1 1 22 3  11 o 39.25000 0.3444000 39.49000 0.4539000 39.02000 0.5180000 0.4683000      0.6888000 
1 1 1 22 3  13 o 23.45000 0.2880000 23.38000 0.4335000 23.53000 0.3793000 -0.1444000     0.5760000 
1 1 1 22 3  15 f 20.74000 0.2773000 20.77000 0.3861000 20.72000 0.3980000 0.5413000E-01  0.5545000 
1 1 1 22 3  17 o 44.60000 0.3491000 44.51000 0.4938000 44.69000 0.4935000 -0.1732000     0.6981000 
1 1 1 22 3  19 o 33.11000 0.3244000 33.35000 0.4922000 32.88000 0.4227000 0.4669000      0.6488000 
1 1 1 22 3  21 o 38.99000 0.4155000 38.96000 0.6412000 39.01000 0.5287000 -0.4999000E-01 0.8310000 
1 1 1 22 3  23 o 32.17000 0.3347000 31.90000 0.5134000 32.43000 0.4297000 -0.5222000     0.6695000 
1 1 1 22 3  25 o 51.03000 0.3930000 50.49000 0.5528000 51.56000 0.5588000 -1.072000      0.7861000 
1 1 1 22 3  27 o 23.36000 0.3122000 23.09000 0.4446000 23.63000 0.4385000 -0.5425000     0.6244000 
1 1 1 22 3  29 o 20.54000 0.3662000 20.93000 0.4947000 20.16000 0.5401000 0.7649000      0.7325000 
1 1 1 22 3  31 o 13.40000 0.4474000 12.96000 0.5691000 13.85000 0.6905000 -0.8857000     0.8948000 
1 1 1 22 3  33 o 27.49000 0.3285000 27.29000 0.4576000 27.69000 0.4713000 -0.4076000     0.6569000 
1 1 1 22 3  35 o 40.48000 0.3548000 40.05000 0.4953000 40.91000 0.5081000 -0.8533000     0.7096000 
1 1 1 22 3  37 o 9.067000 0.6086000 9.171000 0.8328000 8.962000 0.8878000 0.2094000      1.217000  
1 1 1 22 3  39 o 4.553000 1.014000  4.788000 1.441000  4.319000 1.427000  0.4685000      2.028000  
1 1 1 22 3  41 o 24.56000 0.3521000 24.79000 0.5274000 24.32000 0.4666000 0.4738000      0.7041000 
1 1 1 22 3  43 o 9.937000 0.5120000 10.34000 0.6571000 9.538000 0.7853000 0.7988000      1.024000  
1 1 1 22 3  45 o 16.42000 0.3872000 16.31000 0.5970000 16.52000 0.4932000 -0.2098000     0.7743000 
1 1 1 22 3  47 o 15.66000 0.3671000 14.94000 0.5438000 16.38000 0.4934000 -1.444000      0.7343000 
1 1 1 22 3  49 f 13.00000 0.4192000 12.46000 0.5775000 13.55000 0.6077000 -1.086000      0.8384000 
1 1 1 22 3  51 o 4.907000 0.9621000 4.598000 1.377000  5.217000 1.344000  -0.6190000     1.924000  
1 1 1 22 3  53 o 6.924000 0.9443000 6.259000 1.333000  7.589000 1.338000  -1.330000      1.889000  
1 1 1 22 3  55 o 4.416000 1.060000  3.585000 1.623000  5.246000 1.363000  -1.662000      2.120000  
1 1 1 22 3  57 o 3.955000 1.029000  3.980000 1.532000  3.930000 1.373000  0.5000000E-01  2.057000  
1 1 1 22 3  59 o 5.546000 0.9477000 6.187000 1.221000  4.904000 1.450000  1.283000       1.895000  
1 1 1 22 4  0  o 72.53000 0.7298000 72.53000 0.7298000 72.53000 0.7298000 0.000000       0.000000  
1 1 1 22 4  2  o 9.014000 0.4703000 9.256000 0.5753000 8.772000 0.7442000 0.4837000      0.9406000 
1 1 1 22 4  4  o 43.81000 0.3408000 43.49000 0.4793000 44.12000 0.4848000 -0.6312000     0.6817000 
1 1 1 22 4  6  o 22.83000 0.2834000 22.55000 0.3727000 23.11000 0.4270000 -0.5530000     0.5668000 
1 1 1 22 4  8  o 65.90000 0.5123000 65.24000 0.6634000 66.56000 0.7809000 -1.318000      1.025000  
1 1 1 22 4  10 o 38.27000 0.3126000 38.22000 0.4447000 38.32000 0.4395000 -0.9981000E-01 0.6252000 
1 1 1 22 4  12 o 20.89000 0.2732000 20.62000 0.3823000 21.16000 0.3904000 -0.5403000     0.5464000 
1 1 1 22 4  14 o 41.84000 0.3331000 41.51000 0.4696000 42.17000 0.4726000 -0.6582000     0.6662000 
1 1 1 22 4  16 o 25.96000 0.2964000 26.02000 0.4425000 25.90000 0.3944000 0.1130000      0.5928000 
1 1 1 22 4  18 o 30.04000 0.3119000 29.86000 0.4725000 30.22000 0.4072000 -0.3584000     0.6238000 
1 1 1 22 4  20 o 25.08000 0.2845000 24.64000 0.4035000 25.53000 0.4012000 -0.8878000     0.5691000 
1 1 1 22 4  22 o 36.84000 0.3176000 37.18000 0.4514000 36.49000 0.4471000 0.6866000      0.6353000 
1 1 1 22 4  24 o 21.17000 0.4837000 21.49000 0.8445000 20.85000 0.4718000 0.6345000      0.9673000 
1 1 1 22 4  26 o 17.18000 0.3559000 17.08000 0.4782000 17.28000 0.5272000 -0.2071000     0.7118000 
1 1 1 22 4  28 o 4.985000 1.021000  4.505000 1.212000  5.465000 1.644000  -0.9604000     2.043000  
1 1 1 22 4  30 o 30.36000 0.3603000 29.92000 0.4994000 30.80000 0.5195000 -0.8851000     0.7206000 
1 1 1 22 4  32 o 30.12000 0.3391000 30.19000 0.4062000 30.05000 0.5431000 0.1414000      0.6782000 
1 1 1 22 4  34 o 19.68000 0.3614000 19.83000 0.4908000 19.54000 0.5308000 0.2908000      0.7229000 
1 1 1 22 4  36 o 10.03000 0.5446000 9.921000 0.7667000 10.13000 0.7738000 -0.2137000     1.089000  
1 1 1 22 4  38 f 11.65000 0.4902000 10.95000 0.7012000 12.34000 0.6853000 -1.390000      0.9804000 
1 1 1 22 4  40 o 25.64000 0.3483000 25.67000 0.4436000 25.60000 0.5371000 0.7097000E-01  0.6967000 
1 1 1 22 4  42 o 17.07000 0.4531000 16.98000 0.7233000 17.16000 0.5458000 -0.1784000     0.9061000 
1 1 1 22 4  44 o 8.893000 0.5471000 9.438000 0.7185000 8.348000 0.8252000 1.090000       1.094000  
1 1 1 22 4  46 o 10.87000 0.4597000 10.82000 0.6676000 10.92000 0.6321000 -0.1033000     0.9194000 
1 1 1 22 4  48 o 11.80000 0.4538000 11.70000 0.6658000 11.89000 0.6169000 -0.1915000     0.9077000 
1 1 1 22 4  50 o 14.90000 0.4444000 15.12000 0.5476000 14.69000 0.7000000 0.4301000      0.8887000 
1 1 1 22 4  52 o 4.259000 1.022000  4.007000 1.379000  4.511000 1.509000  -0.5039000     2.044000  
1 1 1 22 4  54 f 6.128000 0.9027000 4.475000 1.564000  7.781000 0.9014000 -3.306000      1.805000  
1 1 1 22 4  56 o 6.779000 0.8409000 5.656000 1.349000  7.902000 1.005000  -2.246000      1.682000  
1 1 1 22 4  58 o 3.623000 0.9564000 4.336000 1.438000  2.911000 1.262000  1.425000       1.913000  
1 1 1 22 4  60 o 3.057000 0.9515000 3.052000 1.319000  3.062000 1.371000  -0.9996000E-02 1.903000  
1 1 1 22 5  1  o 99.21000 0.7422000 99.30000 1.122000  99.12000 0.9716000 0.1726000      1.484000  
1 1 1 22 5  3  o 79.52000 0.6029000 79.33000 0.7883000 79.71000 0.9124000 -0.3802000     1.206000  
1 1 1 22 5  5  o 55.12000 0.4375000 54.97000 0.5749000 55.26000 0.6597000 -0.2855000     0.8751000 
1 1 1 22 5  7  o 87.82000 0.6135000 87.40000 0.8638000 88.23000 0.8714000 -0.8341000     1.227000  
1 1 1 22 5  9  o 46.38000 0.3842000 47.07000 0.5088000 45.69000 0.5760000 1.383000       0.7685000 
1 1 1 22 5  11 o 62.37000 0.4503000 62.64000 0.6388000 62.10000 0.6348000 0.5394000      0.9006000 
1 1 1 22 5  13 o 24.09000 0.2894000 23.75000 0.4400000 24.42000 0.3762000 -0.6689000     0.5789000 
1 1 1 22 5  15 o 38.87000 0.3449000 39.21000 0.5255000 38.54000 0.4466000 0.6644000      0.6897000 
1 1 1 22 5  17 o 40.03000 0.3500000 40.05000 0.5293000 40.02000 0.4582000 0.2978000E-01  0.7001000 
1 1 1 22 5  19 o 56.51000 0.4188000 56.07000 0.5886000 56.95000 0.5959000 -0.8840000     0.8376000 
1 1 1 22 5  21 o 53.56000 0.4036000 52.99000 0.5658000 54.13000 0.5757000 -1.139000      0.8072000 
1 1 1 22 5  23 f 35.75000 0.3412000 36.02000 0.5190000 35.49000 0.4431000 0.5269000      0.6824000 
1 1 1 22 5  25 o 45.89000 0.3988000 45.87000 0.6097000 45.90000 0.5143000 -0.3276000E-01 0.7977000 
1 1 1 22 5  27 o 33.53000 0.4833000 33.70000 0.4379000 33.37000 0.8618000 0.3385000      0.9667000 
1 1 1 22 5  29 o 30.04000 0.3285000 29.72000 0.3905000 30.35000 0.5284000 -0.6303000     0.6571000 
1 1 1 22 5  31 o 32.68000 0.3515000 32.43000 0.4505000 32.93000 0.5398000 -0.4971000     0.7031000 
1 1 1 22 5  33 o 43.12000 0.3661000 42.72000 0.5096000 43.51000 0.5259000 -0.7938000     0.7323000 
1 1 1 22 5  35 o 14.12000 0.4344000 13.91000 0.6114000 14.33000 0.6171000 -0.4241000     0.8687000 
1 1 1 22 5  37 f 24.07000 0.3277000 23.94000 0.4484000 24.20000 0.4781000 -0.2639000     0.6555000 
1 1 1 22 5  39 o 7.995000 0.6846000 8.285000 0.9774000 7.704000 0.9589000 0.5802000      1.369000  
1 1 1 22 5  41 o 25.99000 0.3348000 25.55000 0.4433000 26.43000 0.5019000 -0.8825000     0.6697000 
1 1 1 22 5  43 o 8.149000 0.7386000 8.533000 1.160000  7.764000 0.9145000 0.7692000      1.477000  
1 1 1 22 5  45 o 2.834000 0.8676000 2.785000 1.217000  2.883000 1.236000  -0.9772000E-01 1.735000  
1 1 1 22 5  47 o 5.597000 0.8136000 6.792000 1.035000  4.402000 1.256000  2.390000       1.627000  
1 1 1 22 5  49 o 4.483000 1.011000  4.964000 1.395000  4.002000 1.464000  0.9622000      2.023000  
1 1 1 22 5  51 o 11.23000 0.5614000 11.50000 0.7688000 10.96000 0.8183000 0.5491000      1.123000  
1 1 1 22 5  53 o 8.815000 0.7056000 8.643000 1.033000  8.986000 0.9614000 -0.3435000     1.411000  
1 1 1 22 5  55 o 3.419000 0.9846000 4.317000 1.594000  2.522000 1.156000  1.795000       1.969000  
1 1 1 22 5  57 o 5.579000 0.9279000 4.622000 1.449000  6.535000 1.159000  -1.912000      1.856000  
1 1 1 22 5  59 o 5.323000 0.9337000 4.967000 1.388000  5.679000 1.249000  -0.7113000     1.867000  
1 1 1 22 6  0  o 7.301000 0.8074000 7.301000 0.8074000 7.301000 0.8074000 0.000000       0.000000  
1 1 1 22 6  2  o 8.506000 0.5649000 8.448000 0.6908000 8.564000 0.8940000 -0.1163000     1.130000  
1 1 1 22 6  4  o 21.57000 0.2793000 21.51000 0.3692000 21.63000 0.4193000 -0.1180000     0.5587000 
1 1 1 22 6  6  o 22.79000 0.2693000 22.85000 0.3814000 22.74000 0.3802000 0.1142000      0.5385000 
1 1 1 22 6  8  o 54.24000 0.4020000 54.82000 0.5738000 53.66000 0.5632000 1.158000       0.8040000 
1 1 1 22 6  10 o 34.61000 0.3414000 34.73000 0.4784000 34.48000 0.4873000 0.2569000      0.6829000 
1 1 1 22 6  12 o 36.17000 0.3263000 35.86000 0.4895000 36.47000 0.4315000 -0.6066000     0.6525000 
1 1 1 22 6  14 o 31.73000 0.3435000 31.35000 0.5529000 32.11000 0.4079000 -0.7665000     0.6870000 
1 1 1 22 6  16 o 10.56000 0.3815000 10.70000 0.5249000 10.42000 0.5537000 0.2790000      0.7629000 
1 1 1 22 6  18 o 26.37000 0.2778000 26.42000 0.3942000 26.32000 0.3914000 0.9352000E-01  0.5555000 
1 1 1 22 6  20 o 38.29000 0.3208000 38.09000 0.4529000 38.50000 0.4545000 -0.4048000     0.6416000 
1 1 1 22 6  22 o 46.00000 0.3903000 46.09000 0.5906000 45.92000 0.5103000 0.1682000      0.7806000 
1 1 1 22 6  24 o 17.65000 0.3193000 17.75000 0.4572000 17.56000 0.4459000 0.1909000      0.6387000 
1 1 1 22 6  26 o 24.06000 0.4031000 23.79000 0.5134000 24.33000 0.6217000 -0.5339000     0.8062000 
1 1 1 22 6  28 o 26.30000 0.3318000 26.17000 0.4229000 26.43000 0.5115000 -0.2593000     0.6637000 
1 1 1 22 6  30 o 20.94000 0.4129000 20.78000 0.4471000 21.10000 0.6944000 -0.3270000     0.8259000 
1 1 1 22 6  32 o 51.94000 0.4372000 52.45000 0.5738000 51.42000 0.6599000 1.026000       0.8745000 
1 1 1 22 6  34 o 25.71000 0.3318000 25.27000 0.4603000 26.16000 0.4780000 -0.8883000     0.6636000 
1 1 1 22 6  36 o 9.229000 0.6036000 8.762000 0.8948000 9.695000 0.8105000 -0.9330000     1.207000  
1 1 1 22 6  38 o 14.82000 0.4220000 15.21000 0.6019000 14.43000 0.5915000 0.7774000      0.8439000 
1 1 1 22 6  40 o 5.499000 0.9570000 4.727000 1.356000  6.271000 1.351000  -1.544000      1.914000  
1 1 1 22 6  42 o 20.60000 0.3654000 20.89000 0.5462000 20.30000 0.4856000 0.5952000      0.7309000 
1 1 1 22 6  44 o 18.38000 0.3379000 17.81000 0.4780000 18.94000 0.4776000 -1.132000      0.6757000 
1 1 1 22 6  46 o 16.68000 0.3625000 16.25000 0.5202000 17.12000 0.5051000 -0.8730000     0.7251000 
1 1 1 22 6  48 o 8.449000 0.6808000 7.632000 0.9661000 9.265000 0.9594000 -1.632000      1.362000  
1 1 1 22 6  50 o 11.29000 0.4877000 10.64000 0.7616000 11.93000 0.6093000 -1.286000      0.9754000 
1 1 1 22 6  52 o 7.302000 0.7501000 6.861000 1.182000  7.743000 0.9232000 -0.8820000     1.500000  
1 1 1 22 6  54 o 8.817000 0.6463000 8.255000 0.9965000 9.380000 0.8234000 -1.125000      1.293000  
1 1 1 22 6  56 o 4.760000 1.048000  4.273000 1.621000  5.247000 1.327000  -0.9734000     2.095000  
1 1 1 22 6  58 o 3.499000 0.9736000 2.883000 1.325000  4.115000 1.427000  -1.232000      1.947000  
1 1 1 22 6  60 o 4.875000 1.326000  5.307000 1.947000  4.443000 1.800000  0.8645000      2.651000  
1 1 1 22 7  1  o 71.11000 0.5810000 71.09000 0.8214000 71.13000 0.8220000 -0.4061000E-01 1.162000  
1 1 1 22 7  3  o 43.95000 0.3687000 44.03000 0.5557000 43.88000 0.4845000 0.1493000      0.7373000 
1 1 1 22 7  5  o 18.41000 0.3088000 18.58000 0.4195000 18.24000 0.4534000 0.3420000      0.6177000 
1 1 1 22 7  7  o 78.92000 0.6001000 79.25000 0.9107000 78.60000 0.7817000 0.6455000      1.200000  
1 1 1 22 7  9  o 88.71000 0.7141000 89.16000 1.013000  88.26000 1.007000  0.8978000      1.428000  
1 1 1 22 7  11 o 34.17000 0.3190000 34.00000 0.4753000 34.34000 0.4255000 -0.3389000     0.6380000 
1 1 1 22 7  13 o 33.13000 0.2931000 33.11000 0.4154000 33.15000 0.4137000 -0.4438000E-01 0.5862000 
1 1 1 22 7  15 o 33.25000 0.3166000 32.68000 0.4746000 33.82000 0.4192000 -1.143000      0.6332000 
1 1 1 22 7  17 o 36.24000 0.3073000 36.16000 0.4340000 36.32000 0.4352000 -0.1538000     0.6146000 
1 1 1 22 7  19 o 49.74000 0.3791000 49.50000 0.5339000 49.99000 0.5384000 -0.4838000     0.7582000 
1 1 1 22 7  21 o 62.62000 0.4563000 62.59000 0.6462000 62.65000 0.6445000 -0.6882000E-01 0.9126000 
1 1 1 22 7  23 o 6.386000 0.6808000 5.997000 1.023000  6.775000 0.8991000 -0.7781000     1.362000  
1 1 1 22 7  25 o 40.63000 0.3379000 40.41000 0.4777000 40.86000 0.4780000 -0.4468000     0.6758000 
1 1 1 22 7  27 o 37.73000 0.5165000 38.16000 0.4727000 37.30000 0.9186000 0.8652000      1.033000  
1 1 1 22 7  29 o 52.06000 0.4160000 52.63000 0.5115000 51.48000 0.6561000 1.155000       0.8320000 
1 1 1 22 7  31 o 45.86000 0.4606000 46.32000 0.5231000 45.41000 0.7582000 0.9086000      0.9211000 
1 1 1 22 7  33 o 4.231000 1.123000  4.628000 1.535000  3.835000 1.639000  0.7925000      2.246000  
1 1 1 22 7  35 f 3.095000 0.9333000 3.306000 1.349000  2.883000 1.290000  0.4225000      1.867000  
1 1 1 22 7  37 o 17.60000 0.3705000 17.45000 0.5177000 17.75000 0.5303000 -0.3014000     0.7411000 
1 1 1 22 7  39 o 25.45000 0.3467000 26.00000 0.5099000 24.89000 0.4699000 1.107000       0.6934000 
1 1 1 22 7  41 o 19.12000 0.3539000 18.81000 0.4550000 19.42000 0.5421000 -0.6038000     0.7077000 
1 1 1 22 7  43 o 19.68000 0.3308000 19.55000 0.4653000 19.82000 0.4703000 -0.2770000     0.6616000 
1 1 1 22 7  45 o 2.724000 0.8473000 3.009000 1.270000  2.439000 1.122000  0.5691000      1.695000  
1 1 1 22 7  47 o 4.538000 1.072000  4.438000 1.523000  4.638000 1.508000  -0.2000000     2.143000  
1 1 1 22 7  49 o 14.44000 0.4694000 14.05000 0.7444000 14.83000 0.5721000 -0.7800000     0.9389000 
1 1 1 22 7  51 o 4.025000 1.011000  3.274000 1.410000  4.775000 1.451000  -1.501000      2.023000  
1 1 1 22 7  53 o 10.07000 0.6117000 10.35000 0.9082000 9.786000 0.8196000 0.5665000      1.223000  
1 1 1 22 7  55 o 5.145000 0.9665000 4.225000 1.507000  6.066000 1.210000  -1.841000      1.933000  
1 1 1 22 7  57 o 8.922000 0.7064000 9.005000 1.100000  8.838000 0.8863000 0.1669000      1.413000  
1 1 1 22 7  59 o 6.840000 0.9688000 6.513000 1.446000  7.167000 1.290000  -0.6545000     1.938000  
1 1 1 22 8  0  o 77.54000 0.7721000 77.54000 0.7721000 77.54000 0.7721000 0.000000       0.000000  
1 1 1 22 8  2  o 25.86000 0.2660000 25.99000 0.3785000 25.73000 0.3738000 0.2598000      0.5320000 
1 1 1 22 8  4  o 68.76000 0.5275000 68.28000 0.7917000 69.23000 0.6973000 -0.9492000     1.055000  
1 1 1 22 8  6  o 29.05000 0.3121000 29.33000 0.4410000 28.76000 0.4418000 0.5660000      0.6242000 
1 1 1 22 8  8  o 25.33000 0.3670000 25.39000 0.4670000 25.28000 0.5664000 0.1068000      0.7341000 
1 1 1 22 8  10 o 45.27000 0.3803000 45.54000 0.4979000 45.01000 0.5749000 0.5300000      0.7605000 
1 1 1 22 8  12 o 14.79000 0.3005000 14.96000 0.4135000 14.63000 0.4362000 0.3300000      0.6011000 
1 1 1 22 8  14 o 42.76000 0.3630000 42.78000 0.5477000 42.73000 0.4766000 0.4681000E-01  0.7260000 
1 1 1 22 8  16 o 29.36000 0.2805000 29.51000 0.3985000 29.22000 0.3949000 0.2865000      0.5611000 
1 1 1 22 8  18 o 42.63000 0.3396000 42.69000 0.4817000 42.57000 0.4787000 0.1208000      0.6791000 
1 1 1 22 8  20 o 23.77000 0.2782000 23.33000 0.3939000 24.22000 0.3930000 -0.8899000     0.5565000 
1 1 1 22 8  22 o 50.26000 0.4140000 49.71000 0.6220000 50.81000 0.5464000 -1.100000      0.8279000 
1 1 1 22 8  24 o 70.12000 0.5046000 69.51000 0.7083000 70.73000 0.7188000 -1.215000      1.009000  
1 1 1 22 8  26 o 11.29000 0.6658000 12.17000 0.4925000 10.42000 1.237000  1.750000       1.332000  
1 1 1 22 8  28 o 23.97000 0.3299000 23.91000 0.3830000 24.02000 0.5373000 -0.1149000     0.6598000 
1 1 1 22 8  30 o 32.37000 0.3982000 32.15000 0.4441000 32.59000 0.6611000 -0.4389000     0.7964000 
1 1 1 22 8  32 o 26.07000 0.3932000 26.46000 0.4029000 25.68000 0.6753000 0.7720000      0.7864000 
1 1 1 22 8  34 o 17.52000 0.4255000 17.28000 0.5779000 17.76000 0.6246000 -0.4883000     0.8509000 
1 1 1 22 8  36 o 4.684000 1.051000  5.403000 1.441000  3.965000 1.530000  1.437000       2.102000  
1 1 1 22 8  38 o 19.16000 0.3716000 19.31000 0.5550000 19.02000 0.4944000 0.2892000      0.7433000 
1 1 1 22 8  40 o 17.63000 0.3840000 18.00000 0.4827000 17.26000 0.5974000 0.7414000      0.7681000 
1 1 1 22 8  42 f 12.01000 0.4552000 11.92000 0.6274000 12.10000 0.6597000 -0.1752000     0.9104000 
1 1 1 22 8  44 o 6.494000 0.7961000 6.745000 1.101000  6.244000 1.150000  0.5006000      1.592000  
1 1 1 22 8  46 o 8.714000 0.5723000 9.167000 0.8082000 8.260000 0.8105000 0.9073000      1.145000  
1 1 1 22 8  48 o 7.507000 0.9489000 7.847000 1.637000  7.167000 0.9606000 0.6803000      1.898000  
1 1 1 22 8  50 o 7.724000 0.7471000 8.632000 1.062000  6.817000 1.051000  1.815000       1.494000  
1 1 1 22 8  52 o 6.604000 0.8206000 7.880000 1.036000  5.328000 1.273000  2.552000       1.641000  
1 1 1 22 8  54 o 8.686000 0.6416000 8.576000 0.9666000 8.796000 0.8442000 -0.2199000     1.283000  
1 1 1 22 8  56 o 4.468000 0.9722000 4.122000 1.460000  4.814000 1.284000  -0.6922000     1.944000  
1 1 1 22 8  58 o 3.612000 0.9951000 3.546000 1.431000  3.678000 1.383000  -0.1315000     1.990000  
1 1 1 22 9  1  o 62.06000 0.4475000 61.82000 0.6309000 62.29000 0.6350000 -0.4698000     0.8951000 
1 1 1 22 9  3  o 31.66000 0.2835000 31.94000 0.4002000 31.38000 0.4018000 0.5630000      0.5671000 
1 1 1 22 9  5  o 45.19000 0.3479000 45.00000 0.4902000 45.39000 0.4936000 -0.3886000     0.6957000 
1 1 1 22 9  7  o 39.74000 0.3200000 39.91000 0.4538000 39.56000 0.4511000 0.3575000      0.6399000 
1 1 1 22 9  9  o 8.466000 0.5146000 8.884000 0.6684000 8.047000 0.7826000 0.8375000      1.029000  
1 1 1 22 9  11 o 33.04000 0.3171000 32.89000 0.4116000 33.20000 0.4824000 -0.3055000     0.6341000 
1 1 1 22 9  13 o 44.13000 0.3433000 44.05000 0.4838000 44.21000 0.4871000 -0.1631000     0.6865000 
1 1 1 22 9  15 o 19.36000 0.2983000 19.21000 0.4491000 19.50000 0.3926000 -0.2885000     0.5965000 
1 1 1 22 9  17 o 17.05000 0.3857000 16.19000 0.6183000 17.90000 0.4611000 -1.702000      0.7713000 
1 1 1 22 9  19 o 15.19000 0.3106000 14.96000 0.4427000 15.43000 0.4357000 -0.4758000     0.6211000 
1 1 1 22 9  21 o 24.17000 0.2967000 23.89000 0.4469000 24.45000 0.3903000 -0.5637000     0.5934000 
1 1 1 22 9  23 o 28.49000 0.2918000 28.53000 0.4116000 28.45000 0.4139000 0.7908000E-01  0.5837000 
1 1 1 22 9  25 o 40.98000 0.4006000 41.21000 0.4283000 40.75000 0.6770000 0.4583000      0.8011000 
1 1 1 22 9  27 o 70.11000 0.6030000 69.79000 0.6356000 70.43000 1.025000  -0.6449000     1.206000  
1 1 1 22 9  29 o 51.37000 0.4753000 51.31000 0.5019000 51.43000 0.8072000 -0.1258000     0.9505000 
1 1 1 22 9  31 f 57.65000 0.4526000 57.09000 0.5454000 58.20000 0.7224000 -1.119000      0.9052000 
1 1 1 22 9  33 o 36.18000 0.3470000 35.76000 0.4216000 36.60000 0.5511000 -0.8413000     0.6939000 
1 1 1 22 9  35 o 19.24000 0.3924000 18.56000 0.6027000 19.93000 0.5026000 -1.365000      0.7847000 
1 1 1 22 9  37 f 28.65000 0.3831000 28.33000 0.6104000 28.97000 0.4631000 -0.6397000     0.7662000 
1 1 1 22 9  39 o 22.84000 0.3733000 22.77000 0.5148000 22.92000 0.5408000 -0.1513000     0.7467000 
1 1 1 22 9  41 o 10.77000 0.5184000 11.59000 0.6618000 9.961000 0.7982000 1.626000       1.037000  
1 1 1 22 9  43 o 8.989000 0.5633000 8.385000 0.8443000 9.593000 0.7459000 -1.208000      1.127000  
1 1 1 22 9  45 o 6.449000 0.7778000 5.636000 1.187000  7.262000 1.005000  -1.626000      1.556000  
1 1 1 22 9  47 o 15.70000 0.4487000 15.73000 0.7157000 15.66000 0.5416000 0.6796000E-01  0.8975000 
1 1 1 22 9  49 o 3.865000 1.063000  4.335000 1.621000  3.396000 1.374000  0.9390000      2.126000  
1 1 1 22 9  51 o 8.090000 0.7054000 7.289000 1.113000  8.891000 0.8665000 -1.602000      1.411000  
1 1 1 22 9  53 o 4.518000 1.049000  4.975000 1.596000  4.061000 1.362000  0.9146000      2.098000  
1 1 1 22 9  55 o 8.399000 0.6521000 8.162000 0.9534000 8.636000 0.8898000 -0.4743000     1.304000  
1 1 1 22 9  57 o 11.94000 0.4971000 12.23000 0.7319000 11.66000 0.6730000 0.5650000      0.9943000 
1 1 1 22 9  59 o 3.585000 0.9973000 3.586000 1.412000  3.585000 1.409000  0.8647000E-03  1.995000  
1 1 1 22 10 0  o 33.68000 0.4847000 33.68000 0.4847000 33.68000 0.4847000 0.000000       0.000000  
1 1 1 22 10 2  o 36.13000 0.3012000 36.25000 0.4267000 36.01000 0.4251000 0.2400000      0.6023000 
1 1 1 22 10 4  f 45.35000 0.3488000 45.18000 0.4909000 45.52000 0.4957000 -0.3448000     0.6976000 
1 1 1 22 10 6  o 40.21000 0.3218000 40.00000 0.4539000 40.42000 0.4564000 -0.4241000     0.6436000 
1 1 1 22 10 8  o 3.995000 0.8068000 4.484000 1.069000  3.505000 1.208000  0.9789000      1.614000  
1 1 1 22 10 10 o 30.13000 0.2798000 30.46000 0.3980000 29.80000 0.3935000 0.6627000      0.5597000 
1 1 1 22 10 12 o 13.22000 0.3311000 13.31000 0.4949000 13.12000 0.4398000 0.1942000      0.6621000 
1 1 1 22 10 14 o 25.48000 0.2695000 25.65000 0.3816000 25.31000 0.3807000 0.3455000      0.5391000 
1 1 1 22 10 16 o 21.14000 0.2714000 21.17000 0.3843000 21.11000 0.3834000 0.6451000E-01  0.5429000 
1 1 1 22 10 18 o 26.69000 0.2787000 26.79000 0.3958000 26.59000 0.3925000 0.2050000      0.5575000 
1 1 1 22 10 20 o 37.73000 0.3403000 37.49000 0.5117000 37.97000 0.4487000 -0.4814000     0.6806000 
1 1 1 22 10 22 o 34.68000 0.3316000 34.58000 0.4292000 34.77000 0.5056000 -0.1817000     0.6632000 
1 1 1 22 10 24 o 39.92000 0.3471000 39.94000 0.4184000 39.91000 0.5540000 0.2328000E-01  0.6942000 
1 1 1 22 10 26 o 16.20000 0.3673000 16.16000 0.4160000 16.24000 0.6055000 -0.8502000E-01 0.7346000 
1 1 1 22 10 28 o 15.06000 0.4517000 14.83000 0.4702000 15.29000 0.7715000 -0.4576000     0.9035000 
1 1 1 22 10 30 o 27.61000 0.3385000 27.10000 0.4311000 28.12000 0.5220000 -1.025000      0.6770000 
1 1 1 22 10 32 o 23.44000 0.3628000 23.51000 0.4690000 23.36000 0.5535000 0.1502000      0.7255000 
1 1 1 22 10 34 o 24.54000 0.3384000 24.27000 0.4066000 24.81000 0.5411000 -0.5384000     0.6768000 
1 1 1 22 10 36 o 24.65000 0.3724000 24.81000 0.5690000 24.48000 0.4806000 0.3342000      0.7448000 
1 1 1 22 10 38 o 9.403000 0.5748000 9.046000 0.8453000 9.761000 0.7792000 -0.7149000     1.150000  
1 1 1 22 10 40 o 11.70000 0.5259000 11.66000 0.6581000 11.74000 0.8206000 -0.7800000E-01 1.052000  
1 1 1 22 10 42 o 11.42000 0.5281000 10.97000 0.7700000 11.87000 0.7230000 -0.9037000     1.056000  
1 1 1 22 10 44 o 2.998000 0.8926000 2.712000 1.224000  3.283000 1.299000  -0.5706000     1.785000  
1 1 1 22 10 46 o 7.254000 0.7697000 7.151000 1.199000  7.356000 0.9659000 -0.2046000     1.539000  
1 1 1 22 10 48 o 5.678000 0.9707000 5.252000 1.394000  6.103000 1.352000  -0.8516000     1.941000  
1 1 1 22 10 50 o 9.960000 0.5602000 10.24000 0.8187000 9.682000 0.7649000 0.5564000      1.120000  
1 1 1 22 10 52 o 3.075000 0.9405000 2.896000 1.303000  3.254000 1.356000  -0.3582000     1.881000  
1 1 1 22 10 54 o 12.74000 0.4512000 12.95000 0.6771000 12.53000 0.5967000 0.4213000      0.9025000 
1 1 1 22 10 56 o 6.121000 0.8787000 5.512000 1.353000  6.730000 1.122000  -1.218000      1.757000  
1 1 1 22 10 58 o 7.880000 0.7833000 8.336000 1.252000  7.423000 0.9414000 0.9129000      1.567000  
1 1 1 22 11 1  o 31.68000 0.2824000 31.55000 0.3983000 31.81000 0.4004000 -0.2594000     0.5648000 
1 1 1 22 11 3  o 30.94000 0.2793000 30.78000 0.3915000 31.10000 0.3985000 -0.3176000     0.5586000 
1 1 1 22 11 5  o 61.88000 0.4469000 61.72000 0.6302000 62.05000 0.6337000 -0.3223000     0.8938000 
1 1 1 22 11 7  o 50.83000 0.4110000 50.87000 0.5360000 50.79000 0.6232000 0.7898000E-01  0.8220000 
1 1 1 22 11 9  o 23.47000 0.2921000 22.86000 0.3702000 24.08000 0.4520000 -1.226000      0.5842000 
1 1 1 22 11 11 o 39.48000 0.4031000 38.96000 0.4464000 40.01000 0.6714000 -1.044000      0.8062000 
1 1 1 22 11 13 o 22.14000 0.3515000 22.51000 0.4145000 21.77000 0.5679000 0.7368000      0.7030000 
1 1 1 22 11 15 o 54.13000 0.4663000 54.37000 0.6601000 53.90000 0.6589000 0.4741000      0.9327000 
1 1 1 22 11 17 o 61.34000 0.4465000 61.20000 0.6308000 61.48000 0.6321000 -0.2784000     0.8931000 
1 1 1 22 11 19 f 48.30000 0.4009000 48.32000 0.6064000 48.29000 0.5247000 0.3427000E-01  0.8019000 
1 1 1 22 11 21 o 29.34000 0.2854000 29.44000 0.4054000 29.25000 0.4019000 0.1823000      0.5708000 
1 1 1 22 11 23 o 22.26000 0.3063000 21.68000 0.3579000 22.84000 0.4973000 -1.155000      0.6127000 
1 1 1 22 11 25 o 30.80000 0.3577000 30.21000 0.3752000 31.39000 0.6092000 -1.176000      0.7155000 
1 1 1 22 11 27 o 39.27000 0.5502000 39.01000 0.4213000 39.52000 1.017000  -0.5093000     1.100000  
1 1 1 22 11 29 o 8.560000 0.5915000 8.186000 0.7218000 8.935000 0.9372000 -0.7486000     1.183000  
1 1 1 22 11 31 o 6.940000 0.7357000 5.876000 1.016000  8.004000 1.064000  -2.128000      1.471000  
1 1 1 22 11 33 o 20.30000 0.3594000 19.98000 0.4421000 20.63000 0.5667000 -0.6447000     0.7188000 
1 1 1 22 11 35 o 32.08000 0.3407000 31.76000 0.4172000 32.40000 0.5387000 -0.6456000     0.6814000 
1 1 1 22 11 37 o 21.75000 0.3582000 21.58000 0.5343000 21.92000 0.4771000 -0.3347000     0.7163000 
1 1 1 22 11 39 o 13.47000 0.4200000 13.60000 0.5958000 13.34000 0.5922000 0.2530000      0.8400000 
1 1 1 22 11 41 o 5.135000 0.9423000 4.901000 1.348000  5.369000 1.317000  -0.4681000     1.885000  
1 1 1 22 11 43 o 2.753000 0.8475000 3.337000 1.335000  2.169000 1.044000  1.167000       1.695000  
1 1 1 22 11 45 o 4.813000 1.028000  4.575000 1.470000  5.052000 1.437000  -0.4766000     2.055000  
1 1 1 22 11 47 o 3.696000 1.015000  3.393000 1.403000  3.998000 1.468000  -0.6052000     2.030000  
1 1 1 22 11 49 o 2.608000 0.8454000 3.070000 1.342000  2.146000 1.029000  0.9238000      1.691000  
1 1 1 22 11 51 o 6.347000 0.8683000 5.352000 1.387000  7.343000 1.045000  -1.991000      1.737000  
1 1 1 22 11 53 o 7.847000 0.7677000 7.231000 1.238000  8.462000 0.9089000 -1.231000      1.535000  
1 1 1 22 11 55 o 10.59000 0.5392000 10.60000 0.7818000 10.58000 0.7428000 0.1804000E-01  1.078000  
1 1 1 22 11 57 o 6.267000 0.9160000 7.265000 1.093000  5.270000 1.470000  1.996000       1.832000  
1 1 1 22 11 59 o 5.173000 1.164000  5.006000 1.584000  5.340000 1.704000  -0.3334000     2.327000  
1 1 1 22 12 0  o 37.87000 0.4383000 37.87000 0.4383000 37.87000 0.4383000 0.000000       0.000000  
1 1 1 22 12 2  o 9.433000 0.3957000 9.401000 0.5416000 9.464000 0.5770000 -0.6253000E-01 0.7914000 
1 1 1 22 12 4  o 42.95000 0.3651000 42.97000 0.4750000 42.92000 0.5544000 0.5263000E-01  0.7301000 
1 1 1 22 12 6  o 49.99000 0.4086000 49.84000 0.5304000 50.14000 0.6217000 -0.2967000     0.8172000 
1 1 1 22 12 8  o 9.038000 0.4046000 10.02000 0.5246000 8.053000 0.6163000 1.970000       0.8093000 
1 1 1 22 12 10 f 32.71000 0.2885000 32.76000 0.4073000 32.66000 0.4086000 0.9831000E-01  0.5769000 
1 1 1 22 12 12 o 17.94000 0.2952000 18.30000 0.3810000 17.57000 0.4509000 0.7323000      0.5903000 
1 1 1 22 12 14 o 51.91000 0.3877000 51.92000 0.5488000 51.90000 0.5477000 0.2011000E-01  0.7753000 
1 1 1 22 12 16 o 19.18000 0.3923000 19.58000 0.5047000 18.77000 0.6007000 0.8076000      0.7845000 
1 1 1 22 12 18 o 24.30000 0.3247000 24.16000 0.4434000 24.43000 0.4744000 -0.2708000     0.6493000 
1 1 1 22 12 20 o 49.91000 0.3809000 49.74000 0.5380000 50.07000 0.5394000 -0.3310000     0.7619000 
1 1 1 22 12 22 o 34.44000 0.3215000 33.99000 0.3786000 34.88000 0.5196000 -0.8874000     0.6429000 
1 1 1 22 12 24 o 26.55000 0.3517000 26.70000 0.3591000 26.40000 0.6048000 0.2936000      0.7034000 
1 1 1 22 12 26 o 35.11000 0.3804000 34.77000 0.3949000 35.45000 0.6502000 -0.6806000     0.7608000 
1 1 1 22 12 28 o 65.33000 0.4962000 64.78000 0.5986000 65.89000 0.7915000 -1.114000      0.9924000 
1 1 1 22 12 30 o 17.77000 0.3804000 17.35000 0.4937000 18.19000 0.5788000 -0.8418000     0.7607000 
1 1 1 22 12 32 o 18.02000 0.3661000 17.96000 0.4463000 18.08000 0.5805000 -0.1181000     0.7323000 
1 1 1 22 12 34 o 24.08000 0.3325000 23.95000 0.4053000 24.21000 0.5273000 -0.2606000     0.6650000 
1 1 1 22 12 36 o 36.16000 0.3887000 36.39000 0.5468000 35.92000 0.5526000 0.4716000      0.7775000 
1 1 1 22 12 38 o 20.04000 0.3415000 20.32000 0.4745000 19.77000 0.4913000 0.5448000      0.6830000 
1 1 1 22 12 40 o 4.185000 1.043000  3.632000 1.340000  4.737000 1.598000  -1.105000      2.086000  
1 1 1 22 12 42 o 9.667000 0.9764000 10.11000 1.777000  9.226000 0.8104000 0.8821000      1.953000  
1 1 1 22 12 44 o 2.659000 0.8317000 2.609000 1.174000  2.709000 1.178000  -0.1007000     1.663000  
1 1 1 22 12 46 o 8.146000 0.6965000 7.802000 0.9956000 8.490000 0.9744000 -0.6883000     1.393000  
1 1 1 22 12 48 o 13.57000 0.5356000 13.72000 0.8060000 13.43000 0.7055000 0.2875000      1.071000  
1 1 1 22 12 50 o 6.529000 1.015000  6.215000 1.762000  6.843000 1.009000  -0.6281000     2.031000  
1 1 1 22 12 52 o 8.235000 0.6937000 8.165000 0.9293000 8.305000 1.030000  -0.1395000     1.387000  
1 1 1 22 12 54 o 10.14000 0.5659000 9.806000 0.8356000 10.48000 0.7633000 -0.6712000     1.132000  
1 1 1 22 12 56 o 6.302000 0.9733000 5.963000 1.308000  6.641000 1.442000  -0.6778000     1.947000  
1 1 1 22 12 58 o 6.812000 0.8755000 6.293000 1.274000  7.331000 1.202000  -1.038000      1.751000  
1 1 1 22 13 1  o 26.05000 0.2670000 26.13000 0.3788000 25.98000 0.3763000 0.1563000      0.5340000 
1 1 1 22 13 3  o 44.25000 0.3726000 43.88000 0.4828000 44.63000 0.5676000 -0.7500000     0.7451000 
1 1 1 22 13 5  o 23.48000 0.2881000 23.55000 0.3656000 23.41000 0.4454000 0.1392000      0.5762000 
1 1 1 22 13 7  o 46.50000 0.3547000 46.83000 0.5058000 46.18000 0.4976000 0.6569000      0.7095000 
1 1 1 22 13 9  o 26.80000 0.2682000 27.00000 0.3818000 26.59000 0.3767000 0.4085000      0.5364000 
1 1 1 22 13 11 o 36.01000 0.3016000 36.61000 0.4328000 35.41000 0.4203000 1.207000       0.6033000 
1 1 1 22 13 13 o 44.13000 0.3440000 43.83000 0.4834000 44.43000 0.4897000 -0.6040000     0.6880000 
1 1 1 22 13 15 o 26.40000 0.3030000 25.76000 0.3816000 27.05000 0.4707000 -1.289000      0.6059000 
1 1 1 22 13 17 o 11.61000 0.3764000 11.70000 0.5253000 11.52000 0.5393000 0.1760000      0.7529000 
1 1 1 22 13 19 o 32.73000 0.3583000 32.85000 0.5156000 32.61000 0.4978000 0.2464000      0.7167000 
1 1 1 22 13 21 o 16.46000 0.4281000 17.32000 0.4388000 15.60000 0.7352000 1.716000       0.8562000 
1 1 1 22 13 23 o 12.32000 0.4493000 12.08000 0.4462000 12.56000 0.7800000 -0.4761000     0.8986000 
1 1 1 22 13 25 o 39.23000 0.3961000 38.76000 0.4119000 39.69000 0.6768000 -0.9289000     0.7923000 
1 1 1 22 13 27 o 21.30000 0.3774000 20.68000 0.3811000 21.93000 0.6516000 -1.254000      0.7548000 
1 1 1 22 13 29 o 16.29000 0.3961000 15.67000 0.4886000 16.91000 0.6235000 -1.238000      0.7921000 
1 1 1 22 13 31 o 14.44000 0.4097000 14.67000 0.4830000 14.21000 0.6619000 0.4539000      0.8194000 
1 1 1 22 13 33 o 5.189000 0.9805000 5.089000 1.290000  5.289000 1.477000  -0.2003000     1.961000  
1 1 1 22 13 35 o 23.62000 0.3336000 24.21000 0.4121000 23.03000 0.5247000 1.178000       0.6672000 
1 1 1 22 13 37 o 14.94000 0.4012000 14.70000 0.5772000 15.18000 0.5573000 -0.4841000     0.8023000 
1 1 1 22 13 39 o 5.922000 0.9040000 6.456000 1.119000  5.389000 1.420000  1.067000       1.808000  
1 1 1 22 13 41 o 8.744000 0.5732000 8.682000 0.8054000 8.807000 0.8157000 -0.1252000     1.146000  
1 1 1 22 13 43 o 12.84000 0.4681000 12.63000 0.6134000 13.05000 0.7074000 -0.4120000     0.9363000 
1 1 1 22 13 45 o 21.24000 0.3581000 21.40000 0.4725000 21.08000 0.5383000 0.3196000      0.7162000 
1 1 1 22 13 47 o 14.95000 0.3945000 15.25000 0.5668000 14.65000 0.5489000 0.6066000      0.7890000 
1 1 1 22 13 49 o 3.328000 0.9494000 3.087000 1.343000  3.569000 1.342000  -0.4815000     1.899000  
1 1 1 22 13 51 o 2.919000 0.9455000 3.000000 1.420000  2.838000 1.249000  0.1618000      1.891000  
1 1 1 22 13 53 o 6.709000 0.8052000 6.639000 1.112000  6.780000 1.165000  -0.1417000     1.610000  
1 1 1 22 13 55 o 3.903000 0.9848000 3.288000 1.335000  4.519000 1.448000  -1.231000      1.970000  
1 1 1 22 13 57 o 5.290000 1.040000  5.518000 1.334000  5.061000 1.595000  0.4576000      2.080000  
1 1 1 22 14 0  o 72.82000 0.7286000 72.82000 0.7286000 72.82000 0.7286000 0.000000       0.000000  
1 1 1 22 14 2  o 31.11000 0.3070000 31.33000 0.3987000 30.88000 0.4670000 0.4417000      0.6140000 
1 1 1 22 14 4  o 43.70000 0.3398000 43.41000 0.4762000 44.00000 0.4849000 -0.5884000     0.6796000 
1 1 1 22 14 6  o 36.99000 0.3054000 37.28000 0.4364000 36.70000 0.4275000 0.5799000      0.6109000 
1 1 1 22 14 8  o 85.76000 0.5994000 85.96000 0.8496000 85.55000 0.8458000 0.4092000      1.199000  
1 1 1 22 14 10 o 34.05000 0.2935000 33.57000 0.4114000 34.53000 0.4186000 -0.9552000     0.5869000 
1 1 1 22 14 12 o 26.12000 0.2884000 26.62000 0.3803000 25.63000 0.4338000 0.9879000      0.5769000 
1 1 1 22 14 14 o 27.38000 0.2738000 27.22000 0.3848000 27.55000 0.3895000 -0.3349000     0.5475000 
1 1 1 22 14 16 o 35.63000 0.3662000 35.70000 0.5930000 35.57000 0.4297000 0.1305000      0.7323000 
1 1 1 22 14 18 o 33.10000 0.3432000 33.63000 0.4854000 32.58000 0.4854000 1.047000       0.6865000 
1 1 1 22 14 20 o 32.77000 0.3837000 32.73000 0.4742000 32.81000 0.6032000 -0.7228000E-01 0.7673000 
1 1 1 22 14 22 o 18.06000 0.4805000 16.97000 0.4742000 19.15000 0.8358000 -2.180000      0.9609000 
1 1 1 22 14 24 o 36.92000 0.3344000 36.71000 0.3958000 37.13000 0.5390000 -0.4276000     0.6688000 
1 1 1 22 14 26 o 8.034000 0.5983000 7.499000 0.7496000 8.569000 0.9328000 -1.070000      1.197000  
1 1 1 22 14 28 o 20.96000 0.3383000 20.95000 0.4193000 20.97000 0.5310000 -0.2121000E-01 0.6766000 
1 1 1 22 14 30 o 30.73000 0.3381000 30.83000 0.4313000 30.62000 0.5207000 0.2044000      0.6761000 
1 1 1 22 14 32 o 25.87000 0.3297000 26.01000 0.3896000 25.72000 0.5320000 0.2939000      0.6594000 
1 1 1 22 14 34 o 21.13000 0.3691000 20.63000 0.5062000 21.64000 0.5373000 -1.014000      0.7382000 
1 1 1 22 14 36 o 14.66000 0.4135000 14.39000 0.5359000 14.93000 0.6299000 -0.5417000     0.8270000 
1 1 1 22 14 38 o 22.53000 0.3620000 22.18000 0.5605000 22.87000 0.4582000 -0.6904000     0.7239000 
1 1 1 22 14 40 o 14.05000 0.4315000 12.98000 0.5842000 15.12000 0.6352000 -2.141000      0.8630000 
1 1 1 22 14 42 o 22.56000 0.3676000 22.85000 0.4979000 22.28000 0.5409000 0.5621000      0.7352000 
1 1 1 22 14 44 o 5.636000 0.8589000 6.004000 1.151000  5.269000 1.276000  0.7351000      1.718000  
1 1 1 22 14 46 o 14.47000 0.3918000 13.91000 0.5625000 15.03000 0.5455000 -1.122000      0.7835000 
1 1 1 22 14 48 o 14.50000 0.4002000 14.73000 0.5685000 14.28000 0.5635000 0.4451000      0.8005000 
1 1 1 22 14 50 o 6.475000 0.8220000 6.892000 1.163000  6.058000 1.162000  0.8342000      1.644000  
1 1 1 22 14 52 o 6.568000 0.8567000 5.957000 1.375000  7.179000 1.023000  -1.222000      1.713000  
1 1 1 22 14 54 o 3.975000 1.067000  4.356000 1.503000  3.594000 1.516000  0.7619000      2.135000  
1 1 1 22 14 56 o 5.332000 0.9723000 5.505000 1.388000  5.160000 1.362000  0.3451000      1.945000  
1 1 1 22 14 58 o 10.62000 0.5479000 10.35000 0.8303000 10.89000 0.7151000 -0.5461000     1.096000  
1 1 1 22 15 1  o 39.78000 0.3678000 40.64000 0.5201000 38.92000 0.5202000 1.716000       0.7356000 
1 1 1 22 15 3  o 33.41000 0.2886000 33.86000 0.4096000 32.95000 0.4067000 0.9123000      0.5772000 
1 1 1 22 15 5  o 22.66000 0.2614000 22.98000 0.3733000 22.33000 0.3661000 0.6477000      0.5229000 
1 1 1 22 15 7  o 21.95000 0.2897000 22.05000 0.4512000 21.85000 0.3634000 0.1993000      0.5794000 
1 1 1 22 15 9  o 34.54000 0.3251000 34.27000 0.4982000 34.82000 0.4177000 -0.5530000     0.6502000 
1 1 1 22 15 11 o 31.40000 0.3170000 31.67000 0.4927000 31.12000 0.3990000 0.5457000      0.6340000 
1 1 1 22 15 13 o 20.35000 0.3603000 20.65000 0.5777000 20.05000 0.4307000 0.6049000      0.7206000 
1 1 1 22 15 15 o 59.09000 0.5330000 58.71000 0.8724000 59.48000 0.6127000 -0.7672000     1.066000  
1 1 1 22 15 17 o 26.58000 0.3132000 26.35000 0.4935000 26.81000 0.3859000 -0.4511000     0.6265000 
1 1 1 22 15 19 o 26.51000 0.3713000 26.90000 0.4015000 26.13000 0.6247000 0.7701000      0.7426000 
1 1 1 22 15 21 o 15.76000 0.4809000 16.02000 0.3637000 15.51000 0.8904000 0.5115000      0.9618000 
1 1 1 22 15 23 o 25.51000 0.3596000 25.45000 0.5120000 25.57000 0.5051000 -0.1184000     0.7192000 
1 1 1 22 15 25 o 18.24000 0.4350000 18.08000 0.4464000 18.40000 0.7467000 -0.3209000     0.8700000 
1 1 1 22 15 27 o 9.196000 0.6755000 8.914000 0.6647000 9.479000 1.176000  -0.5651000     1.351000  
1 1 1 22 15 29 o 16.57000 0.3602000 15.96000 0.4285000 17.19000 0.5791000 -1.226000      0.7204000 
1 1 1 22 15 31 o 27.07000 0.3234000 27.14000 0.3901000 27.01000 0.5159000 0.1272000      0.6468000 
1 1 1 22 15 33 o 14.14000 0.4036000 13.91000 0.4822000 14.38000 0.6473000 -0.4741000     0.8072000 
1 1 1 22 15 35 o 13.32000 0.4543000 12.45000 0.6159000 14.19000 0.6681000 -1.743000      0.9087000 
1 1 1 22 15 37 o 3.714000 1.091000  4.128000 1.706000  3.300000 1.360000  0.8288000      2.182000  
1 1 1 22 15 39 o 20.47000 0.4322000 20.81000 0.5509000 20.14000 0.6661000 0.6654000      0.8644000 
1 1 1 22 15 41 o 4.018000 1.016000  3.540000 1.359000  4.496000 1.510000  -0.9560000     2.031000  
1 1 1 22 15 43 o 5.566000 0.8312000 6.134000 1.057000  4.998000 1.283000  1.135000       1.662000  
1 1 1 22 15 45 o 5.321000 0.8979000 5.348000 1.251000  5.293000 1.289000  0.5464000E-01  1.796000  
1 1 1 22 15 47 o 7.526000 0.6619000 7.865000 0.8880000 7.188000 0.9817000 0.6772000      1.324000  
1 1 1 22 15 49 o 8.973000 0.5999000 9.212000 0.8864000 8.734000 0.8086000 0.4779000      1.200000  
1 1 1 22 15 51 o 4.543000 1.025000  3.891000 1.453000  5.195000 1.446000  -1.305000      2.050000  
1 1 1 22 15 53 o 7.180000 0.8104000 7.237000 1.142000  7.123000 1.150000  0.1142000      1.621000  
1 1 1 22 15 55 o 8.022000 0.6922000 7.453000 1.021000  8.592000 0.9347000 -1.138000      1.384000  
1 1 1 22 15 57 o 3.944000 0.9957000 3.795000 1.445000  4.093000 1.371000  -0.2987000     1.991000  
1 1 1 22 16 0  o 18.17000 0.4606000 18.17000 0.4606000 18.17000 0.4606000 0.000000       0.000000  
1 1 1 22 16 2  o 38.49000 0.3120000 38.24000 0.4399000 38.74000 0.4425000 -0.5018000     0.6240000 
1 1 1 22 16 4  o 12.90000 0.3118000 13.18000 0.4340000 12.62000 0.4478000 0.5540000      0.6236000 
1 1 1 22 16 6  o 38.30000 0.3421000 37.61000 0.5219000 39.00000 0.4425000 -1.389000      0.6842000 
1 1 1 22 16 8  o 12.72000 0.3527000 12.95000 0.5461000 12.48000 0.4466000 0.4700000      0.7055000 
1 1 1 22 16 10 o 39.17000 0.3380000 39.05000 0.4493000 39.29000 0.5052000 -0.2405000     0.6761000 
1 1 1 22 16 12 o 54.69000 0.4377000 54.80000 0.5709000 54.59000 0.6637000 0.2150000      0.8754000 
1 1 1 22 16 14 o 45.76000 0.3790000 45.88000 0.5718000 45.63000 0.4976000 0.2502000      0.7580000 
1 1 1 22 16 16 o 17.86000 0.2824000 17.96000 0.4186000 17.77000 0.3792000 0.1949000      0.5648000 
1 1 1 22 16 18 o 59.42000 0.5382000 59.25000 0.6171000 59.60000 0.8820000 -0.3472000     1.076000  
1 1 1 22 16 20 o 40.05000 0.5033000 38.88000 0.4053000 41.22000 0.9214000 -2.341000      1.007000  
1 1 1 22 16 22 o 61.85000 0.4705000 62.29000 0.5741000 61.40000 0.7456000 0.8924000      0.9410000 
1 1 1 22 16 24 f 22.85000 0.3918000 22.95000 0.4726000 22.74000 0.6251000 0.2087000      0.7837000 
1 1 1 22 16 26 o 6.712000 0.7531000 6.471000 0.8379000 6.953000 1.252000  -0.4818000     1.506000  
1 1 1 22 16 28 o 13.72000 0.3969000 14.14000 0.4537000 13.30000 0.6513000 0.8336000      0.7937000 
1 1 1 22 16 30 f 30.69000 0.3388000 30.87000 0.4204000 30.50000 0.5315000 0.3683000      0.6777000 
1 1 1 22 16 32 f 23.13000 0.3478000 23.31000 0.4669000 22.95000 0.5156000 0.3545000      0.6956000 
1 1 1 22 16 34 o 39.29000 0.3542000 40.03000 0.4370000 38.55000 0.5575000 1.488000       0.7084000 
1 1 1 22 16 36 o 24.62000 0.3449000 24.84000 0.4565000 24.41000 0.5170000 0.4242000      0.6897000 
1 1 1 22 16 38 f 13.46000 0.4205000 13.16000 0.5510000 13.76000 0.6353000 -0.6024000     0.8410000 
1 1 1 22 16 40 o 13.81000 0.4558000 13.56000 0.6390000 14.07000 0.6502000 -0.5118000     0.9116000 
1 1 1 22 16 42 o 23.28000 0.3377000 24.18000 0.4908000 22.39000 0.4640000 1.794000       0.6754000 
1 1 1 22 16 44 f 9.950000 0.4989000 9.485000 0.7078000 10.42000 0.7035000 -0.9308000     0.9979000 
1 1 1 22 16 46 o 11.87000 0.4356000 11.62000 0.6196000 12.13000 0.6124000 -0.5057000     0.8712000 
1 1 1 22 16 48 o 10.20000 0.5223000 9.539000 0.8070000 10.86000 0.6632000 -1.324000      1.045000  
1 1 1 22 16 50 o 6.975000 0.9263000 5.832000 1.500000  8.117000 1.088000  -2.286000      1.853000  
1 1 1 22 16 52 o 12.48000 0.5373000 11.45000 0.8530000 13.51000 0.6536000 -2.059000      1.075000  
1 1 1 22 16 54 f 5.807000 0.8919000 6.333000 1.163000  5.281000 1.352000  1.052000       1.784000  
1 1 1 22 16 56 o 4.206000 1.031000  3.797000 1.427000  4.615000 1.488000  -0.8182000     2.062000  
1 1 1 22 17 1  o 79.26000 0.5564000 79.59000 0.7902000 78.94000 0.7836000 0.6538000      1.113000  
1 1 1 22 17 3  o 26.96000 0.2635000 26.86000 0.3724000 27.06000 0.3728000 -0.2002000     0.5270000 
1 1 1 22 17 5  o 33.90000 0.3201000 33.80000 0.4930000 34.00000 0.4085000 -0.1947000     0.6403000 
1 1 1 22 17 7  o 21.93000 0.2566000 22.17000 0.3640000 21.69000 0.3616000 0.4792000      0.5131000 
1 1 1 22 17 9  o 20.32000 0.2610000 20.47000 0.3682000 20.18000 0.3701000 0.2993000      0.5221000 
1 1 1 22 17 11 o 11.11000 0.3214000 11.13000 0.4616000 11.10000 0.4474000 0.3008000E-01  0.6429000 
1 1 1 22 17 13 o 39.37000 0.3666000 39.57000 0.5144000 39.17000 0.5224000 0.3989000      0.7332000 
1 1 1 22 17 15 o 10.77000 0.3337000 11.02000 0.4611000 10.52000 0.4825000 0.5046000      0.6674000 
1 1 1 22 17 17 o 13.13000 0.3953000 12.67000 0.3685000 13.60000 0.6995000 -0.9281000     0.7906000 
1 1 1 22 17 19 o 67.81000 0.5784000 67.76000 0.6133000 67.87000 0.9808000 -0.1019000     1.157000  
1 1 1 22 17 21 o 21.21000 0.3749000 21.29000 0.4551000 21.14000 0.5960000 0.1511000      0.7499000 
1 1 1 22 17 23 o 55.27000 0.5045000 55.84000 0.5777000 54.71000 0.8273000 1.125000       1.009000  
1 1 1 22 17 25 o 44.40000 0.3918000 44.71000 0.5093000 44.10000 0.5956000 0.6080000      0.7836000 
1 1 1 22 17 27 o 11.81000 0.5116000 11.82000 0.4931000 11.80000 0.8966000 0.1961000E-01  1.023000  
1 1 1 22 17 29 o 16.01000 0.3642000 15.65000 0.4323000 16.38000 0.5864000 -0.7382000     0.7285000 
1 1 1 22 17 31 o 20.49000 0.3310000 20.47000 0.3889000 20.50000 0.5359000 -0.2492000E-01 0.6621000 
1 1 1 22 17 33 o 9.406000 0.5618000 8.269000 0.7656000 10.54000 0.8224000 -2.273000      1.124000  
1 1 1 22 17 35 o 24.56000 0.3359000 25.03000 0.4292000 24.09000 0.5168000 0.9396000      0.6718000 
1 1 1 22 17 37 o 4.568000 1.004000  4.359000 1.424000  4.777000 1.414000  -0.4180000     2.007000  
1 1 1 22 17 39 o 28.83000 0.3959000 28.60000 0.4237000 29.06000 0.6689000 -0.4619000     0.7918000 
1 1 1 22 17 41 o 5.429000 0.9248000 6.029000 1.337000  4.829000 1.278000  1.200000       1.850000  
1 1 1 22 17 43 o 13.44000 0.3896000 13.03000 0.5568000 13.86000 0.5451000 -0.8256000     0.7792000 
1 1 1 22 17 45 o 10.89000 0.4710000 10.84000 0.6803000 10.95000 0.6517000 -0.1134000     0.9421000 
1 1 1 22 17 47 o 6.980000 0.7323000 7.399000 1.023000  6.562000 1.048000  0.8379000      1.465000  
1 1 1 22 17 49 f 5.122000 0.9569000 4.235000 1.455000  6.010000 1.244000  -1.775000      1.914000  
1 1 1 22 17 51 f 4.425000 1.107000  4.122000 1.607000  4.728000 1.524000  -0.6060000     2.215000  
1 1 1 22 17 53 o 10.73000 0.6432000 11.16000 0.9699000 10.29000 0.8452000 0.8699000      1.286000  
1 1 1 22 17 55 o 3.982000 1.014000  3.965000 1.455000  3.999000 1.412000  -0.3408000E-01 2.028000  
1 1 1 22 17 57 o 9.179000 0.5900000 9.415000 0.8819000 8.943000 0.7840000 0.4729000      1.180000  
1 1 1 22 18 0  o 24.52000 0.6101000 24.52000 0.6101000 24.52000 0.6101000 0.000000       0.000000  
1 1 1 22 18 2  o 21.25000 0.2552000 21.02000 0.3589000 21.49000 0.3630000 -0.4677000     0.5104000 
1 1 1 22 18 4  o 15.93000 0.3203000 16.28000 0.5068000 15.57000 0.3920000 0.7116000      0.6407000 
1 1 1 22 18 6  o 13.51000 0.2911000 13.38000 0.4249000 13.65000 0.3981000 -0.2700000     0.5823000 
1 1 1 22 18 8  o 50.69000 0.3794000 50.67000 0.5360000 50.72000 0.5370000 -0.5766000E-01 0.7587000 
1 1 1 22 18 10 o 80.63000 0.6520000 81.05000 0.9264000 80.21000 0.9176000 0.8383000      1.304000  
1 1 1 22 18 12 o 33.02000 0.3957000 32.74000 0.4602000 33.31000 0.6439000 -0.5667000     0.7914000 
1 1 1 22 18 14 o 30.34000 0.2962000 30.74000 0.3989000 29.93000 0.4381000 0.8178000      0.5925000 
1 1 1 22 18 16 o 5.172000 0.8256000 5.404000 0.7287000 4.940000 1.482000  0.4643000      1.651000  
1 1 1 22 18 18 o 19.79000 0.4869000 19.32000 0.3901000 20.26000 0.8922000 -0.9425000     0.9738000 
1 1 1 22 18 20 o 13.20000 0.3697000 13.46000 0.3819000 12.94000 0.6331000 0.5140000      0.7394000 
1 1 1 22 18 22 o 17.64000 0.4440000 17.82000 0.6953000 17.45000 0.5524000 0.3687000      0.8880000 
1 1 1 22 18 24 o 21.59000 0.3151000 22.17000 0.3637000 21.02000 0.5146000 1.154000       0.6301000 
1 1 1 22 18 26 o 31.01000 0.3184000 30.66000 0.3731000 31.35000 0.5161000 -0.6878000     0.6368000 
1 1 1 22 18 28 o 17.81000 0.4079000 17.76000 0.4200000 17.86000 0.6994000 -0.9981000E-01 0.8158000 
1 1 1 22 18 30 o 5.447000 0.9055000 6.129000 1.023000  4.765000 1.495000  1.364000       1.811000  
1 1 1 22 18 32 o 33.35000 0.3797000 33.50000 0.5374000 33.20000 0.5367000 0.2954000      0.7595000 
1 1 1 22 18 34 o 15.56000 0.3825000 15.58000 0.4765000 15.53000 0.5986000 0.5394000E-01  0.7651000 
1 1 1 22 18 36 o 17.32000 0.3505000 17.65000 0.4090000 16.99000 0.5692000 0.6668000      0.7009000 
1 1 1 22 18 38 o 11.13000 0.7331000 11.27000 0.7182000 10.98000 1.278000  0.2845000      1.466000  
1 1 1 22 18 40 o 3.782000 0.9275000 3.977000 1.283000  3.586000 1.340000  0.3909000      1.855000  
1 1 1 22 18 42 o 4.300000 1.044000  4.609000 1.593000  3.990000 1.350000  0.6184000      2.088000  
1 1 1 22 18 44 o 3.903000 0.8875000 4.909000 1.285000  2.896000 1.225000  2.013000       1.775000  
1 1 1 22 18 46 o 4.069000 0.9408000 4.681000 1.331000  3.457000 1.330000  1.225000       1.882000  
1 1 1 22 18 48 o 4.264000 0.9859000 4.038000 1.447000  4.491000 1.339000  -0.4523000     1.972000  
1 1 1 22 18 50 o 14.80000 0.5178000 15.14000 0.5810000 14.47000 0.8574000 0.6724000      1.036000  
1 1 1 22 18 52 o 16.54000 0.4426000 16.38000 0.6404000 16.71000 0.6110000 -0.3350000     0.8852000 
1 1 1 22 18 54 o 6.270000 0.9858000 6.097000 1.459000  6.444000 1.326000  -0.3469000     1.972000  
1 1 1 22 18 56 o 3.101000 0.9393000 3.302000 1.372000  2.900000 1.283000  0.4019000      1.879000  
1 1 1 22 19 1  o 55.46000 0.4438000 55.70000 0.6759000 55.22000 0.5754000 0.4758000      0.8876000 
1 1 1 22 19 3  o 37.32000 0.3364000 37.74000 0.5189000 36.90000 0.4282000 0.8463000      0.6728000 
1 1 1 22 19 5  o 39.25000 0.3162000 39.17000 0.4471000 39.33000 0.4473000 -0.1624000     0.6325000 
1 1 1 22 19 7  o 68.03000 0.5230000 67.83000 0.7860000 68.23000 0.6901000 -0.3978000     1.046000  
1 1 1 22 19 9  o 23.32000 0.2710000 23.58000 0.4078000 23.05000 0.3569000 0.5335000      0.5419000 
1 1 1 22 19 11 o 34.07000 0.3135000 34.05000 0.4179000 34.09000 0.4676000 -0.4296000E-01 0.6271000 
1 1 1 22 19 13 o 45.63000 0.4274000 45.56000 0.4989000 45.70000 0.6941000 -0.1401000     0.8548000 
1 1 1 22 19 15 o 45.08000 0.3644000 45.42000 0.4370000 44.73000 0.5833000 0.6841000      0.7288000 
1 1 1 22 19 17 o 11.21000 0.4318000 10.91000 0.3582000 11.51000 0.7857000 -0.5994000     0.8635000 
1 1 1 22 19 19 o 38.04000 0.4299000 39.09000 0.5286000 36.99000 0.6780000 2.097000       0.8597000 
1 1 1 22 19 21 o 15.38000 0.3374000 15.61000 0.3722000 15.14000 0.5629000 0.4686000      0.6749000 
1 1 1 22 19 23 o 8.351000 0.5203000 7.927000 0.5592000 8.775000 0.8775000 -0.8480000     1.041000  
1 1 1 22 19 25 o 21.31000 0.3197000 21.77000 0.3589000 20.86000 0.5293000 0.9053000      0.6395000 
1 1 1 22 19 27 o 19.24000 0.4037000 18.88000 0.3753000 19.61000 0.7149000 -0.7263000     0.8074000 
1 1 1 22 19 29 o 17.01000 0.3545000 16.55000 0.4186000 17.47000 0.5722000 -0.9224000     0.7090000 
1 1 1 22 19 31 o 32.68000 0.3372000 33.02000 0.4015000 32.33000 0.5417000 0.6918000      0.6743000 
1 1 1 22 19 33 o 23.99000 0.3299000 24.44000 0.4044000 23.53000 0.5213000 0.9106000      0.6598000 
1 1 1 22 19 35 o 15.73000 0.3613000 15.57000 0.4200000 15.88000 0.5881000 -0.3120000     0.7227000 
1 1 1 22 19 37 o 3.308000 0.9668000 3.352000 1.211000  3.264000 1.507000  0.8825000E-01  1.934000  
1 1 1 22 19 39 o 12.58000 0.4853000 12.56000 0.6565000 12.60000 0.7148000 -0.3846000E-01 0.9706000 
1 1 1 22 19 41 o 8.030000 0.6178000 7.692000 0.9018000 8.368000 0.8445000 -0.6760000     1.236000  
1 1 1 22 19 43 o 10.01000 0.4832000 9.677000 0.6882000 10.34000 0.6785000 -0.6631000     0.9664000 
1 1 1 22 19 45 o 5.420000 0.8745000 6.090000 1.153000  4.749000 1.315000  1.341000       1.749000  
1 1 1 22 19 47 o 5.228000 0.9025000 4.971000 1.335000  5.486000 1.214000  -0.5148000     1.805000  
1 1 1 22 19 49 o 11.17000 0.5057000 11.32000 0.7152000 11.03000 0.7153000 0.2862000      1.011000  
1 1 1 22 19 51 o 13.08000 0.5155000 13.17000 0.6598000 13.00000 0.7921000 0.1730000      1.031000  
1 1 1 22 19 53 o 5.046000 1.022000  4.496000 1.411000  5.596000 1.480000  -1.101000      2.045000  
1 1 1 22 19 55 o 8.675000 0.7757000 8.697000 1.222000  8.653000 0.9556000 0.4399000E-01  1.551000  
1 1 1 22 20 0  o 7.751000 0.6032000 7.751000 0.6032000 7.751000 0.6032000 0.000000       0.000000  
1 1 1 22 20 2  o 28.02000 0.4780000 28.27000 0.8804000 27.78000 0.3724000 0.4944000      0.9559000 
1 1 1 22 20 4  o 40.88000 0.3662000 41.15000 0.5204000 40.62000 0.5152000 0.5336000      0.7324000 
1 1 1 22 20 6  o 11.81000 0.3289000 11.82000 0.4759000 11.80000 0.4542000 0.2636000E-01  0.6578000 
1 1 1 22 20 8  o 24.57000 0.3214000 24.08000 0.3970000 25.07000 0.5054000 -0.9976000     0.6427000 
1 1 1 22 20 10 o 13.29000 0.3992000 13.43000 0.5977000 13.15000 0.5292000 0.2786000      0.7983000 
1 1 1 22 20 12 o 65.56000 0.4721000 65.48000 0.6654000 65.64000 0.6699000 -0.1582000     0.9442000 
1 1 1 22 20 14 o 59.55000 0.4518000 60.16000 0.5513000 58.95000 0.7159000 1.205000       0.9036000 
1 1 1 22 20 16 f 3.541000 0.8509000 3.526000 0.9285000 3.556000 1.426000  -0.2958000E-01 1.702000  
1 1 1 22 20 18 o 40.40000 0.3546000 40.34000 0.4413000 40.46000 0.5551000 -0.1194000     0.7092000 
1 1 1 22 20 20 o 30.88000 0.3135000 31.07000 0.3771000 30.69000 0.5009000 0.3746000      0.6269000 
1 1 1 22 20 22 o 28.40000 0.3014000 28.38000 0.3439000 28.41000 0.4950000 -0.2603000E-01 0.6028000 
1 1 1 22 20 24 o 32.34000 0.3197000 32.50000 0.3720000 32.19000 0.5201000 0.3188000      0.6394000 
1 1 1 22 20 26 o 29.89000 0.3880000 29.88000 0.4206000 29.91000 0.6521000 -0.3174000E-01 0.7759000 
1 1 1 22 20 28 o 3.578000 1.033000  3.747000 1.507000  3.410000 1.412000  0.3369000      2.065000  
1 1 1 22 20 30 o 20.15000 0.3356000 20.95000 0.3896000 19.36000 0.5467000 1.594000       0.6713000 
1 1 1 22 20 32 o 17.59000 0.4310000 18.45000 0.4921000 16.72000 0.7077000 1.734000       0.8620000 
1 1 1 22 20 34 o 21.02000 0.3285000 21.14000 0.3829000 20.89000 0.5339000 0.2504000      0.6570000 
1 1 1 22 20 36 o 12.64000 0.6291000 13.08000 0.4711000 12.20000 1.167000  0.8840000      1.258000  
1 1 1 22 20 38 o 15.21000 0.3747000 15.27000 0.4369000 15.15000 0.6089000 0.1220000      0.7494000 
1 1 1 22 20 40 o 12.76000 0.4426000 13.10000 0.6572000 12.41000 0.5929000 0.6912000      0.8851000 
1 1 1 22 20 42 o 4.175000 0.8740000 3.250000 1.263000  5.099000 1.208000  -1.849000      1.748000  
1 1 1 22 20 44 o 10.56000 0.4929000 10.53000 0.7026000 10.60000 0.6916000 -0.7162000E-01 0.9859000 
1 1 1 22 20 46 f 4.031000 0.9123000 3.073000 1.294000  4.988000 1.286000  -1.915000      1.825000  
1 1 1 22 20 48 o 10.56000 0.5172000 10.22000 0.7556000 10.90000 0.7064000 -0.6801000     1.034000  
1 1 1 22 20 50 o 8.580000 0.9875000 8.927000 0.9209000 8.234000 1.747000  0.6929000      1.975000  
1 1 1 22 20 52 o 5.859000 1.003000  4.763000 1.461000  6.955000 1.374000  -2.193000      2.005000  
1 1 1 22 20 54 f 3.851000 1.021000  3.900000 1.451000  3.803000 1.436000  0.9627000E-01  2.041000  
1 1 1 22 20 56 o 3.770000 0.9725000 3.869000 1.426000  3.671000 1.322000  0.1984000      1.945000  
1 1 1 22 21 1  o 14.19000 0.2921000 14.34000 0.4070000 14.04000 0.4192000 0.3008000      0.5843000 
1 1 1 22 21 3  o 54.94000 0.4613000 55.43000 0.6574000 54.45000 0.6475000 0.9803000      0.9227000 
1 1 1 22 21 5  o 33.98000 0.3546000 32.93000 0.4023000 35.03000 0.5840000 -2.101000      0.7091000 
1 1 1 22 21 7  o 55.86000 0.4426000 55.72000 0.5803000 55.99000 0.6686000 -0.2624000     0.8853000 
1 1 1 22 21 9  o 45.63000 0.3512000 46.32000 0.5038000 44.94000 0.4893000 1.381000       0.7024000 
1 1 1 22 21 11 o 17.87000 0.3181000 18.30000 0.5309000 17.43000 0.3504000 0.8754000      0.6361000 
1 1 1 22 21 13 o 30.57000 0.5127000 29.94000 0.4926000 31.19000 0.8993000 -1.252000      1.025000  
1 1 1 22 21 15 o 27.18000 0.3778000 26.78000 0.4925000 27.58000 0.5731000 -0.8022000     0.7557000 
1 1 1 22 21 17 o 11.83000 0.5152000 11.63000 0.8189000 12.03000 0.6254000 -0.3951000     1.030000  
1 1 1 22 21 19 o 6.895000 0.6056000 7.094000 0.4892000 6.697000 1.108000  0.3963000      1.211000  
1 1 1 22 21 21 o 27.68000 0.3002000 27.00000 0.3259000 28.35000 0.5042000 -1.351000      0.6004000 
1 1 1 22 21 23 o 25.24000 0.3043000 25.22000 0.3353000 25.27000 0.5078000 -0.5068000E-01 0.6085000 
1 1 1 22 21 25 o 18.17000 0.3476000 18.79000 0.3646000 17.56000 0.5919000 1.236000       0.6952000 
1 1 1 22 21 27 o 46.82000 0.4627000 47.43000 0.5265000 46.20000 0.7611000 1.229000       0.9254000 
1 1 1 22 21 29 o 18.50000 0.3432000 18.44000 0.3975000 18.55000 0.5596000 -0.1101000     0.6864000 
1 1 1 22 21 31 o 17.40000 0.3442000 17.85000 0.3888000 16.95000 0.5682000 0.8916000      0.6885000 
1 1 1 22 21 33 o 15.40000 0.3809000 15.56000 0.4229000 15.23000 0.6336000 0.3323000      0.7617000 
1 1 1 22 21 35 o 11.24000 0.5046000 11.03000 0.5131000 11.45000 0.8691000 -0.4241000     1.009000  
1 1 1 22 21 37 o 12.66000 0.4034000 12.20000 0.4857000 13.11000 0.6441000 -0.9085000     0.8068000 
1 1 1 22 21 39 o 17.38000 0.3687000 17.46000 0.4477000 17.30000 0.5860000 0.1647000      0.7374000 
1 1 1 22 21 41 o 4.163000 1.018000  4.113000 1.549000  4.212000 1.321000  -0.9894000E-01 2.036000  
1 1 1 22 21 43 o 6.428000 0.7628000 5.387000 1.227000  7.470000 0.9066000 -2.083000      1.526000  
1 1 1 22 21 45 o 3.082000 0.8776000 2.549000 1.170000  3.615000 1.308000  -1.066000      1.755000  
1 1 1 22 21 47 f 4.048000 0.9609000 3.368000 1.373000  4.727000 1.345000  -1.358000      1.922000  
1 1 1 22 21 49 o 7.856000 0.9724000 6.987000 1.137000  8.724000 1.578000  -1.736000      1.945000  
1 1 1 22 21 51 o 7.546000 0.9148000 8.106000 1.113000  6.985000 1.452000  1.120000       1.830000  
1 1 1 22 21 53 o 4.512000 1.147000  4.643000 1.752000  4.382000 1.481000  0.2613000      2.294000  
1 1 1 22 21 55 o 7.071000 0.7711000 7.260000 1.143000  6.882000 1.035000  0.3788000      1.542000  
1 1 1 22 22 0  o 16.89000 0.3733000 16.89000 0.3733000 16.89000 0.3733000 0.000000       0.000000  
1 1 1 22 22 2  o 18.99000 0.3790000 19.00000 0.6706000 18.97000 0.3535000 0.2829000E-01  0.7580000 
1 1 1 22 22 4  o 47.93000 0.3647000 48.35000 0.5180000 47.52000 0.5135000 0.8373000      0.7294000 
1 1 1 22 22 6  o 8.984000 0.3474000 8.888000 0.5072000 9.079000 0.4749000 -0.1916000     0.6949000 
1 1 1 22 22 8  o 43.88000 0.3414000 43.90000 0.4831000 43.87000 0.4824000 0.2412000E-01  0.6827000 
1 1 1 22 22 10 o 34.85000 0.3610000 35.00000 0.5127000 34.71000 0.5084000 0.2857000      0.7220000 
1 1 1 22 22 12 o 12.29000 0.5028000 12.80000 0.6751000 11.79000 0.7453000 1.015000       1.006000  
1 1 1 22 22 14 o 24.49000 0.4072000 23.96000 0.5843000 25.02000 0.5674000 -1.060000      0.8145000 
1 1 1 22 22 16 o 17.48000 0.4310000 18.29000 0.6725000 16.66000 0.5393000 1.633000       0.8621000 
1 1 1 22 22 18 o 16.67000 0.4020000 16.75000 0.5935000 16.60000 0.5425000 0.1565000      0.8041000 
1 1 1 22 22 20 o 24.66000 0.3659000 24.01000 0.5438000 25.31000 0.4898000 -1.294000      0.7318000 
1 1 1 22 22 22 f 5.510000 0.7793000 4.974000 0.7390000 6.046000 1.372000  -1.072000      1.559000  
1 1 1 22 22 24 o 36.48000 0.3906000 36.84000 0.5595000 36.13000 0.5451000 0.7086000      0.7812000 
1 1 1 22 22 26 o 12.03000 0.4797000 11.23000 0.4521000 12.84000 0.8461000 -1.608000      0.9593000 
1 1 1 22 22 28 o 13.57000 0.4143000 13.20000 0.5070000 13.94000 0.6554000 -0.7349000     0.8286000 
1 1 1 22 22 30 o 16.63000 0.3411000 16.90000 0.3882000 16.37000 0.5609000 0.5302000      0.6821000 
1 1 1 22 22 32 o 4.464000 0.9183000 3.241000 1.188000  5.686000 1.401000  -2.445000      1.837000  
1 1 1 22 22 34 o 9.228000 0.5419000 10.07000 0.5430000 8.391000 0.9379000 1.674000       1.084000  
1 1 1 22 22 36 o 21.28000 0.3877000 21.87000 0.4083000 20.69000 0.6592000 1.174000       0.7754000 
1 1 1 22 22 38 o 8.151000 0.5478000 8.236000 0.6599000 8.066000 0.8747000 0.1701000      1.096000  
1 1 1 22 22 40 o 13.66000 0.3764000 13.69000 0.5060000 13.62000 0.5573000 0.6999000E-01  0.7527000 
1 1 1 22 22 42 o 12.75000 0.4482000 13.36000 0.6742000 12.13000 0.5907000 1.222000       0.8964000 
1 1 1 22 22 44 o 11.34000 0.4964000 12.16000 0.7370000 10.52000 0.6652000 1.640000       0.9928000 
1 1 1 22 22 46 o 4.740000 0.9904000 5.120000 1.459000  4.360000 1.339000  0.7605000      1.981000  
1 1 1 22 22 48 o 6.148000 0.9517000 6.104000 1.252000  6.193000 1.433000  -0.8934000E-01 1.903000  
1 1 1 22 22 50 o 5.197000 0.9837000 6.514000 1.272000  3.879000 1.501000  2.635000       1.967000  
1 1 1 22 22 52 o 9.361000 0.5914000 9.378000 0.8410000 9.345000 0.8316000 0.3222000E-01  1.183000  
1 1 1 22 22 54 o 5.037000 1.073000  5.592000 1.656000  4.483000 1.366000  1.109000       2.147000  
1 1 1 22 23 1  o 23.44000 0.2871000 23.70000 0.4504000 23.19000 0.3562000 0.5078000      0.5742000 
1 1 1 22 23 3  o 39.10000 0.3446000 39.60000 0.5308000 38.61000 0.4397000 0.9910000      0.6893000 
1 1 1 22 23 5  o 12.87000 0.3583000 12.75000 0.5929000 12.98000 0.4026000 -0.2248000     0.7167000 
1 1 1 22 23 7  o 38.79000 0.3135000 39.36000 0.4456000 38.21000 0.4411000 1.152000       0.6270000 
1 1 1 22 23 9  o 34.20000 0.4280000 33.50000 0.6023000 34.90000 0.6082000 -1.401000      0.8560000 
1 1 1 22 23 11 o 34.04000 0.4281000 34.37000 0.6137000 33.71000 0.5971000 0.6647000      0.8562000 
1 1 1 22 23 13 o 9.355000 0.7762000 10.07000 0.9488000 8.637000 1.229000  1.436000       1.552000  
1 1 1 22 23 15 o 12.53000 0.4795000 12.52000 0.7076000 12.54000 0.6474000 -0.2560000E-01 0.9591000 
1 1 1 22 23 17 o 9.439000 0.5827000 8.916000 0.8851000 9.962000 0.7581000 -1.046000      1.165000  
1 1 1 22 23 19 o 6.346000 0.9142000 6.257000 1.360000  6.435000 1.222000  -0.1784000     1.828000  
1 1 1 22 23 21 o 36.37000 0.3804000 36.70000 0.5435000 36.03000 0.5323000 0.6672000      0.7607000 
1 1 1 22 23 23 o 22.64000 0.3795000 22.13000 0.5513000 23.15000 0.5218000 -1.014000      0.7591000 
1 1 1 22 23 25 o 9.979000 0.4707000 9.339000 0.4879000 10.62000 0.8050000 -1.281000      0.9413000 
1 1 1 22 23 27 o 17.43000 0.3445000 18.12000 0.3505000 16.75000 0.5933000 1.372000       0.6891000 
1 1 1 22 23 29 o 11.95000 0.4494000 11.44000 0.5995000 12.46000 0.6696000 -1.014000      0.8987000 
1 1 1 22 23 31 o 19.28000 0.3359000 19.36000 0.3948000 19.19000 0.5436000 0.1716000      0.6718000 
1 1 1 22 23 33 o 11.24000 0.4340000 11.01000 0.4636000 11.47000 0.7337000 -0.4523000     0.8679000 
1 1 1 22 23 35 o 25.46000 0.3584000 26.02000 0.3674000 24.90000 0.6155000 1.124000       0.7168000 
1 1 1 22 23 37 o 9.815000 0.4643000 10.18000 0.5399000 9.447000 0.7555000 0.7365000      0.9286000 
1 1 1 22 23 39 o 4.013000 0.9190000 4.058000 1.173000  3.967000 1.415000  0.9081000E-01  1.838000  
1 1 1 22 23 41 o 8.536000 0.5767000 7.775000 0.8996000 9.297000 0.7217000 -1.522000      1.153000  
1 1 1 22 23 43 f 6.693000 0.7257000 6.158000 1.144000  7.227000 0.8931000 -1.070000      1.451000  
1 1 1 22 23 45 o 8.603000 0.6327000 8.626000 0.9758000 8.579000 0.8056000 0.4742000E-01  1.265000  
1 1 1 22 23 47 o 7.937000 0.8973000 8.387000 0.8798000 7.486000 1.564000  0.9013000      1.795000  
1 1 1 22 23 49 o 5.153000 1.125000  5.191000 1.466000  5.115000 1.708000  0.7648000E-01  2.251000  
1 1 1 22 23 51 o 3.445000 0.9671000 3.242000 1.398000  3.648000 1.336000  -0.4058000     1.934000  
1 1 1 22 23 53 o 3.854000 0.9884000 3.177000 1.357000  4.531000 1.437000  -1.354000      1.977000  
1 1 1 22 23 55 o 3.470000 1.542000  3.470000 1.542000  ?        ?         ?              ?         
1 1 1 22 24 0  o 5.722000 1.080000  5.722000 1.080000  5.722000 1.080000  0.000000       0.000000  
1 1 1 22 24 2  o 15.22000 0.2647000 15.10000 0.3724000 15.33000 0.3762000 -0.2271000     0.5294000 
1 1 1 22 24 4  o 17.81000 0.2767000 17.86000 0.3826000 17.76000 0.3999000 0.1004000      0.5535000 
1 1 1 22 24 6  o 7.667000 0.4282000 7.151000 0.6524000 8.182000 0.5548000 -1.031000      0.8564000 
1 1 1 22 24 8  o 33.61000 0.4214000 33.55000 0.6028000 33.67000 0.5890000 -0.1229000     0.8428000 
1 1 1 22 24 10 o 43.69000 0.4885000 44.00000 0.6963000 43.38000 0.6854000 0.6204000      0.9771000 
1 1 1 22 24 12 o 44.35000 0.4148000 44.22000 0.5857000 44.48000 0.5874000 -0.2620000     0.8295000 
1 1 1 22 24 14 o 26.94000 0.3524000 26.49000 0.4981000 27.39000 0.4986000 -0.9068000     0.7048000 
1 1 1 22 24 16 o 36.66000 0.4284000 36.72000 0.6721000 36.59000 0.5315000 0.1282000      0.8568000 
1 1 1 22 24 18 o 16.01000 0.4274000 16.02000 0.6216000 16.00000 0.5868000 0.2175000E-01  0.8549000 
1 1 1 22 24 20 o 21.35000 0.3829000 20.73000 0.5540000 21.97000 0.5286000 -1.241000      0.7657000 
1 1 1 22 24 22 o 21.57000 0.3845000 21.63000 0.5711000 21.51000 0.5150000 0.1187000      0.7690000 
1 1 1 22 24 24 o 18.45000 0.4075000 18.60000 0.5870000 18.30000 0.5654000 0.3047000      0.8150000 
1 1 1 22 24 26 o 22.07000 0.3982000 21.18000 0.4031000 22.97000 0.6869000 -1.792000      0.7964000 
1 1 1 22 24 28 o 19.42000 0.3157000 19.19000 0.3451000 19.64000 0.5287000 -0.4543000     0.6314000 
1 1 1 22 24 30 f 3.630000 1.018000  3.332000 1.307000  3.928000 1.561000  -0.5959000     2.036000  
1 1 1 22 24 32 f 31.10000 0.3181000 31.00000 0.3699000 31.21000 0.5176000 -0.2087000     0.6362000 
1 1 1 22 24 34 o 13.00000 0.4585000 13.40000 0.4835000 12.59000 0.7792000 0.8112000      0.9170000 
1 1 1 22 24 36 o 15.70000 0.3620000 15.08000 0.4210000 16.33000 0.5890000 -1.250000      0.7240000 
1 1 1 22 24 38 o 14.54000 0.4347000 14.42000 0.4444000 14.67000 0.7471000 -0.2454000     0.8693000 
1 1 1 22 24 40 o 9.171000 0.4707000 9.210000 0.6954000 9.133000 0.6346000 0.7713000E-01  0.9414000 
1 1 1 22 24 42 o 5.094000 0.8477000 4.101000 1.323000  6.087000 1.060000  -1.987000      1.695000  
1 1 1 22 24 44 o 6.741000 0.7384000 6.577000 1.057000  6.904000 1.032000  -0.3279000     1.477000  
1 1 1 22 24 46 o 13.85000 0.6058000 13.94000 0.8208000 13.75000 0.8911000 0.1942000      1.212000  
1 1 1 22 24 48 o 2.692000 0.8670000 2.598000 1.196000  2.786000 1.255000  -0.1884000     1.734000  
1 1 1 22 24 50 o 9.754000 0.5969000 10.09000 0.8112000 9.420000 0.8760000 0.6682000      1.194000  
1 1 1 22 24 52 o 6.663000 0.8138000 7.626000 1.006000  5.701000 1.280000  1.925000       1.628000  
1 1 1 22 24 54 o 6.812000 0.7942000 7.246000 1.098000  6.378000 1.147000  0.8683000      1.588000  
1 1 1 22 25 1  o 11.94000 0.3262000 12.22000 0.4573000 11.66000 0.4652000 0.5611000      0.6524000 
1 1 1 22 25 3  o 20.16000 0.3033000 20.28000 0.4827000 20.05000 0.3673000 0.2250000      0.6066000 
1 1 1 22 25 5  o 39.81000 0.3571000 40.07000 0.5086000 39.56000 0.5013000 0.5029000      0.7141000 
1 1 1 22 25 7  o 60.49000 0.5189000 60.37000 0.7342000 60.61000 0.7335000 -0.2489000     1.038000  
1 1 1 22 25 9  o 35.92000 0.3682000 36.47000 0.5250000 35.37000 0.5164000 1.109000       0.7364000 
1 1 1 22 25 11 o 12.60000 0.4714000 12.12000 0.7087000 13.08000 0.6218000 -0.9567000     0.9428000 
1 1 1 22 25 13 o 28.70000 0.4170000 28.34000 0.4975000 29.06000 0.6692000 -0.7248000     0.8339000 
1 1 1 22 25 15 o 40.45000 0.4019000 40.46000 0.5655000 40.45000 0.5712000 0.2781000E-02  0.8038000 
1 1 1 22 25 17 o 18.31000 0.3851000 18.80000 0.5456000 17.82000 0.5436000 0.9744000      0.7702000 
1 1 1 22 25 19 o 26.93000 0.3695000 27.61000 0.5355000 26.25000 0.5093000 1.360000       0.7390000 
1 1 1 22 25 21 o 10.57000 0.5735000 10.05000 0.8612000 11.10000 0.7576000 -1.051000      1.147000  
1 1 1 22 25 23 o 5.214000 1.049000  4.456000 1.581000  5.973000 1.378000  -1.516000      2.097000  
1 1 1 22 25 25 o 13.82000 0.5013000 13.83000 0.7368000 13.80000 0.6800000 0.2532000E-01  1.003000  
1 1 1 22 25 27 o 13.48000 0.4052000 13.40000 0.4867000 13.56000 0.6479000 -0.1551000     0.8103000 
1 1 1 22 25 29 o 17.49000 0.3894000 17.33000 0.4002000 17.64000 0.6682000 -0.3108000     0.7789000 
1 1 1 22 25 31 o 15.74000 0.3643000 15.47000 0.4538000 16.02000 0.5699000 -0.5518000     0.7285000 
1 1 1 22 25 33 o 7.025000 0.7242000 7.313000 0.7386000 6.737000 1.246000  0.5759000      1.448000  
1 1 1 22 25 35 o 8.449000 0.5695000 8.766000 0.5819000 8.133000 0.9791000 0.6334000      1.139000  
1 1 1 22 25 37 o 11.79000 0.4408000 11.23000 0.5144000 12.35000 0.7161000 -1.122000      0.8817000 
1 1 1 22 25 39 o 7.206000 0.6694000 6.835000 0.7971000 7.578000 1.076000  -0.7437000     1.339000  
1 1 1 22 25 41 o 6.742000 0.8490000 7.254000 0.8727000 6.229000 1.456000  1.026000       1.698000  
1 1 1 22 25 43 o 3.407000 0.9423000 3.711000 1.328000  3.103000 1.337000  0.6077000      1.885000  
1 1 1 22 25 45 o 5.100000 1.016000  5.003000 1.394000  5.198000 1.479000  -0.1953000     2.033000  
1 1 1 22 25 47 o 3.371000 0.9362000 4.259000 1.481000  2.483000 1.146000  1.776000       1.872000  
1 1 1 22 25 49 o 5.002000 0.9715000 4.740000 1.401000  5.264000 1.346000  -0.5235000     1.943000  
1 1 1 22 25 51 o 3.626000 0.9929000 3.298000 1.350000  3.953000 1.457000  -0.6555000     1.986000  
1 1 1 22 25 53 o 3.503000 0.9615000 3.728000 1.430000  3.278000 1.286000  0.4495000      1.923000  
1 1 1 22 26 0  o 13.30000 0.4897000 13.30000 0.4897000 13.30000 0.4897000 0.000000       0.000000  
1 1 1 22 26 2  o 18.45000 0.2542000 18.80000 0.3631000 18.11000 0.3560000 0.6910000      0.5085000 
1 1 1 22 26 4  o 41.73000 0.3308000 41.18000 0.4618000 42.28000 0.4737000 -1.102000      0.6616000 
1 1 1 22 26 6  o 31.73000 0.3517000 31.45000 0.4912000 32.02000 0.5035000 -0.5682000     0.7034000 
1 1 1 22 26 8  o 26.95000 0.3764000 26.21000 0.5782000 27.69000 0.4822000 -1.483000      0.7529000 
1 1 1 22 26 10 o 55.57000 0.4856000 55.74000 0.6866000 55.40000 0.6869000 0.3345000      0.9712000 
1 1 1 22 26 12 o 11.26000 0.5437000 12.05000 0.7491000 10.47000 0.7882000 1.580000       1.087000  
1 1 1 22 26 14 o 44.24000 0.4218000 44.71000 0.6002000 43.78000 0.5928000 0.9257000      0.8436000 
1 1 1 22 26 16 o 13.46000 0.6832000 13.50000 1.218000  13.43000 0.6193000 0.7533000E-01  1.366000  
1 1 1 22 26 18 o 33.92000 0.3767000 34.38000 0.5398000 33.45000 0.5256000 0.9328000      0.7534000 
1 1 1 22 26 20 o 17.53000 0.4028000 17.00000 0.5838000 18.05000 0.5552000 -1.046000      0.8057000 
1 1 1 22 26 22 o 16.07000 0.4375000 16.27000 0.6257000 15.86000 0.6116000 0.4102000      0.8749000 
1 1 1 22 26 24 o 26.03000 0.3728000 26.18000 0.5431000 25.88000 0.5109000 0.3004000      0.7456000 
1 1 1 22 26 26 o 37.26000 0.4490000 37.05000 0.5574000 37.47000 0.7041000 -0.4198000     0.8980000 
1 1 1 22 26 28 o 17.50000 0.3229000 17.50000 0.3229000 ?        ?         ?              ?         
1 1 1 22 26 30 o 13.13000 0.3773000 13.41000 0.3568000 12.85000 0.6649000 0.5568000      0.7546000 
1 1 1 22 26 32 o 3.182000 0.9048000 2.899000 1.108000  3.465000 1.431000  -0.5655000     1.810000  
1 1 1 22 26 34 o 7.836000 0.5722000 7.041000 0.7220000 8.631000 0.8880000 -1.590000      1.144000  
1 1 1 22 26 36 o 17.40000 0.3367000 16.96000 0.3834000 17.85000 0.5535000 -0.8905000     0.6733000 
1 1 1 22 26 38 o 14.26000 0.4419000 13.42000 0.4494000 15.10000 0.7611000 -1.675000      0.8839000 
1 1 1 22 26 40 o 8.284000 0.6159000 7.980000 0.8303000 8.588000 0.9100000 -0.6079000     1.232000  
1 1 1 22 26 42 o 3.832000 0.9478000 3.427000 1.326000  4.237000 1.355000  -0.8107000     1.896000  
1 1 1 22 26 44 o 5.393000 1.005000  5.456000 1.416000  5.330000 1.425000  0.1259000      2.009000  
1 1 1 22 26 46 o 10.64000 0.4968000 10.58000 0.6974000 10.71000 0.7078000 -0.1338000     0.9937000 
1 1 1 22 26 48 o 7.783000 0.7415000 7.549000 0.9299000 8.018000 1.155000  -0.4686000     1.483000  
1 1 1 22 26 50 o 3.921000 0.9972000 3.340000 1.407000  4.501000 1.414000  -1.161000      1.994000  
1 1 1 22 26 52 o 3.609000 0.9338000 3.275000 1.343000  3.943000 1.298000  -0.6675000     1.868000  
1 1 1 22 27 1  o 12.63000 0.3061000 12.63000 0.4323000 12.62000 0.4333000 0.2799000E-02  0.6121000 
1 1 1 22 27 3  o 40.98000 0.3592000 41.13000 0.5481000 40.83000 0.4644000 0.2975000      0.7184000 
1 1 1 22 27 5  o 28.22000 0.3386000 28.31000 0.4777000 28.12000 0.4801000 0.1888000      0.6773000 
1 1 1 22 27 7  o 22.35000 0.3837000 21.67000 0.4981000 23.04000 0.5839000 -1.371000      0.7675000 
1 1 1 22 27 9  o 20.76000 0.3584000 20.44000 0.5066000 21.08000 0.5072000 -0.6451000     0.7169000 
1 1 1 22 27 11 o 53.87000 0.4773000 53.91000 0.6729000 53.83000 0.6770000 0.7978000E-01  0.9545000 
1 1 1 22 27 13 o 23.82000 0.4353000 23.99000 0.5323000 23.65000 0.6889000 0.3400000      0.8706000 
1 1 1 22 27 15 o 16.73000 0.4192000 16.54000 0.6128000 16.92000 0.5722000 -0.3761000     0.8384000 
1 1 1 22 27 17 o 24.48000 0.3689000 24.80000 0.5396000 24.16000 0.5031000 0.6428000      0.7378000 
1 1 1 22 27 19 o 33.30000 0.3772000 33.37000 0.5391000 33.22000 0.5278000 0.1543000      0.7545000 
1 1 1 22 27 21 o 35.52000 0.3879000 35.18000 0.5501000 35.86000 0.5470000 -0.6828000     0.7757000 
1 1 1 22 27 23 o 23.74000 0.3778000 23.08000 0.5513000 24.39000 0.5167000 -1.312000      0.7555000 
1 1 1 22 27 25 o 17.32000 0.4821000 17.45000 0.6340000 17.20000 0.7263000 0.2527000      0.9641000 
1 1 1 22 27 27 o 17.27000 0.5202000 17.15000 0.7546000 17.40000 0.7163000 -0.2569000     1.040000  
1 1 1 22 27 29 o 11.75000 0.4934000 11.57000 0.7160000 11.92000 0.6792000 -0.3483000     0.9868000 
1 1 1 22 27 31 o 3.246000 0.7547000 3.781000 0.9463000 2.710000 1.176000  1.071000       1.509000  
1 1 1 22 27 33 o 2.839000 0.8458000 2.567000 1.064000  3.111000 1.315000  -0.5442000     1.692000  
1 1 1 22 27 35 o 2.827000 0.8142000 3.140000 1.148000  2.514000 1.154000  0.6265000      1.628000  
1 1 1 22 27 37 o 7.651000 0.7214000 8.280000 0.6300000 7.022000 1.298000  1.257000       1.443000  
1 1 1 22 27 39 o 10.23000 0.5155000 9.894000 0.5738000 10.57000 0.8565000 -0.6758000     1.031000  
1 1 1 22 27 41 o 5.187000 0.8389000 6.715000 1.022000  3.658000 1.331000  3.057000       1.678000  
1 1 1 22 27 43 o 12.53000 0.4750000 12.67000 0.5852000 12.39000 0.7483000 0.2770000      0.9499000 
1 1 1 22 27 45 o 19.97000 0.7147000 19.18000 1.257000  20.76000 0.6806000 -1.575000      1.429000  
1 1 1 22 27 47 o 3.457000 0.9713000 3.931000 1.404000  2.983000 1.343000  0.9471000      1.943000  
1 1 1 22 27 49 o 3.861000 0.9818000 3.343000 1.349000  4.379000 1.427000  -1.036000      1.964000  
1 1 1 22 27 51 o 6.873000 0.7939000 5.415000 1.359000  8.331000 0.8211000 -2.917000      1.588000  
1 1 1 22 28 0  o 36.44000 0.5158000 36.44000 0.5158000 36.44000 0.5158000 0.000000       0.000000  
1 1 1 22 28 2  f 14.12000 0.2948000 14.05000 0.4245000 14.20000 0.4093000 -0.1465000     0.5897000 
1 1 1 22 28 4  o 6.179000 0.6128000 6.844000 1.039000  5.514000 0.6498000 1.329000       1.226000  
1 1 1 22 28 6  o 21.41000 0.3506000 21.82000 0.4997000 21.01000 0.4919000 0.8065000      0.7012000 
1 1 1 22 28 8  o 9.747000 0.5899000 9.182000 0.8944000 10.31000 0.7695000 -1.129000      1.180000  
1 1 1 22 28 10 o 11.91000 0.5270000 10.88000 0.8225000 12.95000 0.6591000 -2.075000      1.054000  
1 1 1 22 28 12 o 19.90000 0.4659000 20.25000 0.5549000 19.54000 0.7484000 0.7160000      0.9317000 
1 1 1 22 28 14 o 11.10000 0.5715000 10.38000 0.8737000 11.83000 0.7369000 -1.456000      1.143000  
1 1 1 22 28 16 o 15.94000 0.4943000 15.03000 0.7982000 16.86000 0.5834000 -1.834000      0.9887000 
1 1 1 22 28 18 o 37.44000 0.3897000 38.09000 0.5587000 36.79000 0.5434000 1.297000       0.7794000 
1 1 1 22 28 20 o 33.32000 0.4232000 33.03000 0.6549000 33.60000 0.5363000 -0.5692000     0.8465000 
1 1 1 22 28 22 o 28.33000 0.4311000 28.56000 0.6819000 28.09000 0.5276000 0.4711000      0.8621000 
1 1 1 22 28 24 o 26.92000 0.4175000 27.34000 0.5354000 26.50000 0.6406000 0.8423000      0.8349000 
1 1 1 22 28 26 o 14.88000 0.5194000 14.41000 0.8386000 15.35000 0.6130000 -0.9382000     1.039000  
1 1 1 22 28 28 o 8.556000 0.7201000 8.932000 1.094000  8.181000 0.9362000 0.7511000      1.440000  
1 1 1 22 28 30 o 22.81000 0.4377000 23.18000 0.6234000 22.45000 0.6147000 0.7350000      0.8755000 
1 1 1 22 28 32 o 6.650000 0.6103000 6.686000 0.5975000 6.615000 1.064000  0.7191000E-01  1.221000  
1 1 1 22 28 34 o 4.530000 0.8300000 4.660000 0.9673000 4.401000 1.349000  0.2586000      1.660000  
1 1 1 22 28 36 o 12.13000 0.4120000 11.83000 0.4614000 12.43000 0.6826000 -0.6012000     0.8240000 
1 1 1 22 28 38 o 10.34000 0.4713000 9.737000 0.5890000 10.94000 0.7360000 -1.199000      0.9427000 
1 1 1 22 28 40 o 7.957000 0.5905000 8.324000 0.6339000 7.590000 0.9964000 0.7339000      1.181000  
1 1 1 22 28 42 f 5.233000 0.9548000 4.975000 1.247000  5.491000 1.447000  -0.5155000     1.910000  
1 1 1 22 28 44 o 9.591000 0.5669000 10.07000 0.7689000 9.115000 0.8333000 0.9514000      1.134000  
1 1 1 22 28 46 f 7.401000 0.8710000 7.163000 1.275000  7.639000 1.187000  -0.4757000     1.742000  
1 1 1 22 28 48 o 10.85000 0.5656000 10.33000 0.7422000 11.37000 0.8536000 -1.045000      1.131000  
1 1 1 22 28 50 o 3.563000 0.9418000 3.152000 1.286000  3.973000 1.376000  -0.8213000     1.884000  
1 1 1 22 28 52 o 4.226000 1.125000  4.182000 1.659000  4.271000 1.520000  -0.8947000E-01 2.250000  
1 1 1 22 29 1  o 13.68000 0.3229000 14.07000 0.5330000 13.29000 0.3648000 0.7749000      0.6459000 
1 1 1 22 29 3  o 16.22000 0.4235000 15.74000 0.7899000 16.70000 0.3054000 -0.9604000     0.8469000 
1 1 1 22 29 5  o 28.53000 0.3776000 28.41000 0.5717000 28.66000 0.4935000 -0.2474000     0.7552000 
1 1 1 22 29 7  o 17.81000 0.3734000 17.63000 0.5408000 18.00000 0.5149000 -0.3645000     0.7467000 
1 1 1 22 29 9  o 42.07000 0.4640000 42.45000 0.5773000 41.69000 0.7267000 0.7528000      0.9281000 
1 1 1 22 29 11 o 55.44000 0.4896000 54.39000 0.6794000 56.50000 0.7052000 -2.113000      0.9792000 
1 1 1 22 29 13 o 30.44000 0.4276000 30.05000 0.5247000 30.83000 0.6753000 -0.7831000     0.8551000 
1 1 1 22 29 15 o 36.78000 0.4412000 35.79000 0.6780000 37.76000 0.5648000 -1.965000      0.8824000 
1 1 1 22 29 17 o 41.83000 0.4606000 41.99000 0.7077000 41.66000 0.5896000 0.3310000      0.9212000 
1 1 1 22 29 19 o 32.16000 0.3723000 32.08000 0.5272000 32.24000 0.5257000 -0.1552000     0.7445000 
1 1 1 22 29 21 o 30.80000 0.3836000 30.20000 0.5494000 31.40000 0.5357000 -1.200000      0.7673000 
1 1 1 22 29 23 o 5.907000 1.095000  6.736000 1.436000  5.077000 1.652000  1.659000       2.189000  
1 1 1 22 29 25 o 22.59000 0.4775000 23.23000 0.6755000 21.95000 0.6750000 1.275000       0.9549000 
1 1 1 22 29 27 o 32.91000 0.3731000 33.28000 0.5298000 32.54000 0.5255000 0.7440000      0.7462000 
1 1 1 22 29 29 o 16.49000 0.4462000 16.57000 0.7039000 16.41000 0.5486000 0.1578000      0.8924000 
1 1 1 22 29 31 o 14.69000 0.4373000 14.45000 0.6429000 14.93000 0.5928000 -0.4843000     0.8745000 
1 1 1 22 29 33 o 13.14000 0.3563000 11.96000 0.4036000 14.33000 0.5873000 -2.370000      0.7126000 
1 1 1 22 29 35 o 6.086000 0.7934000 6.506000 0.6992000 5.666000 1.424000  0.8399000      1.587000  
1 1 1 22 29 37 o 5.255000 0.9752000 4.881000 1.229000  5.628000 1.514000  -0.7463000     1.950000  
1 1 1 22 29 39 o 13.46000 0.4040000 13.42000 0.4945000 13.50000 0.6391000 -0.7380000E-01 0.8081000 
1 1 1 22 29 41 o 9.435000 0.5664000 9.583000 0.6623000 9.288000 0.9191000 0.2949000      1.133000  
1 1 1 22 29 43 o 3.546000 0.9404000 3.586000 1.338000  3.507000 1.322000  0.7915000E-01  1.881000  
1 1 1 22 29 45 o 6.514000 0.7737000 6.852000 1.037000  6.176000 1.149000  0.6760000      1.547000  
1 1 1 22 29 47 o 3.481000 0.9998000 2.787000 1.285000  4.175000 1.532000  -1.388000      2.000000  
1 1 1 22 29 49 o 4.322000 1.097000  4.375000 1.643000  4.270000 1.454000  0.1055000      2.194000  
1 1 1 22 29 51 o 3.322000 0.9974000 3.700000 1.542000  2.945000 1.266000  0.7551000      1.995000  
1 1 1 22 30 0  o 28.53000 0.4800000 28.53000 0.4800000 28.53000 0.4800000 0.000000       0.000000  
1 1 1 22 30 2  o 13.60000 0.3313000 14.22000 0.5471000 12.99000 0.3738000 1.232000       0.6626000 
1 1 1 22 30 4  o 29.04000 0.3508000 28.89000 0.4967000 29.19000 0.4956000 -0.2973000     0.7016000 
1 1 1 22 30 6  o 18.19000 0.3723000 18.39000 0.5293000 17.99000 0.5237000 0.3952000      0.7446000 
1 1 1 22 30 8  o 8.577000 0.6604000 8.409000 0.9744000 8.745000 0.8916000 -0.3358000     1.321000  
1 1 1 22 30 10 o 22.42000 0.3727000 22.57000 0.5246000 22.27000 0.5294000 0.3006000      0.7453000 
1 1 1 22 30 12 o 50.66000 0.5242000 50.54000 0.6488000 50.79000 0.8236000 -0.2499000     1.048000  
1 1 1 22 30 14 o 27.59000 0.3732000 27.46000 0.5260000 27.72000 0.5296000 -0.2645000     0.7465000 
1 1 1 22 30 16 o 5.720000 0.9680000 5.728000 1.291000  5.711000 1.442000  0.1724000E-01  1.936000  
1 1 1 22 30 18 o 12.95000 0.5247000 13.09000 0.7529000 12.80000 0.7309000 0.2878000      1.049000  
1 1 1 22 30 20 o 8.185000 0.7294000 8.131000 1.051000  8.239000 1.012000  -0.1073000     1.459000  
1 1 1 22 30 22 o 31.29000 0.4208000 30.79000 0.5362000 31.80000 0.6486000 -1.009000      0.8415000 
1 1 1 22 30 24 o 30.20000 0.4297000 30.90000 0.6793000 29.50000 0.5265000 1.400000       0.8594000 
1 1 1 22 30 26 o 10.59000 0.6154000 9.929000 1.015000  11.25000 0.6956000 -1.320000      1.231000  
1 1 1 22 30 28 o 21.76000 0.4577000 21.68000 0.6524000 21.83000 0.6422000 -0.1490000     0.9155000 
1 1 1 22 30 30 o 27.25000 0.3734000 27.10000 0.5167000 27.40000 0.5391000 -0.2914000     0.7467000 
1 1 1 22 30 32 o 3.704000 1.008000  4.007000 1.419000  3.401000 1.432000  0.6059000      2.017000  
1 1 1 22 30 34 o 12.32000 0.4268000 12.27000 0.5338000 12.38000 0.6661000 -0.1140000     0.8536000 
1 1 1 22 30 36 o 8.960000 0.5366000 8.489000 0.7128000 9.430000 0.8024000 -0.9407000     1.073000  
1 1 1 22 30 38 o 8.991000 0.5564000 8.692000 0.7361000 9.290000 0.8346000 -0.5977000     1.113000  
1 1 1 22 30 40 o 5.572000 0.9260000 5.895000 0.8562000 5.248000 1.642000  0.6466000      1.852000  
1 1 1 22 30 42 o 4.860000 0.8782000 3.683000 1.320000  6.037000 1.158000  -2.354000      1.756000  
1 1 1 22 30 44 o 2.476000 0.7989000 2.526000 1.146000  2.425000 1.114000  0.1011000      1.598000  
1 1 1 22 30 46 o 3.612000 0.9605000 3.379000 1.303000  3.845000 1.411000  -0.4655000     1.921000  
1 1 1 22 30 48 o 2.877000 0.9052000 3.337000 1.407000  2.417000 1.139000  0.9193000      1.810000  
1 1 1 22 30 50 o 5.715000 1.266000  5.859000 1.980000  5.571000 1.577000  0.2877000      2.531000  
1 1 1 22 31 1  o 39.73000 0.3427000 40.20000 0.4641000 39.27000 0.5043000 0.9288000      0.6854000 
1 1 1 22 31 3  o 12.38000 0.6832000 12.20000 0.9650000 12.55000 0.9674000 -0.3544000     1.366000  
1 1 1 22 31 5  o 14.80000 0.4272000 14.09000 0.6316000 15.50000 0.5754000 -1.411000      0.8544000 
1 1 1 22 31 7  o 10.37000 0.5635000 11.09000 0.7437000 9.648000 0.8469000 1.445000       1.127000  
1 1 1 22 31 9  o 8.556000 0.6964000 9.013000 0.9585000 8.099000 1.010000  0.9141000      1.393000  
1 1 1 22 31 11 o 14.90000 0.4625000 14.13000 0.6769000 15.67000 0.6303000 -1.545000      0.9250000 
1 1 1 22 31 13 o 7.686000 0.8169000 7.175000 1.246000  8.198000 1.057000  -1.023000      1.634000  
1 1 1 22 31 15 o 11.70000 0.6150000 11.79000 0.9421000 11.61000 0.7909000 0.1774000      1.230000  
1 1 1 22 31 17 o 9.462000 0.6574000 9.639000 0.8994000 9.285000 0.9591000 0.3544000      1.315000  
1 1 1 22 31 19 o 39.61000 0.4605000 39.39000 0.5774000 39.82000 0.7176000 -0.4297000     0.9210000 
1 1 1 22 31 21 o 33.97000 0.4355000 35.00000 0.6877000 32.95000 0.5345000 2.047000       0.8710000 
1 1 1 22 31 23 f 3.559000 1.015000  3.318000 1.479000  3.801000 1.390000  -0.4829000     2.030000  
1 1 1 22 31 25 o 5.172000 1.126000  5.448000 1.604000  4.896000 1.580000  0.5513000      2.252000  
1 1 1 22 31 27 o 18.33000 0.4831000 18.68000 0.6866000 17.99000 0.6799000 0.6976000      0.9662000 
1 1 1 22 31 29 o 10.31000 0.5911000 10.88000 0.7810000 9.741000 0.8876000 1.136000       1.182000  
1 1 1 22 31 31 o 15.15000 0.4875000 15.32000 0.7913000 14.99000 0.5696000 0.3301000      0.9750000 
1 1 1 22 31 33 o 3.121000 0.9197000 3.110000 1.301000  3.132000 1.301000  -0.2282000E-01 1.839000  
1 1 1 22 31 35 o 4.882000 0.9463000 3.823000 1.431000  5.942000 1.238000  -2.119000      1.893000  
1 1 1 22 31 37 o 7.503000 0.6672000 8.076000 0.7089000 6.931000 1.130000  1.145000       1.334000  
1 1 1 22 31 39 o 18.46000 0.4387000 18.29000 0.5125000 18.63000 0.7121000 -0.3408000     0.8774000 
1 1 1 22 31 41 o 13.06000 0.4026000 12.61000 0.5600000 13.51000 0.5785000 -0.8968000     0.8052000 
1 1 1 22 31 43 o 3.677000 0.9781000 3.687000 1.414000  3.666000 1.352000  0.2097000E-01  1.956000  
1 1 1 22 31 45 o 4.781000 1.025000  5.205000 1.415000  4.357000 1.484000  0.8489000      2.051000  
1 1 1 22 31 47 o 7.889000 0.6761000 6.959000 0.9872000 8.820000 0.9239000 -1.861000      1.352000  
1 1 1 22 31 49 f 4.399000 1.043000  4.061000 1.571000  4.737000 1.373000  -0.6752000     2.086000  
1 1 1 22 32 0  o 5.967000 1.724000  5.967000 1.724000  5.967000 1.724000  0.000000       0.000000  
1 1 1 22 32 2  o 16.31000 0.2853000 16.66000 0.4179000 15.97000 0.3885000 0.6975000      0.5705000 
1 1 1 22 32 4  o 10.23000 0.6194000 9.573000 0.6307000 10.89000 1.066000  -1.321000      1.239000  
1 1 1 22 32 6  o 13.10000 0.4674000 13.12000 0.6777000 13.08000 0.6439000 0.4020000E-01  0.9348000 
1 1 1 22 32 8  o 25.30000 0.3584000 25.26000 0.4940000 25.35000 0.5193000 -0.8692000E-01 0.7167000 
1 1 1 22 32 10 o 16.08000 0.4315000 15.91000 0.6142000 16.24000 0.6062000 -0.3285000     0.8630000 
1 1 1 22 32 12 o 17.99000 0.4730000 18.47000 0.5739000 17.52000 0.7521000 0.9504000      0.9461000 
1 1 1 22 32 14 o 13.39000 0.4829000 13.68000 0.6896000 13.11000 0.6761000 0.5671000      0.9657000 
1 1 1 22 32 16 o 28.87000 0.4453000 28.90000 0.5353000 28.85000 0.7119000 0.4657000E-01  0.8907000 
1 1 1 22 32 18 o 12.66000 0.5797000 12.50000 0.7666000 12.82000 0.8698000 -0.3273000     1.159000  
1 1 1 22 32 20 o 25.20000 0.4209000 24.55000 0.6516000 25.85000 0.5329000 -1.296000      0.8417000 
1 1 1 22 32 22 o 9.680000 0.6038000 10.11000 0.8597000 9.249000 0.8480000 0.8619000      1.208000  
1 1 1 22 32 24 o 10.08000 0.6856000 10.02000 1.003000  10.15000 0.9352000 -0.1357000     1.371000  
1 1 1 22 32 26 o 8.882000 0.6891000 8.453000 0.9839000 9.310000 0.9650000 -0.8569000     1.378000  
1 1 1 22 32 28 o 5.274000 1.046000  4.940000 1.445000  5.607000 1.512000  -0.6670000     2.092000  
1 1 1 22 32 30 o 15.59000 0.4659000 15.58000 0.7309000 15.59000 0.5779000 -0.1363000E-01 0.9317000 
1 1 1 22 32 32 o 8.697000 0.6340000 8.628000 0.9191000 8.766000 0.8735000 -0.1376000     1.268000  
1 1 1 22 32 34 o 4.037000 1.005000  3.754000 1.409000  4.321000 1.434000  -0.5669000     2.010000  
1 1 1 22 32 36 o 5.298000 0.8718000 4.119000 1.074000  6.478000 1.374000  -2.359000      1.744000  
1 1 1 22 32 38 o 9.752000 0.6124000 9.560000 0.7005000 9.945000 1.005000  -0.3856000     1.225000  
1 1 1 22 32 40 o 9.865000 0.4897000 9.126000 0.5691000 10.60000 0.7970000 -1.478000      0.9794000 
1 1 1 22 32 42 o 14.67000 0.4206000 13.67000 0.6268000 15.67000 0.5611000 -1.997000      0.8413000 
1 1 1 22 32 44 o 3.519000 1.016000  3.159000 1.455000  3.879000 1.417000  -0.7204000     2.031000  
1 1 1 22 32 46 o 8.205000 0.9564000 7.204000 1.711000  9.205000 0.8544000 -2.000000      1.913000  
1 1 1 22 32 48 o 7.941000 1.307000  6.518000 2.485000  9.364000 0.8094000 -2.847000      2.614000  
1 1 1 22 33 1  o 10.74000 0.4184000 11.21000 0.6636000 10.28000 0.5098000 0.9289000      0.8368000 
1 1 1 22 33 3  o 33.55000 0.4183000 33.19000 0.6692000 33.92000 0.5022000 -0.7336000     0.8367000 
1 1 1 22 33 5  o 11.47000 0.5628000 11.26000 0.5738000 11.68000 0.9683000 -0.4193000     1.126000  
1 1 1 22 33 7  o 20.97000 0.4325000 20.77000 0.5236000 21.17000 0.6885000 -0.4036000     0.8649000 
1 1 1 22 33 9  o 21.27000 0.3724000 20.78000 0.5294000 21.76000 0.5238000 -0.9784000     0.7447000 
1 1 1 22 33 11 o 12.08000 0.5230000 12.83000 0.7169000 11.33000 0.7616000 1.499000       1.046000  
1 1 1 22 33 13 o 20.63000 0.3914000 20.42000 0.5489000 20.84000 0.5580000 -0.4216000     0.7828000 
1 1 1 22 33 15 o 27.31000 0.4594000 27.19000 0.6570000 27.43000 0.6424000 -0.2401000     0.9189000 
1 1 1 22 33 17 o 10.81000 0.5686000 11.65000 0.7456000 9.978000 0.8586000 1.671000       1.137000  
1 1 1 22 33 19 o 11.54000 0.5853000 11.33000 0.9047000 11.74000 0.7428000 -0.4151000     1.171000  
1 1 1 22 33 21 o 21.27000 0.4266000 21.85000 0.6466000 20.70000 0.5566000 1.144000       0.8532000 
1 1 1 22 33 23 o 6.500000 0.8282000 6.644000 1.270000  6.356000 1.064000  0.2882000      1.656000  
1 1 1 22 33 25 f 11.73000 0.5705000 11.83000 0.8046000 11.64000 0.8091000 0.1846000      1.141000  
1 1 1 22 33 27 o 17.34000 0.5784000 18.00000 0.9988000 16.68000 0.5836000 1.322000       1.157000  
1 1 1 22 33 29 o 13.59000 0.4633000 13.76000 0.6546000 13.41000 0.6560000 0.3550000      0.9267000 
1 1 1 22 33 31 f 21.81000 0.3799000 22.52000 0.5318000 21.10000 0.5426000 1.412000       0.7598000 
1 1 1 22 33 33 o 4.073000 0.9708000 4.803000 1.375000  3.343000 1.371000  1.459000       1.942000  
1 1 1 22 33 35 o 3.659000 1.008000  3.512000 1.401000  3.807000 1.450000  -0.2951000     2.017000  
1 1 1 22 33 37 o 9.888000 0.6596000 9.364000 0.8744000 10.41000 0.9878000 -1.049000      1.319000  
1 1 1 22 33 39 o 14.66000 0.4185000 14.15000 0.5394000 15.18000 0.6401000 -1.035000      0.8371000 
1 1 1 22 33 41 o 8.802000 0.8483000 8.458000 1.503000  9.146000 0.7875000 -0.6881000     1.697000  
1 1 1 22 33 43 o 3.844000 1.131000  4.246000 1.765000  3.442000 1.416000  0.8033000      2.262000  
1 1 1 22 33 45 o 6.389000 1.080000  6.302000 1.877000  6.476000 1.067000  -0.1741000     2.160000  
1 1 1 22 33 47 o 10.46000 0.7980000 10.55000 1.424000  10.37000 0.7205000 0.1814000      1.596000  
1 1 1 22 34 0  o 9.574000 0.5758000 9.574000 0.5758000 9.574000 0.5758000 0.000000       0.000000  
1 1 1 22 34 2  o 13.28000 0.3024000 13.65000 0.4682000 12.92000 0.3829000 0.7287000      0.6048000 
1 1 1 22 34 4  o 13.37000 0.4933000 12.99000 0.5001000 13.75000 0.8504000 -0.7581000     0.9866000 
1 1 1 22 34 6  o 21.35000 0.4942000 21.62000 0.6969000 21.07000 0.7009000 0.5527000      0.9883000 
1 1 1 22 34 8  o 13.83000 0.5196000 13.86000 0.5162000 13.81000 0.9018000 0.5066000E-01  1.039000  
1 1 1 22 34 10 o 19.04000 0.3935000 19.09000 0.5482000 18.98000 0.5645000 0.1174000      0.7869000 
1 1 1 22 34 12 o 4.950000 1.304000  3.255000 1.401000  6.645000 2.200000  -3.390000      2.609000  
1 1 1 22 34 14 o 16.13000 0.5032000 15.45000 0.6668000 16.82000 0.7539000 -1.369000      1.006000  
1 1 1 22 34 16 o 5.000000 1.036000  4.273000 1.597000  5.726000 1.321000  -1.453000      2.073000  
1 1 1 22 34 18 o 3.226000 0.9912000 3.283000 1.467000  3.170000 1.333000  0.1126000      1.982000  
1 1 1 22 34 20 o 20.55000 0.4142000 20.08000 0.6237000 21.02000 0.5452000 -0.9405000     0.8284000 
1 1 1 22 34 22 o 5.936000 0.9093000 6.419000 1.268000  5.453000 1.303000  0.9665000      1.819000  
1 1 1 22 34 24 o 9.571000 0.8962000 10.30000 1.062000  8.841000 1.444000  1.460000       1.792000  
1 1 1 22 34 26 o 11.22000 0.5382000 11.43000 0.7684000 11.02000 0.7539000 0.4134000      1.076000  
1 1 1 22 34 28 o 9.249000 0.6278000 8.576000 1.002000  9.923000 0.7561000 -1.347000      1.256000  
1 1 1 22 34 30 o 12.19000 0.5030000 11.66000 0.7360000 12.72000 0.6858000 -1.062000      1.006000  
1 1 1 22 34 32 o 9.319000 0.5930000 9.443000 0.8445000 9.196000 0.8327000 0.2466000      1.186000  
1 1 1 22 34 34 o 13.89000 0.4443000 14.02000 0.6168000 13.75000 0.6397000 0.2759000      0.8886000 
1 1 1 22 34 36 o 7.743000 0.8097000 7.267000 1.027000  8.219000 1.252000  -0.9526000     1.619000  
1 1 1 22 34 38 o 13.12000 0.5319000 11.81000 0.8471000 14.44000 0.6435000 -2.631000      1.064000  
1 1 1 22 34 40 o 13.02000 0.5754000 13.11000 0.9199000 12.94000 0.6915000 0.1750000      1.151000  
1 1 1 22 34 42 o 12.63000 0.6399000 12.06000 1.056000  13.20000 0.7228000 -1.144000      1.280000  
1 1 1 22 34 44 o 6.398000 1.024000  6.319000 1.745000  6.476000 1.072000  -0.1573000     2.048000  
1 1 1 22 34 46 o 6.748000 1.094000  5.354000 1.953000  8.143000 0.9862000 -2.788000      2.188000  
1 1 1 22 35 1  o 36.78000 0.3442000 36.83000 0.5294000 36.73000 0.4401000 0.9925000E-01  0.6885000 
1 1 1 22 35 3  o 11.05000 0.6703000 11.28000 0.6178000 10.82000 1.190000  0.4623000      1.341000  
1 1 1 22 35 5  o 6.692000 0.9609000 7.253000 0.8418000 6.132000 1.728000  1.121000       1.922000  
1 1 1 22 35 7  o 12.85000 0.4875000 13.25000 0.5322000 12.45000 0.8169000 0.7925000      0.9750000 
1 1 1 22 35 9  o 17.32000 0.6659000 17.73000 0.5702000 16.91000 1.204000  0.8265000      1.332000  
1 1 1 22 35 11 o 27.94000 0.6060000 28.33000 0.6601000 27.55000 1.016000  0.7823000      1.212000  
1 1 1 22 35 13 o 24.16000 0.4160000 23.51000 0.6445000 24.81000 0.5261000 -1.297000      0.8320000 
1 1 1 22 35 15 o 20.63000 0.5469000 20.68000 0.9497000 20.57000 0.5428000 0.1106000      1.094000  
1 1 1 22 35 17 o 9.021000 0.7124000 8.899000 1.108000  9.142000 0.8962000 -0.2431000     1.425000  
1 1 1 22 35 19 o 18.97000 0.4365000 18.82000 0.6696000 19.12000 0.5602000 -0.3074000     0.8731000 
1 1 1 22 35 21 o 18.21000 0.4352000 17.72000 0.5988000 18.70000 0.6318000 -0.9826000     0.8705000 
1 1 1 22 35 23 o 21.20000 0.5235000 20.06000 0.5308000 22.35000 0.9024000 -2.285000      1.047000  
1 1 1 22 35 25 o 32.03000 0.3835000 32.80000 0.5423000 31.27000 0.5426000 1.533000       0.7671000 
1 1 1 22 35 27 o 11.20000 0.5148000 11.55000 0.7079000 10.85000 0.7477000 0.6955000      1.030000  
1 1 1 22 35 29 o 10.55000 0.5456000 10.22000 0.7930000 10.89000 0.7497000 -0.6648000     1.091000  
1 1 1 22 35 31 o 19.35000 0.4003000 19.11000 0.5604000 19.59000 0.5718000 -0.4886000     0.8006000 
1 1 1 22 35 33 o 7.255000 0.8184000 6.975000 1.221000  7.535000 1.090000  -0.5606000     1.637000  
1 1 1 22 35 35 o 6.059000 1.148000  4.748000 1.487000  7.370000 1.749000  -2.622000      2.296000  
1 1 1 22 35 37 o 4.176000 1.195000  4.670000 1.963000  3.681000 1.363000  0.9891000      2.390000  
1 1 1 22 35 39 o 5.605000 0.9756000 4.070000 1.647000  7.140000 1.047000  -3.070000      1.951000  
1 1 1 22 35 41 o 3.953000 1.094000  5.226000 1.827000  2.680000 1.204000  2.546000       2.188000  
1 1 1 22 35 43 o 6.546000 0.9861000 7.466000 1.592000  5.627000 1.164000  1.838000       1.972000  
1 1 1 22 35 45 o 4.167000 1.078000  3.643000 1.648000  4.690000 1.392000  -1.047000      2.157000  
1 1 1 22 35 47 o 7.277000 2.527000  7.277000 2.527000  ?        ?         ?              ?         
1 1 1 22 36 0  o 5.401000 0.8512000 5.401000 0.8512000 5.401000 0.8512000 0.000000       0.000000  
1 1 1 22 36 2  o 20.55000 0.3878000 20.51000 0.6860000 20.58000 0.3618000 -0.6796000E-01 0.7755000 
1 1 1 22 36 4  o 4.584000 1.184000  3.840000 1.193000  5.327000 2.046000  -1.487000      2.369000  
1 1 1 22 36 6  f 6.598000 1.095000  7.400000 0.9086000 5.795000 1.992000  1.605000       2.190000  
1 1 1 22 36 8  o 14.18000 0.4916000 14.08000 0.5481000 14.28000 0.8162000 -0.2020000     0.9832000 
1 1 1 22 36 10 o 7.575000 0.8053000 7.043000 1.027000  8.108000 1.240000  -1.066000      1.611000  
1 1 1 22 36 12 o 25.70000 0.4110000 24.89000 0.4922000 26.50000 0.6585000 -1.609000      0.8221000 
1 1 1 22 36 14 o 13.66000 0.7313000 13.80000 1.176000  13.52000 0.8691000 0.2746000      1.463000  
1 1 1 22 36 16 o 21.29000 0.4210000 20.72000 0.6417000 21.85000 0.5451000 -1.130000      0.8419000 
1 1 1 22 36 18 o 18.16000 0.4255000 17.64000 0.5787000 18.69000 0.6241000 -1.056000      0.8511000 
1 1 1 22 36 20 o 4.542000 1.136000  4.306000 1.636000  4.778000 1.578000  -0.4714000     2.273000  
1 1 1 22 36 22 o 9.105000 0.6848000 10.16000 0.8842000 8.049000 1.046000  2.112000       1.370000  
1 1 1 22 36 24 o 6.486000 0.8929000 6.142000 1.335000  6.831000 1.186000  -0.6890000     1.786000  
1 1 1 22 36 26 o 13.80000 0.5144000 14.11000 0.7353000 13.48000 0.7195000 0.6298000      1.029000  
1 1 1 22 36 28 o 12.77000 0.4806000 12.85000 0.6876000 12.68000 0.6716000 0.1709000      0.9611000 
1 1 1 22 36 30 o 4.684000 0.9666000 5.377000 1.302000  3.990000 1.429000  1.386000       1.933000  
1 1 1 22 36 32 o 3.341000 0.9081000 2.412000 1.137000  4.270000 1.416000  -1.858000      1.816000  
1 1 1 22 36 34 o 12.39000 0.5109000 12.97000 0.6766000 11.82000 0.7656000 1.151000       1.022000  
1 1 1 22 36 36 o 13.30000 0.5473000 12.93000 0.8790000 13.67000 0.6522000 -0.7379000     1.095000  
1 1 1 22 36 38 o 9.683000 0.6734000 10.00000 1.020000  9.362000 0.8801000 0.6413000      1.347000  
1 1 1 22 36 40 o 3.834000 1.026000  3.476000 1.449000  4.192000 1.454000  -0.7164000     2.053000  
1 1 1 22 36 42 o 6.572000 1.019000  6.835000 1.674000  6.309000 1.162000  0.5255000      2.038000  
1 1 1 22 36 44 o 7.069000 1.035000  8.146000 1.803000  5.992000 1.017000  2.154000       2.070000  
1 1 1 22 36 46 o 5.180000 1.279000  5.082000 1.967000  5.278000 1.635000  -0.1956000     2.558000  
1 1 1 22 37 1  f 26.64000 0.2967000 26.52000 0.4301000 26.76000 0.4086000 -0.2453000     0.5933000 
1 1 1 22 37 3  o 7.278000 0.9728000 8.121000 0.9608000 6.435000 1.692000  1.685000       1.946000  
1 1 1 22 37 5  o 6.189000 0.9796000 7.288000 0.8695000 5.090000 1.756000  2.198000       1.959000  
1 1 1 22 37 7  o 23.62000 0.4129000 23.64000 0.4570000 23.60000 0.6878000 0.4494000E-01  0.8258000 
1 1 1 22 37 9  o 8.638000 0.7593000 8.827000 0.7012000 8.450000 1.347000  0.3773000      1.519000  
1 1 1 22 37 11 o 13.45000 0.5523000 12.35000 0.6698000 14.54000 0.8784000 -2.192000      1.105000  
1 1 1 22 37 13 o 20.25000 0.4303000 20.68000 0.4849000 19.81000 0.7109000 0.8703000      0.8605000 
1 1 1 22 37 15 o 16.17000 0.4441000 15.90000 0.4994000 16.43000 0.7345000 -0.5333000     0.8882000 
1 1 1 22 37 17 o 25.40000 0.5510000 25.73000 0.6758000 25.06000 0.8703000 0.6657000      1.102000  
1 1 1 22 37 19 o 13.28000 0.5219000 13.74000 0.7298000 12.81000 0.7461000 0.9353000      1.044000  
1 1 1 22 37 21 o 10.89000 0.5508000 10.55000 0.7715000 11.22000 0.7862000 -0.6703000     1.102000  
1 1 1 22 37 23 o 12.31000 0.5949000 12.21000 0.6967000 12.40000 0.9644000 -0.1939000     1.190000  
1 1 1 22 37 25 o 20.68000 0.3934000 20.89000 0.5332000 20.46000 0.5786000 0.4366000      0.7868000 
1 1 1 22 37 27 o 4.066000 0.9284000 3.273000 1.301000  4.858000 1.324000  -1.585000      1.857000  
1 1 1 22 37 29 o 6.023000 0.8899000 6.772000 1.150000  5.274000 1.358000  1.497000       1.780000  
1 1 1 22 37 31 o 15.23000 0.5185000 15.00000 0.6650000 15.46000 0.7956000 -0.4595000     1.037000  
1 1 1 22 37 33 o 7.713000 0.7400000 6.718000 1.177000  8.708000 0.8976000 -1.990000      1.480000  
1 1 1 22 37 35 o 10.26000 0.6278000 10.56000 0.9613000 9.964000 0.8077000 0.5951000      1.256000  
1 1 1 22 37 37 o 4.205000 1.091000  4.985000 1.695000  3.426000 1.375000  1.559000       2.183000  
1 1 1 22 37 39 o 3.600000 1.021000  3.445000 1.458000  3.756000 1.429000  -0.3116000     2.041000  
1 1 1 22 37 41 o 4.130000 1.116000  5.166000 1.777000  3.095000 1.350000  2.071000       2.231000  
1 1 1 22 37 43 o 5.256000 1.095000  5.129000 1.865000  5.384000 1.149000  -0.2548000     2.190000  
1 1 1 22 37 45 o 4.190000 1.169000  4.904000 1.828000  3.477000 1.458000  1.427000       2.338000  
1 1 1 22 38 0  o 18.81000 0.3571000 18.81000 0.3571000 18.81000 0.3571000 0.000000       0.000000  
1 1 1 22 38 2  o 17.80000 0.2594000 18.47000 0.3932000 17.12000 0.3384000 1.351000       0.5187000 
1 1 1 22 38 4  o 20.28000 0.4172000 21.29000 0.3939000 19.26000 0.7356000 2.033000       0.8344000 
1 1 1 22 38 6  o 11.24000 0.5725000 11.08000 0.5593000 11.39000 0.9992000 -0.3010000     1.145000  
1 1 1 22 38 8  o 25.51000 0.4126000 26.30000 0.4578000 24.71000 0.6866000 1.585000       0.8252000 
1 1 1 22 38 10 o 12.25000 0.5693000 12.55000 0.6133000 11.94000 0.9592000 0.6100000      1.139000  
1 1 1 22 38 12 o 20.47000 0.4178000 21.15000 0.4228000 19.80000 0.7207000 1.351000       0.8356000 
1 1 1 22 38 14 o 4.035000 1.070000  3.537000 1.279000  4.532000 1.716000  -0.9952000     2.140000  
1 1 1 22 38 16 o 4.958000 1.098000  3.663000 1.273000  6.253000 1.790000  -2.590000      2.196000  
1 1 1 22 38 18 o 5.016000 1.011000  4.938000 1.157000  5.094000 1.660000  -0.1559000     2.023000  
1 1 1 22 38 20 o 6.261000 0.9313000 6.037000 1.292000  6.484000 1.342000  -0.4465000     1.863000  
1 1 1 22 38 22 o 8.724000 0.8381000 9.079000 0.9787000 8.369000 1.361000  0.7095000      1.676000  
1 1 1 22 38 24 o 7.285000 0.8365000 7.045000 1.275000  7.525000 1.083000  -0.4803000     1.673000  
1 1 1 22 38 26 o 7.535000 0.7340000 6.922000 0.9969000 8.147000 1.078000  -1.225000      1.468000  
1 1 1 22 38 28 o 4.759000 0.9822000 5.124000 1.375000  4.393000 1.403000  0.7314000      1.964000  
1 1 1 22 38 30 o 16.27000 0.4849000 16.70000 0.6268000 15.83000 0.7400000 0.8682000      0.9698000 
1 1 1 22 38 32 o 4.507000 1.049000  4.050000 1.473000  4.964000 1.495000  -0.9145000     2.099000  
1 1 1 22 38 34 o 7.278000 1.026000  9.024000 1.182000  5.532000 1.677000  3.491000       2.052000  
1 1 1 22 38 36 o 6.137000 1.128000  7.147000 1.813000  5.127000 1.342000  2.020000       2.256000  
1 1 1 22 38 38 o 8.187000 0.7448000 7.566000 1.190000  8.808000 0.8958000 -1.242000      1.490000  
1 1 1 22 38 40 o 4.316000 1.058000  4.907000 1.568000  3.724000 1.420000  1.183000       2.116000  
1 1 1 22 38 42 o 6.308000 1.087000  5.700000 1.955000  6.916000 0.9490000 -1.216000      2.173000  
1 1 1 22 38 44 o 4.781000 1.218000  5.792000 1.924000  3.770000 1.495000  2.022000       2.437000  
1 1 1 22 39 1  o 17.07000 0.2556000 16.79000 0.3747000 17.35000 0.3479000 -0.5594000     0.5113000 
1 1 1 22 39 3  o 11.66000 0.5462000 12.02000 0.5835000 11.31000 0.9234000 0.7169000      1.092000  
1 1 1 22 39 5  o 28.30000 0.4083000 28.65000 0.4578000 27.95000 0.6762000 0.7051000      0.8166000 
1 1 1 22 39 7  o 23.07000 0.4143000 22.86000 0.4562000 23.29000 0.6917000 -0.4302000     0.8286000 
1 1 1 22 39 9  o 3.802000 1.100000  3.060000 1.200000  4.545000 1.844000  -1.485000      2.200000  
1 1 1 22 39 11 o 19.00000 0.5755000 18.43000 0.4501000 19.56000 1.059000  -1.129000      1.151000  
1 1 1 22 39 13 o 17.67000 0.5469000 17.43000 0.6313000 17.91000 0.8932000 -0.4800000     1.094000  
1 1 1 22 39 15 o 5.577000 1.006000  5.039000 1.182000  6.116000 1.627000  -1.077000      2.011000  
1 1 1 22 39 17 o 11.97000 0.5661000 12.30000 0.5791000 11.64000 0.9730000 0.6601000      1.132000  
1 1 1 22 39 19 o 12.87000 0.4591000 12.62000 0.5361000 13.12000 0.7455000 -0.5017000     0.9182000 
1 1 1 22 39 21 o 10.17000 0.6030000 9.669000 0.6842000 10.68000 0.9930000 -1.011000      1.206000  
1 1 1 22 39 23 o 21.30000 0.4544000 21.89000 0.5492000 20.71000 0.7241000 1.177000       0.9088000 
1 1 1 22 39 25 f 13.12000 0.5294000 13.34000 0.7390000 12.89000 0.7582000 0.4527000      1.059000  
1 1 1 22 39 27 o 14.24000 0.5601000 14.58000 0.6238000 13.89000 0.9303000 0.6871000      1.120000  
1 1 1 22 39 29 o 14.79000 0.6655000 16.12000 0.7048000 13.47000 1.129000  2.656000       1.331000  
1 1 1 22 39 31 o 6.591000 0.8606000 6.111000 1.260000  7.070000 1.173000  -0.9589000     1.721000  
1 1 1 22 39 33 o 4.004000 1.018000  3.485000 1.414000  4.524000 1.465000  -1.039000      2.037000  
1 1 1 22 39 35 o 3.068000 0.9650000 2.955000 1.363000  3.182000 1.366000  -0.2268000     1.930000  
1 1 1 22 39 37 o 4.318000 1.030000  5.003000 1.457000  3.632000 1.457000  1.371000       2.060000  
1 1 1 22 39 39 o 3.656000 1.053000  2.741000 1.268000  4.570000 1.681000  -1.829000      2.106000  
1 1 1 22 39 41 o 7.414000 0.8249000 7.894000 1.118000  6.934000 1.213000  0.9597000      1.650000  
1 1 1 22 39 43 o 6.108000 1.133000  5.800000 1.936000  6.416000 1.177000  -0.6162000     2.266000  
1 1 1 22 40 0  o 7.549000 0.5670000 7.549000 0.5670000 7.549000 0.5670000 0.000000       0.000000  
1 1 1 22 40 2  o 9.070000 0.3592000 9.229000 0.5796000 8.910000 0.4244000 0.3192000      0.7183000 
1 1 1 22 40 4  o 4.874000 1.087000  4.080000 1.128000  5.668000 1.860000  -1.589000      2.175000  
1 1 1 22 40 6  o 11.92000 0.6749000 13.61000 0.4929000 10.23000 1.257000  3.377000       1.350000  
1 1 1 22 40 8  o 10.19000 0.7781000 9.715000 0.6481000 10.66000 1.415000  -0.9481000     1.556000  
1 1 1 22 40 10 o 4.282000 1.088000  4.843000 1.558000  3.722000 1.519000  1.121000       2.176000  
1 1 1 22 40 12 o 4.702000 0.9529000 5.274000 1.147000  4.129000 1.522000  1.145000       1.906000  
1 1 1 22 40 14 o 10.16000 0.6210000 9.874000 0.6341000 10.44000 1.068000  -0.5644000     1.242000  
1 1 1 22 40 16 o 12.01000 0.5683000 12.46000 0.5538000 11.55000 0.9925000 0.9167000      1.137000  
1 1 1 22 40 18 o 5.894000 0.8778000 4.553000 1.200000  7.236000 1.282000  -2.683000      1.756000  
1 1 1 22 40 20 o 3.125000 0.9068000 2.150000 1.015000  4.100000 1.503000  -1.950000      1.814000  
1 1 1 22 40 22 f 3.791000 1.021000  3.974000 1.483000  3.608000 1.405000  0.3659000      2.043000  
1 1 1 22 40 24 o 4.611000 1.064000  4.397000 1.296000  4.825000 1.688000  -0.4283000     2.128000  
1 1 1 22 40 26 o 11.09000 0.5788000 11.68000 0.5932000 10.49000 0.9941000 1.188000       1.158000  
1 1 1 22 40 28 o 3.883000 1.178000  3.511000 1.358000  4.256000 1.925000  -0.7451000     2.356000  
1 1 1 22 40 30 o 10.03000 0.6104000 10.34000 0.7130000 9.728000 0.9910000 0.6136000      1.221000  
1 1 1 22 40 32 o 4.050000 1.045000  4.200000 1.443000  3.900000 1.510000  0.2995000      2.089000  
1 1 1 22 40 34 f 5.407000 1.255000  6.040000 1.922000  4.775000 1.615000  1.265000       2.511000  
1 1 1 22 40 36 o 3.234000 0.9800000 3.286000 1.432000  3.183000 1.338000  0.1023000      1.960000  
1 1 1 22 40 38 o 3.861000 1.046000  2.707000 1.234000  5.015000 1.689000  -2.308000      2.092000  
1 1 1 22 40 40 o 4.188000 1.084000  4.412000 1.573000  3.965000 1.492000  0.4472000      2.168000  
1 1 1 22 40 42 o 4.316000 1.238000  3.736000 1.679000  4.897000 1.819000  -1.161000      2.476000  
1 1 1 22 41 1  o 13.88000 0.2662000 14.07000 0.3904000 13.69000 0.3620000 0.3750000      0.5324000 
1 1 1 22 41 3  o 3.190000 0.9309000 2.175000 0.9554000 4.205000 1.598000  -2.030000      1.862000  
1 1 1 22 41 5  o 17.89000 0.4217000 18.67000 0.3933000 17.11000 0.7461000 1.556000       0.8434000 
1 1 1 22 41 7  o 13.96000 0.5945000 13.66000 0.5292000 14.26000 1.065000  -0.5996000     1.189000  
1 1 1 22 41 9  o 13.84000 0.5105000 13.69000 0.4928000 13.98000 0.8941000 -0.2908000     1.021000  
1 1 1 22 41 11 o 12.89000 0.5605000 12.71000 0.5207000 13.07000 0.9927000 -0.3579000     1.121000  
1 1 1 22 41 13 o 5.086000 1.016000  4.685000 1.209000  5.487000 1.633000  -0.8022000     2.032000  
1 1 1 22 41 15 o 9.466000 0.8531000 10.23000 0.5722000 8.703000 1.607000  1.526000       1.706000  
1 1 1 22 41 17 o 6.422000 0.8751000 7.017000 0.7934000 5.826000 1.560000  1.191000       1.750000  
1 1 1 22 41 19 o 14.96000 0.4865000 15.73000 0.4859000 14.18000 0.8429000 1.548000       0.9729000 
1 1 1 22 41 21 o 4.892000 0.9579000 5.994000 1.304000  3.790000 1.404000  2.205000       1.916000  
1 1 1 22 41 23 o 8.455000 0.7524000 8.928000 0.7671000 7.982000 1.295000  0.9458000      1.505000  
1 1 1 22 41 25 o 4.212000 1.154000  4.053000 1.268000  4.371000 1.929000  -0.3183000     2.309000  
1 1 1 22 41 27 o 7.597000 0.8551000 7.683000 0.8897000 7.511000 1.461000  0.1725000      1.710000  
1 1 1 22 41 29 o 9.796000 0.7498000 10.46000 0.7817000 9.131000 1.280000  1.331000       1.500000  
1 1 1 22 41 31 f 6.082000 1.007000  6.519000 0.9327000 5.645000 1.785000  0.8739000      2.014000  
1 1 1 22 41 33 o 6.092000 1.112000  5.586000 1.563000  6.598000 1.581000  -1.012000      2.223000  
1 1 1 22 41 35 o 6.930000 0.9547000 8.006000 1.251000  5.855000 1.443000  2.151000       1.909000  
1 1 1 22 41 37 o 3.508000 1.019000  3.065000 1.295000  3.951000 1.572000  -0.8864000     2.037000  
1 1 1 22 41 39 o 4.214000 1.045000  5.001000 1.551000  3.426000 1.401000  1.575000       2.090000  
1 1 1 22 41 41 o 4.517000 2.024000  4.517000 2.024000  ?        ?         ?              ?         
1 1 1 22 42 0  o 8.195000 0.7617000 8.195000 0.7617000 8.195000 0.7617000 0.000000       0.000000  
1 1 1 22 42 2  o 15.11000 0.2895000 15.97000 0.4672000 14.24000 0.3421000 1.730000       0.5791000 
1 1 1 22 42 4  o 9.326000 0.8062000 9.267000 0.5451000 9.385000 1.517000  -0.1183000     1.612000  
1 1 1 22 42 6  o 8.931000 0.6412000 8.584000 0.6563000 9.278000 1.102000  -0.6935000     1.282000  
1 1 1 22 42 8  f 11.93000 0.5317000 11.12000 0.5923000 12.74000 0.8833000 -1.620000      1.063000  
1 1 1 22 42 10 o 13.99000 0.5565000 14.27000 0.6472000 13.71000 0.9056000 0.5649000      1.113000  
1 1 1 22 42 12 o 14.23000 0.5135000 14.48000 0.5017000 13.97000 0.8961000 0.5110000      1.027000  
1 1 1 22 42 14 o 13.86000 0.4832000 14.25000 0.5185000 13.48000 0.8154000 0.7736000      0.9663000 
1 1 1 22 42 16 o 13.65000 0.4815000 13.56000 0.5110000 13.74000 0.8163000 -0.1772000     0.9630000 
1 1 1 22 42 18 o 6.853000 0.8690000 7.389000 0.8121000 6.317000 1.537000  1.072000       1.738000  
1 1 1 22 42 20 o 4.864000 0.9916000 4.373000 1.259000  5.355000 1.532000  -0.9820000     1.983000  
1 1 1 22 42 22 o 4.063000 1.008000  3.792000 1.300000  4.335000 1.540000  -0.5428000     2.016000  
1 1 1 22 42 24 o 8.734000 1.047000  8.449000 0.8503000 9.019000 1.913000  -0.5691000     2.093000  
1 1 1 22 42 26 o 9.187000 0.7178000 9.342000 0.7432000 9.032000 1.228000  0.3096000      1.436000  
1 1 1 22 42 28 o 7.223000 0.9645000 7.996000 0.9999000 6.451000 1.650000  1.544000       1.929000  
1 1 1 22 42 30 o 4.578000 1.029000  4.659000 1.160000  4.497000 1.699000  0.1619000      2.058000  
1 1 1 22 42 32 o 3.252000 0.9671000 3.581000 1.391000  2.923000 1.344000  0.6580000      1.934000  
1 1 1 22 42 34 o 5.530000 1.009000  6.031000 1.249000  5.029000 1.584000  1.003000       2.017000  
1 1 1 22 42 36 o 4.401000 1.063000  4.763000 1.402000  4.038000 1.598000  0.7253000      2.126000  
1 1 1 22 42 38 o 5.488000 1.032000  5.115000 1.174000  5.861000 1.697000  -0.7459000     2.064000  
1 1 1 22 43 1  o 9.961000 0.3285000 10.57000 0.4627000 9.347000 0.4664000 1.227000       0.6570000 
1 1 1 22 43 3  o 12.32000 0.5036000 12.08000 0.4660000 12.55000 0.8930000 -0.4763000     1.007000  
1 1 1 22 43 5  o 23.59000 0.4869000 23.62000 0.3998000 23.55000 0.8880000 0.7278000E-01  0.9738000 
1 1 1 22 43 7  o 21.29000 0.4518000 20.65000 0.4091000 21.93000 0.8058000 -1.288000      0.9036000 
1 1 1 22 43 9  o 15.64000 0.5025000 15.98000 0.4797000 15.30000 0.8831000 0.6854000      1.005000  
1 1 1 22 43 11 o 8.996000 0.7097000 9.490000 0.6970000 8.503000 1.237000  0.9872000      1.419000  
1 1 1 22 43 13 f 4.210000 0.9675000 3.834000 1.227000  4.586000 1.496000  -0.7518000     1.935000  
1 1 1 22 43 15 o 9.080000 0.7010000 9.411000 0.6660000 8.749000 1.234000  0.6626000      1.402000  
1 1 1 22 43 17 o 10.29000 0.5980000 9.969000 0.6217000 10.61000 1.022000  -0.6413000     1.196000  
1 1 1 22 43 19 o 3.721000 0.9816000 3.773000 1.296000  3.668000 1.475000  0.1049000      1.963000  
1 1 1 22 43 21 o 5.357000 1.235000  3.512000 1.348000  7.201000 2.069000  -3.689000      2.469000  
1 1 1 22 43 23 o 12.35000 0.5111000 12.18000 0.5896000 12.52000 0.8351000 -0.3445000     1.022000  
1 1 1 22 43 25 o 11.67000 0.5349000 11.65000 0.5827000 11.69000 0.8972000 -0.4094000E-01 1.070000  
1 1 1 22 43 27 o 4.948000 0.9940000 6.130000 1.149000  3.765000 1.622000  2.365000       1.988000  
1 1 1 22 43 29 o 4.757000 1.139000  4.552000 1.492000  4.962000 1.722000  -0.4106000     2.279000  
1 1 1 22 43 31 o 10.07000 0.7268000 10.80000 0.6856000 9.346000 1.282000  1.455000       1.454000  
1 1 1 22 43 33 o 12.99000 0.6571000 12.60000 0.6070000 13.39000 1.166000  -0.7959000     1.314000  
1 1 1 22 43 35 o 6.539000 0.9332000 7.958000 0.9515000 5.121000 1.606000  2.837000       1.866000  
1 1 1 22 43 37 o 8.367000 0.7565000 8.072000 0.9161000 8.662000 1.204000  -0.5898000     1.513000  
1 1 1 22 44 0  o 19.00000 0.5785000 19.00000 0.5785000 19.00000 0.5785000 0.000000       0.000000  
1 1 1 22 44 2  o 16.40000 0.3405000 17.12000 0.5124000 15.68000 0.4485000 1.438000       0.6809000 
1 1 1 22 44 4  o 13.34000 0.4760000 12.97000 0.4641000 13.72000 0.8313000 -0.7494000     0.9521000 
1 1 1 22 44 6  o 11.37000 0.5461000 10.90000 0.5375000 11.84000 0.9507000 -0.9390000     1.092000  
1 1 1 22 44 8  o 19.25000 0.4640000 18.77000 0.4249000 19.72000 0.8250000 -0.9469000     0.9280000 
1 1 1 22 44 10 o 8.794000 0.8039000 9.548000 0.6706000 8.040000 1.461000  1.508000       1.608000  
1 1 1 22 44 12 o 5.887000 0.9729000 6.336000 1.058000  5.439000 1.633000  0.8963000      1.946000  
1 1 1 22 44 14 o 3.387000 0.9608000 2.885000 1.185000  3.889000 1.513000  -1.004000      1.922000  
1 1 1 22 44 16 o 3.409000 0.9662000 2.370000 1.065000  4.449000 1.612000  -2.080000      1.932000  
1 1 1 22 44 18 o 10.61000 0.6131000 10.76000 0.6135000 10.46000 1.062000  0.2999000      1.226000  
1 1 1 22 44 20 o 12.87000 0.7511000 13.06000 0.6289000 12.68000 1.364000  0.3791000      1.502000  
1 1 1 22 44 22 o 6.047000 0.9612000 5.970000 1.094000  6.125000 1.581000  -0.1546000     1.922000  
1 1 1 22 44 24 o 3.352000 0.9542000 2.724000 1.211000  3.981000 1.475000  -1.257000      1.908000  
1 1 1 22 44 26 o 4.193000 1.047000  3.363000 1.265000  5.024000 1.669000  -1.661000      2.094000  
1 1 1 22 44 28 o 4.688000 1.122000  3.953000 1.412000  5.423000 1.743000  -1.470000      2.243000  
1 1 1 22 44 30 o 7.859000 0.8859000 9.517000 0.7777000 6.200000 1.592000  3.316000       1.772000  
1 1 1 22 44 32 o 6.251000 1.060000  5.471000 1.254000  7.031000 1.709000  -1.560000      2.119000  
1 1 1 22 44 34 o 3.243000 0.9917000 2.537000 1.170000  3.950000 1.602000  -1.413000      1.983000  
1 1 1 22 44 36 o 3.299000 0.9831000 3.177000 1.296000  3.421000 1.479000  -0.2442000     1.966000  
1 1 1 22 45 1  o 5.293000 0.5699000 5.052000 0.8664000 5.535000 0.7408000 -0.4834000     1.140000  
1 1 1 22 45 3  o 5.947000 1.075000  6.400000 0.7579000 5.494000 2.011000  0.9058000      2.149000  
1 1 1 22 45 5  o 5.171000 0.9508000 6.035000 0.9697000 4.307000 1.636000  1.727000       1.902000  
1 1 1 22 45 7  o 7.304000 0.8041000 7.536000 0.7380000 7.072000 1.429000  0.4644000      1.608000  
1 1 1 22 45 9  o 9.952000 0.6782000 9.111000 0.8720000 10.79000 1.039000  -1.682000      1.356000  
1 1 1 22 45 11 o 8.923000 0.7428000 9.734000 0.6229000 8.111000 1.349000  1.622000       1.486000  
1 1 1 22 45 13 o 3.115000 0.9670000 2.778000 1.196000  3.451000 1.520000  -0.6728000     1.934000  
1 1 1 22 45 15 o 6.308000 0.8651000 6.950000 0.9189000 5.665000 1.466000  1.285000       1.730000  
1 1 1 22 45 17 o 3.431000 1.070000  2.897000 1.190000  3.965000 1.778000  -1.067000      2.139000  
1 1 1 22 45 19 o 3.870000 1.027000  3.198000 1.219000  4.542000 1.655000  -1.344000      2.055000  
1 1 1 22 45 21 o 5.032000 1.044000  4.848000 1.214000  5.215000 1.700000  -0.3669000     2.089000  
1 1 1 22 45 23 o 4.164000 1.047000  4.400000 1.470000  3.929000 1.490000  0.4705000      2.093000  
1 1 1 22 45 25 o 4.772000 1.047000  5.376000 1.349000  4.169000 1.602000  1.207000       2.094000  
1 1 1 22 45 27 f 2.936000 0.9193000 3.007000 1.266000  2.866000 1.333000  0.1416000      1.839000  
1 1 1 22 45 29 o 5.860000 0.9854000 5.856000 1.171000  5.865000 1.585000  -0.8534000E-02 1.971000  
1 1 1 22 45 31 o 4.966000 1.169000  4.120000 1.525000  5.812000 1.772000  -1.692000      2.338000  
1 1 1 22 45 33 o 3.648000 1.042000  3.027000 1.313000  4.270000 1.619000  -1.243000      2.084000  
1 1 1 22 45 35 o 7.381000 1.169000  7.906000 0.8194000 6.857000 2.191000  1.049000       2.339000  
1 1 1 22 46 0  f 8.508000 0.8098000 8.508000 0.8098000 8.508000 0.8098000 0.000000       0.000000  
1 1 1 22 46 2  o 5.512000 0.6781000 6.042000 1.038000  4.983000 0.8727000 1.060000       1.356000  
1 1 1 22 46 4  o 10.73000 0.5679000 11.06000 0.5197000 10.39000 1.010000  0.6720000      1.136000  
1 1 1 22 46 6  o 4.256000 1.051000  4.555000 1.134000  3.957000 1.771000  0.5987000      2.103000  
1 1 1 22 46 8  o 5.504000 0.9543000 5.611000 1.009000  5.397000 1.620000  0.2134000      1.909000  
1 1 1 22 46 10 o 6.146000 0.9664000 5.659000 0.9970000 6.633000 1.656000  -0.9741000     1.933000  
1 1 1 22 46 12 o 7.314000 0.9074000 8.272000 0.8514000 6.356000 1.603000  1.916000       1.815000  
1 1 1 22 46 14 o 6.570000 1.181000  5.794000 1.138000  7.346000 2.070000  -1.552000      2.362000  
1 1 1 22 46 16 o 5.083000 1.206000  4.251000 1.303000  5.916000 2.030000  -1.666000      2.412000  
1 1 1 22 46 18 o 7.745000 0.7720000 7.381000 0.8869000 8.110000 1.264000  -0.7288000     1.544000  
1 1 1 22 46 20 o 4.668000 1.167000  4.259000 1.510000  5.077000 1.780000  -0.8179000     2.334000  
1 1 1 22 46 22 o 5.176000 0.9328000 5.083000 1.164000  5.270000 1.458000  -0.1861000     1.866000  
1 1 1 22 46 24 o 4.087000 1.083000  3.386000 1.378000  4.787000 1.672000  -1.400000      2.166000  
1 1 1 22 46 26 o 6.038000 0.9847000 7.387000 1.026000  4.689000 1.681000  2.698000       1.969000  
1 1 1 22 46 28 o 3.847000 0.9225000 4.607000 1.257000  3.087000 1.350000  1.520000       1.845000  
1 1 1 22 46 30 o 5.302000 1.098000  4.466000 1.300000  6.139000 1.770000  -1.673000      2.196000  
1 1 1 22 46 32 o 6.344000 0.9812000 7.140000 0.9010000 5.548000 1.743000  1.592000       1.962000  
1 1 1 22 46 34 o 4.285000 1.202000  2.692000 1.301000  5.877000 2.022000  -3.186000      2.404000  
1 1 1 22 47 1  o 6.007000 0.9023000 6.619000 0.6826000 5.395000 1.671000  1.224000       1.805000  
1 1 1 22 47 3  o 4.730000 0.9434000 5.089000 0.9590000 4.371000 1.625000  0.7179000      1.887000  
1 1 1 22 47 5  o 3.190000 0.9117000 3.045000 1.145000  3.335000 1.419000  -0.2901000     1.823000  
1 1 1 22 47 7  o 8.632000 0.6772000 8.809000 0.6662000 8.454000 1.179000  0.3549000      1.354000  
1 1 1 22 47 9  o 5.764000 1.168000  5.907000 1.046000  5.620000 2.089000  0.2878000      2.336000  
1 1 1 22 47 11 o 5.458000 1.356000  4.040000 1.325000  6.877000 2.365000  -2.837000      2.711000  
1 1 1 22 47 13 o 9.598000 0.8236000 8.725000 0.7370000 10.47000 1.473000  -1.746000      1.647000  
1 1 1 22 47 15 o 4.543000 1.068000  3.649000 1.262000  5.438000 1.724000  -1.789000      2.136000  
1 1 1 22 47 17 o 4.475000 0.9270000 5.679000 1.189000  3.271000 1.423000  2.408000       1.854000  
1 1 1 22 47 19 o 6.855000 1.013000  5.729000 1.485000  7.982000 1.378000  -2.253000      2.026000  
1 1 1 22 47 21 o 10.76000 0.6368000 10.69000 0.7945000 10.84000 0.9954000 -0.1487000     1.274000  
1 1 1 22 47 23 o 4.637000 1.083000  4.549000 1.368000  4.725000 1.681000  -0.1762000     2.167000  
1 1 1 22 47 25 o 3.749000 1.033000  3.682000 1.317000  3.816000 1.592000  -0.1339000     2.066000  
1 1 1 22 47 27 o 4.945000 1.118000  4.231000 1.340000  5.658000 1.790000  -1.426000      2.236000  
1 1 1 22 47 29 o 6.413000 0.8807000 6.239000 1.041000  6.588000 1.421000  -0.3490000     1.761000  
1 1 1 22 47 31 o 3.917000 1.028000  3.989000 1.292000  3.846000 1.600000  0.1432000      2.056000  
1 1 1 22 48 0  o 10.29000 0.6290000 10.29000 0.6290000 10.29000 0.6290000 0.000000       0.000000  
1 1 1 22 48 2  o 6.004000 0.6673000 5.937000 1.117000  6.072000 0.7302000 -0.1346000     1.335000  
1 1 1 22 48 4  o 2.893000 0.8361000 3.187000 1.134000  2.599000 1.229000  0.5877000      1.672000  
1 1 1 22 48 6  o 3.365000 0.9208000 3.625000 1.200000  3.105000 1.397000  0.5196000      1.842000  
1 1 1 22 48 8  o 5.550000 1.232000  5.161000 1.375000  5.938000 2.044000  -0.7773000     2.464000  
1 1 1 22 48 10 o 15.19000 0.7718000 15.90000 0.4904000 14.47000 1.464000  1.432000       1.544000  
1 1 1 22 48 12 f 4.450000 1.323000  3.162000 1.247000  5.738000 2.333000  -2.575000      2.645000  
1 1 1 22 48 14 o 6.236000 0.9494000 5.768000 1.112000  6.704000 1.539000  -0.9360000     1.899000  
1 1 1 22 48 16 o 14.96000 0.5435000 15.58000 0.7121000 14.35000 0.8211000 1.236000       1.087000  
1 1 1 22 48 18 o 4.871000 1.029000  5.789000 1.261000  3.953000 1.627000  1.836000       2.059000  
1 1 1 22 48 20 o 3.974000 1.047000  3.816000 1.427000  4.133000 1.531000  -0.3173000     2.093000  
1 1 1 22 48 22 o 3.376000 1.028000  2.872000 1.258000  3.880000 1.626000  -1.008000      2.056000  
1 1 1 22 48 24 o 5.414000 1.055000  5.502000 1.114000  5.327000 1.793000  0.1755000      2.111000  
1 1 1 22 48 26 o 6.730000 0.9940000 7.057000 0.9247000 6.403000 1.760000  0.6539000      1.988000  
1 1 1 22 48 28 o 3.765000 1.040000  2.892000 1.233000  4.638000 1.674000  -1.746000      2.079000  
1 1 1 22 48 30 o 3.788000 1.092000  3.538000 1.389000  4.039000 1.685000  -0.5011000     2.184000  
1 1 1 22 49 1  o 15.80000 0.6932000 15.30000 0.7887000 16.30000 1.140000  -1.008000      1.386000  
1 1 1 22 49 3  o 10.90000 0.8349000 10.91000 0.4971000 10.89000 1.594000  0.1662000E-01  1.670000  
1 1 1 22 49 5  o 6.078000 1.014000  6.175000 0.8506000 5.981000 1.841000  0.1934000      2.028000  
1 1 1 22 49 7  o 5.645000 1.196000  4.633000 1.111000  6.657000 2.119000  -2.024000      2.393000  
1 1 1 22 49 9  o 3.777000 1.023000  2.624000 1.144000  4.930000 1.695000  -2.305000      2.045000  
1 1 1 22 49 11 o 5.608000 1.024000  5.552000 1.133000  5.664000 1.707000  -0.1113000     2.049000  
1 1 1 22 49 13 o 5.612000 1.070000  5.527000 1.275000  5.697000 1.719000  -0.1697000     2.140000  
1 1 1 22 49 15 f 6.365000 1.189000  6.124000 1.071000  6.607000 2.122000  -0.4829000     2.377000  
1 1 1 22 49 17 o 4.627000 1.094000  4.689000 1.398000  4.566000 1.684000  0.1231000      2.189000  
1 1 1 22 49 19 o 7.334000 0.8438000 7.140000 0.8817000 7.527000 1.439000  -0.3876000     1.688000  
1 1 1 22 49 21 o 4.977000 1.091000  5.323000 1.332000  4.631000 1.729000  0.6923000      2.183000  
1 1 1 22 49 23 o 4.268000 1.177000  4.033000 1.365000  4.502000 1.917000  -0.4688000     2.353000  
1 1 1 22 49 25 o 5.648000 0.9857000 5.939000 1.113000  5.357000 1.627000  0.5820000      1.971000  
1 1 1 22 49 27 o 3.789000 1.000000  2.755000 1.193000  4.822000 1.605000  -2.067000      2.000000  
1 1 1 22 49 29 o 4.813000 2.007000  4.813000 2.007000  ?        ?         ?              ?         
1 1 1 22 50 0  o 7.918000 1.647000  7.918000 1.647000  7.918000 1.647000  0.000000       0.000000  
1 1 1 22 50 2  o 7.205000 0.8322000 6.809000 0.9325000 7.601000 1.379000  -0.7924000     1.664000  
1 1 1 22 50 4  o 10.55000 0.6814000 11.70000 0.5561000 9.395000 1.244000  2.310000       1.363000  
1 1 1 22 50 6  o 4.842000 1.031000  4.288000 1.222000  5.396000 1.661000  -1.108000      2.062000  
1 1 1 22 50 8  o 4.383000 1.011000  3.551000 1.329000  5.215000 1.525000  -1.664000      2.023000  
1 1 1 22 50 10 o 5.961000 1.103000  6.567000 1.474000  5.355000 1.641000  1.212000       2.205000  
1 1 1 22 50 12 o 3.378000 0.9491000 3.940000 1.369000  2.817000 1.315000  1.123000       1.898000  
1 1 1 22 50 14 o 7.949000 0.7629000 8.049000 0.7223000 7.849000 1.344000  0.2008000      1.526000  
1 1 1 22 50 16 o 6.008000 1.031000  6.147000 1.086000  5.870000 1.753000  0.2766000      2.062000  
1 1 1 22 50 18 o 8.966000 1.189000  9.822000 1.068000  8.111000 2.124000  1.711000       2.377000  
1 1 1 22 50 20 o 7.501000 1.058000  6.744000 0.9596000 8.257000 1.887000  -1.513000      2.117000  
1 1 1 22 50 22 o 7.889000 1.147000  8.759000 0.7401000 7.019000 2.172000  1.740000       2.294000  
1 1 1 22 50 24 o 10.17000 0.6652000 10.10000 0.7370000 10.23000 1.108000  -0.1289000     1.330000  
1 1 1 22 50 26 o 3.742000 0.9940000 4.250000 1.343000  3.234000 1.466000  1.016000       1.988000  
1 1 1 22 51 1  o 5.435000 1.119000  4.471000 1.608000  6.399000 1.556000  -1.928000      2.238000  
1 1 1 22 51 3  o 6.097000 1.020000  6.060000 1.276000  6.133000 1.590000  -0.7308000E-01 2.039000  
1 1 1 22 51 5  o 5.918000 1.078000  6.165000 1.283000  5.671000 1.733000  0.4937000      2.156000  
1 1 1 22 51 7  o 8.076000 0.6818000 7.009000 0.7878000 9.143000 1.113000  -2.134000      1.364000  
1 1 1 22 51 9  o 2.794000 0.8755000 2.561000 1.102000  3.026000 1.361000  -0.4651000     1.751000  
1 1 1 22 51 11 o 3.104000 0.9340000 2.945000 1.198000  3.262000 1.434000  -0.3171000     1.868000  
1 1 1 22 51 13 o 3.335000 0.9726000 3.430000 1.289000  3.241000 1.457000  0.1893000      1.945000  
1 1 1 22 51 15 o 3.391000 0.9253000 3.824000 1.248000  2.957000 1.366000  0.8676000      1.851000  
1 1 1 22 51 17 o 4.020000 1.142000  3.005000 1.210000  5.036000 1.937000  -2.031000      2.284000  
1 1 1 22 51 19 o 3.576000 1.090000  2.947000 1.225000  4.204000 1.804000  -1.257000      2.181000  
1 1 1 22 51 21 o 3.926000 1.218000  3.132000 1.353000  4.720000 2.025000  -1.588000      2.436000  
1 1 1 22 51 23 o 4.044000 1.049000  3.166000 1.252000  4.922000 1.684000  -1.756000      2.099000  
1 1 1 22 52 0  o 4.865000 1.869000  4.865000 1.869000  4.865000 1.869000  0.000000       0.000000  
1 1 1 22 52 2  o 4.605000 1.291000  3.930000 1.705000  5.280000 1.938000  -1.350000      2.582000  
1 1 1 22 52 4  o 7.126000 1.061000  7.187000 1.049000  7.064000 1.845000  0.1232000      2.122000  
1 1 1 22 52 6  o 3.710000 1.060000  3.717000 1.322000  3.704000 1.656000  0.1264000E-01  2.119000  
1 1 1 22 52 8  o 5.273000 1.077000  5.717000 0.9498000 4.829000 1.934000  0.8887000      2.154000  
1 1 1 22 52 10 o 4.995000 1.121000  4.744000 1.329000  5.245000 1.805000  -0.5001000     2.242000  
1 1 1 22 52 12 o 5.313000 1.045000  6.069000 0.9853000 4.558000 1.843000  1.512000       2.089000  
1 1 1 22 52 14 f 3.453000 1.064000  2.501000 1.108000  4.405000 1.817000  -1.904000      2.128000  
1 1 1 22 52 16 o 4.510000 1.074000  3.440000 1.272000  5.580000 1.731000  -2.140000      2.148000  
1 1 1 22 52 18 o 4.492000 1.028000  4.861000 1.187000  4.123000 1.679000  0.7384000      2.056000  
1 1 1 22 52 20 o 4.480000 1.119000  4.325000 1.361000  4.634000 1.775000  -0.3097000     2.237000  
1 1 1 22 52 22 o 6.313000 1.967000  6.313000 1.967000  ?        ?         ?              ?         
1 1 1 22 53 1  o 6.448000 1.150000  6.905000 1.573000  5.991000 1.678000  0.9140000      2.300000  
1 1 1 22 53 3  o 4.128000 1.060000  3.404000 1.474000  4.853000 1.524000  -1.450000      2.120000  
1 1 1 22 53 5  o 5.031000 1.194000  5.718000 1.649000  4.345000 1.727000  1.373000       2.387000  
1 1 1 22 53 7  o 7.419000 0.9395000 7.885000 0.9925000 6.952000 1.596000  0.9331000      1.879000  
1 1 1 22 53 9  o 4.221000 0.8989000 5.031000 1.086000  3.410000 1.432000  1.622000       1.798000  
1 1 1 22 53 11 o 3.088000 0.9644000 2.556000 1.126000  3.619000 1.566000  -1.063000      1.929000  
1 1 1 22 53 13 o 3.600000 0.9792000 3.645000 1.258000  3.554000 1.501000  0.9129000E-01  1.958000  
1 1 1 22 53 15 o 5.191000 1.063000  4.910000 1.149000  5.473000 1.790000  -0.5636000     2.127000  
1 1 1 22 53 17 o 3.883000 1.071000  3.230000 1.372000  4.535000 1.644000  -1.305000      2.142000  
1 1 1 22 53 19 o 4.305000 1.872000  4.305000 1.872000  ?        ?         ?              ?         
1 1 1 22 54 0  o 5.035000 1.552000  5.035000 1.552000  5.035000 1.552000  0.000000       0.000000  
1 1 1 22 54 2  o 9.778000 0.8544000 8.617000 1.378000  10.94000 1.011000  -2.323000      1.709000  
1 1 1 22 54 4  o 7.756000 1.040000  9.068000 1.282000  6.444000 1.637000  2.624000       2.080000  
1 1 1 22 54 6  o 3.735000 1.095000  3.417000 1.449000  4.052000 1.642000  -0.6346000     2.190000  
1 1 1 22 54 8  o 3.402000 1.034000  2.928000 1.376000  3.875000 1.545000  -0.9474000     2.069000  
1 1 1 22 54 10 o 3.712000 1.041000  3.297000 1.367000  4.126000 1.569000  -0.8291000     2.081000  
1 1 1 22 54 12 o 3.384000 0.9731000 2.847000 1.160000  3.922000 1.563000  -1.075000      1.946000  
1 1 1 22 54 14 o 4.185000 1.010000  4.350000 1.228000  4.020000 1.603000  0.3297000      2.020000  
1 1 1 22 55 1  o 3.675000 1.054000  3.271000 1.418000  4.079000 1.561000  -0.8072000     2.109000  
1 1 1 22 55 3  o 4.724000 1.184000  4.935000 1.639000  4.512000 1.710000  0.4232000      2.369000  
1 1 1 22 55 5  o 4.213000 1.180000  4.592000 1.711000  3.834000 1.627000  0.7586000      2.361000  
1 1 1 22 55 7  o 4.613000 1.093000  3.630000 1.557000  5.595000 1.533000  -1.965000      2.185000  
1 1 1 22 55 9  o 4.056000 1.138000  3.347000 1.448000  4.764000 1.756000  -1.416000      2.276000  
1 1 1 23 0  1  o 3.200000 1.373000  3.200000 1.373000  3.200000 1.373000  0.000000       0.000000  
1 1 1 23 0  3  o 19.75000 0.4573000 19.75000 0.4573000 19.75000 0.4573000 0.000000       0.000000  
1 1 1 23 0  5  o 38.16000 0.4440000 38.16000 0.4440000 38.16000 0.4440000 0.000000       0.000000  
1 1 1 23 0  7  o 13.96000 0.5251000 13.96000 0.5251000 13.96000 0.5251000 0.000000       0.000000  
1 1 1 23 0  9  o 24.19000 0.4466000 24.19000 0.4466000 24.19000 0.4466000 0.000000       0.000000  
1 1 1 23 0  11 o 49.37000 0.6189000 49.37000 0.6189000 49.37000 0.6189000 0.000000       0.000000  
1 1 1 23 0  13 o 23.53000 0.4605000 23.53000 0.4605000 23.53000 0.4605000 0.000000       0.000000  
1 1 1 23 0  15 o 25.35000 0.5481000 25.35000 0.5481000 25.35000 0.5481000 0.000000       0.000000  
1 1 1 23 0  17 o 28.40000 0.4657000 28.40000 0.4657000 28.40000 0.4657000 0.000000       0.000000  
1 1 1 23 0  19 o 23.92000 0.3880000 23.92000 0.3880000 23.92000 0.3880000 0.000000       0.000000  
1 1 1 23 0  21 o 14.60000 0.4906000 14.60000 0.4906000 14.60000 0.4906000 0.000000       0.000000  
1 1 1 23 0  23 o 20.49000 0.6056000 20.49000 0.6056000 20.49000 0.6056000 0.000000       0.000000  
1 1 1 23 0  25 o 4.879000 1.312000  4.879000 1.312000  4.879000 1.312000  0.000000       0.000000  
1 1 1 23 0  27 o 39.88000 0.5529000 39.88000 0.5529000 39.88000 0.5529000 0.000000       0.000000  
1 1 1 23 0  29 o 30.54000 0.4556000 30.54000 0.4556000 30.54000 0.4556000 0.000000       0.000000  
1 1 1 23 0  31 o 3.638000 1.366000  3.638000 1.366000  3.638000 1.366000  0.000000       0.000000  
1 1 1 23 0  33 o 40.32000 0.5015000 40.32000 0.5015000 40.32000 0.5015000 0.000000       0.000000  
1 1 1 23 0  35 o 10.58000 0.7995000 10.58000 0.7995000 10.58000 0.7995000 0.000000       0.000000  
1 1 1 23 0  37 o 19.57000 0.5005000 19.57000 0.5005000 19.57000 0.5005000 0.000000       0.000000  
1 1 1 23 0  39 o 6.344000 1.247000  6.344000 1.247000  6.344000 1.247000  0.000000       0.000000  
1 1 1 23 0  41 f 5.282000 1.599000  5.282000 1.599000  5.282000 1.599000  0.000000       0.000000  
1 1 1 23 0  43 o 11.74000 0.6546000 11.74000 0.6546000 11.74000 0.6546000 0.000000       0.000000  
1 1 1 23 0  45 o 8.539000 0.7674000 8.539000 0.7674000 8.539000 0.7674000 0.000000       0.000000  
1 1 1 23 0  47 o 4.074000 1.306000  4.074000 1.306000  4.074000 1.306000  0.000000       0.000000  
1 1 1 23 0  49 o 12.53000 0.5781000 12.53000 0.5781000 12.53000 0.5781000 0.000000       0.000000  
1 1 1 23 0  51 o 18.01000 0.5090000 18.01000 0.5090000 18.01000 0.5090000 0.000000       0.000000  
1 1 1 23 0  53 o 3.912000 1.284000  3.912000 1.284000  3.912000 1.284000  0.000000       0.000000  
1 1 1 23 0  55 o 3.266000 1.314000  3.266000 1.314000  3.266000 1.314000  0.000000       0.000000  
1 1 1 23 0  57 o 5.799000 1.877000  5.799000 1.877000  5.799000 1.877000  0.000000       0.000000  
1 1 1 23 0  59 o 11.64000 0.7249000 11.64000 0.7249000 11.64000 0.7249000 0.000000       0.000000  
1 1 1 23 1  0  o 23.90000 0.4399000 23.90000 0.4399000 23.90000 0.4399000 0.000000       0.000000  
1 1 1 23 1  2  o 28.04000 0.3449000 28.00000 0.3927000 28.08000 0.5672000 -0.7635000E-01 0.6899000 
1 1 1 23 1  4  o 80.70000 0.6128000 80.86000 0.8035000 80.53000 0.9254000 0.3319000      1.226000  
1 1 1 23 1  6  o 48.04000 0.4482000 47.94000 0.5176000 48.15000 0.7318000 -0.2103000     0.8964000 
1 1 1 23 1  8  o 24.64000 0.3554000 24.30000 0.4411000 24.97000 0.5574000 -0.6735000     0.7108000 
1 1 1 23 1  10 o 99.26000 0.7957000 99.11000 1.122000  99.42000 1.129000  -0.3146000     1.591000  
1 1 1 23 1  12 o 18.12000 0.3183000 17.80000 0.4133000 18.44000 0.4841000 -0.6429000     0.6365000 
1 1 1 23 1  14 o 44.87000 0.4035000 44.54000 0.5681000 45.21000 0.5733000 -0.6626000     0.8071000 
1 1 1 23 1  16 o 17.42000 0.3327000 17.36000 0.5124000 17.48000 0.4246000 -0.1184000     0.6654000 
1 1 1 23 1  18 f 24.89000 0.3691000 24.96000 0.5803000 24.83000 0.4563000 0.1235000      0.7382000 
1 1 1 23 1  20 o 47.60000 0.4260000 47.29000 0.5994000 47.91000 0.6054000 -0.6258000     0.8519000 
1 1 1 23 1  22 o 29.76000 0.3224000 29.45000 0.4873000 30.06000 0.4221000 -0.6080000     0.6447000 
1 1 1 23 1  24 o 31.38000 0.3993000 31.90000 0.5042000 30.86000 0.6193000 1.044000       0.7986000 
1 1 1 23 1  26 f 44.99000 0.3666000 44.91000 0.5177000 45.07000 0.5191000 -0.1581000     0.7332000 
1 1 1 23 1  28 o 62.15000 0.4970000 62.91000 0.7557000 61.39000 0.6456000 1.515000       0.9939000 
1 1 1 23 1  30 o 19.40000 0.3424000 19.45000 0.4830000 19.35000 0.4853000 0.1042000      0.6847000 
1 1 1 23 1  32 o 31.51000 0.3269000 31.60000 0.4601000 31.42000 0.4645000 0.1756000      0.6538000 
1 1 1 23 1  34 o 32.65000 0.3355000 32.63000 0.4716000 32.67000 0.4774000 -0.3545000E-01 0.6711000 
1 1 1 23 1  36 o 22.72000 0.3396000 22.74000 0.4808000 22.70000 0.4797000 0.4765000E-01  0.6792000 
1 1 1 23 1  38 o 10.11000 0.5673000 9.948000 0.8441000 10.26000 0.7583000 -0.3161000     1.135000  
1 1 1 23 1  40 o 21.37000 0.3282000 21.65000 0.4676000 21.09000 0.4608000 0.5538000      0.6565000 
1 1 1 23 1  42 o 14.22000 0.4315000 14.11000 0.6312000 14.32000 0.5886000 -0.2045000     0.8631000 
1 1 1 23 1  44 o 13.43000 0.4051000 14.04000 0.5510000 12.83000 0.5940000 1.211000       0.8102000 
1 1 1 23 1  46 f 5.254000 0.8395000 4.081000 1.304000  6.426000 1.058000  -2.345000      1.679000  
1 1 1 23 1  48 o 7.315000 0.6091000 6.750000 0.8860000 7.881000 0.8362000 -1.132000      1.218000  
1 1 1 23 1  50 o 7.210000 0.7968000 5.814000 1.344000  8.606000 0.8559000 -2.792000      1.594000  
1 1 1 23 1  52 o 5.988000 0.8927000 6.254000 1.137000  5.722000 1.376000  0.5320000      1.785000  
1 1 1 23 1  54 o 7.412000 0.7253000 7.070000 0.9961000 7.753000 1.055000  -0.6831000     1.451000  
1 1 1 23 1  56 o 4.617000 1.017000  5.249000 1.441000  3.986000 1.435000  1.262000       2.034000  
1 1 1 23 1  58 o 10.41000 0.6962000 10.55000 0.7475000 10.28000 1.175000  0.2739000      1.392000  
1 1 1 23 2  1  o 41.93000 0.3316000 41.93000 0.4694000 41.93000 0.4685000 -0.2010000E-02 0.6632000 
1 1 1 23 2  3  o 45.38000 0.3796000 45.44000 0.4957000 45.31000 0.5750000 0.1332000      0.7591000 
1 1 1 23 2  5  o 62.43000 0.4884000 62.02000 0.6351000 62.84000 0.7420000 -0.8154000     0.9767000 
1 1 1 23 2  7  o 60.43000 0.4732000 61.39000 0.6302000 59.46000 0.7060000 1.936000       0.9463000 
1 1 1 23 2  9  o 20.55000 0.2936000 20.97000 0.4372000 20.13000 0.3922000 0.8383000      0.5873000 
1 1 1 23 2  11 o 28.31000 0.3539000 28.31000 0.5455000 28.31000 0.4509000 -0.5117000E-02 0.7078000 
1 1 1 23 2  13 o 13.68000 0.3169000 14.00000 0.4470000 13.35000 0.4493000 0.6463000      0.6338000 
1 1 1 23 2  15 o 57.11000 0.4225000 57.72000 0.6042000 56.50000 0.5907000 1.227000       0.8450000 
1 1 1 23 2  17 o 50.19000 0.3821000 49.38000 0.5337000 51.00000 0.5469000 -1.616000      0.7642000 
1 1 1 23 2  19 o 29.32000 0.3691000 29.48000 0.6111000 29.17000 0.4141000 0.3108000      0.7382000 
1 1 1 23 2  21 o 31.39000 0.3428000 31.31000 0.4805000 31.47000 0.4890000 -0.1562000     0.6856000 
1 1 1 23 2  23 o 8.115000 0.5881000 7.722000 0.8885000 8.509000 0.7706000 -0.7877000     1.176000  
1 1 1 23 2  25 o 64.03000 0.5771000 64.04000 0.6642000 64.02000 0.9439000 0.2358000E-01  1.154000  
1 1 1 23 2  27 o 25.03000 0.3339000 24.67000 0.4450000 25.39000 0.4978000 -0.7184000     0.6677000 
1 1 1 23 2  29 o 33.12000 0.3270000 33.12000 0.4620000 33.11000 0.4630000 0.1324000E-01  0.6541000 
1 1 1 23 2  31 o 26.34000 0.3344000 26.15000 0.4049000 26.52000 0.5324000 -0.3629000     0.6689000 
1 1 1 23 2  33 o 45.42000 0.3748000 44.64000 0.5237000 46.20000 0.5364000 -1.565000      0.7497000 
1 1 1 23 2  35 o 18.68000 0.3713000 19.10000 0.5127000 18.27000 0.5373000 0.8294000      0.7427000 
1 1 1 23 2  37 o 14.02000 0.4344000 14.42000 0.6072000 13.62000 0.6214000 0.7988000      0.8688000 
1 1 1 23 2  39 o 5.928000 0.8919000 6.825000 1.003000  5.030000 1.475000  1.795000       1.784000  
1 1 1 23 2  41 o 15.15000 0.4283000 14.68000 0.6281000 15.63000 0.5823000 -0.9494000     0.8565000 
1 1 1 23 2  43 o 21.91000 0.3471000 21.84000 0.5158000 21.99000 0.4645000 -0.1535000     0.6941000 
1 1 1 23 2  45 o 4.681000 0.9273000 4.833000 1.300000  4.529000 1.323000  0.3036000      1.855000  
1 1 1 23 2  47 o 8.594000 0.5398000 9.102000 0.6767000 8.085000 0.8412000 1.017000       1.080000  
1 1 1 23 2  49 f 8.066000 0.5833000 7.323000 0.8897000 8.808000 0.7546000 -1.485000      1.167000  
1 1 1 23 2  51 o 5.962000 0.7945000 6.263000 1.144000  5.661000 1.102000  0.6020000      1.589000  
1 1 1 23 2  53 o 4.821000 1.033000  3.623000 1.489000  6.018000 1.431000  -2.395000      2.065000  
1 1 1 23 2  55 o 5.281000 0.9406000 5.209000 1.381000  5.352000 1.278000  -0.1435000     1.881000  
1 1 1 23 2  57 o 6.912000 0.8103000 7.234000 1.193000  6.591000 1.097000  0.6432000      1.621000  
1 1 1 23 2  59 o 9.064000 0.6313000 9.013000 0.8719000 9.115000 0.9131000 -0.1029000     1.263000  
1 1 1 23 3  0  o 71.10000 0.7166000 71.10000 0.7166000 71.10000 0.7166000 0.000000       0.000000  
1 1 1 23 3  2  o 30.75000 0.2836000 30.82000 0.4009000 30.68000 0.4011000 0.1408000      0.5671000 
1 1 1 23 3  4  o 16.56000 0.3448000 16.39000 0.4081000 16.73000 0.5559000 -0.3388000     0.6896000 
1 1 1 23 3  6  o 42.75000 0.3358000 42.76000 0.4759000 42.74000 0.4739000 0.1957000E-01  0.6716000 
1 1 1 23 3  8  f 78.24000 0.7104000 77.85000 1.096000  78.63000 0.9042000 -0.7789000     1.421000  
1 1 1 23 3  10 o 18.01000 0.3047000 18.25000 0.4569000 17.78000 0.4033000 0.4775000      0.6094000 
1 1 1 23 3  12 o 16.87000 0.2903000 17.35000 0.4116000 16.38000 0.4096000 0.9673000      0.5807000 
1 1 1 23 3  14 o 24.20000 0.2710000 24.36000 0.3843000 24.04000 0.3822000 0.3226000      0.5420000 
1 1 1 23 3  16 o 26.98000 0.3015000 27.07000 0.4554000 26.88000 0.3952000 0.1932000      0.6030000 
1 1 1 23 3  18 o 58.93000 0.4679000 58.75000 0.7074000 59.12000 0.6127000 -0.3728000     0.9358000 
1 1 1 23 3  20 o 32.10000 0.3299000 31.89000 0.5023000 32.30000 0.4278000 -0.4043000     0.6598000 
1 1 1 23 3  22 o 32.42000 0.3832000 32.68000 0.6378000 32.17000 0.4251000 0.5107000      0.7665000 
1 1 1 23 3  24 o 26.27000 0.3405000 25.76000 0.4803000 26.78000 0.4827000 -1.019000      0.6810000 
1 1 1 23 3  26 o 42.31000 0.3754000 42.71000 0.5004000 41.90000 0.5596000 0.8115000      0.7507000 
1 1 1 23 3  28 o 29.52000 0.3610000 29.32000 0.5022000 29.73000 0.5188000 -0.4046000     0.7220000 
1 1 1 23 3  30 o 26.87000 0.3356000 26.73000 0.4030000 27.02000 0.5366000 -0.2886000     0.6711000 
1 1 1 23 3  32 o 42.48000 0.3732000 42.34000 0.4536000 42.62000 0.5927000 -0.2806000     0.7463000 
1 1 1 23 3  34 o 21.28000 0.3488000 21.10000 0.4757000 21.46000 0.5102000 -0.3618000     0.6975000 
1 1 1 23 3  36 o 23.79000 0.3330000 23.99000 0.4637000 23.58000 0.4781000 0.4124000      0.6660000 
1 1 1 23 3  38 o 14.76000 0.4332000 14.99000 0.6288000 14.53000 0.5961000 0.4541000      0.8664000 
1 1 1 23 3  40 o 9.078000 0.5985000 9.417000 0.8516000 8.739000 0.8411000 0.6783000      1.197000  
1 1 1 23 3  42 o 10.77000 0.5248000 10.61000 0.7880000 10.92000 0.6935000 -0.3009000     1.050000  
1 1 1 23 3  44 o 3.938000 0.9481000 3.418000 1.347000  4.457000 1.334000  -1.039000      1.896000  
1 1 1 23 3  46 o 4.497000 0.9085000 3.899000 1.331000  5.094000 1.237000  -1.195000      1.817000  
1 1 1 23 3  48 o 9.152000 0.5465000 8.973000 0.8026000 9.330000 0.7419000 -0.3563000     1.093000  
1 1 1 23 3  50 o 7.597000 0.7712000 8.799000 0.8470000 6.395000 1.289000  2.404000       1.542000  
1 1 1 23 3  52 o 7.579000 0.6326000 8.366000 0.8184000 6.792000 0.9648000 1.574000       1.265000  
1 1 1 23 3  54 o 11.89000 0.5166000 11.71000 0.8127000 12.07000 0.6380000 -0.3592000     1.033000  
1 1 1 23 3  56 o 3.585000 1.009000  3.615000 1.495000  3.556000 1.355000  0.5962000E-01  2.018000  
1 1 1 23 3  58 o 3.124000 0.9296000 3.081000 1.319000  3.167000 1.310000  -0.8654000E-01 1.859000  
1 1 1 23 4  1  o 84.39000 0.6373000 84.66000 0.8382000 84.12000 0.9601000 0.5444000      1.275000  
1 1 1 23 4  3  o 72.95000 0.5576000 73.02000 0.7321000 72.88000 0.8412000 0.1372000      1.115000  
1 1 1 23 4  5  o 31.98000 0.4474000 32.82000 0.4113000 31.13000 0.7946000 1.683000       0.8948000 
1 1 1 23 4  7  o 74.97000 0.5311000 74.58000 0.7477000 75.35000 0.7543000 -0.7688000     1.062000  
1 1 1 23 4  9  o 42.38000 0.3347000 42.56000 0.4753000 42.20000 0.4712000 0.3608000      0.6693000 
1 1 1 23 4  11 o 29.11000 0.2990000 28.75000 0.4485000 29.47000 0.3955000 -0.7213000     0.5980000 
1 1 1 23 4  13 o 27.42000 0.2995000 27.00000 0.4512000 27.83000 0.3940000 -0.8335000     0.5991000 
1 1 1 23 4  15 o 71.96000 0.5523000 71.41000 0.8295000 72.51000 0.7294000 -1.101000      1.105000  
1 1 1 23 4  17 o 3.944000 0.8350000 3.077000 1.182000  4.810000 1.180000  -1.733000      1.670000  
1 1 1 23 4  19 o 45.50000 0.3575000 45.89000 0.5111000 45.11000 0.5000000 0.7852000      0.7150000 
1 1 1 23 4  21 f 33.73000 0.3052000 33.66000 0.4337000 33.81000 0.4296000 -0.1578000     0.6105000 
1 1 1 23 4  23 o 29.33000 0.3271000 29.01000 0.4988000 29.64000 0.4232000 -0.6313000     0.6541000 
1 1 1 23 4  25 o 19.30000 0.3437000 19.32000 0.4581000 19.28000 0.5124000 0.3643000E-01  0.6873000 
1 1 1 23 4  27 o 12.46000 0.4648000 12.57000 0.6692000 12.36000 0.6453000 0.2152000      0.9297000 
1 1 1 23 4  29 o 13.02000 0.5026000 12.64000 0.6952000 13.40000 0.7261000 -0.7595000     1.005000  
1 1 1 23 4  31 o 16.65000 0.4032000 16.49000 0.4796000 16.81000 0.6483000 -0.3211000     0.8064000 
1 1 1 23 4  33 o 10.86000 0.5665000 10.66000 0.7426000 11.05000 0.8558000 -0.3862000     1.133000  
1 1 1 23 4  35 o 14.50000 0.4218000 14.47000 0.5728000 14.52000 0.6192000 -0.4865000E-01 0.8435000 
1 1 1 23 4  37 f 4.151000 1.005000  4.004000 1.394000  4.298000 1.448000  -0.2940000     2.010000  
1 1 1 23 4  39 o 32.64000 0.3553000 32.42000 0.4583000 32.87000 0.5431000 -0.4491000     0.7107000 
1 1 1 23 4  41 o 28.92000 0.4530000 28.57000 0.6423000 29.27000 0.6391000 -0.7042000     0.9061000 
1 1 1 23 4  43 o 9.644000 0.5141000 9.492000 0.7358000 9.796000 0.7183000 -0.3038000     1.028000  
1 1 1 23 4  45 o 3.869000 0.9318000 3.223000 1.318000  4.516000 1.318000  -1.293000      1.864000  
1 1 1 23 4  47 o 3.397000 0.9192000 3.752000 1.337000  3.041000 1.262000  0.7111000      1.838000  
1 1 1 23 4  49 o 6.928000 0.8438000 5.842000 1.293000  8.014000 1.085000  -2.172000      1.688000  
1 1 1 23 4  51 o 8.932000 0.5790000 9.155000 0.7963000 8.709000 0.8407000 0.4456000      1.158000  
1 1 1 23 4  53 o 7.611000 0.6876000 8.053000 0.9259000 7.169000 1.017000  0.8848000      1.375000  
1 1 1 23 4  55 o 2.996000 0.8890000 3.405000 1.332000  2.587000 1.177000  0.8176000      1.778000  
1 1 1 23 4  57 o 3.311000 0.9685000 3.995000 1.527000  2.627000 1.191000  1.368000       1.937000  
1 1 1 23 4  59 o 6.320000 0.8725000 6.464000 1.252000  6.177000 1.216000  0.2877000      1.745000  
1 1 1 23 5  0  o 12.00000 0.6663000 12.00000 0.6663000 12.00000 0.6663000 0.000000       0.000000  
1 1 1 23 5  2  o 52.36000 0.4487000 53.22000 0.6436000 51.51000 0.6254000 1.706000       0.8974000 
1 1 1 23 5  4  o 34.12000 0.3572000 34.47000 0.5824000 33.78000 0.4136000 0.6945000      0.7143000 
1 1 1 23 5  6  f 70.98000 0.5833000 71.46000 0.8299000 70.49000 0.8199000 0.9631000      1.167000  
1 1 1 23 5  8  o 68.06000 0.5271000 68.33000 0.8000000 67.79000 0.6864000 0.5491000      1.054000  
1 1 1 23 5  10 o 23.42000 0.2895000 23.50000 0.4376000 23.34000 0.3792000 0.1664000      0.5791000 
1 1 1 23 5  12 o 40.74000 0.3966000 40.72000 0.6457000 40.76000 0.4608000 -0.3728000E-01 0.7933000 
1 1 1 23 5  14 o 32.67000 0.2906000 32.79000 0.4125000 32.56000 0.4094000 0.2321000      0.5812000 
1 1 1 23 5  16 f 22.56000 0.2812000 22.94000 0.4030000 22.17000 0.3922000 0.7782000      0.5623000 
1 1 1 23 5  18 o 18.46000 0.2919000 18.43000 0.4169000 18.49000 0.4087000 -0.6093000E-01 0.5838000 
1 1 1 23 5  20 o 28.65000 0.2866000 28.25000 0.4038000 29.05000 0.4070000 -0.8087000     0.5733000 
1 1 1 23 5  22 o 26.08000 0.3115000 25.80000 0.4682000 26.36000 0.4109000 -0.5578000     0.6229000 
1 1 1 23 5  24 o 11.34000 0.4803000 12.14000 0.7020000 10.54000 0.6557000 1.599000       0.9606000 
1 1 1 23 5  26 o 51.30000 0.4257000 52.04000 0.5660000 50.57000 0.6359000 1.477000       0.8513000 
1 1 1 23 5  28 o 2.368000 0.7873000 2.335000 1.073000  2.402000 1.153000  -0.6737000E-01 1.575000  
1 1 1 23 5  30 o 16.02000 0.5031000 15.62000 0.6067000 16.42000 0.8029000 -0.8003000     1.006000  
1 1 1 23 5  32 o 17.70000 0.3854000 17.81000 0.4625000 17.60000 0.6166000 0.2147000      0.7708000 
1 1 1 23 5  34 o 29.15000 0.3280000 28.78000 0.4546000 29.51000 0.4731000 -0.7290000     0.6561000 
1 1 1 23 5  36 o 22.43000 0.3361000 22.81000 0.4583000 22.05000 0.4917000 0.7583000      0.6722000 
1 1 1 23 5  38 f 15.89000 0.4026000 16.57000 0.5670000 15.20000 0.5716000 1.368000       0.8051000 
1 1 1 23 5  40 o 4.062000 0.9622000 3.369000 1.331000  4.756000 1.390000  -1.387000      1.924000  
1 1 1 23 5  42 o 9.676000 0.6835000 9.427000 1.150000  9.926000 0.7397000 -0.4992000     1.367000  
1 1 1 23 5  44 o 18.47000 0.3425000 18.59000 0.4793000 18.35000 0.4894000 0.2454000      0.6851000 
1 1 1 23 5  46 o 7.237000 0.7400000 7.835000 1.051000  6.640000 1.042000  1.196000       1.480000  
1 1 1 23 5  48 f 9.065000 0.6026000 8.439000 0.8347000 9.690000 0.8695000 -1.251000      1.205000  
1 1 1 23 5  50 o 3.899000 1.104000  4.781000 1.836000  3.017000 1.229000  1.764000       2.209000  
1 1 1 23 5  52 o 6.041000 0.9359000 5.938000 1.277000  6.144000 1.368000  -0.2062000     1.872000  
1 1 1 23 5  54 o 6.994000 0.7644000 6.793000 1.154000  7.195000 1.003000  -0.4019000     1.529000  
1 1 1 23 5  56 o 9.613000 0.5811000 10.32000 0.8034000 8.903000 0.8397000 1.419000       1.162000  
1 1 1 23 5  58 o 3.877000 0.9448000 4.467000 1.339000  3.286000 1.333000  1.181000       1.890000  
1 1 1 23 6  1  o 46.42000 0.4092000 46.56000 0.5794000 46.29000 0.5779000 0.2621000      0.8183000 
1 1 1 23 6  3  o 21.61000 0.2874000 21.65000 0.4273000 21.57000 0.3844000 0.8085000E-01  0.5748000 
1 1 1 23 6  5  o 16.71000 0.3101000 17.08000 0.4581000 16.35000 0.4181000 0.7230000      0.6202000 
1 1 1 23 6  7  o 33.34000 0.3395000 33.30000 0.4746000 33.39000 0.4856000 -0.9354000E-01 0.6790000 
1 1 1 23 6  9  o 46.65000 0.3850000 46.86000 0.5812000 46.45000 0.5052000 0.4081000      0.7700000 
1 1 1 23 6  11 f 53.59000 0.3984000 53.18000 0.5604000 54.01000 0.5666000 -0.8323000     0.7969000 
1 1 1 23 6  13 o 39.60000 0.3468000 39.46000 0.5252000 39.75000 0.4530000 -0.2915000     0.6935000 
1 1 1 23 6  15 o 15.27000 0.3048000 15.20000 0.4348000 15.34000 0.4273000 -0.1312000     0.6096000 
1 1 1 23 6  17 o 39.78000 0.3251000 39.99000 0.4626000 39.56000 0.4568000 0.4227000      0.6501000 
1 1 1 23 6  19 o 32.69000 0.2989000 32.33000 0.4244000 33.04000 0.4208000 -0.7082000     0.5977000 
1 1 1 23 6  21 o 41.37000 0.3637000 41.17000 0.5496000 41.58000 0.4766000 -0.4086000     0.7275000 
1 1 1 23 6  23 o 28.03000 0.2954000 27.61000 0.4152000 28.45000 0.4202000 -0.8423000     0.5907000 
1 1 1 23 6  25 o 38.22000 0.4261000 38.58000 0.5536000 37.86000 0.6478000 0.7114000      0.8522000 
1 1 1 23 6  27 o 15.07000 0.4025000 15.40000 0.4752000 14.75000 0.6497000 0.6433000      0.8049000 
1 1 1 23 6  29 o 12.11000 0.4780000 11.20000 0.6540000 13.02000 0.6972000 -1.818000      0.9559000 
1 1 1 23 6  31 o 6.630000 0.8680000 7.905000 0.9898000 5.355000 1.426000  2.550000       1.736000  
1 1 1 23 6  33 f 37.54000 0.4234000 37.68000 0.4771000 37.41000 0.6995000 0.2649000      0.8467000 
1 1 1 23 6  35 o 20.34000 0.3503000 20.06000 0.4805000 20.62000 0.5097000 -0.5600000     0.7005000 
1 1 1 23 6  37 o 15.45000 0.4106000 15.72000 0.5965000 15.19000 0.5643000 0.5268000      0.8211000 
1 1 1 23 6  39 o 13.18000 0.4517000 12.98000 0.5741000 13.38000 0.6975000 -0.3985000     0.9033000 
1 1 1 23 6  41 o 17.69000 0.3617000 17.60000 0.5056000 17.79000 0.5175000 -0.1947000     0.7235000 
1 1 1 23 6  43 o 5.878000 0.8893000 6.032000 1.287000  5.724000 1.228000  0.3080000      1.779000  
1 1 1 23 6  45 o 7.346000 0.6424000 7.335000 0.9281000 7.356000 0.8883000 -0.2100000E-01 1.285000  
1 1 1 23 6  47 o 11.30000 0.5416000 11.36000 0.6896000 11.24000 0.8354000 0.1158000      1.083000  
1 1 1 23 6  49 o 6.837000 1.008000  6.249000 1.762000  7.425000 0.9816000 -1.176000      2.017000  
1 1 1 23 6  51 o 11.03000 0.4950000 11.71000 0.7243000 10.36000 0.6749000 1.348000       0.9900000 
1 1 1 23 6  53 o 6.184000 0.8686000 5.869000 1.342000  6.499000 1.103000  -0.6308000     1.737000  
1 1 1 23 6  55 o 5.045000 0.9893000 4.765000 1.476000  5.325000 1.317000  -0.5605000     1.979000  
1 1 1 23 6  57 o 5.516000 0.9449000 5.348000 1.366000  5.685000 1.305000  -0.3360000     1.890000  
1 1 1 23 6  59 o 3.440000 1.014000  3.112000 1.356000  3.769000 1.507000  -0.6566000     2.028000  
1 1 1 23 7  0  o 55.82000 0.5815000 55.82000 0.5815000 55.82000 0.5815000 0.000000       0.000000  
1 1 1 23 7  2  o 17.20000 0.3251000 17.45000 0.4524000 16.94000 0.4669000 0.5052000      0.6501000 
1 1 1 23 7  4  o 10.94000 0.3645000 10.61000 0.5063000 11.26000 0.5246000 -0.6463000     0.7291000 
1 1 1 23 7  6  o 44.53000 0.3469000 44.63000 0.4911000 44.43000 0.4902000 0.2036000      0.6939000 
1 1 1 23 7  8  o 48.95000 0.4029000 49.32000 0.5284000 48.58000 0.6083000 0.7400000      0.8057000 
1 1 1 23 7  10 o 4.168000 0.8132000 4.441000 1.105000  3.895000 1.193000  0.5465000      1.626000  
1 1 1 23 7  12 o 53.31000 0.4284000 53.09000 0.6451000 53.54000 0.5637000 -0.4492000     0.8567000 
1 1 1 23 7  14 o 39.43000 0.3222000 39.28000 0.4548000 39.58000 0.4564000 -0.3038000     0.6443000 
1 1 1 23 7  16 o 32.93000 0.2970000 33.00000 0.4228000 32.86000 0.4172000 0.1411000      0.5939000 
1 1 1 23 7  18 o 9.822000 0.4252000 10.26000 0.6055000 9.388000 0.5972000 0.8670000      0.8505000 
1 1 1 23 7  20 o 34.38000 0.3298000 34.11000 0.4957000 34.65000 0.4351000 -0.5447000     0.6595000 
1 1 1 23 7  22 o 32.22000 0.3012000 31.70000 0.4244000 32.74000 0.4275000 -1.048000      0.6023000 
1 1 1 23 7  24 o 40.46000 0.3657000 40.38000 0.5511000 40.54000 0.4807000 -0.1634000     0.7313000 
1 1 1 23 7  26 o 25.94000 0.3586000 25.19000 0.5200000 26.70000 0.4939000 -1.510000      0.7172000 
1 1 1 23 7  28 o 23.45000 0.3348000 23.65000 0.4033000 23.24000 0.5345000 0.4152000      0.6696000 
1 1 1 23 7  30 o 12.94000 0.5324000 12.27000 0.5740000 13.60000 0.8967000 -1.332000      1.065000  
1 1 1 23 7  32 o 25.25000 0.3594000 25.38000 0.4640000 25.12000 0.5490000 0.2608000      0.7188000 
1 1 1 23 7  34 o 13.55000 0.4473000 13.60000 0.5480000 13.50000 0.7071000 0.9515000E-01  0.8946000 
1 1 1 23 7  36 o 18.11000 0.4175000 17.76000 0.5749000 18.45000 0.6056000 -0.6901000     0.8350000 
1 1 1 23 7  38 f 15.06000 0.3968000 15.35000 0.5372000 14.76000 0.5841000 0.5957000      0.7936000 
1 1 1 23 7  40 o 20.92000 0.3506000 20.93000 0.4496000 20.91000 0.5381000 0.2399000E-01  0.7012000 
1 1 1 23 7  42 f 20.51000 0.3486000 20.48000 0.5166000 20.53000 0.4681000 -0.5231000E-01 0.6971000 
1 1 1 23 7  44 o 12.63000 0.4562000 12.02000 0.7082000 13.23000 0.5753000 -1.202000      0.9124000 
1 1 1 23 7  46 o 5.489000 0.8966000 4.633000 1.393000  6.344000 1.130000  -1.711000      1.793000  
1 1 1 23 7  48 o 7.968000 0.6912000 6.067000 1.169000  9.869000 0.7373000 -3.802000      1.382000  
1 1 1 23 7  50 f 4.099000 1.040000  4.371000 1.541000  3.827000 1.397000  0.5440000      2.080000  
1 1 1 23 7  52 o 5.198000 0.9403000 3.563000 1.474000  6.833000 1.168000  -3.270000      1.881000  
1 1 1 23 7  54 o 6.095000 0.9036000 5.593000 1.482000  6.598000 1.035000  -1.005000      1.807000  
1 1 1 23 7  56 o 9.095000 0.6729000 9.357000 1.027000  8.834000 0.8702000 0.5227000      1.346000  
1 1 1 23 7  58 o 3.572000 0.9847000 3.240000 1.364000  3.903000 1.421000  -0.6636000     1.969000  
1 1 1 23 8  1  o 33.09000 0.2888000 32.91000 0.4082000 33.27000 0.4087000 -0.3630000     0.5776000 
1 1 1 23 8  3  o 27.42000 0.2933000 27.32000 0.3823000 27.51000 0.4449000 -0.1810000     0.5866000 
1 1 1 23 8  5  o 73.37000 0.5608000 73.09000 0.8437000 73.65000 0.7390000 -0.5531000     1.122000  
1 1 1 23 8  7  o 29.96000 0.2831000 30.31000 0.4018000 29.62000 0.3990000 0.6907000      0.5662000 
1 1 1 23 8  9  o 50.43000 0.4106000 50.54000 0.5359000 50.32000 0.6223000 0.2124000      0.8212000 
1 1 1 23 8  11 o 29.03000 0.2786000 28.99000 0.3901000 29.07000 0.3979000 -0.7708000E-01 0.5572000 
1 1 1 23 8  13 o 45.04000 0.3778000 45.39000 0.5739000 44.70000 0.4916000 0.6892000      0.7556000 
1 1 1 23 8  15 o 20.05000 0.2804000 19.66000 0.3934000 20.44000 0.3995000 -0.7804000     0.5607000 
1 1 1 23 8  17 o 14.94000 0.3165000 15.07000 0.4494000 14.81000 0.4457000 0.2553000      0.6329000 
1 1 1 23 8  19 o 38.49000 0.3484000 37.99000 0.5251000 38.99000 0.4580000 -0.9998000     0.6968000 
1 1 1 23 8  21 o 13.20000 0.3484000 12.66000 0.4974000 13.74000 0.4878000 -1.074000      0.6967000 
1 1 1 23 8  23 o 40.73000 0.3383000 40.89000 0.4808000 40.58000 0.4761000 0.3124000      0.6766000 
1 1 1 23 8  25 o 44.41000 0.4349000 44.30000 0.5079000 44.51000 0.7061000 -0.2052000     0.8698000 
1 1 1 23 8  27 o 58.72000 0.4553000 58.56000 0.5546000 58.87000 0.7222000 -0.3097000     0.9106000 
1 1 1 23 8  29 o 15.93000 0.5091000 15.85000 0.6237000 16.02000 0.8047000 -0.1705000     1.018000  
1 1 1 23 8  31 o 33.68000 0.3404000 34.30000 0.4139000 33.07000 0.5405000 1.234000       0.6807000 
1 1 1 23 8  33 o 28.06000 0.3529000 27.58000 0.4607000 28.54000 0.5348000 -0.9647000     0.7059000 
1 1 1 23 8  35 o 19.18000 0.3831000 19.46000 0.4838000 18.91000 0.5943000 0.5417000      0.7663000 
1 1 1 23 8  37 o 10.56000 0.5125000 10.33000 0.7445000 10.78000 0.7044000 -0.4459000     1.025000  
1 1 1 23 8  39 o 20.15000 0.3849000 20.30000 0.5307000 20.01000 0.5575000 0.2883000      0.7697000 
1 1 1 23 8  41 o 6.121000 0.8443000 5.078000 1.349000  7.165000 1.016000  -2.087000      1.689000  
1 1 1 23 8  43 o 9.913000 0.5479000 10.80000 0.7050000 9.028000 0.8389000 1.769000       1.096000  
1 1 1 23 8  45 o 9.163000 0.6351000 9.283000 0.9463000 9.043000 0.8474000 0.2400000      1.270000  
1 1 1 23 8  47 o 4.656000 0.9909000 4.468000 1.408000  4.845000 1.394000  -0.3766000     1.982000  
1 1 1 23 8  49 f 5.541000 0.9937000 5.006000 1.468000  6.075000 1.340000  -1.069000      1.987000  
1 1 1 23 8  51 o 7.481000 0.7094000 8.616000 0.9189000 6.345000 1.081000  2.271000       1.419000  
1 1 1 23 8  53 o 5.946000 0.9032000 6.761000 1.198000  5.131000 1.352000  1.630000       1.806000  
1 1 1 23 8  55 o 7.749000 0.7158000 7.919000 1.004000  7.578000 1.020000  0.3410000      1.432000  
1 1 1 23 8  57 o 7.389000 0.8279000 8.382000 1.212000  6.396000 1.128000  1.986000       1.656000  
1 1 1 23 9  0  o 66.39000 0.6724000 66.39000 0.6724000 66.39000 0.6724000 0.000000       0.000000  
1 1 1 23 9  2  o 53.91000 0.3999000 53.87000 0.5644000 53.96000 0.5666000 -0.9060000E-01 0.7998000 
1 1 1 23 9  4  o 44.32000 0.3440000 44.42000 0.4867000 44.21000 0.4862000 0.2087000      0.6879000 
1 1 1 23 9  6  o 24.45000 0.3069000 24.68000 0.4301000 24.22000 0.4380000 0.4563000      0.6139000 
1 1 1 23 9  8  f 10.02000 0.3975000 10.28000 0.5232000 9.767000 0.5987000 0.5100000      0.7951000 
1 1 1 23 9  10 o 57.37000 0.4558000 57.26000 0.5938000 57.49000 0.6917000 -0.2245000     0.9116000 
1 1 1 23 9  12 o 24.76000 0.2713000 24.54000 0.3816000 24.99000 0.3858000 -0.4469000     0.5426000 
1 1 1 23 9  14 o 41.46000 0.3562000 41.59000 0.5390000 41.32000 0.4658000 0.2678000      0.7124000 
1 1 1 23 9  16 o 26.17000 0.2780000 26.49000 0.3933000 25.86000 0.3930000 0.6265000      0.5560000 
1 1 1 23 9  18 o 10.08000 0.4178000 10.41000 0.5813000 9.747000 0.6001000 0.6605000      0.8355000 
1 1 1 23 9  20 o 26.96000 0.2821000 26.37000 0.3967000 27.56000 0.4012000 -1.199000      0.5642000 
1 1 1 23 9  22 o 26.35000 0.2863000 26.28000 0.4070000 26.42000 0.4027000 -0.1404000     0.5725000 
1 1 1 23 9  24 o 42.72000 0.3741000 42.46000 0.4932000 42.98000 0.5625000 -0.5152000     0.7481000 
1 1 1 23 9  26 o 15.51000 0.4424000 15.75000 0.4407000 15.27000 0.7673000 0.4807000      0.8849000 
1 1 1 23 9  28 o 21.68000 0.3892000 21.24000 0.4010000 22.11000 0.6671000 -0.8629000     0.7783000 
1 1 1 23 9  30 o 12.99000 0.4886000 12.48000 0.6477000 13.50000 0.7318000 -1.026000      0.9773000 
1 1 1 23 9  32 o 36.83000 0.3516000 37.25000 0.4212000 36.40000 0.5632000 0.8496000      0.7032000 
1 1 1 23 9  34 o 27.35000 0.3526000 27.11000 0.4643000 27.59000 0.5309000 -0.4856000     0.7053000 
1 1 1 23 9  36 o 25.98000 0.3449000 25.62000 0.5097000 26.35000 0.4647000 -0.7358000     0.6897000 
1 1 1 23 9  38 o 24.99000 0.3229000 25.12000 0.4445000 24.85000 0.4685000 0.2713000      0.6459000 
1 1 1 23 9  40 o 15.23000 0.4118000 14.79000 0.5287000 15.67000 0.6314000 -0.8793000     0.8236000 
1 1 1 23 9  42 o 18.67000 0.3878000 19.07000 0.5229000 18.28000 0.5729000 0.7895000      0.7757000 
1 1 1 23 9  44 o 4.588000 0.9551000 3.553000 1.457000  5.622000 1.236000  -2.069000      1.910000  
1 1 1 23 9  46 o 12.40000 0.4641000 12.46000 0.6469000 12.34000 0.6657000 0.1140000      0.9282000 
1 1 1 23 9  48 o 3.895000 1.039000  3.421000 1.461000  4.369000 1.478000  -0.9482000     2.078000  
1 1 1 23 9  50 o 13.69000 0.4735000 13.64000 0.6374000 13.73000 0.7003000 -0.9477000E-01 0.9469000 
1 1 1 23 9  52 o 3.677000 0.9790000 4.570000 1.530000  2.784000 1.222000  1.786000       1.958000  
1 1 1 23 9  54 o 11.66000 0.5113000 11.96000 0.7261000 11.36000 0.7200000 0.5935000      1.023000  
1 1 1 23 9  56 o 3.236000 0.9345000 2.696000 1.228000  3.777000 1.409000  -1.081000      1.869000  
1 1 1 23 9  58 o 8.582000 0.6261000 8.957000 0.8884000 8.207000 0.8826000 0.7501000      1.252000  
1 1 1 23 10 1  o 46.34000 0.3549000 46.30000 0.5003000 46.38000 0.5035000 -0.8046000E-01 0.7098000 
1 1 1 23 10 3  o 68.88000 0.4913000 68.69000 0.6924000 69.08000 0.6972000 -0.3847000     0.9826000 
1 1 1 23 10 5  f 42.48000 0.3353000 42.55000 0.4740000 42.40000 0.4745000 0.1526000      0.6707000 
1 1 1 23 10 7  o 63.13000 0.4562000 64.13000 0.6544000 62.13000 0.6358000 2.004000       0.9124000 
1 1 1 23 10 9  o 45.02000 0.4494000 45.23000 0.5675000 44.80000 0.6971000 0.4306000      0.8989000 
1 1 1 23 10 11 o 41.66000 0.3325000 42.05000 0.4721000 41.27000 0.4683000 0.7880000      0.6650000 
1 1 1 23 10 13 o 23.65000 0.2704000 23.60000 0.3828000 23.70000 0.3819000 -0.1011000     0.5407000 
1 1 1 23 10 15 o 30.25000 0.2858000 30.22000 0.4058000 30.29000 0.4024000 -0.7353000E-01 0.5715000 
1 1 1 23 10 17 o 46.99000 0.3643000 46.83000 0.5133000 47.15000 0.5172000 -0.3210000     0.7286000 
1 1 1 23 10 19 o 41.96000 0.3646000 41.87000 0.5500000 42.05000 0.4788000 -0.1758000     0.7292000 
1 1 1 23 10 21 o 18.69000 0.2923000 18.40000 0.4109000 18.97000 0.4157000 -0.5726000     0.5846000 
1 1 1 23 10 23 o 13.74000 0.3639000 13.41000 0.4779000 14.07000 0.5489000 -0.6625000     0.7278000 
1 1 1 23 10 25 o 29.32000 0.3255000 29.27000 0.4174000 29.37000 0.4995000 -0.1020000     0.6510000 
1 1 1 23 10 27 o 25.25000 0.3900000 25.21000 0.4173000 25.29000 0.6589000 -0.8473000E-01 0.7799000 
1 1 1 23 10 29 o 16.07000 0.4019000 15.19000 0.5064000 16.95000 0.6243000 -1.755000      0.8039000 
1 1 1 23 10 31 o 35.34000 0.3837000 35.84000 0.5422000 34.85000 0.5431000 0.9876000      0.7674000 
1 1 1 23 10 33 o 11.00000 0.5284000 11.12000 0.6083000 10.87000 0.8640000 0.2421000      1.057000  
1 1 1 23 10 35 o 18.47000 0.3949000 18.14000 0.5175000 18.81000 0.5966000 -0.6723000     0.7898000 
1 1 1 23 10 37 o 16.97000 0.3573000 16.95000 0.4887000 16.98000 0.5212000 -0.2549000E-01 0.7145000 
1 1 1 23 10 39 o 11.39000 0.5555000 11.89000 0.6459000 10.88000 0.9041000 1.005000       1.111000  
1 1 1 23 10 41 o 6.605000 0.7569000 6.211000 1.160000  6.999000 0.9730000 -0.7877000     1.514000  
1 1 1 23 10 43 o 17.60000 0.4702000 17.71000 0.7936000 17.48000 0.5044000 0.2256000      0.9403000 
1 1 1 23 10 45 f 8.072000 0.7227000 7.368000 1.135000  8.776000 0.8953000 -1.409000      1.445000  
1 1 1 23 10 47 o 15.99000 0.4251000 16.51000 0.5513000 15.47000 0.6471000 1.043000       0.8501000 
1 1 1 23 10 49 o 6.259000 1.014000  6.234000 1.689000  6.285000 1.123000  -0.5046000E-01 2.028000  
1 1 1 23 10 51 o 11.49000 0.5256000 12.07000 0.6749000 10.92000 0.8060000 1.151000       1.051000  
1 1 1 23 10 53 o 9.522000 0.5824000 9.422000 0.8589000 9.622000 0.7868000 -0.2006000     1.165000  
1 1 1 23 10 55 o 6.780000 0.7745000 6.599000 1.193000  6.962000 0.9879000 -0.3637000     1.549000  
1 1 1 23 10 57 o 4.021000 1.047000  3.635000 1.426000  4.408000 1.535000  -0.7729000     2.095000  
1 1 1 23 11 0  o 48.23000 0.5179000 48.23000 0.5179000 48.23000 0.5179000 0.000000       0.000000  
1 1 1 23 11 2  o 26.99000 0.2688000 27.00000 0.3772000 26.99000 0.3830000 0.1395000E-01  0.5375000 
1 1 1 23 11 4  o 66.53000 0.4770000 66.75000 0.6767000 66.31000 0.6724000 0.4372000      0.9540000 
1 1 1 23 11 6  o 53.28000 0.3958000 53.09000 0.5584000 53.47000 0.5612000 -0.3836000     0.7917000 
1 1 1 23 11 8  o 47.96000 0.3661000 47.98000 0.5178000 47.93000 0.5176000 0.5077000E-01  0.7322000 
1 1 1 23 11 10 o 77.60000 0.7063000 77.59000 0.8906000 77.60000 1.097000  -0.8247000E-02 1.413000  
1 1 1 23 11 12 o 54.02000 0.4012000 54.50000 0.5722000 53.54000 0.5625000 0.9589000      0.8024000 
1 1 1 23 11 14 f 9.823000 0.4219000 9.970000 0.6126000 9.677000 0.5802000 0.2935000      0.8437000 
1 1 1 23 11 16 o 33.08000 0.3247000 33.48000 0.4258000 32.68000 0.4905000 0.8018000      0.6495000 
1 1 1 23 11 18 o 11.08000 0.3916000 11.27000 0.5769000 10.90000 0.5297000 0.3674000      0.7832000 
1 1 1 23 11 20 o 4.682000 0.8201000 4.776000 1.126000  4.588000 1.193000  0.1886000      1.640000  
1 1 1 23 11 22 o 31.75000 0.3168000 31.18000 0.4174000 32.31000 0.4766000 -1.135000      0.6335000 
1 1 1 23 11 24 o 19.70000 0.3314000 19.71000 0.3710000 19.69000 0.5492000 0.1494000E-01  0.6627000 
1 1 1 23 11 26 o 11.57000 0.7220000 10.40000 0.5657000 12.74000 1.329000  -2.337000      1.444000  
1 1 1 23 11 28 o 8.360000 0.6963000 9.079000 0.6693000 7.641000 1.221000  1.438000       1.393000  
1 1 1 23 11 30 o 21.90000 0.3503000 21.83000 0.4494000 21.98000 0.5375000 -0.1464000     0.7006000 
1 1 1 23 11 32 o 15.96000 0.4129000 16.33000 0.5483000 15.59000 0.6174000 0.7402000      0.8258000 
1 1 1 23 11 34 o 16.01000 0.3869000 15.86000 0.4699000 16.16000 0.6147000 -0.2979000     0.7738000 
1 1 1 23 11 36 o 15.26000 0.4408000 15.32000 0.5819000 15.21000 0.6624000 0.1064000      0.8817000 
1 1 1 23 11 38 o 23.11000 0.3235000 23.62000 0.4448000 22.61000 0.4699000 1.009000       0.6471000 
1 1 1 23 11 40 o 6.926000 0.7512000 6.859000 1.067000  6.993000 1.058000  -0.1346000     1.502000  
1 1 1 23 11 42 o 6.712000 0.7434000 6.697000 1.087000  6.726000 1.014000  -0.2905000E-01 1.487000  
1 1 1 23 11 44 o 3.924000 0.9089000 4.671000 1.330000  3.177000 1.239000  1.494000       1.818000  
1 1 1 23 11 46 o 7.164000 0.7561000 6.833000 1.042000  7.494000 1.095000  -0.6614000     1.512000  
1 1 1 23 11 48 o 3.584000 1.012000  3.414000 1.421000  3.755000 1.441000  -0.3416000     2.024000  
1 1 1 23 11 50 o 6.053000 1.024000  6.007000 1.565000  6.099000 1.323000  -0.9219000E-01 2.049000  
1 1 1 23 11 52 o 3.716000 1.008000  3.992000 1.505000  3.440000 1.342000  0.5525000      2.016000  
1 1 1 23 11 54 o 10.14000 0.5434000 9.772000 0.7911000 10.52000 0.7452000 -0.7443000     1.087000  
1 1 1 23 11 56 o 6.759000 0.9161000 6.249000 1.308000  7.268000 1.283000  -1.019000      1.832000  
1 1 1 23 11 58 o 3.299000 0.9645000 3.132000 1.335000  3.467000 1.393000  -0.3345000     1.929000  
1 1 1 23 12 1  o 16.08000 0.2864000 16.00000 0.4070000 16.15000 0.4030000 -0.1499000     0.5727000 
1 1 1 23 12 3  o 14.55000 0.3059000 14.40000 0.4325000 14.71000 0.4326000 -0.3161000     0.6118000 
1 1 1 23 12 5  f 12.12000 0.3365000 12.74000 0.4549000 11.51000 0.4959000 1.232000       0.6729000 
1 1 1 23 12 7  o 49.84000 0.3763000 49.80000 0.5326000 49.88000 0.5317000 -0.8209000E-01 0.7525000 
1 1 1 23 12 9  o 37.09000 0.3379000 36.76000 0.4356000 37.43000 0.5167000 -0.6660000     0.6758000 
1 1 1 23 12 11 o 36.01000 0.3918000 36.09000 0.4331000 35.93000 0.6530000 0.1662000      0.7836000 
1 1 1 23 12 13 o 29.03000 0.3650000 28.79000 0.4423000 29.27000 0.5809000 -0.4737000     0.7301000 
1 1 1 23 12 15 o 29.62000 0.3307000 29.28000 0.4585000 29.95000 0.4767000 -0.6776000     0.6614000 
1 1 1 23 12 17 o 24.08000 0.2946000 23.95000 0.4413000 24.21000 0.3906000 -0.2666000     0.5893000 
1 1 1 23 12 19 o 36.52000 0.3135000 36.70000 0.4463000 36.34000 0.4405000 0.3603000      0.6271000 
1 1 1 23 12 21 o 6.761000 0.5607000 6.865000 0.7567000 6.657000 0.8276000 0.2080000      1.121000  
1 1 1 23 12 23 o 10.89000 0.5374000 11.09000 0.4872000 10.70000 0.9580000 0.3924000      1.075000  
1 1 1 23 12 25 o 44.12000 0.4291000 43.41000 0.4434000 44.84000 0.7348000 -1.432000      0.8582000 
1 1 1 23 12 27 o 47.84000 0.3962000 47.21000 0.4733000 48.47000 0.6354000 -1.258000      0.7923000 
1 1 1 23 12 29 o 6.098000 0.9293000 5.467000 1.328000  6.729000 1.300000  -1.262000      1.859000  
1 1 1 23 12 31 o 19.11000 0.3537000 18.81000 0.4277000 19.40000 0.5635000 -0.5912000     0.7075000 
1 1 1 23 12 33 o 17.31000 0.3968000 17.23000 0.5222000 17.39000 0.5976000 -0.1678000     0.7936000 
1 1 1 23 12 35 o 15.62000 0.3924000 15.94000 0.4997000 15.29000 0.6052000 0.6421000      0.7848000 
1 1 1 23 12 37 o 29.24000 0.3515000 29.39000 0.5375000 29.08000 0.4530000 0.3150000      0.7029000 
1 1 1 23 12 39 o 5.560000 0.9561000 4.979000 1.344000  6.142000 1.361000  -1.163000      1.912000  
1 1 1 23 12 41 o 3.999000 0.9554000 4.187000 1.364000  3.811000 1.338000  0.3765000      1.911000  
1 1 1 23 12 43 o 6.617000 0.8064000 6.534000 1.040000  6.701000 1.232000  -0.1672000     1.613000  
1 1 1 23 12 45 o 13.01000 0.4221000 13.06000 0.6025000 12.97000 0.5913000 0.9197000E-01  0.8442000 
1 1 1 23 12 47 f 17.87000 0.3962000 17.76000 0.6166000 17.99000 0.4976000 -0.2300000     0.7923000 
1 1 1 23 12 49 o 5.683000 0.9265000 4.779000 1.524000  6.586000 1.055000  -1.806000      1.853000  
1 1 1 23 12 51 o 7.647000 0.8830000 6.328000 1.290000  8.966000 1.206000  -2.638000      1.766000  
1 1 1 23 12 53 o 5.464000 0.9341000 6.683000 1.221000  4.245000 1.414000  2.437000       1.868000  
1 1 1 23 12 55 o 4.012000 1.015000  4.280000 1.464000  3.744000 1.407000  0.5358000      2.030000  
1 1 1 23 12 57 o 3.289000 0.9587000 3.381000 1.373000  3.197000 1.338000  0.1835000      1.917000  
1 1 1 23 13 0  o 64.38000 0.6542000 64.38000 0.6542000 64.38000 0.6542000 0.000000       0.000000  
1 1 1 23 13 2  o 21.12000 0.2634000 21.34000 0.3671000 20.90000 0.3778000 0.4428000      0.5268000 
1 1 1 23 13 4  o 28.74000 0.2760000 28.78000 0.3888000 28.70000 0.3918000 0.8255000E-01  0.5520000 
1 1 1 23 13 6  o 53.36000 0.4288000 54.27000 0.5682000 52.44000 0.6424000 1.827000       0.8577000 
1 1 1 23 13 8  o 51.60000 0.4727000 51.17000 0.5424000 52.04000 0.7744000 -0.8694000     0.9455000 
1 1 1 23 13 10 o 54.32000 0.5022000 54.52000 0.5721000 54.12000 0.8255000 0.3982000      1.004000  
1 1 1 23 13 12 o 21.68000 0.2657000 22.09000 0.3759000 21.27000 0.3755000 0.8268000      0.5313000 
1 1 1 23 13 14 o 20.48000 0.3147000 21.03000 0.4176000 19.93000 0.4708000 1.105000       0.6293000 
1 1 1 23 13 16 o 36.49000 0.3609000 36.47000 0.4987000 36.52000 0.5218000 -0.4829000E-01 0.7218000 
1 1 1 23 13 18 o 43.92000 0.3778000 43.43000 0.4881000 44.41000 0.5769000 -0.9827000     0.7556000 
1 1 1 23 13 20 o 31.65000 0.3300000 31.88000 0.5079000 31.42000 0.4216000 0.4606000      0.6601000 
1 1 1 23 13 22 o 27.79000 0.4452000 28.20000 0.4161000 27.38000 0.7872000 0.8260000      0.8904000 
1 1 1 23 13 24 o 43.58000 0.4370000 42.36000 0.4795000 44.80000 0.7307000 -2.443000      0.8740000 
1 1 1 23 13 26 o 18.88000 0.4219000 18.74000 0.3894000 19.02000 0.7485000 -0.2759000     0.8438000 
1 1 1 23 13 28 o 26.60000 0.3331000 26.44000 0.4175000 26.75000 0.5190000 -0.3050000     0.6661000 
1 1 1 23 13 30 o 18.95000 0.3419000 18.60000 0.4085000 19.31000 0.5484000 -0.7064000     0.6838000 
1 1 1 23 13 32 o 21.36000 0.3401000 21.66000 0.4015000 21.05000 0.5492000 0.6132000      0.6803000 
1 1 1 23 13 34 o 9.939000 0.5744000 9.386000 0.8073000 10.49000 0.8173000 -1.105000      1.149000  
1 1 1 23 13 36 o 17.18000 0.3569000 17.04000 0.4393000 17.32000 0.5625000 -0.2803000     0.7137000 
1 1 1 23 13 38 o 12.36000 0.6440000 11.83000 1.084000  12.89000 0.6958000 -1.060000      1.288000  
1 1 1 23 13 40 o 4.278000 0.9503000 3.697000 1.348000  4.859000 1.340000  -1.161000      1.901000  
1 1 1 23 13 42 o 7.475000 0.7146000 7.216000 0.9104000 7.734000 1.102000  -0.5183000     1.429000  
1 1 1 23 13 44 o 7.345000 0.6444000 7.129000 0.8856000 7.561000 0.9365000 -0.4311000     1.289000  
1 1 1 23 13 46 o 11.36000 0.4838000 11.07000 0.6948000 11.66000 0.6735000 -0.5923000     0.9676000 
1 1 1 23 13 48 o 7.509000 0.9194000 7.146000 1.600000  7.873000 0.9068000 -0.7267000     1.839000  
1 1 1 23 13 50 o 3.382000 0.9277000 3.976000 1.367000  2.787000 1.255000  1.189000       1.855000  
1 1 1 23 13 52 o 3.783000 1.005000  3.733000 1.446000  3.834000 1.397000  -0.1009000     2.011000  
1 1 1 23 13 54 o 2.983000 0.9146000 2.815000 1.265000  3.151000 1.321000  -0.3359000     1.829000  
1 1 1 23 13 56 o 7.305000 0.8689000 6.025000 1.387000  8.586000 1.047000  -2.561000      1.738000  
1 1 1 23 14 1  o 39.39000 0.3178000 39.26000 0.4473000 39.51000 0.4514000 -0.2522000     0.6355000 
1 1 1 23 14 3  o 42.78000 0.3353000 42.85000 0.4749000 42.71000 0.4734000 0.1462000      0.6706000 
1 1 1 23 14 5  o 8.222000 0.5275000 8.593000 0.6141000 7.851000 0.8578000 0.7413000      1.055000  
1 1 1 23 14 7  o 30.87000 0.2812000 31.25000 0.3996000 30.48000 0.3957000 0.7680000      0.5623000 
1 1 1 23 14 9  o 20.49000 0.2648000 20.96000 0.3728000 20.02000 0.3762000 0.9419000      0.5296000 
1 1 1 23 14 11 o 10.28000 0.3908000 10.05000 0.5246000 10.51000 0.5793000 -0.4586000     0.7815000 
1 1 1 23 14 13 o 21.56000 0.2857000 21.67000 0.4235000 21.44000 0.3836000 0.2301000      0.5714000 
1 1 1 23 14 15 o 21.92000 0.3166000 21.94000 0.4966000 21.90000 0.3930000 0.3563000E-01  0.6333000 
1 1 1 23 14 17 o 46.14000 0.4110000 46.47000 0.5839000 45.81000 0.5785000 0.6566000      0.8220000 
1 1 1 23 14 19 o 22.46000 0.3761000 23.11000 0.4051000 21.80000 0.6337000 1.310000       0.7521000 
1 1 1 23 14 21 o 53.52000 0.6202000 53.05000 0.5036000 53.98000 1.133000  -0.9262000     1.240000  
1 1 1 23 14 23 o 7.106000 0.6689000 6.670000 0.7595000 7.541000 1.101000  -0.8706000     1.338000  
1 1 1 23 14 25 o 41.71000 0.3650000 41.15000 0.4290000 42.27000 0.5907000 -1.128000      0.7300000 
1 1 1 23 14 27 o 6.715000 0.7975000 6.966000 0.8796000 6.463000 1.331000  0.5030000      1.595000  
1 1 1 23 14 29 o 28.78000 0.3306000 28.54000 0.4211000 29.02000 0.5097000 -0.4836000     0.6612000 
1 1 1 23 14 31 o 15.24000 0.3901000 14.66000 0.4771000 15.82000 0.6174000 -1.159000      0.7802000 
1 1 1 23 14 33 o 24.25000 0.3297000 23.91000 0.3982000 24.58000 0.5256000 -0.6633000     0.6594000 
1 1 1 23 14 35 o 16.44000 0.4247000 16.30000 0.6014000 16.58000 0.5999000 -0.2841000     0.8494000 
1 1 1 23 14 37 o 21.24000 0.3746000 21.23000 0.5265000 21.26000 0.5329000 -0.3526000E-01 0.7491000 
1 1 1 23 14 39 o 17.51000 0.3754000 17.35000 0.4795000 17.68000 0.5778000 -0.3305000     0.7508000 
1 1 1 23 14 41 o 14.09000 0.4438000 13.52000 0.6147000 14.67000 0.6404000 -1.150000      0.8877000 
1 1 1 23 14 43 o 7.182000 0.6569000 6.507000 0.9884000 7.856000 0.8657000 -1.349000      1.314000  
1 1 1 23 14 45 o 19.61000 0.3395000 19.70000 0.4716000 19.52000 0.4886000 0.1836000      0.6791000 
1 1 1 23 14 47 o 5.354000 0.9002000 5.036000 1.355000  5.673000 1.186000  -0.6368000     1.800000  
1 1 1 23 14 49 o 6.541000 0.8722000 5.173000 1.498000  7.909000 0.8944000 -2.736000      1.744000  
1 1 1 23 14 51 o 7.754000 0.6719000 7.355000 0.9653000 8.153000 0.9349000 -0.7971000     1.344000  
1 1 1 23 14 53 o 11.61000 0.5554000 11.81000 0.7183000 11.42000 0.8472000 0.3959000      1.111000  
1 1 1 23 14 55 o 5.564000 0.9117000 4.645000 1.441000  6.483000 1.117000  -1.838000      1.823000  
1 1 1 23 14 57 o 4.257000 1.028000  4.439000 1.444000  4.075000 1.465000  0.3644000      2.057000  
1 1 1 23 15 0  o 4.568000 1.040000  4.568000 1.040000  4.568000 1.040000  0.000000       0.000000  
1 1 1 23 15 2  o 13.32000 0.3090000 13.55000 0.4253000 13.08000 0.4484000 0.4608000      0.6180000 
1 1 1 23 15 4  o 40.54000 0.3522000 40.27000 0.4540000 40.80000 0.5385000 -0.5369000     0.7044000 
1 1 1 23 15 6  o 72.52000 0.5148000 72.98000 0.7329000 72.06000 0.7231000 0.9186000      1.030000  
1 1 1 23 15 8  o 25.74000 0.2679000 25.89000 0.3775000 25.59000 0.3803000 0.3004000      0.5359000 
1 1 1 23 15 10 o 12.37000 0.3163000 12.84000 0.4406000 11.90000 0.4539000 0.9400000      0.6326000 
1 1 1 23 15 12 o 44.64000 0.4004000 44.13000 0.5563000 45.16000 0.5759000 -1.027000      0.8007000 
1 1 1 23 15 14 o 32.20000 0.3119000 32.63000 0.4707000 31.76000 0.4092000 0.8702000      0.6237000 
1 1 1 23 15 16 o 31.05000 0.2910000 30.42000 0.4105000 31.69000 0.4127000 -1.267000      0.5821000 
1 1 1 23 15 18 o 55.31000 0.4432000 55.02000 0.5794000 55.59000 0.6707000 -0.5708000     0.8864000 
1 1 1 23 15 20 f 31.47000 0.4535000 31.77000 0.4045000 31.17000 0.8118000 0.5911000      0.9070000 
1 1 1 23 15 22 o 16.88000 0.3529000 16.51000 0.4457000 17.26000 0.5472000 -0.7549000     0.7058000 
1 1 1 23 15 24 o 24.35000 0.3185000 23.38000 0.3541000 25.32000 0.5296000 -1.943000      0.6371000 
1 1 1 23 15 26 o 12.53000 0.5234000 11.67000 0.5286000 13.39000 0.9034000 -1.721000      1.047000  
1 1 1 23 15 28 o 16.27000 0.3664000 16.39000 0.4273000 16.15000 0.5954000 0.2357000      0.7329000 
1 1 1 23 15 30 o 27.10000 0.3261000 26.74000 0.3884000 27.46000 0.5239000 -0.7176000     0.6521000 
1 1 1 23 15 32 o 21.23000 0.3388000 21.20000 0.3954000 21.27000 0.5502000 -0.6702000E-01 0.6776000 
1 1 1 23 15 34 o 27.48000 0.3408000 27.93000 0.4394000 27.03000 0.5210000 0.9042000      0.6815000 
1 1 1 23 15 36 o 16.85000 0.3855000 17.22000 0.5203000 16.49000 0.5689000 0.7274000      0.7710000 
1 1 1 23 15 38 o 4.596000 0.9025000 4.370000 1.323000  4.822000 1.227000  -0.4521000     1.805000  
1 1 1 23 15 40 o 20.48000 0.3481000 20.34000 0.4530000 20.62000 0.5286000 -0.2800000     0.6962000 
1 1 1 23 15 42 o 23.51000 0.3189000 23.34000 0.4477000 23.69000 0.4542000 -0.3473000     0.6377000 
1 1 1 23 15 44 o 4.423000 0.9282000 3.807000 1.329000  5.040000 1.296000  -1.232000      1.856000  
1 1 1 23 15 46 o 6.614000 0.7337000 6.568000 1.076000  6.660000 0.9975000 -0.9182000E-01 1.467000  
1 1 1 23 15 48 o 8.206000 0.6760000 8.057000 1.029000  8.355000 0.8767000 -0.2983000     1.352000  
1 1 1 23 15 50 o 5.291000 1.038000  4.943000 1.305000  5.639000 1.615000  -0.6962000     2.076000  
1 1 1 23 15 52 o 8.181000 0.7015000 8.137000 1.016000  8.224000 0.9674000 -0.8732000E-01 1.403000  
1 1 1 23 15 54 o 4.986000 0.9889000 3.979000 1.467000  5.992000 1.327000  -2.012000      1.978000  
1 1 1 23 15 56 o 3.536000 0.9749000 3.851000 1.410000  3.221000 1.347000  0.6297000      1.950000  
1 1 1 23 16 1  o 3.812000 0.8135000 4.075000 1.108000  3.550000 1.192000  0.5247000      1.627000  
1 1 1 23 16 3  o 23.84000 0.2948000 23.45000 0.3751000 24.24000 0.4548000 -0.7906000     0.5895000 
1 1 1 23 16 5  o 20.63000 0.2686000 20.65000 0.3856000 20.61000 0.3740000 0.4179000E-01  0.5371000 
1 1 1 23 16 7  o 37.68000 0.3106000 37.62000 0.4395000 37.75000 0.4390000 -0.1326000     0.6212000 
1 1 1 23 16 9  o 26.06000 0.3022000 26.27000 0.4707000 25.84000 0.3790000 0.4234000      0.6043000 
1 1 1 23 16 11 o 10.33000 0.5539000 10.04000 0.9486000 10.61000 0.5720000 -0.5658000     1.108000  
1 1 1 23 16 13 f 28.72000 0.3372000 29.13000 0.5009000 28.32000 0.4515000 0.8147000      0.6743000 
1 1 1 23 16 15 o 38.36000 0.4248000 38.84000 0.6853000 37.88000 0.5022000 0.9564000      0.8496000 
1 1 1 23 16 17 o 21.03000 0.3374000 21.05000 0.5171000 21.00000 0.4334000 0.5576000E-01  0.6747000 
1 1 1 23 16 19 o 20.89000 0.3421000 21.09000 0.3477000 20.70000 0.5892000 0.3837000      0.6841000 
1 1 1 23 16 21 o 47.49000 0.4531000 47.30000 0.5095000 47.67000 0.7494000 -0.3702000     0.9062000 
1 1 1 23 16 23 o 28.74000 0.3457000 28.48000 0.4631000 29.01000 0.5133000 -0.5358000     0.6913000 
1 1 1 23 16 25 f 36.85000 0.3402000 36.62000 0.4023000 37.09000 0.5487000 -0.4730000     0.6804000 
1 1 1 23 16 27 o 6.708000 0.7617000 6.770000 0.7926000 6.645000 1.301000  0.1251000      1.523000  
1 1 1 23 16 29 o 15.63000 0.3912000 15.88000 0.4515000 15.37000 0.6388000 0.5128000      0.7823000 
1 1 1 23 16 31 o 19.21000 0.3396000 19.28000 0.4079000 19.15000 0.5431000 0.1339000      0.6792000 
1 1 1 23 16 33 o 17.09000 0.4758000 17.24000 0.7441000 16.93000 0.5932000 0.3074000      0.9516000 
1 1 1 23 16 35 o 20.01000 0.3324000 20.15000 0.4036000 19.88000 0.5282000 0.2736000      0.6648000 
1 1 1 23 16 37 o 12.09000 0.4945000 11.62000 0.6344000 12.56000 0.7587000 -0.9443000     0.9890000 
1 1 1 23 16 39 o 8.332000 0.7492000 7.642000 0.8904000 9.023000 1.205000  -1.382000      1.498000  
1 1 1 23 16 41 o 5.007000 0.9456000 5.081000 1.355000  4.932000 1.319000  0.1493000      1.891000  
1 1 1 23 16 43 o 11.56000 0.4358000 12.33000 0.5511000 10.80000 0.6751000 1.537000       0.8715000 
1 1 1 23 16 45 o 14.17000 0.3995000 14.55000 0.5549000 13.80000 0.5749000 0.7473000      0.7990000 
1 1 1 23 16 47 o 4.827000 0.9530000 4.349000 1.458000  5.306000 1.227000  -0.9573000     1.906000  
1 1 1 23 16 49 o 6.248000 0.8126000 7.016000 0.9842000 5.480000 1.293000  1.536000       1.625000  
1 1 1 23 16 51 o 5.170000 0.9358000 3.908000 1.446000  6.432000 1.188000  -2.525000      1.872000  
1 1 1 23 16 53 f 12.17000 0.5960000 11.81000 0.9432000 12.53000 0.7291000 -0.7193000     1.192000  
1 1 1 23 16 55 o 4.754000 1.082000  4.823000 1.428000  4.685000 1.627000  0.1375000      2.164000  
1 1 1 23 16 57 o 2.810000 1.326000  ?        ?         2.810000 1.326000  ?              ?         
1 1 1 23 17 0  o 13.53000 0.4317000 13.53000 0.4317000 13.53000 0.4317000 0.000000       0.000000  
1 1 1 23 17 2  o 56.06000 0.4465000 56.44000 0.5857000 55.69000 0.6741000 0.7546000      0.8930000 
1 1 1 23 17 4  o 32.25000 0.2878000 32.37000 0.4046000 32.13000 0.4095000 0.2320000      0.5756000 
1 1 1 23 17 6  o 28.69000 0.3061000 28.27000 0.4722000 29.11000 0.3895000 -0.8427000     0.6122000 
1 1 1 23 17 8  f 46.29000 0.4419000 46.52000 0.7271000 46.07000 0.5024000 0.4470000      0.8838000 
1 1 1 23 17 10 o 31.73000 0.3036000 31.95000 0.4549000 31.51000 0.4021000 0.4315000      0.6071000 
1 1 1 23 17 12 o 41.85000 0.4049000 42.17000 0.4743000 41.53000 0.6565000 0.6367000      0.8099000 
1 1 1 23 17 14 o 33.71000 0.3142000 33.88000 0.4201000 33.54000 0.4672000 0.3400000      0.6283000 
1 1 1 23 17 16 f 12.96000 0.3222000 12.82000 0.4804000 13.09000 0.4295000 -0.2758000     0.6444000 
1 1 1 23 17 18 o 27.93000 0.3547000 27.94000 0.4121000 27.91000 0.5774000 0.2209000E-01  0.7094000 
1 1 1 23 17 20 o 62.03000 0.4947000 62.05000 0.6431000 62.01000 0.7518000 0.4082000E-01  0.9894000 
1 1 1 23 17 22 o 21.86000 0.3307000 22.04000 0.4157000 21.68000 0.5145000 0.3608000      0.6615000 
1 1 1 23 17 24 o 30.56000 0.4022000 31.50000 0.4814000 29.61000 0.6445000 1.892000       0.8045000 
1 1 1 23 17 26 o 20.40000 0.3809000 19.88000 0.3686000 20.92000 0.6667000 -1.045000      0.7618000 
1 1 1 23 17 28 o 24.11000 0.3239000 24.24000 0.3783000 23.98000 0.5260000 0.2655000      0.6479000 
1 1 1 23 17 30 o 12.33000 0.4448000 12.79000 0.5046000 11.88000 0.7327000 0.9062000      0.8896000 
1 1 1 23 17 32 f 9.058000 0.5782000 8.554000 0.7197000 9.563000 0.9051000 -1.009000      1.156000  
1 1 1 23 17 34 o 6.130000 0.7741000 5.852000 1.029000  6.408000 1.157000  -0.5562000     1.548000  
1 1 1 23 17 36 o 9.566000 0.5627000 9.653000 0.6258000 9.478000 0.9354000 0.1751000      1.125000  
1 1 1 23 17 38 o 5.693000 0.9516000 6.255000 1.007000  5.131000 1.615000  1.124000       1.903000  
1 1 1 23 17 40 o 21.31000 0.3192000 20.99000 0.4380000 21.64000 0.4646000 -0.6498000     0.6385000 
1 1 1 23 17 42 o 9.416000 0.5053000 9.238000 0.7261000 9.595000 0.7029000 -0.3570000     1.011000  
1 1 1 23 17 44 o 7.455000 0.6017000 6.880000 0.9019000 8.030000 0.7966000 -1.150000      1.203000  
1 1 1 23 17 46 o 8.194000 0.5726000 8.314000 0.8335000 8.074000 0.7854000 0.2400000      1.145000  
1 1 1 23 17 48 o 3.261000 0.9348000 3.397000 1.348000  3.124000 1.295000  0.2728000      1.870000  
1 1 1 23 17 50 o 2.824000 0.8874000 2.955000 1.286000  2.693000 1.223000  0.2623000      1.775000  
1 1 1 23 17 52 o 13.04000 0.5300000 13.22000 0.6549000 12.86000 0.8335000 0.3597000      1.060000  
1 1 1 23 17 54 o 7.404000 0.8445000 7.171000 1.097000  7.636000 1.284000  -0.4652000     1.689000  
1 1 1 23 17 56 o 3.347000 0.9670000 3.631000 1.424000  3.062000 1.309000  0.5693000      1.934000  
1 1 1 23 18 1  o 23.82000 0.3165000 24.31000 0.3644000 23.34000 0.5176000 0.9707000      0.6330000 
1 1 1 23 18 3  o 15.54000 0.2858000 15.67000 0.4026000 15.42000 0.4059000 0.2503000      0.5716000 
1 1 1 23 18 5  o 34.79000 0.3746000 34.85000 0.6212000 34.73000 0.4188000 0.1241000      0.7491000 
1 1 1 23 18 7  o 25.24000 0.3356000 25.41000 0.5576000 25.08000 0.3737000 0.3286000      0.6712000 
1 1 1 23 18 9  o 15.30000 0.3010000 15.02000 0.4149000 15.57000 0.4361000 -0.5510000     0.6019000 
1 1 1 23 18 11 f 32.60000 0.3072000 33.39000 0.4194000 31.82000 0.4489000 1.575000       0.6144000 
1 1 1 23 18 13 o 59.13000 0.5285000 59.12000 0.6127000 59.14000 0.8612000 -0.2008000E-01 1.057000  
1 1 1 23 18 15 o 24.88000 0.2981000 24.55000 0.4289000 25.21000 0.4141000 -0.6534000     0.5962000 
1 1 1 23 18 17 o 22.00000 0.3286000 21.51000 0.3275000 22.49000 0.5697000 -0.9828000     0.6571000 
1 1 1 23 18 19 o 34.31000 0.3305000 34.31000 0.4110000 34.32000 0.5176000 -0.1313000E-01 0.6609000 
1 1 1 23 18 21 o 38.83000 0.4345000 38.33000 0.6688000 39.32000 0.5549000 -0.9929000     0.8690000 
1 1 1 23 18 23 o 60.04000 0.4594000 60.99000 0.5657000 59.08000 0.7241000 1.904000       0.9189000 
1 1 1 23 18 25 o 13.49000 0.4741000 13.84000 0.4534000 13.13000 0.8327000 0.7140000      0.9481000 
1 1 1 23 18 27 o 19.68000 0.3655000 19.93000 0.4630000 19.44000 0.5656000 0.4903000      0.7309000 
1 1 1 23 18 29 o 24.73000 0.3544000 25.18000 0.4880000 24.29000 0.5140000 0.8843000      0.7087000 
1 1 1 23 18 31 o 19.52000 0.3356000 19.40000 0.3867000 19.64000 0.5485000 -0.2369000     0.6711000 
1 1 1 23 18 33 o 21.97000 0.3394000 21.63000 0.4224000 22.30000 0.5315000 -0.6701000     0.6789000 
1 1 1 23 18 35 o 7.237000 0.6624000 7.625000 0.7506000 6.850000 1.092000  0.7752000      1.325000  
1 1 1 23 18 37 o 8.170000 0.7429000 8.759000 0.6675000 7.580000 1.327000  1.180000       1.486000  
1 1 1 23 18 39 o 21.31000 0.3127000 21.78000 0.4302000 20.84000 0.4539000 0.9379000      0.6254000 
1 1 1 23 18 41 o 11.84000 0.5367000 11.01000 0.8922000 12.67000 0.5969000 -1.662000      1.073000  
1 1 1 23 18 43 o 5.414000 0.8372000 5.771000 1.101000  5.057000 1.261000  0.7142000      1.674000  
1 1 1 23 18 45 o 9.330000 0.5354000 9.678000 0.7539000 8.981000 0.7605000 0.6969000      1.071000  
1 1 1 23 18 47 o 12.23000 0.4694000 12.60000 0.6833000 11.86000 0.6438000 0.7419000      0.9388000 
1 1 1 23 18 49 o 8.870000 0.7407000 8.774000 0.8735000 8.967000 1.197000  -0.1935000     1.481000  
1 1 1 23 18 51 o 5.871000 1.130000  5.535000 1.769000  6.206000 1.408000  -0.6713000     2.261000  
1 1 1 23 18 53 o 6.461000 0.9616000 6.766000 1.193000  6.157000 1.509000  0.6086000      1.923000  
1 1 1 23 18 55 o 3.453000 0.9768000 3.693000 1.425000  3.213000 1.336000  0.4806000      1.954000  
1 1 1 23 19 0  o 16.67000 0.5323000 16.67000 0.5323000 16.67000 0.5323000 0.000000       0.000000  
1 1 1 23 19 2  o 28.18000 0.3021000 28.26000 0.4284000 28.09000 0.4260000 0.1644000      0.6041000 
1 1 1 23 19 4  o 20.97000 0.3508000 21.09000 0.5674000 20.85000 0.4126000 0.2466000      0.7016000 
1 1 1 23 19 6  o 20.07000 0.2801000 20.27000 0.4003000 19.87000 0.3918000 0.4011000      0.5602000 
1 1 1 23 19 8  o 52.11000 0.4176000 52.36000 0.5518000 51.86000 0.6269000 0.5022000      0.8351000 
1 1 1 23 19 10 o 17.36000 0.2721000 17.57000 0.3940000 17.14000 0.3755000 0.4251000      0.5443000 
1 1 1 23 19 12 f 21.74000 0.2908000 21.66000 0.3713000 21.83000 0.4476000 -0.1724000     0.5816000 
1 1 1 23 19 14 o 24.51000 0.2766000 24.94000 0.3762000 24.08000 0.4055000 0.8620000      0.5531000 
1 1 1 23 19 16 o 16.72000 0.3215000 16.85000 0.3400000 16.59000 0.5459000 0.2567000      0.6431000 
1 1 1 23 19 18 o 6.968000 0.6250000 7.062000 0.5749000 6.873000 1.110000  0.1890000      1.250000  
1 1 1 23 19 20 o 58.64000 0.4503000 58.53000 0.5406000 58.76000 0.7202000 -0.2309000     0.9005000 
1 1 1 23 19 22 o 26.58000 0.3077000 26.67000 0.3492000 26.48000 0.5067000 0.1900000      0.6154000 
1 1 1 23 19 24 o 16.26000 0.3820000 15.76000 0.4784000 16.76000 0.5956000 -1.001000      0.7640000 
1 1 1 23 19 26 o 10.75000 0.5884000 10.71000 0.5080000 10.79000 1.062000  -0.7691000E-01 1.177000  
1 1 1 23 19 28 o 17.12000 0.3999000 17.15000 0.5786000 17.10000 0.5522000 0.5546000E-01  0.7998000 
1 1 1 23 19 30 o 40.41000 0.3590000 41.25000 0.4364000 39.57000 0.5702000 1.682000       0.7180000 
1 1 1 23 19 32 o 23.58000 0.3786000 24.18000 0.4088000 22.99000 0.6373000 1.193000       0.7571000 
1 1 1 23 19 34 o 8.330000 0.5978000 8.988000 0.5903000 7.672000 1.040000  1.316000       1.196000  
1 1 1 23 19 36 o 17.94000 0.4896000 18.32000 0.3842000 17.57000 0.9007000 0.7542000      0.9793000 
1 1 1 23 19 38 o 17.83000 0.4055000 18.01000 0.4103000 17.64000 0.6995000 0.3713000      0.8109000 
1 1 1 23 19 40 o 13.11000 0.3992000 12.85000 0.5568000 13.36000 0.5722000 -0.5111000     0.7984000 
1 1 1 23 19 42 o 5.974000 0.8636000 5.313000 1.409000  6.635000 0.9994000 -1.322000      1.727000  
1 1 1 23 19 44 o 3.968000 0.9280000 4.425000 1.301000  3.510000 1.324000  0.9147000      1.856000  
1 1 1 23 19 46 o 8.007000 0.6528000 7.859000 0.9955000 8.156000 0.8446000 -0.2971000     1.306000  
1 1 1 23 19 48 o 10.69000 0.5129000 10.30000 0.7603000 11.09000 0.6886000 -0.7915000     1.026000  
1 1 1 23 19 50 o 5.221000 1.049000  4.792000 1.443000  5.649000 1.522000  -0.8569000     2.097000  
1 1 1 23 19 52 o 4.128000 1.078000  4.552000 1.586000  3.704000 1.461000  0.8478000      2.157000  
1 1 1 23 19 54 o 2.967000 0.9112000 3.106000 1.311000  2.827000 1.266000  0.2795000      1.822000  
1 1 1 23 20 1  o 22.10000 0.5749000 21.90000 0.6469000 22.30000 0.9506000 -0.4000000     1.150000  
1 1 1 23 20 3  o 6.100000 0.6631000 7.132000 0.9304000 5.067000 0.9450000 2.064000       1.326000  
1 1 1 23 20 5  o 30.10000 0.2751000 30.46000 0.3911000 29.75000 0.3869000 0.7184000      0.5501000 
1 1 1 23 20 7  o 57.96000 0.4238000 57.75000 0.5976000 58.17000 0.6011000 -0.4106000     0.8476000 
1 1 1 23 20 9  o 26.30000 0.2692000 26.70000 0.3872000 25.90000 0.3741000 0.7976000      0.5384000 
1 1 1 23 20 11 o 50.86000 0.4097000 50.79000 0.5388000 50.93000 0.6172000 -0.1432000     0.8193000 
1 1 1 23 20 13 o 38.51000 0.3583000 38.65000 0.5089000 38.38000 0.5046000 0.2621000      0.7167000 
1 1 1 23 20 15 o 33.31000 0.3362000 32.98000 0.4308000 33.64000 0.5163000 -0.6607000     0.6724000 
1 1 1 23 20 17 o 3.654000 0.7761000 4.354000 0.8655000 2.954000 1.288000  1.399000       1.552000  
1 1 1 23 20 19 o 21.96000 0.3005000 22.22000 0.3234000 21.69000 0.5066000 0.5328000      0.6010000 
1 1 1 23 20 21 o 24.87000 0.2983000 24.31000 0.3301000 25.44000 0.4969000 -1.123000      0.5965000 
1 1 1 23 20 23 o 10.40000 0.4683000 10.16000 0.4993000 10.64000 0.7924000 -0.4771000     0.9366000 
1 1 1 23 20 25 o 21.53000 0.3948000 21.27000 0.5782000 21.78000 0.5377000 -0.5070000     0.7896000 
1 1 1 23 20 27 f 30.61000 0.3208000 30.82000 0.3749000 30.39000 0.5207000 0.4307000      0.6417000 
1 1 1 23 20 29 o 14.65000 0.5021000 14.51000 0.6465000 14.79000 0.7685000 -0.2775000     1.004000  
1 1 1 23 20 31 o 19.09000 0.3501000 19.92000 0.4164000 18.26000 0.5628000 1.664000       0.7001000 
1 1 1 23 20 33 o 12.04000 0.4163000 12.29000 0.4612000 11.79000 0.6933000 0.4987000      0.8327000 
1 1 1 23 20 35 o 20.81000 0.4609000 20.72000 0.3709000 20.91000 0.8440000 -0.1933000     0.9219000 
1 1 1 23 20 37 o 9.782000 0.4962000 10.43000 0.5443000 9.131000 0.8297000 1.303000       0.9923000 
1 1 1 23 20 39 o 13.77000 0.3760000 14.04000 0.4474000 13.50000 0.6044000 0.5413000      0.7520000 
1 1 1 23 20 41 o 10.61000 0.4812000 10.16000 0.7326000 11.06000 0.6242000 -0.9056000     0.9624000 
1 1 1 23 20 43 o 5.628000 0.8570000 5.991000 1.242000  5.265000 1.181000  0.7263000      1.714000  
1 1 1 23 20 45 o 4.864000 0.9158000 5.141000 1.317000  4.586000 1.273000  0.5554000      1.832000  
1 1 1 23 20 47 o 8.762000 0.5683000 8.315000 0.8298000 9.209000 0.7768000 -0.8945000     1.137000  
1 1 1 23 20 49 o 6.468000 0.9926000 6.958000 1.017000  5.978000 1.705000  0.9798000      1.985000  
1 1 1 23 20 51 o 3.459000 0.9893000 2.878000 1.291000  4.041000 1.500000  -1.163000      1.979000  
1 1 1 23 20 53 o 3.105000 0.9276000 2.715000 1.270000  3.495000 1.352000  -0.7803000     1.855000  
1 1 1 23 20 55 o 6.289000 1.012000  6.744000 1.511000  5.833000 1.347000  0.9117000      2.024000  
1 1 1 23 21 0  o 93.00000 0.9156000 93.00000 0.9156000 93.00000 0.9156000 0.000000       0.000000  
1 1 1 23 21 2  o 41.37000 0.3488000 40.66000 0.5181000 42.07000 0.4670000 -1.410000      0.6975000 
1 1 1 23 21 4  f 10.70000 0.3529000 11.18000 0.4723000 10.21000 0.5246000 0.9710000      0.7059000 
1 1 1 23 21 6  o 47.39000 0.3611000 47.29000 0.5106000 47.49000 0.5107000 -0.2015000     0.7222000 
1 1 1 23 21 8  o 52.65000 0.3946000 53.16000 0.5616000 52.14000 0.5546000 1.024000       0.7893000 
1 1 1 23 21 10 o 28.15000 0.2868000 27.95000 0.3821000 28.35000 0.4279000 -0.3971000     0.5737000 
1 1 1 23 21 12 o 39.08000 0.4007000 39.18000 0.5086000 38.98000 0.6193000 0.1994000      0.8013000 
1 1 1 23 21 14 o 26.09000 0.3210000 26.18000 0.4218000 26.00000 0.4839000 0.1805000      0.6419000 
1 1 1 23 21 16 o 4.352000 0.8320000 4.400000 0.8105000 4.304000 1.453000  0.9623000E-01  1.664000  
1 1 1 23 21 18 o 10.48000 0.4172000 10.48000 0.3781000 10.47000 0.7439000 0.1360000E-01  0.8345000 
1 1 1 23 21 20 o 7.109000 0.6178000 7.507000 0.5124000 6.711000 1.124000  0.7952000      1.236000  
1 1 1 23 21 22 o 20.71000 0.3088000 20.46000 0.3329000 20.95000 0.5202000 -0.4920000     0.6177000 
1 1 1 23 21 24 o 28.07000 0.3761000 27.43000 0.5486000 28.70000 0.5146000 -1.266000      0.7522000 
1 1 1 23 21 26 o 37.28000 0.4172000 37.68000 0.4620000 36.89000 0.6948000 0.7926000      0.8344000 
1 1 1 23 21 28 o 40.71000 0.3573000 41.04000 0.4225000 40.38000 0.5762000 0.6600000      0.7145000 
1 1 1 23 21 30 o 46.80000 0.4363000 46.79000 0.6112000 46.80000 0.6227000 -0.1028000E-01 0.8726000 
1 1 1 23 21 32 o 6.347000 0.7683000 6.496000 0.7862000 6.199000 1.320000  0.2969000      1.537000  
1 1 1 23 21 34 o 12.38000 0.4588000 12.61000 0.4450000 12.16000 0.8024000 0.4462000      0.9175000 
1 1 1 23 21 36 o 11.65000 0.4215000 11.71000 0.4914000 11.59000 0.6851000 0.1186000      0.8431000 
1 1 1 23 21 38 o 9.625000 0.5553000 9.474000 0.5702000 9.777000 0.9531000 -0.3027000     1.111000  
1 1 1 23 21 40 o 9.349000 0.4771000 9.250000 0.6664000 9.447000 0.6831000 -0.1972000     0.9543000 
1 1 1 23 21 42 o 12.65000 0.3986000 12.99000 0.5458000 12.30000 0.5812000 0.6893000      0.7973000 
1 1 1 23 21 44 o 8.791000 0.6039000 8.305000 0.9648000 9.277000 0.7265000 -0.9713000     1.208000  
1 1 1 23 21 46 o 5.218000 0.9311000 5.244000 1.341000  5.193000 1.292000  0.5058000E-01  1.862000  
1 1 1 23 21 48 o 12.99000 0.5748000 13.44000 0.6044000 12.54000 0.9778000 0.9059000      1.150000  
1 1 1 23 21 50 o 7.401000 0.7424000 7.776000 1.017000  7.026000 1.082000  0.7497000      1.485000  
1 1 1 23 21 52 f 6.753000 0.8344000 6.528000 1.250000  6.979000 1.105000  -0.4513000     1.669000  
1 1 1 23 21 54 o 4.127000 0.9890000 3.264000 1.368000  4.991000 1.428000  -1.727000      1.978000  
1 1 1 23 22 1  o 17.42000 0.2890000 17.67000 0.4474000 17.18000 0.3659000 0.4903000      0.5780000 
1 1 1 23 22 3  o 36.41000 0.3775000 36.51000 0.6226000 36.31000 0.4271000 0.1961000      0.7550000 
1 1 1 23 22 5  o 42.88000 0.3571000 42.95000 0.4747000 42.81000 0.5337000 0.1481000      0.7143000 
1 1 1 23 22 7  o 54.79000 0.4622000 54.97000 0.6535000 54.62000 0.6537000 0.3522000      0.9244000 
1 1 1 23 22 9  o 9.931000 0.3354000 10.07000 0.4738000 9.790000 0.4749000 0.2820000      0.6708000 
1 1 1 23 22 11 o 34.61000 0.3746000 34.66000 0.6194000 34.56000 0.4217000 0.9553000E-01  0.7493000 
1 1 1 23 22 13 f 47.04000 0.4346000 46.72000 0.6075000 47.37000 0.6216000 -0.6514000     0.8692000 
1 1 1 23 22 15 o 78.57000 0.7281000 79.36000 1.139000  77.78000 0.9077000 1.575000       1.456000  
1 1 1 23 22 17 o 22.38000 0.3628000 22.96000 0.5234000 21.79000 0.5026000 1.176000       0.7256000 
1 1 1 23 22 19 o 12.70000 0.5076000 13.00000 0.7450000 12.39000 0.6896000 0.6091000      1.015000  
1 1 1 23 22 21 o 25.43000 0.3170000 24.89000 0.3806000 25.98000 0.5070000 -1.089000      0.6339000 
1 1 1 23 22 23 o 13.44000 0.3737000 12.76000 0.3714000 14.12000 0.6485000 -1.359000      0.7473000 
1 1 1 23 22 25 o 17.35000 0.3366000 17.73000 0.3418000 16.97000 0.5800000 0.7613000      0.6732000 
1 1 1 23 22 27 o 20.55000 0.3432000 19.97000 0.4270000 21.13000 0.5373000 -1.163000      0.6863000 
1 1 1 23 22 29 o 19.08000 0.3374000 19.27000 0.4067000 18.90000 0.5384000 0.3680000      0.6747000 
1 1 1 23 22 31 o 10.35000 0.5178000 9.999000 0.6813000 10.71000 0.7799000 -0.7114000     1.036000  
1 1 1 23 22 33 o 9.670000 0.7067000 9.000000 0.6244000 10.34000 1.268000  -1.338000      1.413000  
1 1 1 23 22 35 o 10.34000 0.4913000 10.58000 0.5209000 10.09000 0.8332000 0.4845000      0.9827000 
1 1 1 23 22 37 o 18.41000 0.3354000 18.23000 0.3912000 18.59000 0.5450000 -0.3559000     0.6709000 
1 1 1 23 22 39 o 8.937000 0.5068000 8.490000 0.6422000 9.384000 0.7842000 -0.8945000     1.014000  
1 1 1 23 22 41 o 8.007000 0.5951000 8.828000 0.7396000 7.185000 0.9326000 1.643000       1.190000  
1 1 1 23 22 43 o 8.387000 0.5691000 9.169000 0.7158000 7.605000 0.8849000 1.564000       1.138000  
1 1 1 23 22 45 o 7.886000 0.7624000 7.509000 1.261000  8.263000 0.8573000 -0.7539000     1.525000  
1 1 1 23 22 47 o 8.528000 0.6691000 9.088000 0.7794000 7.967000 1.088000  1.121000       1.338000  
1 1 1 23 22 49 f 8.332000 0.6834000 8.940000 0.7753000 7.725000 1.126000  1.215000       1.367000  
1 1 1 23 22 51 o 5.368000 0.9932000 6.071000 1.249000  4.665000 1.545000  1.406000       1.986000  
1 1 1 23 22 53 o 4.512000 1.024000  4.504000 1.561000  4.520000 1.325000  -0.1564000E-01 2.047000  
1 1 1 23 23 0  o 15.25000 0.4173000 15.25000 0.4173000 15.25000 0.4173000 0.000000       0.000000  
1 1 1 23 23 2  o 28.05000 0.4787000 27.98000 0.8650000 28.11000 0.4105000 -0.1317000     0.9574000 
1 1 1 23 23 4  o 31.79000 0.3162000 32.00000 0.4455000 31.58000 0.4488000 0.4237000      0.6324000 
1 1 1 23 23 6  o 12.37000 0.3142000 12.86000 0.4325000 11.87000 0.4558000 0.9927000      0.6283000 
1 1 1 23 23 8  o 47.21000 0.3851000 47.73000 0.5806000 46.69000 0.5060000 1.040000       0.7702000 
1 1 1 23 23 10 o 41.55000 0.4027000 40.92000 0.5590000 42.17000 0.5799000 -1.250000      0.8055000 
1 1 1 23 23 12 o 33.24000 0.4236000 33.58000 0.5146000 32.90000 0.6731000 0.6875000      0.8472000 
1 1 1 23 23 14 o 15.03000 0.4272000 15.17000 0.6193000 14.88000 0.5885000 0.2891000      0.8544000 
1 1 1 23 23 16 f 31.99000 0.4142000 31.89000 0.6482000 32.10000 0.5159000 -0.2163000     0.8284000 
1 1 1 23 23 18 o 17.33000 0.4166000 17.32000 0.6227000 17.34000 0.5536000 -0.1834000E-01 0.8332000 
1 1 1 23 23 20 o 21.60000 0.3749000 21.57000 0.5453000 21.63000 0.5147000 -0.6176000E-01 0.7498000 
1 1 1 23 23 22 o 13.81000 0.4789000 13.53000 0.7268000 14.09000 0.6237000 -0.5607000     0.9578000 
1 1 1 23 23 24 o 37.19000 0.3573000 36.97000 0.4556000 37.42000 0.5505000 -0.4539000     0.7145000 
1 1 1 23 23 26 o 14.09000 0.4563000 13.06000 0.3838000 15.13000 0.8279000 -2.075000      0.9125000 
1 1 1 23 23 28 o 4.808000 0.8070000 4.605000 0.8610000 5.011000 1.365000  -0.4064000     1.614000  
1 1 1 23 23 30 o 10.51000 0.5459000 9.907000 0.5870000 11.10000 0.9206000 -1.196000      1.092000  
1 1 1 23 23 32 o 12.02000 0.4434000 12.02000 0.5516000 12.02000 0.6944000 0.2266000E-02  0.8868000 
1 1 1 23 23 34 o 4.420000 0.8909000 4.960000 1.089000  3.880000 1.410000  1.080000       1.782000  
1 1 1 23 23 36 o 3.561000 0.9093000 2.782000 1.139000  4.340000 1.418000  -1.558000      1.819000  
1 1 1 23 23 38 o 8.310000 0.6472000 8.292000 0.6641000 8.329000 1.111000  -0.3728000E-01 1.294000  
1 1 1 23 23 40 o 4.651000 0.9327000 3.945000 1.366000  5.356000 1.270000  -1.411000      1.865000  
1 1 1 23 23 42 o 4.747000 0.8722000 4.529000 1.214000  4.964000 1.253000  -0.4353000     1.744000  
1 1 1 23 23 44 o 6.768000 0.6914000 6.544000 0.9830000 6.993000 0.9724000 -0.4488000     1.383000  
1 1 1 23 23 46 o 12.66000 0.4657000 12.85000 0.5543000 12.46000 0.7486000 0.3880000      0.9315000 
1 1 1 23 23 48 f 7.808000 0.7498000 6.726000 1.090000  8.890000 1.030000  -2.164000      1.500000  
1 1 1 23 23 50 o 5.150000 1.071000  4.773000 1.527000  5.527000 1.502000  -0.7535000     2.142000  
1 1 1 23 23 52 o 4.308000 1.018000  4.596000 1.460000  4.020000 1.420000  0.5768000      2.037000  
1 1 1 23 23 54 o 2.918000 0.9272000 2.667000 1.235000  3.169000 1.384000  -0.5015000     1.854000  
1 1 1 23 24 1  o 31.59000 0.3140000 31.01000 0.4839000 32.16000 0.4002000 -1.149000      0.6279000 
1 1 1 23 24 3  o 16.61000 0.2719000 16.79000 0.3967000 16.44000 0.3718000 0.3484000      0.5437000 
1 1 1 23 24 5  o 38.69000 0.3175000 38.74000 0.4499000 38.65000 0.4480000 0.9066000E-01  0.6349000 
1 1 1 23 24 7  o 4.953000 0.6414000 5.085000 0.8736000 4.821000 0.9392000 0.2639000      1.283000  
1 1 1 23 24 9  o 9.368000 0.5727000 9.850000 0.7736000 8.885000 0.8447000 0.9650000      1.145000  
1 1 1 23 24 11 o 32.61000 0.3628000 32.06000 0.5100000 33.15000 0.5162000 -1.091000      0.7257000 
1 1 1 23 24 13 o 51.87000 0.4645000 51.88000 0.6530000 51.86000 0.6608000 0.1519000E-01  0.9290000 
1 1 1 23 24 15 o 52.41000 0.5260000 52.91000 0.8228000 51.91000 0.6554000 0.9972000      1.052000  
1 1 1 23 24 17 o 23.64000 0.3568000 23.51000 0.5182000 23.77000 0.4905000 -0.2510000     0.7135000 
1 1 1 23 24 19 o 3.596000 1.003000  3.583000 1.471000  3.610000 1.365000  -0.2791000E-01 2.006000  
1 1 1 23 24 21 o 28.17000 0.3690000 27.45000 0.5308000 28.89000 0.5128000 -1.448000      0.7381000 
1 1 1 23 24 23 o 44.89000 0.4321000 45.11000 0.6166000 44.67000 0.6055000 0.4402000      0.8642000 
1 1 1 23 24 25 o 22.57000 0.4352000 22.14000 0.5759000 22.99000 0.6525000 -0.8495000     0.8703000 
1 1 1 23 24 27 o 18.79000 0.3656000 18.94000 0.4838000 18.63000 0.5484000 0.3081000      0.7313000 
1 1 1 23 24 29 o 9.530000 0.5323000 9.235000 0.4631000 9.826000 0.9585000 -0.5909000     1.065000  
1 1 1 23 24 31 o 21.12000 0.3245000 21.15000 0.4053000 21.09000 0.5068000 0.6292000E-01  0.6490000 
1 1 1 23 24 33 o 13.74000 0.4331000 14.26000 0.5896000 13.22000 0.6347000 1.047000       0.8663000 
1 1 1 23 24 35 o 3.056000 0.8073000 3.769000 1.178000  2.342000 1.105000  1.427000       1.615000  
1 1 1 23 24 37 o 10.81000 0.5462000 11.79000 0.5505000 9.825000 0.9435000 1.966000       1.092000  
1 1 1 23 24 39 o 5.818000 0.8180000 6.097000 0.9017000 5.539000 1.365000  0.5575000      1.636000  
1 1 1 23 24 41 o 14.06000 0.3819000 14.12000 0.5265000 13.99000 0.5534000 0.1260000      0.7638000 
1 1 1 23 24 43 o 5.033000 0.9544000 4.748000 1.451000  5.319000 1.240000  -0.5711000     1.909000  
1 1 1 23 24 45 o 7.996000 0.7179000 8.551000 0.8024000 7.440000 1.191000  1.111000       1.436000  
1 1 1 23 24 47 o 6.328000 0.8329000 5.084000 1.268000  7.572000 1.080000  -2.488000      1.666000  
1 1 1 23 24 49 o 6.608000 0.8504000 7.228000 1.033000  5.989000 1.351000  1.238000       1.701000  
1 1 1 23 24 51 o 3.149000 0.9030000 2.580000 1.193000  3.718000 1.356000  -1.138000      1.806000  
1 1 1 23 24 53 o 6.106000 0.9030000 6.491000 1.297000  5.722000 1.257000  0.7690000      1.806000  
1 1 1 23 25 0  o 9.603000 0.5264000 9.603000 0.5264000 9.603000 0.5264000 0.000000       0.000000  
1 1 1 23 25 2  o 9.910000 0.3963000 9.871000 0.6274000 9.950000 0.4843000 -0.7935000E-01 0.7925000 
1 1 1 23 25 4  o 43.90000 0.3445000 43.65000 0.4846000 44.15000 0.4898000 -0.5001000     0.6891000 
1 1 1 23 25 6  o 48.66000 0.3698000 49.43000 0.5312000 47.88000 0.5146000 1.558000       0.7396000 
1 1 1 23 25 8  o 19.68000 0.4033000 19.79000 0.6275000 19.57000 0.5068000 0.2244000      0.8066000 
1 1 1 23 25 10 o 17.46000 0.3885000 17.87000 0.5500000 17.05000 0.5488000 0.8171000      0.7769000 
1 1 1 23 25 12 o 27.19000 0.4171000 26.71000 0.5005000 27.68000 0.6674000 -0.9713000     0.8342000 
1 1 1 23 25 14 o 8.574000 0.7034000 8.379000 1.045000  8.769000 0.9424000 -0.3905000     1.407000  
1 1 1 23 25 16 o 14.91000 0.4942000 15.40000 0.7544000 14.42000 0.6386000 0.9789000      0.9884000 
1 1 1 23 25 18 o 13.13000 0.4936000 13.46000 0.7303000 12.79000 0.6643000 0.6706000      0.9873000 
1 1 1 23 25 20 o 19.67000 0.3893000 18.80000 0.5943000 20.54000 0.5029000 -1.740000      0.7785000 
1 1 1 23 25 22 o 12.99000 0.5018000 12.88000 0.7481000 13.10000 0.6690000 -0.2212000     1.004000  
1 1 1 23 25 24 o 24.29000 0.3747000 23.89000 0.5391000 24.69000 0.5207000 -0.7959000     0.7495000 
1 1 1 23 25 26 o 16.98000 0.4169000 16.98000 0.6079000 16.98000 0.5707000 0.8183000E-03  0.8338000 
1 1 1 23 25 28 o 10.10000 0.5282000 9.323000 0.4849000 10.87000 0.9385000 -1.546000      1.056000  
1 1 1 23 25 30 o 13.29000 0.3490000 13.01000 0.3547000 13.57000 0.6011000 -0.5636000     0.6980000 
1 1 1 23 25 32 o 7.356000 0.7459000 7.114000 0.9009000 7.599000 1.189000  -0.4853000     1.492000  
1 1 1 23 25 34 o 12.61000 0.3845000 12.34000 0.4220000 12.89000 0.6429000 -0.5457000     0.7690000 
1 1 1 23 25 36 o 10.39000 0.4486000 10.07000 0.5150000 10.71000 0.7346000 -0.6415000     0.8971000 
1 1 1 23 25 38 o 16.26000 0.3605000 15.89000 0.4049000 16.62000 0.5966000 -0.7361000     0.7210000 
1 1 1 23 25 40 o 8.959000 0.5284000 8.090000 0.6881000 9.829000 0.8020000 -1.739000      1.057000  
1 1 1 23 25 42 o 3.683000 0.9144000 3.094000 1.260000  4.272000 1.326000  -1.178000      1.829000  
1 1 1 23 25 44 o 6.092000 1.015000  5.578000 1.604000  6.605000 1.244000  -1.027000      2.030000  
1 1 1 23 25 46 o 4.120000 1.028000  3.643000 1.386000  4.597000 1.519000  -0.9537000     2.056000  
1 1 1 23 25 48 o 3.634000 0.9769000 4.123000 1.378000  3.145000 1.385000  0.9780000      1.954000  
1 1 1 23 25 50 o 7.080000 0.8104000 8.295000 1.075000  5.865000 1.213000  2.430000       1.621000  
1 1 1 23 25 52 o 4.462000 0.9569000 3.559000 1.403000  5.364000 1.302000  -1.805000      1.914000  
1 1 1 23 26 1  o 22.90000 0.2900000 23.14000 0.4516000 22.66000 0.3639000 0.4793000      0.5800000 
1 1 1 23 26 3  o 22.84000 0.2588000 22.62000 0.3656000 23.06000 0.3663000 -0.4382000     0.5175000 
1 1 1 23 26 5  o 9.386000 0.3729000 9.568000 0.5158000 9.204000 0.5386000 0.3646000      0.7458000 
1 1 1 23 26 7  f 41.70000 0.4023000 41.90000 0.5725000 41.49000 0.5653000 0.4045000      0.8046000 
1 1 1 23 26 9  o 9.362000 0.5986000 9.167000 0.8862000 9.556000 0.8049000 -0.3884000     1.197000  
1 1 1 23 26 11 o 40.75000 0.3987000 40.16000 0.5598000 41.35000 0.5678000 -1.188000      0.7973000 
1 1 1 23 26 13 o 32.75000 0.3704000 32.68000 0.5180000 32.83000 0.5297000 -0.1552000     0.7409000 
1 1 1 23 26 15 o 18.12000 0.4584000 18.38000 0.7169000 17.87000 0.5714000 0.5069000      0.9168000 
1 1 1 23 26 17 o 29.26000 0.4200000 29.60000 0.5194000 28.92000 0.6601000 0.6885000      0.8400000 
1 1 1 23 26 19 o 28.68000 0.3692000 28.97000 0.5348000 28.39000 0.5092000 0.5773000      0.7385000 
1 1 1 23 26 21 o 19.48000 0.3811000 19.18000 0.5663000 19.78000 0.5102000 -0.6018000     0.7622000 
1 1 1 23 26 23 o 18.26000 0.4167000 18.04000 0.6169000 18.49000 0.5604000 -0.4439000     0.8335000 
1 1 1 23 26 25 f 24.06000 0.4736000 24.96000 0.6770000 23.16000 0.6626000 1.797000       0.9472000 
1 1 1 23 26 27 o 7.456000 0.8598000 8.008000 1.081000  6.903000 1.337000  1.104000       1.720000  
1 1 1 23 26 29 o 13.34000 0.3838000 12.81000 0.4652000 13.87000 0.6106000 -1.062000      0.7676000 
1 1 1 23 26 31 o 3.106000 0.8285000 3.381000 1.032000  2.831000 1.296000  0.5498000      1.657000  
1 1 1 23 26 33 o 3.978000 0.9241000 3.623000 1.197000  4.334000 1.408000  -0.7104000     1.848000  
1 1 1 23 26 35 o 14.07000 0.3522000 13.62000 0.4013000 14.52000 0.5789000 -0.9038000     0.7043000 
1 1 1 23 26 37 o 12.29000 0.4850000 12.47000 0.4545000 12.11000 0.8569000 0.3623000      0.9700000 
1 1 1 23 26 39 o 10.80000 0.4462000 10.42000 0.5367000 11.18000 0.7128000 -0.7596000     0.8923000 
1 1 1 23 26 41 o 7.406000 0.8185000 7.450000 0.8378000 7.361000 1.406000  0.8908000E-01  1.637000  
1 1 1 23 26 43 o 8.274000 0.7394000 7.941000 0.8914000 8.608000 1.180000  -0.6674000     1.479000  
1 1 1 23 26 45 o 8.764000 0.7088000 9.674000 1.030000  7.854000 0.9736000 1.820000       1.418000  
1 1 1 23 26 47 o 3.956000 0.9758000 3.771000 1.352000  4.140000 1.408000  -0.3687000     1.952000  
1 1 1 23 26 49 o 3.482000 0.9403000 2.833000 1.234000  4.131000 1.419000  -1.297000      1.881000  
1 1 1 23 26 51 o 4.620000 0.9130000 3.641000 1.402000  5.600000 1.170000  -1.959000      1.826000  
1 1 1 23 27 0  f 6.350000 0.9804000 6.350000 0.9804000 6.350000 0.9804000 0.000000       0.000000  
1 1 1 23 27 2  o 29.81000 0.3352000 29.54000 0.4728000 30.08000 0.4752000 -0.5413000     0.6703000 
1 1 1 23 27 4  o 4.969000 0.7274000 4.534000 1.053000  5.404000 1.004000  -0.8701000     1.455000  
1 1 1 23 27 6  o 37.01000 0.4394000 36.76000 0.5311000 37.25000 0.7001000 -0.4855000     0.8787000 
1 1 1 23 27 8  o 36.84000 0.3853000 37.35000 0.5506000 36.33000 0.5392000 1.025000       0.7707000 
1 1 1 23 27 10 o 30.01000 0.3601000 30.27000 0.5103000 29.74000 0.5082000 0.5291000      0.7201000 
1 1 1 23 27 12 o 23.66000 0.4746000 23.70000 0.6563000 23.63000 0.6858000 0.7050000E-01  0.9492000 
1 1 1 23 27 14 o 16.85000 0.4129000 16.81000 0.5875000 16.89000 0.5804000 -0.7179000E-01 0.8259000 
1 1 1 23 27 16 o 31.19000 0.4192000 31.30000 0.6498000 31.09000 0.5300000 0.2034000      0.8385000 
1 1 1 23 27 18 f 5.418000 1.028000  6.096000 1.465000  4.741000 1.443000  1.355000       2.056000  
1 1 1 23 27 20 o 25.88000 0.3743000 25.18000 0.5416000 26.59000 0.5167000 -1.409000      0.7485000 
1 1 1 23 27 22 o 37.32000 0.3980000 37.52000 0.5755000 37.12000 0.5498000 0.4017000      0.7959000 
1 1 1 23 27 24 o 13.78000 0.6078000 13.30000 0.9310000 14.27000 0.7815000 -0.9717000     1.216000  
1 1 1 23 27 26 o 3.136000 0.9458000 3.581000 1.432000  2.690000 1.236000  0.8912000      1.892000  
1 1 1 23 27 28 o 20.35000 0.4073000 19.87000 0.6204000 20.83000 0.5279000 -0.9577000     0.8147000 
1 1 1 23 27 30 o 11.30000 0.4969000 11.09000 0.5444000 11.52000 0.8313000 -0.4314000     0.9937000 
1 1 1 23 27 32 o 7.414000 0.6048000 7.822000 0.5140000 7.006000 1.095000  0.8161000      1.210000  
1 1 1 23 27 34 o 11.69000 0.4323000 11.70000 0.5406000 11.69000 0.6749000 0.1513000E-01  0.8647000 
1 1 1 23 27 36 o 3.923000 0.8431000 2.846000 1.069000  4.999000 1.304000  -2.152000      1.686000  
1 1 1 23 27 38 o 9.427000 0.4993000 8.872000 0.5978000 9.983000 0.7999000 -1.111000      0.9986000 
1 1 1 23 27 40 o 7.974000 0.6077000 8.174000 0.7071000 7.774000 0.9884000 0.3999000      1.215000  
1 1 1 23 27 42 o 3.794000 1.026000  3.842000 1.388000  3.747000 1.511000  0.9504000E-01  2.052000  
1 1 1 23 27 44 o 10.28000 0.5046000 10.30000 0.6829000 10.26000 0.7429000 0.3636000E-01  1.009000  
1 1 1 23 27 46 o 3.458000 0.9838000 3.155000 1.396000  3.761000 1.386000  -0.6054000     1.968000  
1 1 1 23 27 48 o 7.480000 0.7758000 6.806000 1.258000  8.153000 0.9086000 -1.348000      1.552000  
1 1 1 23 27 50 o 3.737000 0.9654000 4.377000 1.417000  3.096000 1.311000  1.281000       1.931000  
1 1 1 23 28 1  o 9.232000 0.4073000 9.441000 0.5746000 9.023000 0.5774000 0.4182000      0.8146000 
1 1 1 23 28 3  o 17.29000 0.3016000 17.32000 0.4610000 17.25000 0.3891000 0.6956000E-01  0.6033000 
1 1 1 23 28 5  o 7.128000 0.7180000 6.897000 1.041000  7.360000 0.9893000 -0.4632000     1.436000  
1 1 1 23 28 7  o 24.82000 0.3488000 25.30000 0.4939000 24.35000 0.4926000 0.9542000      0.6975000 
1 1 1 23 28 9  o 9.771000 0.5968000 9.641000 0.8413000 9.900000 0.8468000 -0.2596000     1.194000  
1 1 1 23 28 11 o 48.12000 0.4443000 48.11000 0.6240000 48.12000 0.6327000 -0.1384000E-01 0.8886000 
1 1 1 23 28 13 o 16.71000 0.4330000 16.95000 0.5975000 16.46000 0.6269000 0.4884000      0.8661000 
1 1 1 23 28 15 o 13.31000 0.5551000 14.09000 0.8301000 12.53000 0.7372000 1.560000       1.110000  
1 1 1 23 28 17 o 10.33000 0.6112000 10.73000 0.8178000 9.926000 0.9085000 0.8000000      1.222000  
1 1 1 23 28 19 o 31.74000 0.4193000 31.34000 0.5459000 32.14000 0.6366000 -0.8027000     0.8386000 
1 1 1 23 28 21 o 46.37000 0.4420000 46.06000 0.6221000 46.68000 0.6281000 -0.6218000     0.8841000 
1 1 1 23 28 23 o 17.29000 0.5258000 16.89000 0.8038000 17.70000 0.6779000 -0.8080000     1.052000  
1 1 1 23 28 25 o 31.49000 0.4306000 30.97000 0.5450000 32.01000 0.6669000 -1.045000      0.8612000 
1 1 1 23 28 27 o 12.31000 0.4787000 12.66000 0.6813000 11.95000 0.6728000 0.7131000      0.9575000 
1 1 1 23 28 29 o 9.542000 0.6618000 9.371000 0.8945000 9.714000 0.9757000 -0.3431000     1.324000  
1 1 1 23 28 31 o 14.48000 0.4146000 14.88000 0.5646000 14.07000 0.6074000 0.8154000      0.8293000 
1 1 1 23 28 33 o 8.156000 0.5079000 8.197000 0.4884000 8.115000 0.8908000 0.8176000E-01  1.016000  
1 1 1 23 28 35 o 4.335000 0.8871000 3.719000 1.220000  4.952000 1.288000  -1.233000      1.774000  
1 1 1 23 28 37 o 4.287000 0.9936000 3.520000 1.311000  5.054000 1.493000  -1.534000      1.987000  
1 1 1 23 28 39 o 13.20000 0.4669000 12.30000 0.5241000 14.09000 0.7729000 -1.792000      0.9338000 
1 1 1 23 28 41 o 21.62000 0.4192000 21.82000 0.4694000 21.42000 0.6945000 0.3989000      0.8383000 
1 1 1 23 28 43 o 11.13000 0.4801000 11.74000 0.6118000 10.52000 0.7401000 1.220000       0.9603000 
1 1 1 23 28 45 o 3.125000 0.9160000 2.518000 1.150000  3.731000 1.426000  -1.213000      1.832000  
1 1 1 23 28 47 f 2.737000 0.8867000 2.423000 1.161000  3.051000 1.341000  -0.6274000     1.773000  
1 1 1 23 28 49 o 9.347000 0.7786000 9.671000 1.238000  9.024000 0.9443000 0.6470000      1.557000  
1 1 1 23 28 51 f 4.237000 1.056000  5.229000 1.666000  3.245000 1.299000  1.984000       2.112000  
1 1 1 23 29 0  o 29.69000 0.4906000 29.69000 0.4906000 29.69000 0.4906000 0.000000       0.000000  
1 1 1 23 29 2  o 11.75000 0.3975000 11.70000 0.6468000 11.81000 0.4623000 -0.1112000     0.7950000 
1 1 1 23 29 4  o 18.44000 0.3115000 19.28000 0.5000000 17.60000 0.3718000 1.686000       0.6231000 
1 1 1 23 29 6  o 11.97000 0.4771000 12.77000 0.6466000 11.17000 0.7018000 1.605000       0.9543000 
1 1 1 23 29 8  o 21.05000 0.3678000 20.83000 0.5121000 21.28000 0.5282000 -0.4491000     0.7357000 
1 1 1 23 29 10 o 60.38000 0.5238000 59.70000 0.7316000 61.06000 0.7497000 -1.361000      1.048000  
1 1 1 23 29 12 o 56.52000 0.5655000 56.58000 0.7027000 56.46000 0.8863000 0.1261000      1.131000  
1 1 1 23 29 14 o 9.880000 0.6342000 9.894000 0.9416000 9.866000 0.8498000 0.2764000E-01  1.268000  
1 1 1 23 29 16 o 17.27000 0.4185000 17.31000 0.5902000 17.23000 0.5934000 0.7567000E-01  0.8369000 
1 1 1 23 29 18 o 21.13000 0.4123000 21.73000 0.5351000 20.53000 0.6275000 1.193000       0.8246000 
1 1 1 23 29 20 o 19.74000 0.4257000 19.35000 0.5518000 20.14000 0.6484000 -0.7955000     0.8515000 
1 1 1 23 29 22 o 28.41000 0.4562000 27.94000 0.6477000 28.87000 0.6426000 -0.9381000     0.9124000 
1 1 1 23 29 24 o 7.885000 0.7275000 7.910000 1.138000  7.859000 0.9060000 0.5177000E-01  1.455000  
1 1 1 23 29 26 o 18.66000 0.4174000 19.25000 0.6462000 18.07000 0.5286000 1.175000       0.8349000 
1 1 1 23 29 28 o 15.75000 0.4533000 14.80000 0.5757000 16.69000 0.7004000 -1.887000      0.9067000 
1 1 1 23 29 30 o 4.745000 0.9818000 4.553000 1.418000  4.936000 1.359000  -0.3826000     1.964000  
1 1 1 23 29 32 o 4.690000 0.9676000 4.700000 1.389000  4.680000 1.348000  0.2026000E-01  1.935000  
1 1 1 23 29 34 o 6.925000 0.6134000 5.917000 0.8549000 7.933000 0.8799000 -2.017000      1.227000  
1 1 1 23 29 36 o 9.795000 0.5264000 8.714000 0.6764000 10.88000 0.8067000 -2.162000      1.053000  
1 1 1 23 29 38 o 6.265000 0.8243000 5.418000 1.290000  7.111000 1.027000  -1.693000      1.649000  
1 1 1 23 29 40 o 3.607000 0.9728000 3.453000 1.196000  3.760000 1.534000  -0.3064000     1.946000  
1 1 1 23 29 42 o 6.543000 0.7182000 5.824000 1.053000  7.262000 0.9773000 -1.438000      1.436000  
1 1 1 23 29 44 o 5.740000 0.8774000 4.348000 1.336000  7.132000 1.138000  -2.785000      1.755000  
1 1 1 23 29 46 o 6.007000 1.029000  5.351000 1.209000  6.662000 1.665000  -1.311000      2.058000  
1 1 1 23 29 48 f 10.70000 0.6021000 10.33000 0.9402000 11.07000 0.7524000 -0.7429000     1.204000  
1 1 1 23 29 50 o 3.191000 1.027000  3.648000 1.653000  2.735000 1.218000  0.9135000      2.054000  
1 1 1 23 30 1  o 23.01000 0.2933000 23.18000 0.4802000 22.84000 0.3369000 0.3378000      0.5866000 
1 1 1 23 30 3  o 18.31000 0.4404000 18.30000 0.7151000 18.31000 0.5143000 -0.1187000E-01 0.8808000 
1 1 1 23 30 5  o 14.22000 0.4149000 14.09000 0.5921000 14.35000 0.5812000 -0.2599000     0.8297000 
1 1 1 23 30 7  o 27.49000 0.3520000 27.46000 0.4976000 27.53000 0.4980000 -0.6718000E-01 0.7040000 
1 1 1 23 30 9  o 17.67000 0.3889000 17.34000 0.5578000 18.01000 0.5420000 -0.6615000     0.7777000 
1 1 1 23 30 11 o 4.582000 1.057000  3.743000 1.499000  5.422000 1.491000  -1.679000      2.115000  
1 1 1 23 30 13 o 33.12000 0.3787000 32.95000 0.5310000 33.28000 0.5402000 -0.3344000     0.7575000 
1 1 1 23 30 15 o 3.954000 1.031000  3.203000 1.442000  4.705000 1.474000  -1.502000      2.062000  
1 1 1 23 30 17 o 18.70000 0.4095000 18.92000 0.5725000 18.48000 0.5856000 0.4428000      0.8190000 
1 1 1 23 30 19 o 38.86000 0.4560000 38.96000 0.5706000 38.76000 0.7115000 0.1991000      0.9120000 
1 1 1 23 30 21 o 25.68000 0.4089000 25.49000 0.6358000 25.88000 0.5144000 -0.3891000     0.8178000 
1 1 1 23 30 23 o 7.842000 0.7460000 7.424000 1.150000  8.259000 0.9499000 -0.8347000     1.492000  
1 1 1 23 30 25 o 6.269000 0.9408000 6.191000 1.573000  6.346000 1.033000  -0.1550000     1.882000  
1 1 1 23 30 27 o 8.676000 0.7662000 8.379000 1.160000  8.974000 1.002000  -0.5952000     1.532000  
1 1 1 23 30 29 o 20.51000 0.3812000 20.85000 0.5395000 20.16000 0.5385000 0.6925000      0.7623000 
1 1 1 23 30 31 o 5.778000 0.8506000 6.602000 1.020000  4.954000 1.361000  1.648000       1.701000  
1 1 1 23 30 33 o 6.400000 0.7767000 6.636000 0.9918000 6.164000 1.196000  0.4724000      1.553000  
1 1 1 23 30 35 o 4.383000 0.9904000 3.847000 1.122000  4.920000 1.632000  -1.072000      1.981000  
1 1 1 23 30 37 o 5.214000 0.8587000 4.752000 1.155000  5.676000 1.271000  -0.9239000     1.717000  
1 1 1 23 30 39 o 9.400000 0.6383000 8.873000 0.7595000 9.926000 1.026000  -1.054000      1.277000  
1 1 1 23 30 41 o 18.61000 0.3540000 18.69000 0.4161000 18.53000 0.5728000 0.1565000      0.7080000 
1 1 1 23 30 43 o 6.438000 0.8717000 7.204000 1.143000  5.672000 1.317000  1.532000       1.743000  
1 1 1 23 30 45 o 4.308000 1.032000  4.286000 1.489000  4.330000 1.429000  -0.4323000E-01 2.064000  
1 1 1 23 30 47 o 5.471000 0.8755000 6.129000 1.022000  4.813000 1.422000  1.316000       1.751000  
1 1 1 23 30 49 o 8.760000 0.9848000 9.066000 1.766000  8.454000 0.8730000 0.6123000      1.970000  
1 1 1 23 31 0  o 9.566000 1.298000  9.566000 1.298000  9.566000 1.298000  0.000000       0.000000  
1 1 1 23 31 2  o 23.46000 0.2956000 23.50000 0.4900000 23.42000 0.3310000 0.7576000E-01  0.5913000 
1 1 1 23 31 4  o 40.69000 0.3988000 40.44000 0.5593000 40.94000 0.5687000 -0.4994000     0.7976000 
1 1 1 23 31 6  o 11.40000 0.5083000 11.85000 0.7164000 10.95000 0.7214000 0.9060000      1.017000  
1 1 1 23 31 8  o 31.28000 0.4266000 31.81000 0.5147000 30.74000 0.6804000 1.070000       0.8532000 
1 1 1 23 31 10 o 12.67000 0.4874000 12.54000 0.6954000 12.79000 0.6830000 -0.2552000     0.9748000 
1 1 1 23 31 12 o 25.84000 0.4278000 25.50000 0.5209000 26.18000 0.6788000 -0.6835000     0.8556000 
1 1 1 23 31 14 o 20.91000 0.3896000 21.09000 0.5498000 20.73000 0.5523000 0.3571000      0.7793000 
1 1 1 23 31 16 o 10.92000 0.6211000 10.73000 0.7757000 11.11000 0.9701000 -0.3800000     1.242000  
1 1 1 23 31 18 o 19.29000 0.4907000 20.25000 0.6928000 18.34000 0.6950000 1.911000       0.9813000 
1 1 1 23 31 20 f 14.22000 0.5064000 13.80000 0.8125000 14.65000 0.6047000 -0.8542000     1.013000  
1 1 1 23 31 22 f 21.16000 0.3838000 20.87000 0.5561000 21.44000 0.5291000 -0.5654000     0.7676000 
1 1 1 23 31 24 o 23.82000 0.4413000 23.95000 0.6036000 23.69000 0.6438000 0.2607000      0.8825000 
1 1 1 23 31 26 o 16.64000 0.4459000 17.00000 0.5919000 16.29000 0.6671000 0.7122000      0.8918000 
1 1 1 23 31 28 o 15.21000 0.4165000 14.96000 0.5980000 15.45000 0.5799000 -0.4850000     0.8330000 
1 1 1 23 31 30 o 15.57000 0.4196000 15.83000 0.5862000 15.31000 0.6005000 0.5182000      0.8392000 
1 1 1 23 31 32 o 13.02000 0.5265000 13.54000 0.6287000 12.49000 0.8447000 1.056000       1.053000  
1 1 1 23 31 34 o 9.666000 0.6257000 9.932000 0.9455000 9.400000 0.8198000 0.5317000      1.251000  
1 1 1 23 31 36 o 5.422000 1.078000  5.324000 1.472000  5.520000 1.575000  -0.1959000     2.155000  
1 1 1 23 31 38 o 8.308000 0.7508000 8.506000 0.7764000 8.110000 1.285000  0.3963000      1.502000  
1 1 1 23 31 40 o 10.48000 0.4794000 10.06000 0.5540000 10.89000 0.7826000 -0.8286000     0.9588000 
1 1 1 23 31 42 o 5.441000 0.9105000 5.734000 1.292000  5.149000 1.283000  0.5852000      1.821000  
1 1 1 23 31 44 o 4.816000 1.118000  5.025000 1.766000  4.606000 1.372000  0.4184000      2.236000  
1 1 1 23 31 46 o 8.513000 0.9541000 7.996000 1.642000  9.031000 0.9716000 -1.035000      1.908000  
1 1 1 23 31 48 o 9.738000 1.270000  9.514000 2.443000  9.962000 0.6940000 -0.4478000     2.540000  
1 1 1 23 32 1  o 47.57000 0.3922000 48.41000 0.5324000 46.73000 0.5761000 1.680000       0.7844000 
1 1 1 23 32 3  o 16.75000 0.5673000 16.85000 1.037000  16.65000 0.4595000 0.1998000      1.135000  
1 1 1 23 32 5  o 24.41000 0.3560000 24.33000 0.4974000 24.50000 0.5096000 -0.1647000     0.7121000 
1 1 1 23 32 7  o 21.86000 0.3676000 21.77000 0.5222000 21.95000 0.5175000 -0.1815000     0.7352000 
1 1 1 23 32 9  o 5.321000 1.019000  5.363000 1.462000  5.280000 1.420000  0.8308000E-01  2.038000  
1 1 1 23 32 11 o 12.79000 0.4984000 13.23000 0.6783000 12.35000 0.7305000 0.8834000      0.9968000 
1 1 1 23 32 13 o 7.407000 0.7961000 8.783000 1.003000  6.032000 1.236000  2.751000       1.592000  
1 1 1 23 32 15 o 6.958000 0.9828000 5.085000 1.642000  8.831000 1.081000  -3.746000      1.966000  
1 1 1 23 32 17 o 11.15000 0.6255000 11.56000 0.9886000 10.75000 0.7667000 0.8063000      1.251000  
1 1 1 23 32 19 o 10.53000 0.5791000 10.62000 0.8471000 10.43000 0.7900000 0.1881000      1.158000  
1 1 1 23 32 21 o 19.98000 0.4327000 19.56000 0.6646000 20.40000 0.5543000 -0.8358000     0.8654000 
1 1 1 23 32 23 o 16.26000 0.4574000 16.07000 0.6234000 16.45000 0.6695000 -0.3863000     0.9147000 
1 1 1 23 32 25 o 13.81000 0.4969000 14.28000 0.6713000 13.34000 0.7327000 0.9414000      0.9937000 
1 1 1 23 32 27 o 3.618000 0.9775000 3.404000 1.387000  3.832000 1.378000  -0.4275000     1.955000  
1 1 1 23 32 29 o 16.45000 0.4067000 16.25000 0.5790000 16.64000 0.5712000 -0.3875000     0.8133000 
1 1 1 23 32 31 o 11.49000 0.5441000 11.63000 0.8341000 11.35000 0.6990000 0.2833000      1.088000  
1 1 1 23 32 33 f 4.706000 1.005000  4.693000 1.391000  4.720000 1.450000  -0.2695000E-01 2.009000  
1 1 1 23 32 35 o 3.382000 0.9635000 3.036000 1.330000  3.727000 1.394000  -0.6909000     1.927000  
1 1 1 23 32 37 o 7.040000 0.9188000 5.692000 1.452000  8.389000 1.126000  -2.696000      1.838000  
1 1 1 23 32 39 o 11.82000 0.4673000 11.07000 0.6380000 12.57000 0.6828000 -1.501000      0.9345000 
1 1 1 23 32 41 o 14.87000 0.4609000 14.63000 0.6871000 15.12000 0.6145000 -0.4942000     0.9218000 
1 1 1 23 32 43 o 10.37000 0.7748000 9.920000 1.387000  10.81000 0.6911000 -0.8915000     1.550000  
1 1 1 23 32 45 o 4.335000 1.177000  5.207000 1.917000  3.464000 1.365000  1.743000       2.354000  
1 1 1 23 32 47 o 3.219000 1.000000  3.142000 1.516000  3.295000 1.304000  -0.1531000     2.000000  
1 1 1 23 33 0  o 22.80000 0.3762000 22.80000 0.3762000 22.80000 0.3762000 0.000000       0.000000  
1 1 1 23 33 2  o 26.32000 0.3097000 26.04000 0.4888000 26.60000 0.3803000 -0.5633000     0.6193000 
1 1 1 23 33 4  o 12.73000 0.5240000 12.41000 0.5074000 13.05000 0.9171000 -0.6391000     1.048000  
1 1 1 23 33 6  o 11.19000 0.4929000 11.05000 0.7183000 11.33000 0.6750000 -0.2817000     0.9857000 
1 1 1 23 33 8  o 22.00000 0.4310000 22.07000 0.6863000 21.94000 0.5215000 0.1276000      0.8620000 
1 1 1 23 33 10 o 22.35000 0.4118000 21.66000 0.5265000 23.03000 0.6335000 -1.372000      0.8237000 
1 1 1 23 33 12 o 28.12000 0.5478000 28.37000 0.5140000 27.87000 0.9676000 0.5008000      1.096000  
1 1 1 23 33 14 o 17.19000 0.4658000 17.13000 0.7283000 17.25000 0.5809000 -0.1221000     0.9316000 
1 1 1 23 33 16 o 15.44000 0.4906000 14.64000 0.7967000 16.24000 0.5727000 -1.607000      0.9812000 
1 1 1 23 33 18 o 15.65000 0.4322000 15.17000 0.6261000 16.13000 0.5958000 -0.9615000     0.8643000 
1 1 1 23 33 20 f 20.70000 0.4133000 21.05000 0.6149000 20.35000 0.5524000 0.6992000      0.8266000 
1 1 1 23 33 22 o 11.84000 0.5326000 11.91000 0.7649000 11.77000 0.7413000 0.1416000      1.065000  
1 1 1 23 33 24 f 15.05000 0.5103000 14.64000 0.6628000 15.46000 0.7761000 -0.8195000     1.021000  
1 1 1 23 33 26 o 5.547000 0.8635000 5.570000 1.261000  5.524000 1.180000  0.4593000E-01  1.727000  
1 1 1 23 33 28 o 14.02000 0.4634000 13.98000 0.5903000 14.05000 0.7145000 -0.7085000E-01 0.9268000 
1 1 1 23 33 30 o 10.04000 0.6092000 9.452000 0.9672000 10.62000 0.7410000 -1.172000      1.218000  
1 1 1 23 33 32 o 13.25000 0.4736000 13.73000 0.6200000 12.77000 0.7162000 0.9617000      0.9473000 
1 1 1 23 33 34 o 15.01000 0.4345000 15.72000 0.5762000 14.30000 0.6506000 1.429000       0.8691000 
1 1 1 23 33 36 o 9.969000 0.6794000 9.814000 0.8283000 10.12000 1.077000  -0.3085000     1.359000  
1 1 1 23 33 38 o 10.04000 0.8439000 8.335000 1.527000  11.75000 0.7186000 -3.413000      1.688000  
1 1 1 23 33 40 o 5.853000 0.9531000 5.840000 1.413000  5.866000 1.279000  -0.2676000E-01 1.906000  
1 1 1 23 33 42 o 4.324000 1.119000  4.337000 1.742000  4.311000 1.405000  0.2628000E-01  2.238000  
1 1 1 23 33 44 o 4.671000 1.141000  5.364000 1.825000  3.978000 1.371000  1.386000       2.283000  
1 1 1 23 33 46 o 4.231000 1.156000  4.463000 1.794000  4.000000 1.459000  0.4637000      2.313000  
1 1 1 23 34 1  o 28.46000 0.2807000 28.47000 0.4018000 28.45000 0.3919000 0.1375000E-01  0.5613000 
1 1 1 23 34 3  o 11.92000 0.5892000 11.69000 0.6320000 12.15000 0.9946000 -0.4562000     1.178000  
1 1 1 23 34 5  o 20.90000 0.5800000 21.02000 0.4192000 20.79000 1.082000  0.2306000      1.160000  
1 1 1 23 34 7  o 14.71000 0.7144000 14.98000 0.4815000 14.43000 1.345000  0.5534000      1.429000  
1 1 1 23 34 9  o 3.091000 0.9921000 2.742000 1.301000  3.439000 1.498000  -0.6972000     1.984000  
1 1 1 23 34 11 o 17.12000 0.6851000 17.14000 1.052000  17.09000 0.8778000 0.4651000E-01  1.370000  
1 1 1 23 34 13 o 8.747000 0.7344000 8.981000 1.153000  8.513000 0.9104000 0.4678000      1.469000  
1 1 1 23 34 15 o 16.63000 0.4350000 16.39000 0.5788000 16.86000 0.6496000 -0.4681000     0.8700000 
1 1 1 23 34 17 o 14.74000 0.4856000 14.24000 0.7772000 15.24000 0.5826000 -1.002000      0.9713000 
1 1 1 23 34 19 o 17.60000 0.4166000 17.15000 0.5811000 18.04000 0.5971000 -0.8870000     0.8332000 
1 1 1 23 34 21 o 15.65000 0.4367000 15.76000 0.6026000 15.55000 0.6322000 0.2033000      0.8734000 
1 1 1 23 34 23 o 8.183000 0.6498000 9.285000 0.8621000 7.080000 0.9724000 2.205000       1.300000  
1 1 1 23 34 25 o 9.140000 0.5887000 9.755000 0.8247000 8.525000 0.8403000 1.230000       1.177000  
1 1 1 23 34 27 o 12.31000 0.5086000 11.83000 0.8009000 12.79000 0.6273000 -0.9622000     1.017000  
1 1 1 23 34 29 o 17.07000 0.3981000 16.90000 0.5498000 17.25000 0.5760000 -0.3498000     0.7963000 
1 1 1 23 34 31 o 12.98000 0.4674000 12.64000 0.6643000 13.32000 0.6576000 -0.6827000     0.9347000 
1 1 1 23 34 33 o 3.442000 0.9554000 3.300000 1.352000  3.585000 1.350000  -0.2853000     1.911000  
1 1 1 23 34 35 o 5.474000 1.167000  5.868000 1.384000  5.079000 1.881000  0.7890000      2.335000  
1 1 1 23 34 37 o 5.600000 1.332000  ?        ?         5.600000 1.332000  ?              ?         
1 1 1 23 34 39 o 9.592000 0.6558000 9.330000 1.009000  9.854000 0.8374000 -0.5241000     1.312000  
1 1 1 23 34 41 o 5.767000 1.079000  6.239000 1.390000  5.295000 1.651000  0.9438000      2.158000  
1 1 1 23 34 43 o 5.706000 1.098000  5.185000 1.825000  6.228000 1.222000  -1.043000      2.196000  
1 1 1 23 34 45 o 4.650000 1.186000  5.645000 1.941000  3.656000 1.365000  1.989000       2.373000  
1 1 1 23 35 0  o 32.89000 0.4696000 32.89000 0.4696000 32.89000 0.4696000 0.000000       0.000000  
1 1 1 23 35 2  o 17.80000 0.3327000 18.19000 0.4488000 17.42000 0.4912000 0.7721000      0.6654000 
1 1 1 23 35 4  o 24.70000 0.5594000 24.35000 0.4422000 25.06000 1.028000  -0.7108000     1.119000  
1 1 1 23 35 6  o 6.641000 1.177000  6.489000 0.9819000 6.792000 2.140000  -0.3039000     2.355000  
1 1 1 23 35 8  o 10.06000 0.6428000 9.404000 0.7185000 10.72000 1.066000  -1.313000      1.286000  
1 1 1 23 35 10 o 14.09000 0.5192000 13.82000 0.8111000 14.36000 0.6483000 -0.5402000     1.038000  
1 1 1 23 35 12 o 29.96000 0.3752000 29.87000 0.5207000 30.05000 0.5403000 -0.1784000     0.7503000 
1 1 1 23 35 14 o 4.421000 1.172000  4.301000 1.658000  4.541000 1.657000  -0.2396000     2.344000  
1 1 1 23 35 16 o 23.55000 0.4036000 22.95000 0.6079000 24.15000 0.5310000 -1.199000      0.8071000 
1 1 1 23 35 18 o 24.35000 0.4309000 24.08000 0.6068000 24.62000 0.6118000 -0.5454000     0.8617000 
1 1 1 23 35 20 o 8.243000 0.6265000 8.054000 0.8635000 8.432000 0.9079000 -0.3789000     1.253000  
1 1 1 23 35 22 o 6.697000 0.8576000 5.783000 1.350000  7.610000 1.058000  -1.827000      1.715000  
1 1 1 23 35 24 o 3.744000 1.004000  3.069000 1.370000  4.419000 1.467000  -1.350000      2.007000  
1 1 1 23 35 26 o 2.792000 0.8622000 2.305000 1.094000  3.279000 1.333000  -0.9741000     1.724000  
1 1 1 23 35 28 o 7.140000 0.7212000 7.518000 0.9426000 6.762000 1.092000  0.7552000      1.442000  
1 1 1 23 35 30 o 10.04000 0.5679000 9.754000 0.7878000 10.33000 0.8183000 -0.5782000     1.136000  
1 1 1 23 35 32 o 3.474000 0.9625000 3.215000 1.313000  3.733000 1.408000  -0.5189000     1.925000  
1 1 1 23 35 34 o 3.195000 0.9318000 3.804000 1.446000  2.587000 1.175000  1.217000       1.864000  
1 1 1 23 35 36 o 12.60000 0.7869000 12.17000 1.423000  13.04000 0.6732000 -0.8634000     1.574000  
1 1 1 23 35 38 o 3.551000 1.010000  3.851000 1.517000  3.252000 1.334000  0.5992000      2.020000  
1 1 1 23 35 40 o 3.302000 0.9939000 2.422000 1.147000  4.182000 1.623000  -1.760000      1.988000  
1 1 1 23 35 42 o 5.209000 1.091000  5.886000 1.744000  4.532000 1.310000  1.355000       2.181000  
1 1 1 23 35 44 o 3.461000 1.066000  3.858000 1.716000  3.065000 1.265000  0.7930000      2.132000  
1 1 1 23 35 46 o 7.925000 1.962000  7.925000 1.962000  ?        ?         ?              ?         
1 1 1 23 36 1  o 8.642000 0.4726000 8.306000 0.7998000 8.978000 0.5039000 -0.6717000     0.9453000 
1 1 1 23 36 3  o 7.074000 0.9518000 7.439000 0.8989000 6.708000 1.678000  0.7305000      1.904000  
1 1 1 23 36 5  o 11.71000 0.4960000 10.87000 0.5520000 12.55000 0.8243000 -1.676000      0.9920000 
1 1 1 23 36 7  o 18.27000 0.4037000 17.41000 0.4307000 19.14000 0.6830000 -1.722000      0.8075000 
1 1 1 23 36 9  o 4.431000 0.9866000 3.948000 1.248000  4.913000 1.528000  -0.9647000     1.973000  
1 1 1 23 36 11 o 7.829000 0.8902000 6.678000 1.414000  8.980000 1.082000  -2.302000      1.780000  
1 1 1 23 36 13 o 10.15000 0.6110000 10.68000 0.9174000 9.612000 0.8072000 1.070000       1.222000  
1 1 1 23 36 15 o 6.864000 0.8428000 7.016000 1.030000  6.711000 1.334000  0.3047000      1.686000  
1 1 1 23 36 17 o 4.895000 1.036000  4.832000 1.388000  4.958000 1.540000  -0.1261000     2.073000  
1 1 1 23 36 19 o 6.177000 1.005000  5.652000 1.500000  6.702000 1.339000  -1.050000      2.010000  
1 1 1 23 36 21 o 4.984000 1.024000  5.631000 1.361000  4.337000 1.531000  1.295000       2.048000  
1 1 1 23 36 23 o 2.854000 0.8987000 2.875000 1.266000  2.834000 1.276000  0.4089000E-01  1.797000  
1 1 1 23 36 25 o 7.754000 0.7503000 7.854000 1.065000  7.654000 1.057000  0.2000000      1.501000  
1 1 1 23 36 27 o 3.955000 0.9889000 4.142000 1.382000  3.769000 1.414000  0.3732000      1.978000  
1 1 1 23 36 29 o 5.783000 0.8698000 7.033000 1.001000  4.534000 1.423000  2.498000       1.740000  
1 1 1 23 36 31 o 6.637000 0.8433000 6.058000 1.164000  7.215000 1.221000  -1.157000      1.687000  
1 1 1 23 36 33 o 10.48000 0.5522000 10.33000 0.7252000 10.63000 0.8328000 -0.3035000     1.104000  
1 1 1 23 36 35 o 5.374000 1.284000  5.970000 2.091000  4.777000 1.491000  1.193000       2.568000  
1 1 1 23 36 37 o 10.35000 0.6863000 10.71000 1.072000  9.997000 0.8576000 0.7155000      1.373000  
1 1 1 23 36 39 o 5.905000 1.038000  7.202000 1.268000  4.607000 1.644000  2.596000       2.077000  
1 1 1 23 36 41 o 4.391000 1.076000  4.694000 1.539000  4.087000 1.504000  0.6073000      2.152000  
1 1 1 23 36 43 o 4.738000 1.161000  4.872000 1.906000  4.603000 1.328000  0.2690000      2.323000  
1 1 1 23 36 45 o 3.559000 1.095000  3.324000 1.563000  3.794000 1.536000  -0.4707000     2.191000  
1 1 1 23 37 0  o 24.03000 0.3685000 24.03000 0.3685000 24.03000 0.3685000 0.000000       0.000000  
1 1 1 23 37 2  o 17.71000 0.2922000 18.22000 0.3999000 17.21000 0.4262000 1.016000       0.5845000 
1 1 1 23 37 4  o 16.93000 0.4479000 16.50000 0.4231000 17.36000 0.7897000 -0.8527000     0.8959000 
1 1 1 23 37 6  o 18.72000 0.4216000 18.58000 0.4481000 18.87000 0.7143000 -0.2904000     0.8432000 
1 1 1 23 37 8  o 3.975000 0.8525000 5.154000 1.086000  2.796000 1.314000  2.358000       1.705000  
1 1 1 23 37 10 o 13.18000 0.5537000 13.87000 0.5464000 12.48000 0.9632000 1.389000       1.107000  
1 1 1 23 37 12 o 9.994000 0.8275000 9.973000 0.6301000 10.01000 1.530000  -0.4105000E-01 1.655000  
1 1 1 23 37 14 o 14.13000 0.6189000 14.37000 0.5572000 13.88000 1.105000  0.4909000      1.238000  
1 1 1 23 37 16 o 16.59000 0.4104000 17.06000 0.5789000 16.11000 0.5820000 0.9481000      0.8208000 
1 1 1 23 37 18 o 8.512000 0.6070000 9.289000 0.7953000 7.735000 0.9172000 1.554000       1.214000  
1 1 1 23 37 20 o 3.347000 0.9480000 2.804000 1.291000  3.891000 1.389000  -1.086000      1.896000  
1 1 1 23 37 22 o 5.910000 0.9487000 6.729000 1.152000  5.091000 1.508000  1.638000       1.897000  
1 1 1 23 37 24 o 10.45000 0.7641000 10.02000 1.093000  10.89000 1.068000  -0.8713000     1.528000  
1 1 1 23 37 26 o 6.488000 0.8466000 6.136000 1.263000  6.840000 1.127000  -0.7036000     1.693000  
1 1 1 23 37 28 o 3.017000 0.8624000 2.195000 1.063000  3.839000 1.359000  -1.644000      1.725000  
1 1 1 23 37 30 f 14.89000 0.5059000 15.58000 0.6079000 14.21000 0.8087000 1.366000       1.012000  
1 1 1 23 37 32 o 4.116000 0.9835000 3.488000 1.359000  4.744000 1.423000  -1.256000      1.967000  
1 1 1 23 37 34 o 6.511000 1.338000  7.219000 2.216000  5.802000 1.499000  1.418000       2.675000  
1 1 1 23 37 36 o 5.447000 1.129000  5.677000 1.755000  5.217000 1.420000  0.4599000      2.257000  
1 1 1 23 37 38 o 3.617000 1.072000  3.634000 1.514000  3.600000 1.517000  0.3453000E-01  2.143000  
1 1 1 23 37 40 o 11.08000 0.6087000 11.33000 0.8082000 10.83000 0.9104000 0.4992000      1.217000  
1 1 1 23 37 42 f 7.690000 1.020000  7.519000 1.855000  7.862000 0.8502000 -0.3421000     2.040000  
1 1 1 23 37 44 o 5.642000 1.362000  5.298000 1.941000  5.986000 1.912000  -0.6884000     2.725000  
1 1 1 23 38 1  o 8.701000 0.4668000 8.161000 0.8120000 9.240000 0.4609000 -1.079000      0.9336000 
1 1 1 23 38 3  o 3.277000 1.012000  2.987000 1.246000  3.567000 1.594000  -0.5804000     2.023000  
1 1 1 23 38 5  o 9.333000 0.7898000 9.455000 0.6507000 9.211000 1.439000  0.2431000      1.580000  
1 1 1 23 38 7  o 3.361000 1.043000  2.660000 1.126000  4.062000 1.755000  -1.402000      2.086000  
1 1 1 23 38 9  o 9.231000 0.8704000 8.940000 0.6279000 9.521000 1.624000  -0.5807000     1.741000  
1 1 1 23 38 11 o 10.83000 0.7914000 10.03000 0.7765000 11.63000 1.379000  -1.602000      1.583000  
1 1 1 23 38 13 o 3.931000 0.9284000 4.701000 1.186000  3.161000 1.429000  1.541000       1.857000  
1 1 1 23 38 15 o 11.29000 0.5395000 11.61000 0.5867000 10.98000 0.9056000 0.6224000      1.079000  
1 1 1 23 38 17 f 5.554000 0.9340000 6.441000 1.038000  4.667000 1.553000  1.774000       1.868000  
1 1 1 23 38 19 o 13.09000 0.4550000 12.85000 0.6264000 13.33000 0.6601000 -0.4894000     0.9100000 
1 1 1 23 38 21 o 5.481000 0.8852000 6.569000 1.173000  4.393000 1.326000  2.175000       1.770000  
1 1 1 23 38 23 o 4.132000 1.044000  4.316000 1.474000  3.948000 1.480000  0.3685000      2.089000  
1 1 1 23 38 25 o 15.41000 0.5027000 15.73000 0.7540000 15.08000 0.6651000 0.6575000      1.005000  
1 1 1 23 38 27 o 7.751000 0.9142000 7.964000 1.119000  7.538000 1.446000  0.4262000      1.828000  
1 1 1 23 38 29 o 13.27000 0.8434000 13.27000 0.8434000 ?        ?         ?              ?         
1 1 1 23 38 31 o 7.621000 0.8400000 7.456000 1.219000  7.787000 1.156000  -0.3304000     1.680000  
1 1 1 23 38 33 o 7.747000 0.8369000 7.477000 1.218000  8.018000 1.148000  -0.5405000     1.674000  
1 1 1 23 38 35 o 2.901000 0.9059000 3.152000 1.350000  2.651000 1.208000  0.5009000      1.812000  
1 1 1 23 38 37 o 9.873000 0.7087000 9.807000 0.9572000 9.939000 1.045000  -0.1321000     1.417000  
1 1 1 23 38 39 f 13.29000 0.5135000 13.58000 0.7141000 12.99000 0.7382000 0.5840000      1.027000  
1 1 1 23 38 41 o 8.343000 0.7296000 9.110000 0.9744000 7.575000 1.086000  1.535000       1.459000  
1 1 1 23 38 43 o 5.248000 1.241000  5.290000 1.853000  5.206000 1.653000  0.8394000E-01  2.483000  
1 1 1 23 39 0  o 9.123000 0.5119000 9.123000 0.5119000 9.123000 0.5119000 0.000000       0.000000  
1 1 1 23 39 2  o 8.544000 0.3206000 9.322000 0.5396000 7.767000 0.3464000 1.555000       0.6412000 
1 1 1 23 39 4  o 6.716000 0.9645000 5.880000 0.9217000 7.551000 1.694000  -1.671000      1.929000  
1 1 1 23 39 6  o 4.561000 0.9031000 5.554000 1.002000  3.568000 1.502000  1.987000       1.806000  
1 1 1 23 39 8  o 3.870000 1.007000  3.146000 1.190000  4.593000 1.624000  -1.447000      2.013000  
1 1 1 23 39 10 o 12.40000 0.5667000 13.01000 0.5769000 11.79000 0.9756000 1.217000       1.133000  
1 1 1 23 39 12 o 11.02000 0.6083000 10.26000 0.6026000 11.78000 1.057000  -1.517000      1.217000  
1 1 1 23 39 14 o 15.79000 0.4383000 15.79000 0.4383000 ?        ?         ?              ?         
1 1 1 23 39 16 o 24.75000 0.4028000 24.78000 0.4288000 24.71000 0.6821000 0.7037000E-01  0.8057000 
1 1 1 23 39 18 o 8.566000 0.6580000 8.483000 0.6875000 8.649000 1.122000  -0.1662000     1.316000  
1 1 1 23 39 20 o 4.556000 1.005000  4.161000 1.223000  4.950000 1.595000  -0.7895000     2.010000  
1 1 1 23 39 22 o 5.799000 0.9886000 5.868000 1.222000  5.731000 1.554000  0.1363000      1.977000  
1 1 1 23 39 24 o 12.07000 0.5317000 12.86000 0.7227000 11.28000 0.7800000 1.585000       1.063000  
1 1 1 23 39 26 o 8.561000 0.6778000 9.458000 0.9361000 7.664000 0.9805000 1.794000       1.356000  
1 1 1 23 39 28 o 5.727000 1.018000  5.280000 1.407000  6.173000 1.471000  -0.8936000     2.035000  
1 1 1 23 39 30 o 8.103000 0.8403000 9.657000 1.115000  6.549000 1.257000  3.109000       1.681000  
1 1 1 23 39 32 o 4.057000 1.035000  3.856000 1.511000  4.259000 1.414000  -0.4031000     2.070000  
1 1 1 23 39 34 o 10.70000 0.6530000 10.55000 0.8034000 10.85000 1.030000  -0.2998000     1.306000  
1 1 1 23 39 36 o 4.257000 1.121000  5.182000 1.646000  3.332000 1.523000  1.850000       2.243000  
1 1 1 23 39 38 o 8.124000 0.8644000 8.185000 1.315000  8.063000 1.122000  0.1217000      1.729000  
1 1 1 23 39 40 o 4.792000 1.030000  4.915000 1.438000  4.668000 1.475000  0.2477000      2.060000  
1 1 1 23 39 42 o 4.988000 1.929000  4.988000 1.929000  ?        ?         ?              ?         
1 1 1 23 40 1  o 9.803000 0.3816000 9.812000 0.6250000 9.794000 0.4379000 0.1806000E-01  0.7632000 
1 1 1 23 40 3  o 16.26000 0.4674000 16.96000 0.4854000 15.55000 0.7989000 1.415000       0.9348000 
1 1 1 23 40 5  o 11.84000 0.5637000 12.23000 0.4934000 11.45000 1.014000  0.7819000      1.127000  
1 1 1 23 40 7  o 7.435000 0.7956000 6.465000 0.8520000 8.405000 1.344000  -1.940000      1.591000  
1 1 1 23 40 9  o 8.914000 0.7151000 8.395000 0.6822000 9.434000 1.257000  -1.039000      1.430000  
1 1 1 23 40 11 o 8.972000 0.9526000 9.332000 0.6612000 8.613000 1.787000  0.7190000      1.905000  
1 1 1 23 40 13 o 13.79000 0.5245000 14.92000 0.6633000 12.67000 0.8126000 2.245000       1.049000  
1 1 1 23 40 15 o 8.744000 0.7351000 8.610000 0.7778000 8.878000 1.248000  -0.2682000     1.470000  
1 1 1 23 40 17 o 7.515000 0.8468000 8.085000 0.7627000 6.945000 1.512000  1.140000       1.694000  
1 1 1 23 40 19 o 5.822000 0.8886000 6.271000 0.9331000 5.373000 1.512000  0.8976000      1.777000  
1 1 1 23 40 21 o 6.686000 0.9010000 7.074000 0.8855000 6.298000 1.569000  0.7758000      1.802000  
1 1 1 23 40 23 o 4.537000 0.9851000 4.349000 1.279000  4.725000 1.499000  -0.3763000     1.970000  
1 1 1 23 40 25 o 5.421000 1.145000  6.237000 0.9686000 4.604000 2.074000  1.633000       2.289000  
1 1 1 23 40 27 o 4.950000 1.050000  4.605000 1.441000  5.294000 1.529000  -0.6890000     2.101000  
1 1 1 23 40 29 o 7.705000 0.9165000 8.637000 1.220000  6.774000 1.368000  1.863000       1.833000  
1 1 1 23 40 31 o 5.203000 1.099000  5.773000 1.683000  4.632000 1.413000  1.141000       2.197000  
1 1 1 23 40 33 o 7.985000 0.7340000 7.947000 0.9403000 8.023000 1.127000  -0.7615000E-01 1.468000  
1 1 1 23 40 35 o 7.233000 0.9359000 7.692000 1.088000  6.773000 1.523000  0.9192000      1.872000  
1 1 1 23 40 37 o 5.012000 1.054000  5.170000 1.473000  4.853000 1.507000  0.3170000      2.107000  
1 1 1 23 40 39 f 8.825000 0.7239000 8.992000 1.024000  8.658000 1.023000  0.3334000      1.448000  
1 1 1 23 40 41 o 4.003000 1.895000  4.003000 1.895000  ?        ?         ?              ?         
1 1 1 23 41 0  o 13.01000 0.3921000 13.01000 0.3921000 13.01000 0.3921000 0.000000       0.000000  
1 1 1 23 41 2  o 4.398000 0.9403000 4.361000 1.037000  4.436000 1.569000  -0.7475000E-01 1.881000  
1 1 1 23 41 4  o 9.994000 0.5860000 9.829000 0.5537000 10.16000 1.033000  -0.3297000     1.172000  
1 1 1 23 41 6  o 14.85000 0.4690000 13.98000 0.4757000 15.71000 0.8084000 -1.734000      0.9379000 
1 1 1 23 41 8  o 20.73000 0.5472000 19.51000 0.4255000 21.95000 1.008000  -2.441000      1.094000  
1 1 1 23 41 10 o 13.49000 0.5911000 13.39000 0.7682000 13.59000 0.8986000 -0.1906000     1.182000  
1 1 1 23 41 12 o 3.898000 1.038000  3.337000 1.222000  4.460000 1.677000  -1.123000      2.075000  
1 1 1 23 41 14 o 4.296000 1.001000  4.563000 1.254000  4.028000 1.561000  0.5355000      2.002000  
1 1 1 23 41 16 o 11.16000 0.5688000 11.42000 0.6051000 10.90000 0.9633000 0.5219000      1.138000  
1 1 1 23 41 18 o 5.643000 0.9558000 4.682000 1.199000  6.605000 1.489000  -1.924000      1.912000  
1 1 1 23 41 20 o 6.118000 0.9296000 5.376000 1.253000  6.860000 1.374000  -1.484000      1.859000  
1 1 1 23 41 22 o 4.838000 1.029000  4.137000 1.347000  5.538000 1.556000  -1.400000      2.058000  
1 1 1 23 41 24 o 9.648000 0.8904000 10.06000 0.7746000 9.240000 1.604000  0.8149000      1.781000  
1 1 1 23 41 26 o 4.492000 1.057000  4.697000 1.244000  4.287000 1.709000  0.4099000      2.113000  
1 1 1 23 41 28 o 3.244000 0.9407000 3.784000 1.402000  2.704000 1.255000  1.080000       1.881000  
1 1 1 23 41 30 o 7.448000 0.9241000 7.554000 1.426000  7.343000 1.176000  0.2108000      1.848000  
1 1 1 23 41 32 o 4.866000 1.036000  5.581000 1.465000  4.150000 1.466000  1.431000       2.073000  
1 1 1 23 41 34 o 3.876000 1.058000  3.971000 1.412000  3.781000 1.576000  0.1899000      2.116000  
1 1 1 23 41 36 o 2.960000 0.9229000 2.882000 1.290000  3.038000 1.320000  -0.1561000     1.846000  
1 1 1 23 41 38 f 5.688000 0.9932000 4.673000 1.600000  6.703000 1.177000  -2.031000      1.986000  
1 1 1 23 42 1  o 2.522000 0.6847000 2.285000 0.9830000 2.759000 0.9534000 -0.4739000     1.369000  
1 1 1 23 42 3  o 4.126000 1.027000  3.759000 1.231000  4.494000 1.645000  -0.7344000     2.055000  
1 1 1 23 42 5  o 6.621000 0.8961000 7.838000 0.6754000 5.404000 1.660000  2.434000       1.792000  
1 1 1 23 42 7  o 5.771000 0.9323000 6.185000 0.9605000 5.356000 1.598000  0.8290000      1.865000  
1 1 1 23 42 9  f 14.64000 0.4598000 14.62000 0.4942000 14.65000 0.7754000 -0.3470000E-01 0.9195000 
1 1 1 23 42 11 f 5.716000 0.9634000 6.399000 0.8535000 5.034000 1.728000  1.365000       1.927000  
1 1 1 23 42 13 f 7.249000 0.9082000 8.484000 0.7009000 6.014000 1.676000  2.470000       1.816000  
1 1 1 23 42 15 o 22.53000 0.4061000 22.60000 0.4410000 22.47000 0.6821000 0.1354000      0.8122000 
1 1 1 23 42 17 o 6.358000 0.8895000 6.305000 0.9957000 6.410000 1.474000  -0.1046000     1.779000  
1 1 1 23 42 19 o 11.46000 0.5821000 11.54000 0.6352000 11.37000 0.9757000 0.1672000      1.164000  
1 1 1 23 42 21 o 5.668000 1.139000  5.568000 1.327000  5.768000 1.852000  -0.1993000     2.278000  
1 1 1 23 42 23 o 5.025000 1.041000  4.617000 1.372000  5.433000 1.566000  -0.8162000     2.082000  
1 1 1 23 42 25 o 15.15000 0.5070000 14.47000 0.6445000 15.82000 0.7828000 -1.345000      1.014000  
1 1 1 23 42 27 o 6.704000 0.8827000 7.045000 0.9035000 6.363000 1.517000  0.6818000      1.765000  
1 1 1 23 42 29 o 6.241000 0.9559000 7.017000 1.079000  5.465000 1.578000  1.552000       1.912000  
1 1 1 23 42 31 o 5.494000 1.028000  6.219000 1.210000  4.769000 1.663000  1.450000       2.057000  
1 1 1 23 42 33 o 4.056000 1.123000  3.654000 1.306000  4.458000 1.828000  -0.8047000     2.247000  
1 1 1 23 42 35 o 4.503000 1.083000  4.815000 1.405000  4.192000 1.648000  0.6236000      2.166000  
1 1 1 23 42 37 o 9.460000 0.7208000 9.319000 1.071000  9.601000 0.9648000 -0.2825000     1.442000  
1 1 1 23 43 0  o 7.155000 0.5712000 7.155000 0.5712000 7.155000 0.5712000 0.000000       0.000000  
1 1 1 23 43 2  o 6.663000 0.6901000 6.188000 0.7112000 7.139000 1.183000  -0.9508000     1.380000  
1 1 1 23 43 4  o 5.130000 1.033000  5.251000 0.9658000 5.010000 1.826000  0.2408000      2.066000  
1 1 1 23 43 6  o 10.28000 0.5953000 10.71000 0.6504000 9.840000 0.9973000 0.8706000      1.191000  
1 1 1 23 43 8  o 17.66000 0.4897000 17.25000 0.4384000 18.07000 0.8758000 -0.8176000     0.9794000 
1 1 1 23 43 10 o 16.32000 0.5259000 16.46000 0.5692000 16.18000 0.8844000 0.2805000      1.052000  
1 1 1 23 43 12 o 5.264000 0.9330000 6.214000 0.9046000 4.314000 1.632000  1.900000       1.866000  
1 1 1 23 43 14 o 16.97000 0.4392000 17.34000 0.4713000 16.59000 0.7413000 0.7510000      0.8785000 
1 1 1 23 43 16 o 9.537000 0.6820000 9.837000 0.6398000 9.236000 1.205000  0.6015000      1.364000  
1 1 1 23 43 18 o 4.838000 0.9307000 4.330000 1.227000  5.346000 1.400000  -1.016000      1.861000  
1 1 1 23 43 20 f 4.258000 1.209000  2.897000 1.212000  5.619000 2.092000  -2.722000      2.418000  
1 1 1 23 43 22 o 3.799000 0.9825000 3.496000 1.318000  4.101000 1.457000  -0.6053000     1.965000  
1 1 1 23 43 24 o 7.522000 0.9466000 8.009000 1.150000  7.034000 1.504000  0.9742000      1.893000  
1 1 1 23 43 26 o 10.17000 0.6020000 10.09000 0.8192000 10.25000 0.8823000 -0.1596000     1.204000  
1 1 1 23 43 28 o 3.467000 0.9971000 3.450000 1.306000  3.484000 1.507000  -0.3404000E-01 1.994000  
1 1 1 23 43 30 f 6.264000 1.013000  6.430000 1.096000  6.098000 1.705000  0.3313000      2.027000  
1 1 1 23 43 32 o 4.777000 1.151000  4.880000 1.341000  4.674000 1.871000  0.2063000      2.302000  
1 1 1 23 43 34 o 4.145000 1.085000  3.371000 1.348000  4.919000 1.702000  -1.547000      2.171000  
1 1 1 23 43 36 o 4.081000 1.060000  3.744000 1.317000  4.419000 1.660000  -0.6744000     2.119000  
1 1 1 23 44 1  o 5.512000 0.5918000 6.099000 0.7779000 4.925000 0.8921000 1.175000       1.184000  
1 1 1 23 44 3  o 3.380000 0.9273000 3.153000 1.114000  3.606000 1.482000  -0.4525000     1.855000  
1 1 1 23 44 5  o 3.373000 0.9482000 2.983000 1.151000  3.763000 1.507000  -0.7797000     1.896000  
1 1 1 23 44 7  o 4.194000 1.004000  3.822000 1.146000  4.567000 1.648000  -0.7450000     2.007000  
1 1 1 23 44 9  o 7.001000 0.8498000 6.219000 0.7586000 7.783000 1.521000  -1.564000      1.700000  
1 1 1 23 44 11 o 6.479000 0.9706000 5.957000 0.9985000 7.001000 1.665000  -1.044000      1.941000  
1 1 1 23 44 13 o 4.640000 1.020000  4.176000 1.281000  5.105000 1.588000  -0.9292000     2.040000  
1 1 1 23 44 15 o 4.549000 1.048000  4.250000 1.287000  4.849000 1.654000  -0.5993000     2.096000  
1 1 1 23 44 17 o 10.92000 0.9201000 11.40000 0.6878000 10.43000 1.707000  0.9738000      1.840000  
1 1 1 23 44 19 o 9.424000 0.6277000 8.969000 0.7363000 9.880000 1.017000  -0.9105000     1.255000  
1 1 1 23 44 21 o 5.042000 1.003000  5.039000 1.236000  5.046000 1.579000  -0.6226000E-02 2.005000  
1 1 1 23 44 23 o 9.473000 0.7342000 9.715000 0.9834000 9.231000 1.090000  0.4839000      1.468000  
1 1 1 23 44 25 o 9.373000 0.7325000 7.452000 1.139000  11.29000 0.9209000 -3.842000      1.465000  
1 1 1 23 44 27 o 4.391000 1.036000  4.019000 1.383000  4.763000 1.542000  -0.7447000     2.071000  
1 1 1 23 44 29 o 3.955000 1.025000  4.063000 1.318000  3.848000 1.571000  0.2145000      2.051000  
1 1 1 23 44 31 o 11.54000 0.8441000 12.19000 0.7562000 10.88000 1.509000  1.311000       1.688000  
1 1 1 23 44 33 o 4.317000 1.037000  5.018000 1.327000  3.617000 1.592000  1.401000       2.073000  
1 1 1 23 44 35 o 3.272000 0.9699000 3.294000 1.254000  3.251000 1.480000  0.4260000E-01  1.940000  
1 1 1 23 45 0  o 13.19000 0.4244000 13.19000 0.4244000 13.19000 0.4244000 0.000000       0.000000  
1 1 1 23 45 2  o 4.565000 0.8926000 4.896000 0.9878000 4.233000 1.487000  0.6638000      1.785000  
1 1 1 23 45 4  o 4.934000 0.9805000 4.678000 1.066000  5.189000 1.646000  -0.5108000     1.961000  
1 1 1 23 45 6  o 4.843000 1.002000  4.218000 1.179000  5.467000 1.621000  -1.250000      2.005000  
1 1 1 23 45 8  o 3.144000 0.9500000 2.988000 1.172000  3.300000 1.496000  -0.3116000     1.900000  
1 1 1 23 45 10 o 13.24000 0.5282000 13.20000 0.5140000 13.27000 0.9229000 -0.7246000E-01 1.056000  
1 1 1 23 45 12 o 6.636000 0.9262000 6.458000 1.004000  6.814000 1.557000  -0.3561000     1.852000  
1 1 1 23 45 14 f 9.880000 1.092000  11.83000 0.5751000 7.931000 2.107000  3.897000       2.184000  
1 1 1 23 45 16 o 13.93000 0.4865000 13.67000 0.5585000 14.20000 0.7968000 -0.5254000     0.9731000 
1 1 1 23 45 18 o 14.10000 0.5374000 14.24000 0.5512000 13.96000 0.9228000 0.2735000      1.075000  
1 1 1 23 45 20 o 10.51000 0.6437000 10.30000 0.9166000 10.73000 0.9039000 -0.4302000     1.287000  
1 1 1 23 45 22 o 4.206000 1.095000  4.270000 1.431000  4.142000 1.658000  0.1286000      2.190000  
1 1 1 23 45 24 o 5.942000 0.9324000 6.483000 1.169000  5.401000 1.453000  1.082000       1.865000  
1 1 1 23 45 26 f 4.117000 1.007000  4.374000 1.341000  3.860000 1.502000  0.5137000      2.014000  
1 1 1 23 45 28 o 4.196000 1.177000  3.653000 1.344000  4.739000 1.932000  -1.086000      2.354000  
1 1 1 23 45 30 o 4.029000 1.065000  3.718000 1.343000  4.340000 1.652000  -0.6222000     2.129000  
1 1 1 23 45 32 o 7.024000 0.9828000 7.737000 0.8162000 6.312000 1.788000  1.425000       1.966000  
1 1 1 23 45 34 o 6.646000 1.197000  7.390000 0.9747000 5.902000 2.187000  1.488000       2.394000  
1 1 1 23 46 1  o 3.558000 0.9130000 2.665000 1.014000  4.451000 1.518000  -1.785000      1.826000  
1 1 1 23 46 3  o 4.916000 1.089000  3.571000 1.094000  6.262000 1.883000  -2.691000      2.178000  
1 1 1 23 46 5  o 5.220000 0.9514000 4.701000 1.116000  5.740000 1.541000  -1.039000      1.903000  
1 1 1 23 46 7  o 5.428000 0.9379000 4.198000 1.152000  6.658000 1.481000  -2.459000      1.876000  
1 1 1 23 46 9  o 4.306000 1.050000  4.851000 1.343000  3.761000 1.616000  1.090000       2.101000  
1 1 1 23 46 11 o 6.155000 1.060000  6.435000 0.9523000 5.875000 1.894000  0.5603000      2.120000  
1 1 1 23 46 13 o 6.217000 1.211000  5.815000 1.147000  6.619000 2.134000  -0.8041000     2.423000  
1 1 1 23 46 15 o 13.45000 0.5111000 14.02000 0.5536000 12.88000 0.8593000 1.141000       1.022000  
1 1 1 23 46 17 o 5.149000 1.029000  5.283000 1.285000  5.014000 1.608000  0.2690000      2.058000  
1 1 1 23 46 19 o 8.824000 0.7266000 8.242000 0.9754000 9.405000 1.077000  -1.162000      1.453000  
1 1 1 23 46 21 o 4.375000 1.044000  5.053000 1.437000  3.697000 1.516000  1.356000       2.089000  
1 1 1 23 46 23 o 4.492000 0.9361000 5.560000 1.141000  3.424000 1.484000  2.136000       1.872000  
1 1 1 23 46 25 o 3.205000 0.9096000 3.530000 1.273000  2.879000 1.300000  0.6501000      1.819000  
1 1 1 23 46 27 o 4.167000 1.126000  4.155000 1.333000  4.179000 1.815000  -0.2374000E-01 2.252000  
1 1 1 23 46 29 o 3.759000 1.055000  2.492000 1.143000  5.027000 1.774000  -2.535000      2.110000  
1 1 1 23 46 31 o 3.068000 0.9417000 2.949000 1.212000  3.187000 1.442000  -0.2380000     1.883000  
1 1 1 23 46 33 o 5.195000 1.926000  ?        ?         5.195000 1.926000  ?              ?         
1 1 1 23 47 0  o 4.430000 1.070000  4.430000 1.070000  4.430000 1.070000  0.000000       0.000000  
1 1 1 23 47 2  f 5.967000 1.075000  5.775000 1.403000  6.159000 1.630000  -0.3846000     2.150000  
1 1 1 23 47 4  o 6.087000 0.8883000 7.512000 0.6598000 4.661000 1.650000  2.851000       1.777000  
1 1 1 23 47 6  o 7.785000 1.101000  8.316000 0.6584000 7.255000 2.100000  1.060000       2.201000  
1 1 1 23 47 8  o 3.985000 1.130000  3.021000 1.194000  4.948000 1.919000  -1.927000      2.260000  
1 1 1 23 47 10 o 6.879000 1.185000  7.610000 0.7342000 6.149000 2.253000  1.461000       2.370000  
1 1 1 23 47 12 f 5.577000 0.9935000 4.069000 1.204000  7.085000 1.580000  -3.016000      1.987000  
1 1 1 23 47 14 o 5.867000 0.9277000 6.481000 1.057000  5.253000 1.525000  1.229000       1.855000  
1 1 1 23 47 16 o 12.18000 0.6744000 12.74000 0.8267000 11.62000 1.066000  1.113000       1.349000  
1 1 1 23 47 18 o 7.880000 0.7563000 7.542000 1.000000  8.218000 1.135000  -0.6762000     1.513000  
1 1 1 23 47 20 o 3.639000 0.9682000 4.041000 1.258000  3.236000 1.472000  0.8046000      1.936000  
1 1 1 23 47 22 o 4.856000 1.027000  4.274000 1.375000  5.439000 1.526000  -1.165000      2.055000  
1 1 1 23 47 24 o 3.689000 1.017000  4.011000 1.338000  3.367000 1.531000  0.6438000      2.033000  
1 1 1 23 47 26 o 8.474000 0.8185000 8.352000 0.7830000 8.595000 1.437000  -0.2430000     1.637000  
1 1 1 23 47 28 o 4.829000 1.026000  5.146000 1.170000  4.512000 1.685000  0.6347000      2.051000  
1 1 1 23 47 30 o 3.625000 1.042000  2.695000 1.248000  4.554000 1.670000  -1.859000      2.085000  
1 1 1 23 48 1  o 4.454000 1.233000  3.829000 1.347000  5.078000 2.066000  -1.248000      2.466000  
1 1 1 23 48 3  o 3.276000 1.008000  2.786000 1.131000  3.767000 1.669000  -0.9812000     2.017000  
1 1 1 23 48 5  o 5.257000 1.040000  5.534000 0.7554000 4.980000 1.938000  0.5541000      2.080000  
1 1 1 23 48 7  o 5.258000 0.8793000 5.603000 0.7732000 4.912000 1.580000  0.6919000      1.759000  
1 1 1 23 48 9  o 6.279000 1.070000  7.404000 0.9326000 5.155000 1.925000  2.249000       2.139000  
1 1 1 23 48 11 o 9.371000 0.8679000 9.400000 1.068000  9.342000 1.368000  0.5745000E-01  1.736000  
1 1 1 23 48 13 o 2.775000 0.9059000 2.364000 1.115000  3.186000 1.428000  -0.8217000     1.812000  
1 1 1 23 48 15 o 5.425000 1.048000  5.105000 1.278000  5.745000 1.662000  -0.6401000     2.097000  
1 1 1 23 48 17 f 6.711000 0.8838000 6.816000 0.9686000 6.606000 1.479000  0.2106000      1.768000  
1 1 1 23 48 19 o 4.085000 1.042000  4.562000 1.420000  3.608000 1.526000  0.9539000      2.085000  
1 1 1 23 48 21 o 4.468000 1.133000  3.012000 1.196000  5.924000 1.924000  -2.912000      2.266000  
1 1 1 23 48 23 o 4.344000 1.093000  4.360000 1.323000  4.328000 1.740000  0.3239000E-01  2.186000  
1 1 1 23 48 25 o 3.472000 1.043000  3.009000 1.257000  3.935000 1.665000  -0.9257000     2.086000  
1 1 1 23 48 27 o 4.399000 1.066000  2.924000 1.214000  5.873000 1.752000  -2.950000      2.132000  
1 1 1 23 48 29 o 7.223000 1.271000  7.779000 1.540000  6.667000 2.023000  1.112000       2.542000  
1 1 1 23 49 0  o 5.262000 1.611000  5.262000 1.611000  5.262000 1.611000  0.000000       0.000000  
1 1 1 23 49 2  o 7.299000 1.213000  6.343000 1.988000  8.256000 1.391000  -1.913000      2.426000  
1 1 1 23 49 4  o 3.686000 0.9925000 3.611000 1.214000  3.762000 1.570000  -0.1508000     1.985000  
1 1 1 23 49 6  o 5.132000 0.9249000 4.200000 1.232000  6.063000 1.380000  -1.863000      1.850000  
1 1 1 23 49 8  o 5.210000 1.240000  5.190000 1.815000  5.229000 1.689000  -0.3962000E-01 2.479000  
1 1 1 23 49 10 o 4.859000 0.9942000 5.557000 1.128000  4.162000 1.637000  1.396000       1.988000  
1 1 1 23 49 12 o 3.857000 1.122000  3.337000 1.213000  4.377000 1.889000  -1.040000      2.245000  
1 1 1 23 49 14 o 4.811000 1.073000  4.145000 1.241000  5.478000 1.750000  -1.333000      2.146000  
1 1 1 23 49 16 o 7.970000 0.6881000 7.638000 0.7701000 8.302000 1.141000  -0.6642000     1.376000  
1 1 1 23 49 18 o 9.537000 0.8488000 8.068000 0.7700000 11.01000 1.513000  -2.937000      1.698000  
1 1 1 23 49 20 o 6.635000 1.109000  6.053000 1.046000  7.218000 1.955000  -1.165000      2.217000  
1 1 1 23 49 22 o 3.387000 1.007000  2.850000 1.182000  3.925000 1.629000  -1.076000      2.013000  
1 1 1 23 49 24 o 3.724000 1.019000  3.784000 1.274000  3.664000 1.592000  0.1206000      2.039000  
1 1 1 23 49 26 o 4.132000 1.087000  3.778000 1.361000  4.487000 1.696000  -0.7091000     2.174000  
1 1 1 23 50 1  o 4.357000 1.138000  4.768000 1.651000  3.946000 1.566000  0.8213000      2.276000  
1 1 1 23 50 3  o 4.295000 1.171000  4.163000 1.789000  4.428000 1.510000  -0.2650000     2.341000  
1 1 1 23 50 5  o 4.012000 1.082000  4.225000 1.493000  3.799000 1.567000  0.4258000      2.165000  
1 1 1 23 50 7  o 6.875000 0.9584000 7.531000 1.034000  6.219000 1.614000  1.312000       1.917000  
1 1 1 23 50 9  o 5.257000 0.9093000 6.196000 0.9195000 4.318000 1.569000  1.878000       1.819000  
1 1 1 23 50 11 o 3.576000 1.001000  3.311000 1.263000  3.840000 1.553000  -0.5286000     2.002000  
1 1 1 23 50 13 o 5.292000 1.075000  5.908000 0.9830000 4.676000 1.912000  1.231000       2.150000  
1 1 1 23 50 15 o 4.950000 1.172000  4.950000 1.172000  ?        ?         ?              ?         
1 1 1 23 50 17 o 4.951000 1.171000  4.496000 1.239000  5.406000 1.986000  -0.9109000     2.341000  
1 1 1 23 50 19 o 7.666000 0.9595000 8.577000 0.7424000 6.755000 1.770000  1.822000       1.919000  
1 1 1 23 50 21 o 4.300000 1.056000  3.180000 1.277000  5.420000 1.681000  -2.240000      2.111000  
1 1 1 23 50 23 o 7.478000 0.9196000 6.085000 1.062000  8.871000 1.502000  -2.786000      1.839000  
1 1 1 23 50 25 o 8.581000 2.037000  8.581000 2.037000  ?        ?         ?              ?         
1 1 1 23 51 0  o 5.673000 1.810000  5.673000 1.810000  5.673000 1.810000  0.000000       0.000000  
1 1 1 23 51 2  o 7.052000 1.068000  6.295000 1.569000  7.809000 1.450000  -1.514000      2.136000  
1 1 1 23 51 4  o 12.81000 0.8253000 11.48000 1.063000  14.14000 1.262000  -2.660000      1.651000  
1 1 1 23 51 6  o 8.293000 1.019000  8.282000 0.9563000 8.304000 1.800000  -0.2263000E-01 2.039000  
1 1 1 23 51 8  o 5.725000 1.086000  6.000000 1.227000  5.450000 1.792000  0.5494000      2.172000  
1 1 1 23 51 10 o 3.363000 1.040000  1.908000 0.9214000 4.818000 1.864000  -2.910000      2.080000  
1 1 1 23 51 12 o 3.345000 1.056000  2.169000 1.017000  4.520000 1.851000  -2.351000      2.112000  
1 1 1 23 51 14 o 4.430000 1.020000  4.073000 1.232000  4.788000 1.625000  -0.7151000     2.040000  
1 1 1 23 51 16 o 5.114000 1.047000  5.481000 1.075000  4.747000 1.796000  0.7333000      2.093000  
1 1 1 23 51 18 o 4.891000 1.247000  3.890000 1.446000  5.891000 2.032000  -2.001000      2.494000  
1 1 1 23 51 20 o 4.635000 1.080000  4.331000 1.219000  4.939000 1.784000  -0.6083000     2.161000  
1 1 1 23 51 22 o 8.904000 0.7759000 8.451000 0.8365000 9.357000 1.307000  -0.9058000     1.552000  
1 1 1 23 52 1  o 4.540000 1.122000  5.221000 1.655000  3.858000 1.514000  1.363000       2.243000  
1 1 1 23 52 3  o 7.160000 1.121000  6.653000 1.583000  7.667000 1.588000  -1.014000      2.242000  
1 1 1 23 52 5  o 4.121000 1.117000  4.880000 1.636000  3.362000 1.520000  1.518000       2.233000  
1 1 1 23 52 7  o 3.411000 1.033000  3.494000 1.517000  3.328000 1.403000  0.1656000      2.066000  
1 1 1 23 52 9  o 5.573000 1.128000  5.368000 1.422000  5.777000 1.752000  -0.4083000     2.257000  
1 1 1 23 52 11 f 3.253000 0.9602000 2.812000 1.170000  3.694000 1.523000  -0.8820000     1.920000  
1 1 1 23 52 13 o 5.528000 0.9265000 6.900000 0.9249000 4.156000 1.606000  2.744000       1.853000  
1 1 1 23 52 15 o 3.974000 1.026000  4.043000 1.249000  3.904000 1.629000  0.1389000      2.052000  
1 1 1 23 52 17 o 7.037000 0.9332000 5.553000 1.082000  8.521000 1.521000  -2.968000      1.866000  
1 1 1 23 52 19 o 6.138000 0.9619000 5.236000 1.193000  7.039000 1.509000  -1.803000      1.924000  
1 1 1 23 53 0  o 12.06000 0.9451000 12.06000 0.9451000 12.06000 0.9451000 0.000000       0.000000  
1 1 1 23 53 2  o 6.375000 1.077000  7.417000 1.210000  5.332000 1.782000  2.085000       2.154000  
1 1 1 23 53 4  o 4.414000 1.167000  4.845000 1.703000  3.984000 1.598000  0.8609000      2.335000  
1 1 1 23 53 6  o 3.287000 1.013000  3.523000 1.491000  3.050000 1.370000  0.4730000      2.025000  
1 1 1 23 53 8  f 4.260000 1.113000  4.993000 1.637000  3.526000 1.509000  1.467000       2.227000  
1 1 1 23 53 10 f 4.002000 1.128000  4.819000 1.740000  3.184000 1.436000  1.635000       2.256000  
1 1 1 23 53 12 o 4.968000 1.061000  4.378000 1.258000  5.558000 1.709000  -1.179000      2.122000  
1 1 1 23 53 14 o 4.672000 1.064000  4.213000 1.292000  5.130000 1.692000  -0.9164000     2.129000  
1 1 1 23 53 16 o 4.730000 1.231000  3.404000 1.464000  6.057000 1.981000  -2.654000      2.463000  
1 1 1 23 54 1  o 3.914000 1.104000  3.354000 1.485000  4.474000 1.634000  -1.120000      2.208000  
1 1 1 23 54 3  o 3.416000 1.047000  3.520000 1.465000  3.311000 1.496000  0.2095000      2.094000  
1 1 1 23 54 5  o 3.745000 1.036000  2.859000 1.313000  4.631000 1.604000  -1.771000      2.072000  
1 1 1 23 54 7  o 3.980000 1.153000  4.194000 1.663000  3.767000 1.599000  0.4271000      2.307000  
1 1 1 23 54 9  o 3.566000 1.060000  3.641000 1.509000  3.491000 1.489000  0.1505000      2.120000  
1 1 1 23 54 11 f 4.768000 1.284000  4.456000 1.922000  5.079000 1.703000  -0.6229000     2.568000  
1 1 1 23 55 0  o 4.234000 1.846000  4.234000 1.846000  4.234000 1.846000  0.000000       0.000000  
1 1 1 23 55 2  o 5.367000 1.406000  5.813000 2.096000  4.922000 1.873000  0.8915000      2.811000  
1 1 1 24 0  0  o 62.77000 0.9120000 62.77000 0.9120000 62.77000 0.9120000 0.000000       0.000000  
1 1 1 24 0  2  o 38.22000 0.4481000 38.22000 0.4481000 38.22000 0.4481000 0.000000       0.000000  
1 1 1 24 0  4  f 30.83000 0.4718000 30.83000 0.4718000 30.83000 0.4718000 0.000000       0.000000  
1 1 1 24 0  6  o 2.929000 1.248000  2.929000 1.248000  2.929000 1.248000  0.000000       0.000000  
1 1 1 24 0  8  o 46.69000 0.5922000 46.69000 0.5922000 46.69000 0.5922000 0.000000       0.000000  
1 1 1 24 0  10 o 12.24000 0.5792000 12.24000 0.5792000 12.24000 0.5792000 0.000000       0.000000  
1 1 1 24 0  12 o 42.58000 0.4818000 42.58000 0.4818000 42.58000 0.4818000 0.000000       0.000000  
1 1 1 24 0  14 o 15.30000 0.4409000 15.30000 0.4409000 15.30000 0.4409000 0.000000       0.000000  
1 1 1 24 0  16 o 11.70000 0.5194000 11.70000 0.5194000 11.70000 0.5194000 0.000000       0.000000  
1 1 1 24 0  18 o 32.26000 0.4301000 32.26000 0.4301000 32.26000 0.4301000 0.000000       0.000000  
1 1 1 24 0  22 f 33.95000 0.6306000 33.95000 0.6306000 33.95000 0.6306000 0.000000       0.000000  
1 1 1 24 0  24 o 5.993000 1.118000  5.993000 1.118000  5.993000 1.118000  0.000000       0.000000  
1 1 1 24 0  26 o 59.46000 0.7235000 59.46000 0.7235000 59.46000 0.7235000 0.000000       0.000000  
1 1 1 24 0  28 o 59.64000 0.6316000 59.64000 0.6316000 59.64000 0.6316000 0.000000       0.000000  
1 1 1 24 0  30 o 12.08000 0.6502000 12.08000 0.6502000 12.08000 0.6502000 0.000000       0.000000  
1 1 1 24 0  32 o 25.05000 0.4706000 25.05000 0.4706000 25.05000 0.4706000 0.000000       0.000000  
1 1 1 24 0  34 o 3.084000 1.332000  3.084000 1.332000  3.084000 1.332000  0.000000       0.000000  
1 1 1 24 0  36 f 3.561000 1.419000  3.561000 1.419000  3.561000 1.419000  0.000000       0.000000  
1 1 1 24 0  38 o 3.482000 1.311000  3.482000 1.311000  3.482000 1.311000  0.000000       0.000000  
1 1 1 24 0  40 o 2.881000 1.258000  2.881000 1.258000  2.881000 1.258000  0.000000       0.000000  
1 1 1 24 0  42 o 3.426000 1.326000  3.426000 1.326000  3.426000 1.326000  0.000000       0.000000  
1 1 1 24 0  44 o 13.78000 0.5692000 13.78000 0.5692000 13.78000 0.5692000 0.000000       0.000000  
1 1 1 24 0  46 o 8.019000 0.8177000 8.019000 0.8177000 8.019000 0.8177000 0.000000       0.000000  
1 1 1 24 0  48 o 6.653000 1.017000  6.653000 1.017000  6.653000 1.017000  0.000000       0.000000  
1 1 1 24 0  50 o 10.97000 0.6252000 10.97000 0.6252000 10.97000 0.6252000 0.000000       0.000000  
1 1 1 24 0  52 o 2.674000 1.156000  2.674000 1.156000  2.674000 1.156000  0.000000       0.000000  
1 1 1 24 0  54 o 3.549000 1.425000  3.549000 1.425000  3.549000 1.425000  0.000000       0.000000  
1 1 1 24 0  56 o 3.039000 1.292000  3.039000 1.292000  3.039000 1.292000  0.000000       0.000000  
1 1 1 24 0  58 f 2.837000 1.269000  2.837000 1.269000  2.837000 1.269000  0.000000       0.000000  
1 1 1 24 1  1  o 78.42000 0.7161000 77.82000 0.8998000 79.02000 1.114000  -1.209000      1.432000  
1 1 1 24 1  3  o 17.77000 0.3172000 17.33000 0.4580000 18.21000 0.4390000 -0.8802000     0.6344000 
1 1 1 24 1  5  o 31.31000 0.3292000 31.41000 0.4697000 31.20000 0.4615000 0.2044000      0.6585000 
1 1 1 24 1  7  o 32.70000 0.3562000 32.55000 0.5845000 32.85000 0.4074000 -0.3039000     0.7124000 
1 1 1 24 1  9  o 72.67000 0.5595000 72.95000 0.8494000 72.40000 0.7285000 0.5486000      1.119000  
1 1 1 24 1  11 o 20.62000 0.3001000 20.65000 0.4531000 20.59000 0.3937000 0.5475000E-01  0.6002000 
1 1 1 24 1  13 o 8.282000 0.5390000 7.899000 0.8620000 8.666000 0.6475000 -0.7662000     1.078000  
1 1 1 24 1  15 o 15.03000 0.3529000 14.47000 0.5539000 15.59000 0.4374000 -1.118000      0.7057000 
1 1 1 24 1  17 o 14.31000 0.3750000 14.22000 0.5291000 14.41000 0.5317000 -0.1989000     0.7501000 
1 1 1 24 1  19 o 19.07000 0.3267000 18.89000 0.5074000 19.26000 0.4115000 -0.3659000     0.6533000 
1 1 1 24 1  21 o 26.10000 0.2908000 25.76000 0.4117000 26.44000 0.4108000 -0.6795000     0.5816000 
1 1 1 24 1  23 o 27.13000 0.3815000 27.16000 0.4774000 27.10000 0.5952000 0.6439000E-01  0.7630000 
1 1 1 24 1  25 o 67.52000 0.5333000 67.51000 0.8053000 67.53000 0.6993000 -0.2540000E-01 1.067000  
1 1 1 24 1  27 o 25.20000 0.3364000 25.13000 0.5048000 25.27000 0.4448000 -0.1358000     0.6728000 
1 1 1 24 1  29 o 24.65000 0.3219000 24.55000 0.4525000 24.75000 0.4580000 -0.1985000     0.6438000 
1 1 1 24 1  31 o 27.02000 0.3575000 27.21000 0.4629000 26.82000 0.5450000 0.3863000      0.7151000 
1 1 1 24 1  33 o 14.78000 0.4283000 14.75000 0.5976000 14.81000 0.6137000 -0.6053000E-01 0.8566000 
1 1 1 24 1  35 o 35.27000 0.3362000 35.20000 0.4745000 35.35000 0.4764000 -0.1569000     0.6724000 
1 1 1 24 1  37 o 19.83000 0.3953000 20.03000 0.5566000 19.64000 0.5615000 0.3872000      0.7906000 
1 1 1 24 1  39 o 3.248000 0.9006000 2.826000 1.216000  3.671000 1.328000  -0.8447000     1.801000  
1 1 1 24 1  41 o 2.695000 0.8491000 2.529000 1.152000  2.861000 1.248000  -0.3323000     1.698000  
1 1 1 24 1  43 o 11.91000 0.4538000 12.24000 0.6079000 11.59000 0.6740000 0.6498000      0.9076000 
1 1 1 24 1  45 o 3.747000 0.9462000 3.389000 1.307000  4.104000 1.369000  -0.7150000     1.892000  
1 1 1 24 1  47 o 2.517000 0.8060000 2.527000 1.143000  2.506000 1.137000  0.2038000E-01  1.612000  
1 1 1 24 1  49 o 5.156000 0.8777000 5.427000 1.176000  4.886000 1.303000  0.5403000      1.755000  
1 1 1 24 1  51 o 10.07000 0.6069000 9.253000 0.8164000 10.89000 0.8981000 -1.640000      1.214000  
1 1 1 24 1  53 o 5.851000 0.9065000 4.959000 1.411000  6.743000 1.138000  -1.784000      1.813000  
1 1 1 24 1  55 o 5.935000 0.9289000 5.321000 1.423000  6.550000 1.194000  -1.229000      1.858000  
1 1 1 24 1  57 o 4.181000 0.9435000 5.174000 1.355000  3.188000 1.314000  1.986000       1.887000  
1 1 1 24 2  0  o 30.69000 0.5671000 30.69000 0.5671000 30.69000 0.5671000 0.000000       0.000000  
1 1 1 24 2  2  o 38.41000 0.3661000 37.91000 0.5151000 38.91000 0.5203000 -1.002000      0.7322000 
1 1 1 24 2  4  o 36.15000 0.3294000 36.21000 0.4337000 36.08000 0.4960000 0.1271000      0.6589000 
1 1 1 24 2  6  o 36.96000 0.3104000 37.22000 0.4413000 36.71000 0.4365000 0.5150000      0.6207000 
1 1 1 24 2  8  o 22.23000 0.3018000 22.08000 0.4537000 22.38000 0.3980000 -0.3007000     0.6036000 
1 1 1 24 2  10 f 67.42000 0.4844000 67.33000 0.6851000 67.52000 0.6849000 -0.1898000     0.9687000 
1 1 1 24 2  12 o 27.47000 0.2789000 27.77000 0.3961000 27.16000 0.3927000 0.6109000      0.5577000 
1 1 1 24 2  14 o 10.04000 0.5366000 9.837000 0.8939000 10.25000 0.5937000 -0.4110000     1.073000  
1 1 1 24 2  16 o 23.08000 0.3473000 22.67000 0.5681000 23.49000 0.3995000 -0.8207000     0.6945000 
1 1 1 24 2  18 o 5.831000 0.9184000 5.615000 1.570000  6.048000 0.9527000 -0.4327000     1.837000  
1 1 1 24 2  20 o 39.42000 0.3317000 38.77000 0.4650000 40.08000 0.4730000 -1.315000      0.6633000 
1 1 1 24 2  22 o 38.98000 0.3591000 39.05000 0.5430000 38.91000 0.4702000 0.1352000      0.7183000 
1 1 1 24 2  24 f 20.04000 0.3672000 19.72000 0.4991000 20.37000 0.5388000 -0.6509000     0.7345000 
1 1 1 24 2  26 o 58.39000 0.5661000 58.34000 0.7136000 58.43000 0.8790000 -0.9479000E-01 1.132000  
1 1 1 24 2  28 o 14.03000 0.4152000 13.99000 0.5941000 14.07000 0.5801000 -0.8793000E-01 0.8303000 
1 1 1 24 2  30 o 30.59000 0.3234000 30.44000 0.4579000 30.75000 0.4568000 -0.3046000     0.6468000 
1 1 1 24 2  32 o 17.86000 0.3934000 18.11000 0.4713000 17.61000 0.6301000 0.4946000      0.7869000 
1 1 1 24 2  34 o 23.06000 0.3401000 23.19000 0.4777000 22.93000 0.4843000 0.2581000      0.6802000 
1 1 1 24 2  36 f 15.06000 0.4146000 15.06000 0.5806000 15.07000 0.5920000 -0.8236000E-02 0.8292000 
1 1 1 24 2  38 o 6.729000 0.8255000 5.729000 1.269000  7.729000 1.057000  -2.000000      1.651000  
1 1 1 24 2  40 o 12.09000 0.4811000 12.38000 0.6461000 11.79000 0.7129000 0.5941000      0.9621000 
1 1 1 24 2  42 o 12.25000 0.4304000 11.76000 0.6230000 12.75000 0.5941000 -0.9910000     0.8608000 
1 1 1 24 2  44 o 12.82000 0.4188000 13.09000 0.5651000 12.54000 0.6182000 0.5418000      0.8376000 
1 1 1 24 2  46 o 3.414000 0.9316000 3.085000 1.273000  3.743000 1.361000  -0.6578000     1.863000  
1 1 1 24 2  48 o 3.653000 0.9244000 3.599000 1.253000  3.706000 1.359000  -0.1072000     1.849000  
1 1 1 24 2  50 o 4.522000 1.045000  4.723000 1.244000  4.321000 1.679000  0.4016000      2.090000  
1 1 1 24 2  52 o 3.605000 0.9336000 2.802000 1.310000  4.408000 1.331000  -1.606000      1.867000  
1 1 1 24 2  54 o 5.842000 0.8299000 5.404000 1.264000  6.281000 1.076000  -0.8772000     1.660000  
1 1 1 24 2  56 o 3.004000 0.9149000 3.079000 1.308000  2.928000 1.280000  0.1509000      1.830000  
1 1 1 24 2  58 o 5.955000 0.8437000 7.632000 1.034000  4.278000 1.333000  3.354000       1.687000  
1 1 1 24 3  1  o 69.26000 0.6386000 68.97000 0.8033000 69.55000 0.9930000 -0.5872000     1.277000  
1 1 1 24 3  3  o 23.26000 0.3114000 23.74000 0.4394000 22.79000 0.4413000 0.9578000      0.6228000 
1 1 1 24 3  5  o 11.00000 0.3671000 11.25000 0.4949000 10.75000 0.5424000 0.4978000      0.7342000 
1 1 1 24 3  7  o 42.41000 0.3367000 42.57000 0.4767000 42.25000 0.4758000 0.3140000      0.6735000 
1 1 1 24 3  9  o 32.07000 0.3147000 32.08000 0.4765000 32.07000 0.4113000 0.1020000E-01  0.6294000 
1 1 1 24 3  11 o 46.69000 0.4648000 47.54000 0.7293000 45.85000 0.5763000 1.691000       0.9295000 
1 1 1 24 3  13 o 8.477000 0.5038000 7.641000 0.8268000 9.313000 0.5758000 -1.672000      1.008000  
1 1 1 24 3  15 o 42.95000 0.3706000 43.20000 0.5612000 42.70000 0.4843000 0.5010000      0.7413000 
1 1 1 24 3  17 o 44.41000 0.3793000 43.95000 0.5704000 44.87000 0.5002000 -0.9169000     0.7586000 
1 1 1 24 3  19 o 37.38000 0.3490000 37.07000 0.5307000 37.69000 0.4535000 -0.6154000     0.6980000 
1 1 1 24 3  21 o 47.80000 0.4038000 47.61000 0.6096000 48.00000 0.5298000 -0.3890000     0.8076000 
1 1 1 24 3  23 o 24.66000 0.3167000 24.43000 0.4145000 24.88000 0.4789000 -0.4528000     0.6334000 
1 1 1 24 3  25 o 22.72000 0.3862000 22.48000 0.4275000 22.97000 0.6433000 -0.4854000     0.7724000 
1 1 1 24 3  27 o 27.01000 0.3589000 26.99000 0.5043000 27.04000 0.5108000 -0.5430000E-01 0.7178000 
1 1 1 24 3  29 o 19.89000 0.3653000 19.56000 0.4863000 20.23000 0.5453000 -0.6664000     0.7307000 
1 1 1 24 3  31 o 37.03000 0.3588000 36.81000 0.4347000 37.24000 0.5709000 -0.4340000     0.7175000 
1 1 1 24 3  33 o 30.38000 0.3420000 30.14000 0.4093000 30.62000 0.5481000 -0.4792000     0.6841000 
1 1 1 24 3  35 o 14.08000 0.4315000 14.10000 0.6180000 14.06000 0.6024000 0.4169000E-01  0.8630000 
1 1 1 24 3  37 o 14.90000 0.4341000 14.59000 0.6467000 15.21000 0.5793000 -0.6244000     0.8683000 
1 1 1 24 3  39 o 12.54000 0.4423000 12.51000 0.6189000 12.57000 0.6319000 -0.5839000E-01 0.8845000 
1 1 1 24 3  41 o 5.208000 0.9201000 5.273000 1.318000  5.143000 1.284000  0.1303000      1.840000  
1 1 1 24 3  43 o 5.314000 0.9259000 4.605000 1.487000  6.022000 1.103000  -1.417000      1.852000  
1 1 1 24 3  45 o 7.509000 0.6243000 7.073000 0.9109000 7.944000 0.8538000 -0.8710000     1.249000  
1 1 1 24 3  47 o 8.214000 0.5931000 8.577000 0.8256000 7.852000 0.8516000 0.7251000      1.186000  
1 1 1 24 3  49 o 8.543000 0.7098000 9.361000 0.8356000 7.725000 1.148000  1.636000       1.420000  
1 1 1 24 3  51 o 6.627000 1.006000  5.402000 1.708000  7.852000 1.062000  -2.450000      2.011000  
1 1 1 24 3  53 o 10.97000 0.4842000 10.55000 0.6641000 11.40000 0.7049000 -0.8428000     0.9685000 
1 1 1 24 3  55 o 5.058000 0.9238000 4.812000 1.361000  5.304000 1.250000  -0.4920000     1.848000  
1 1 1 24 3  57 o 4.550000 0.9813000 4.344000 1.399000  4.757000 1.376000  -0.4125000     1.963000  
1 1 1 24 4  0  o 64.37000 0.6576000 64.37000 0.6576000 64.37000 0.6576000 0.000000       0.000000  
1 1 1 24 4  2  o 42.36000 0.3891000 42.37000 0.5466000 42.34000 0.5538000 0.2872000E-01  0.7782000 
1 1 1 24 4  4  o 32.52000 0.3391000 32.61000 0.4738000 32.43000 0.4853000 0.1835000      0.6782000 
1 1 1 24 4  6  o 20.87000 0.2943000 20.65000 0.4425000 21.09000 0.3881000 -0.4386000     0.5886000 
1 1 1 24 4  8  o 36.80000 0.3542000 36.69000 0.4992000 36.92000 0.5026000 -0.2325000     0.7084000 
1 1 1 24 4  10 o 24.66000 0.4050000 24.80000 0.7102000 24.51000 0.3894000 0.2853000      0.8100000 
1 1 1 24 4  12 o 5.765000 0.7174000 6.520000 0.9453000 5.010000 1.079000  1.510000       1.435000  
1 1 1 24 4  14 o 33.50000 0.2997000 33.63000 0.4264000 33.37000 0.4213000 0.2640000      0.5994000 
1 1 1 24 4  16 o 13.77000 0.3283000 14.02000 0.4600000 13.52000 0.4687000 0.4974000      0.6567000 
1 1 1 24 4  18 f 3.630000 0.8485000 2.907000 1.177000  4.353000 1.222000  -1.446000      1.697000  
1 1 1 24 4  20 o 15.11000 0.4001000 14.93000 0.6573000 15.29000 0.4563000 -0.3553000     0.8002000 
1 1 1 24 4  22 o 17.48000 0.3505000 17.14000 0.5347000 17.83000 0.4534000 -0.6882000     0.7010000 
1 1 1 24 4  24 o 50.34000 0.4752000 50.00000 0.5475000 50.68000 0.7770000 -0.6775000     0.9505000 
1 1 1 24 4  26 o 61.15000 0.4542000 61.39000 0.6434000 60.91000 0.6412000 0.4789000      0.9084000 
1 1 1 24 4  28 o 38.72000 0.3958000 38.77000 0.5510000 38.68000 0.5683000 0.8803000E-01  0.7916000 
1 1 1 24 4  30 o 27.65000 0.3985000 27.50000 0.4429000 27.81000 0.6627000 -0.3055000     0.7971000 
1 1 1 24 4  32 o 36.73000 0.4103000 36.29000 0.4280000 37.17000 0.7002000 -0.8704000     0.8206000 
1 1 1 24 4  34 o 28.32000 0.3269000 28.44000 0.4623000 28.20000 0.4622000 0.2443000      0.6537000 
1 1 1 24 4  36 o 37.25000 0.3744000 37.57000 0.5626000 36.92000 0.4941000 0.6485000      0.7488000 
1 1 1 24 4  38 o 9.854000 0.5560000 9.389000 0.7591000 10.32000 0.8127000 -0.9294000     1.112000  
1 1 1 24 4  40 o 7.385000 0.6962000 6.648000 1.049000  8.122000 0.9154000 -1.474000      1.392000  
1 1 1 24 4  42 o 11.54000 0.4413000 12.24000 0.5985000 10.85000 0.6487000 1.391000       0.8827000 
1 1 1 24 4  44 o 8.771000 0.6530000 7.928000 1.089000  9.613000 0.7204000 -1.685000      1.306000  
1 1 1 24 4  46 o 3.851000 0.9581000 3.879000 1.360000  3.824000 1.349000  0.5561000E-01  1.916000  
1 1 1 24 4  48 o 5.734000 0.9286000 6.335000 1.123000  5.133000 1.479000  1.202000       1.857000  
1 1 1 24 4  50 o 4.155000 1.025000  3.597000 1.490000  4.714000 1.408000  -1.117000      2.050000  
1 1 1 24 4  52 o 5.582000 0.9574000 6.469000 1.292000  4.694000 1.413000  1.775000       1.915000  
1 1 1 24 4  54 o 6.584000 0.9297000 7.518000 1.283000  5.650000 1.346000  1.868000       1.859000  
1 1 1 24 4  56 o 4.431000 0.9426000 4.964000 1.299000  3.899000 1.366000  1.065000       1.885000  
1 1 1 24 4  58 o 2.627000 0.8459000 2.748000 1.229000  2.506000 1.163000  0.2424000      1.692000  
1 1 1 24 5  1  o 13.48000 0.3256000 13.59000 0.4462000 13.38000 0.4743000 0.2107000      0.6511000 
1 1 1 24 5  3  o 71.47000 0.5495000 71.94000 0.7229000 70.99000 0.8279000 0.9535000      1.099000  
1 1 1 24 5  5  f 73.21000 0.5618000 73.53000 0.7386000 72.89000 0.8467000 0.6412000      1.124000  
1 1 1 24 5  7  o 25.10000 0.3103000 25.45000 0.4408000 24.76000 0.4369000 0.6824000      0.6207000 
1 1 1 24 5  9  o 29.62000 0.2850000 29.81000 0.4038000 29.43000 0.4022000 0.3884000      0.5699000 
1 1 1 24 5  11 o 31.57000 0.3125000 31.46000 0.4693000 31.69000 0.4128000 -0.2384000     0.6250000 
1 1 1 24 5  13 o 63.20000 0.4588000 62.95000 0.6474000 63.44000 0.6504000 -0.4894000     0.9176000 
1 1 1 24 5  15 o 42.26000 0.3381000 42.13000 0.4787000 42.39000 0.4777000 -0.2650000     0.6763000 
1 1 1 24 5  17 o 32.97000 0.3000000 32.95000 0.4264000 32.98000 0.4223000 -0.2526000E-01 0.6001000 
1 1 1 24 5  19 o 18.17000 0.3201000 18.58000 0.4738000 17.77000 0.4307000 0.8092000      0.6403000 
1 1 1 24 5  21 o 22.05000 0.2903000 22.20000 0.4145000 21.91000 0.4066000 0.2832000      0.5806000 
1 1 1 24 5  23 o 34.50000 0.3479000 34.29000 0.5342000 34.72000 0.4457000 -0.4293000     0.6957000 
1 1 1 24 5  25 o 29.48000 0.3292000 29.26000 0.4309000 29.69000 0.4979000 -0.4281000     0.6584000 
1 1 1 24 5  27 o 32.35000 0.3428000 32.29000 0.5142000 32.41000 0.4535000 -0.1181000     0.6856000 
1 1 1 24 5  29 o 32.86000 0.3574000 32.68000 0.4619000 33.03000 0.5454000 -0.3477000     0.7147000 
1 1 1 24 5  31 o 21.20000 0.4537000 20.86000 0.5089000 21.54000 0.7512000 -0.6880000     0.9073000 
1 1 1 24 5  33 o 10.88000 0.6330000 11.19000 0.6779000 10.57000 1.069000  0.6182000      1.266000  
1 1 1 24 5  35 o 11.68000 0.5337000 11.15000 0.7245000 12.21000 0.7838000 -1.058000      1.067000  
1 1 1 24 5  37 o 4.332000 0.9734000 4.275000 1.366000  4.389000 1.387000  -0.1146000     1.947000  
1 1 1 24 5  39 o 11.23000 0.4897000 11.53000 0.5943000 10.92000 0.7785000 0.6141000      0.9795000 
1 1 1 24 5  41 o 3.780000 0.9661000 3.852000 1.389000  3.708000 1.343000  0.1439000      1.932000  
1 1 1 24 5  43 o 7.004000 0.6829000 7.103000 0.9331000 6.904000 0.9973000 0.1981000      1.366000  
1 1 1 24 5  45 o 10.15000 0.5566000 10.28000 0.8365000 10.03000 0.7346000 0.2576000      1.113000  
1 1 1 24 5  47 o 13.15000 0.4383000 13.63000 0.5946000 12.67000 0.6440000 0.9553000      0.8765000 
1 1 1 24 5  49 o 8.467000 0.6276000 8.695000 0.9062000 8.238000 0.8685000 0.4564000      1.255000  
1 1 1 24 5  51 o 3.205000 0.9727000 3.086000 1.306000  3.324000 1.442000  -0.2383000     1.945000  
1 1 1 24 5  53 o 4.584000 1.001000  4.419000 1.456000  4.749000 1.374000  -0.3298000     2.002000  
1 1 1 24 5  55 o 5.832000 0.9806000 4.961000 1.595000  6.703000 1.141000  -1.742000      1.961000  
1 1 1 24 5  57 o 3.935000 0.9932000 3.617000 1.481000  4.253000 1.324000  -0.6357000     1.986000  
1 1 1 24 6  0  o 21.92000 0.4457000 21.92000 0.4457000 21.92000 0.4457000 0.000000       0.000000  
1 1 1 24 6  2  o 59.46000 0.4348000 59.46000 0.6146000 59.47000 0.6152000 -0.1397000E-01 0.8696000 
1 1 1 24 6  4  o 14.44000 0.3484000 14.47000 0.4995000 14.41000 0.4859000 0.5931000E-01  0.6969000 
1 1 1 24 6  6  o 40.51000 0.3534000 40.56000 0.4618000 40.45000 0.5351000 0.1062000      0.7069000 
1 1 1 24 6  8  o 102.2000 0.7088000 102.6000 1.006000  101.9000 0.9986000 0.7073000      1.418000  
1 1 1 24 6  10 o 28.49000 0.3030000 28.67000 0.4575000 28.31000 0.3974000 0.3631000      0.6060000 
1 1 1 24 6  12 o 20.96000 0.2726000 20.85000 0.3823000 21.06000 0.3885000 -0.2128000     0.5451000 
1 1 1 24 6  14 o 29.21000 0.2870000 28.93000 0.4046000 29.49000 0.4072000 -0.5654000     0.5740000 
1 1 1 24 6  16 o 28.84000 0.2867000 28.67000 0.4072000 29.00000 0.4038000 -0.3331000     0.5734000 
1 1 1 24 6  18 o 22.57000 0.3053000 22.59000 0.3952000 22.54000 0.4655000 0.4914000E-01  0.6106000 
1 1 1 24 6  20 o 31.58000 0.3216000 31.41000 0.4829000 31.76000 0.4248000 -0.3506000     0.6431000 
1 1 1 24 6  22 o 6.263000 0.6973000 6.155000 1.008000  6.371000 0.9636000 -0.2158000     1.395000  
1 1 1 24 6  24 o 20.73000 0.3964000 20.50000 0.5401000 20.96000 0.5802000 -0.4619000     0.7927000 
1 1 1 24 6  26 o 37.33000 0.3320000 37.27000 0.4720000 37.39000 0.4670000 -0.1221000     0.6640000 
1 1 1 24 6  28 o 54.65000 0.4536000 55.00000 0.5925000 54.31000 0.6870000 0.6820000      0.9072000 
1 1 1 24 6  30 o 24.36000 0.4069000 23.54000 0.4545000 25.19000 0.6750000 -1.660000      0.8138000 
1 1 1 24 6  32 o 35.27000 0.3523000 35.27000 0.4277000 35.28000 0.5601000 -0.1089000E-01 0.7047000 
1 1 1 24 6  34 o 8.748000 0.6596000 8.844000 0.7656000 8.652000 1.074000  0.1920000      1.319000  
1 1 1 24 6  36 f 19.14000 0.4284000 19.63000 0.6319000 18.65000 0.5786000 0.9743000      0.8568000 
1 1 1 24 6  38 o 5.559000 0.9172000 6.703000 1.056000  4.415000 1.500000  2.288000       1.834000  
1 1 1 24 6  40 o 17.32000 0.3500000 17.44000 0.4700000 17.19000 0.5188000 0.2515000      0.7000000 
1 1 1 24 6  42 o 7.600000 0.7357000 7.779000 1.121000  7.420000 0.9526000 0.3592000      1.471000  
1 1 1 24 6  44 o 5.486000 0.8371000 5.674000 1.145000  5.298000 1.221000  0.3753000      1.674000  
1 1 1 24 6  46 o 6.917000 0.7767000 6.849000 1.187000  6.986000 1.003000  -0.1373000     1.553000  
1 1 1 24 6  48 o 10.97000 0.5183000 10.41000 0.7409000 11.52000 0.7249000 -1.110000      1.037000  
1 1 1 24 6  50 o 3.809000 1.030000  2.858000 1.259000  4.759000 1.630000  -1.901000      2.060000  
1 1 1 24 6  52 o 10.44000 0.5909000 11.04000 0.8503000 9.842000 0.8208000 1.202000       1.182000  
1 1 1 24 6  54 o 3.803000 0.9288000 4.775000 1.403000  2.830000 1.218000  1.945000       1.858000  
1 1 1 24 6  56 o 8.682000 0.6445000 8.223000 0.9321000 9.141000 0.8903000 -0.9178000     1.289000  
1 1 1 24 6  58 o 3.362000 1.013000  3.550000 1.549000  3.174000 1.307000  0.3755000      2.026000  
1 1 1 24 7  1  o 41.51000 0.3792000 41.63000 0.5387000 41.40000 0.5337000 0.2353000      0.7583000 
1 1 1 24 7  3  o 45.26000 0.3525000 45.03000 0.4956000 45.49000 0.5015000 -0.4636000     0.7051000 
1 1 1 24 7  5  o 51.29000 0.4184000 51.06000 0.5437000 51.53000 0.6361000 -0.4757000     0.8369000 
1 1 1 24 7  7  o 47.80000 0.3968000 47.76000 0.5185000 47.85000 0.6009000 -0.8982000E-01 0.7937000 
1 1 1 24 7  9  o 39.71000 0.3219000 39.55000 0.4559000 39.88000 0.4546000 -0.3373000     0.6438000 
1 1 1 24 7  11 o 51.85000 0.4198000 51.78000 0.6348000 51.92000 0.5496000 -0.1473000     0.8397000 
1 1 1 24 7  13 o 15.43000 0.3038000 15.37000 0.4324000 15.49000 0.4269000 -0.1211000     0.6076000 
1 1 1 24 7  15 o 63.94000 0.4628000 63.48000 0.6515000 64.40000 0.6576000 -0.9189000     0.9257000 
1 1 1 24 7  17 o 43.25000 0.3446000 43.50000 0.4893000 42.99000 0.4853000 0.5178000      0.6891000 
1 1 1 24 7  19 o 37.38000 0.3441000 37.24000 0.5195000 37.53000 0.4513000 -0.2879000     0.6881000 
1 1 1 24 7  21 o 33.76000 0.3052000 33.38000 0.4272000 34.14000 0.4361000 -0.7639000     0.6105000 
1 1 1 24 7  23 o 24.26000 0.3143000 24.10000 0.4130000 24.42000 0.4738000 -0.3211000     0.6286000 
1 1 1 24 7  25 o 42.55000 0.4116000 41.95000 0.5773000 43.16000 0.5868000 -1.203000      0.8231000 
1 1 1 24 7  27 o 54.27000 0.4521000 53.94000 0.5886000 54.61000 0.6864000 -0.6660000     0.9042000 
1 1 1 24 7  29 o 20.36000 0.4141000 20.09000 0.4287000 20.64000 0.7086000 -0.5461000     0.8282000 
1 1 1 24 7  31 o 42.55000 0.3909000 42.55000 0.5078000 42.54000 0.5943000 0.8839000E-02  0.7818000 
1 1 1 24 7  33 o 10.50000 0.5881000 11.30000 0.6235000 9.696000 0.9975000 1.600000       1.176000  
1 1 1 24 7  35 o 23.56000 0.3318000 23.32000 0.3990000 23.80000 0.5303000 -0.4833000     0.6636000 
1 1 1 24 7  37 o 12.45000 0.4500000 12.61000 0.6134000 12.29000 0.6587000 0.3126000      0.9001000 
1 1 1 24 7  39 o 15.85000 0.4496000 16.10000 0.5641000 15.60000 0.7002000 0.4983000      0.8992000 
1 1 1 24 7  41 o 9.940000 0.5636000 10.01000 0.7933000 9.875000 0.8006000 0.1305000      1.127000  
1 1 1 24 7  43 o 5.648000 0.9025000 4.827000 1.493000  6.469000 1.014000  -1.642000      1.805000  
1 1 1 24 7  45 o 10.44000 0.5479000 10.40000 0.8473000 10.48000 0.6949000 -0.8297000E-01 1.096000  
1 1 1 24 7  47 o 5.017000 0.9906000 4.626000 1.500000  5.408000 1.295000  -0.7816000     1.981000  
1 1 1 24 7  49 o 4.040000 1.029000  4.244000 1.435000  3.835000 1.475000  0.4090000      2.058000  
1 1 1 24 7  51 o 4.696000 1.018000  3.903000 1.452000  5.489000 1.426000  -1.586000      2.035000  
1 1 1 24 7  53 f 2.918000 0.9025000 3.035000 1.307000  2.801000 1.245000  0.2341000      1.805000  
1 1 1 24 7  55 o 4.135000 0.9685000 3.801000 1.417000  4.470000 1.321000  -0.6686000     1.937000  
1 1 1 24 7  57 o 4.341000 0.9901000 3.807000 1.469000  4.874000 1.327000  -1.067000      1.980000  
1 1 1 24 8  0  o 18.05000 0.4469000 18.05000 0.4469000 18.05000 0.4469000 0.000000       0.000000  
1 1 1 24 8  2  o 61.21000 0.4792000 60.96000 0.7195000 61.46000 0.6332000 -0.5009000     0.9584000 
1 1 1 24 8  4  o 42.87000 0.3390000 43.19000 0.4834000 42.54000 0.4753000 0.6457000      0.6779000 
1 1 1 24 8  6  o 17.53000 0.3094000 17.54000 0.4052000 17.52000 0.4676000 0.2190000E-01  0.6187000 
1 1 1 24 8  8  o 27.62000 0.2775000 27.77000 0.3927000 27.48000 0.3922000 0.2911000      0.5550000 
1 1 1 24 8  10 o 27.57000 0.2722000 27.53000 0.3863000 27.60000 0.3836000 -0.7129000E-01 0.5444000 
1 1 1 24 8  12 f 34.08000 0.3228000 34.41000 0.4901000 33.75000 0.4202000 0.6591000      0.6456000 
1 1 1 24 8  14 o 20.31000 0.2797000 20.27000 0.3949000 20.34000 0.3963000 -0.6688000E-01 0.5594000 
1 1 1 24 8  16 o 23.77000 0.2794000 23.87000 0.3954000 23.66000 0.3949000 0.2105000      0.5588000 
1 1 1 24 8  18 o 22.21000 0.2958000 22.34000 0.4415000 22.09000 0.3937000 0.2498000      0.5915000 
1 1 1 24 8  20 o 19.84000 0.2902000 19.51000 0.4086000 20.17000 0.4123000 -0.6581000     0.5804000 
1 1 1 24 8  22 o 11.29000 0.4169000 11.08000 0.5724000 11.49000 0.6063000 -0.4098000     0.8337000 
1 1 1 24 8  24 o 22.82000 0.3228000 22.60000 0.4235000 23.04000 0.4873000 -0.4438000     0.6456000 
1 1 1 24 8  26 o 34.55000 0.3241000 33.62000 0.4530000 35.47000 0.4636000 -1.854000      0.6482000 
1 1 1 24 8  28 o 31.05000 0.4186000 30.51000 0.5328000 31.59000 0.6458000 -1.082000      0.8372000 
1 1 1 24 8  30 o 14.13000 0.4332000 14.42000 0.5121000 13.84000 0.6988000 0.5787000      0.8664000 
1 1 1 24 8  32 o 18.67000 0.3868000 18.98000 0.4966000 18.36000 0.5932000 0.6171000      0.7737000 
1 1 1 24 8  34 o 14.95000 0.4207000 14.31000 0.5317000 15.59000 0.6521000 -1.280000      0.8414000 
1 1 1 24 8  36 o 19.01000 0.3670000 18.88000 0.5480000 19.15000 0.4882000 -0.2721000     0.7339000 
1 1 1 24 8  38 o 19.96000 0.3867000 19.81000 0.4566000 20.12000 0.6243000 -0.3071000     0.7734000 
1 1 1 24 8  40 o 17.70000 0.3512000 17.70000 0.4944000 17.70000 0.4990000 0.4856000E-02  0.7025000 
1 1 1 24 8  42 o 4.609000 1.021000  4.978000 1.415000  4.241000 1.473000  0.7374000      2.043000  
1 1 1 24 8  44 o 12.01000 0.8967000 11.09000 1.644000  12.93000 0.7156000 -1.841000      1.793000  
1 1 1 24 8  46 o 11.13000 0.4961000 11.53000 0.6668000 10.73000 0.7349000 0.8013000      0.9923000 
1 1 1 24 8  48 o 9.618000 0.6077000 8.975000 0.8654000 10.26000 0.8534000 -1.286000      1.215000  
1 1 1 24 8  50 o 9.030000 0.6562000 8.331000 0.9593000 9.729000 0.8958000 -1.398000      1.312000  
1 1 1 24 8  52 o 4.048000 0.9839000 4.317000 1.399000  3.779000 1.383000  0.5381000      1.968000  
1 1 1 24 8  54 o 12.92000 0.4586000 12.37000 0.6606000 13.47000 0.6364000 -1.099000      0.9173000 
1 1 1 24 8  56 o 3.404000 0.9343000 2.686000 1.229000  4.121000 1.407000  -1.436000      1.869000  
1 1 1 24 8  58 o 3.875000 1.112000  4.269000 1.705000  3.482000 1.428000  0.7871000      2.224000  
1 1 1 24 9  1  o 24.00000 0.2683000 24.39000 0.3798000 23.60000 0.3790000 0.7911000      0.5365000 
1 1 1 24 9  3  o 77.14000 0.6278000 77.36000 0.8897000 76.93000 0.8859000 0.4310000      1.256000  
1 1 1 24 9  5  o 19.15000 0.2725000 19.16000 0.3770000 19.13000 0.3936000 0.3108000E-01  0.5450000 
1 1 1 24 9  7  o 41.35000 0.3598000 41.40000 0.4707000 41.30000 0.5444000 0.1066000      0.7196000 
1 1 1 24 9  9  o 8.858000 0.4274000 8.924000 0.5819000 8.793000 0.6261000 0.1308000      0.8548000 
1 1 1 24 9  11 o 25.96000 0.2745000 25.92000 0.3888000 26.00000 0.3875000 -0.8216000E-01 0.5489000 
1 1 1 24 9  13 o 31.81000 0.3111000 31.77000 0.4679000 31.85000 0.4101000 -0.8445000E-01 0.6221000 
1 1 1 24 9  15 o 60.47000 0.4421000 60.50000 0.6258000 60.45000 0.6247000 0.4542000E-01  0.8843000 
1 1 1 24 9  17 o 19.79000 0.3009000 19.72000 0.4491000 19.86000 0.4006000 -0.1408000     0.6018000 
1 1 1 24 9  19 o 34.13000 0.3091000 34.29000 0.4416000 33.97000 0.4325000 0.3284000      0.6181000 
1 1 1 24 9  21 o 12.61000 0.3682000 12.70000 0.5153000 12.52000 0.5262000 0.1759000      0.7365000 
1 1 1 24 9  23 o 20.19000 0.3207000 19.97000 0.4300000 20.41000 0.4760000 -0.4445000     0.6415000 
1 1 1 24 9  25 o 46.98000 0.4062000 47.04000 0.5329000 46.92000 0.6132000 0.1200000      0.8124000 
1 1 1 24 9  27 o 22.29000 0.3923000 22.18000 0.3988000 22.41000 0.6757000 -0.2346000     0.7847000 
1 1 1 24 9  29 o 16.56000 0.4087000 15.88000 0.5658000 17.25000 0.5899000 -1.375000      0.8174000 
1 1 1 24 9  31 o 17.72000 0.3845000 17.39000 0.4921000 18.05000 0.5908000 -0.6587000     0.7689000 
1 1 1 24 9  33 o 20.11000 0.3800000 20.30000 0.4840000 19.92000 0.5860000 0.3722000      0.7600000 
1 1 1 24 9  35 o 24.15000 0.3431000 24.64000 0.4477000 23.66000 0.5201000 0.9787000      0.6862000 
1 1 1 24 9  37 o 5.527000 0.8790000 5.322000 1.262000  5.733000 1.224000  -0.4107000     1.758000  
1 1 1 24 9  39 o 20.30000 0.3381000 20.65000 0.4566000 19.94000 0.4989000 0.7147000      0.6762000 
1 1 1 24 9  41 o 8.917000 0.5967000 8.330000 0.9422000 9.503000 0.7323000 -1.174000      1.193000  
1 1 1 24 9  43 o 10.81000 0.4783000 10.30000 0.6932000 11.32000 0.6593000 -1.018000      0.9566000 
1 1 1 24 9  45 o 4.747000 1.079000  5.034000 1.682000  4.460000 1.352000  0.5747000      2.158000  
1 1 1 24 9  47 o 5.693000 1.049000  5.121000 1.436000  6.265000 1.529000  -1.144000      2.098000  
1 1 1 24 9  49 o 4.982000 0.9630000 5.165000 1.339000  4.799000 1.384000  0.3656000      1.926000  
1 1 1 24 9  51 o 10.81000 0.5423000 10.49000 0.8053000 11.13000 0.7265000 -0.6382000     1.085000  
1 1 1 24 9  53 o 3.355000 0.9474000 3.853000 1.404000  2.857000 1.273000  0.9958000      1.895000  
1 1 1 24 9  55 o 3.186000 0.9289000 3.481000 1.371000  2.892000 1.253000  0.5886000      1.858000  
1 1 1 24 9  57 o 3.919000 1.086000  4.288000 1.580000  3.549000 1.491000  0.7386000      2.173000  
1 1 1 24 10 0  o 28.98000 0.3916000 28.98000 0.3916000 28.98000 0.3916000 0.000000       0.000000  
1 1 1 24 10 2  o 55.45000 0.4103000 55.84000 0.5832000 55.06000 0.5772000 0.7800000      0.8206000 
1 1 1 24 10 4  o 33.07000 0.2924000 33.15000 0.4152000 32.99000 0.4118000 0.1640000      0.5848000 
1 1 1 24 10 6  o 16.19000 0.2953000 16.63000 0.4360000 15.75000 0.3985000 0.8718000      0.5907000 
1 1 1 24 10 8  o 53.20000 0.4299000 53.53000 0.5650000 52.86000 0.6481000 0.6670000      0.8598000 
1 1 1 24 10 10 o 29.22000 0.2812000 29.57000 0.4005000 28.88000 0.3948000 0.6887000      0.5623000 
1 1 1 24 10 12 o 11.91000 0.3733000 11.93000 0.5694000 11.88000 0.4830000 0.4718000E-01  0.7467000 
1 1 1 24 10 14 o 37.57000 0.3150000 37.89000 0.4495000 37.24000 0.4414000 0.6511000      0.6300000 
1 1 1 24 10 16 o 26.98000 0.2971000 27.39000 0.4440000 26.58000 0.3949000 0.8046000      0.5942000 
1 1 1 24 10 18 o 16.97000 0.2968000 16.85000 0.4193000 17.10000 0.4203000 -0.2536000     0.5937000 
1 1 1 24 10 20 o 43.30000 0.3479000 43.01000 0.4879000 43.59000 0.4962000 -0.5775000     0.6959000 
1 1 1 24 10 22 o 10.67000 0.4417000 11.35000 0.5628000 9.996000 0.6809000 1.350000       0.8834000 
1 1 1 24 10 24 f 11.51000 0.4228000 11.36000 0.6076000 11.66000 0.5882000 -0.3048000     0.8456000 
1 1 1 24 10 26 o 9.985000 0.5889000 9.659000 0.6099000 10.31000 1.008000  -0.6508000     1.178000  
1 1 1 24 10 28 o 30.34000 0.3458000 30.41000 0.4337000 30.27000 0.5386000 0.1344000      0.6915000 
1 1 1 24 10 30 o 34.85000 0.3841000 35.17000 0.5412000 34.52000 0.5453000 0.6455000      0.7683000 
1 1 1 24 10 32 o 40.76000 0.3820000 41.21000 0.4998000 40.31000 0.5778000 0.8990000      0.7639000 
1 1 1 24 10 34 o 20.76000 0.3668000 21.21000 0.4802000 20.31000 0.5546000 0.9050000      0.7336000 
1 1 1 24 10 36 o 5.734000 0.9088000 5.313000 1.178000  6.155000 1.384000  -0.8425000     1.818000  
1 1 1 24 10 38 o 3.560000 0.9827000 2.770000 1.212000  4.351000 1.548000  -1.581000      1.965000  
1 1 1 24 10 40 o 3.980000 0.9486000 3.618000 1.334000  4.341000 1.349000  -0.7236000     1.897000  
1 1 1 24 10 42 o 8.211000 0.6120000 8.119000 0.9008000 8.303000 0.8289000 -0.1840000     1.224000  
1 1 1 24 10 44 o 14.84000 0.4263000 14.33000 0.5665000 15.36000 0.6372000 -1.030000      0.8526000 
1 1 1 24 10 46 o 9.997000 0.5669000 10.12000 0.8540000 9.873000 0.7456000 0.2472000      1.134000  
1 1 1 24 10 48 o 5.592000 1.001000  5.840000 1.441000  5.344000 1.391000  0.4958000      2.003000  
1 1 1 24 10 50 o 8.832000 0.7292000 9.167000 0.9104000 8.496000 1.139000  0.6705000      1.458000  
1 1 1 24 10 52 o 8.386000 0.6622000 7.558000 1.054000  9.213000 0.8024000 -1.655000      1.324000  
1 1 1 24 10 54 o 7.135000 0.7640000 6.461000 1.180000  7.809000 0.9702000 -1.348000      1.528000  
1 1 1 24 10 56 o 4.214000 1.043000  4.475000 1.460000  3.953000 1.489000  0.5217000      2.086000  
1 1 1 24 11 1  o 8.239000 0.4491000 8.815000 0.6006000 7.663000 0.6678000 1.152000       0.8981000 
1 1 1 24 11 3  o 48.69000 0.3694000 48.68000 0.5208000 48.71000 0.5240000 -0.3209000E-01 0.7387000 
1 1 1 24 11 5  o 40.08000 0.3234000 40.28000 0.4603000 39.88000 0.4544000 0.4020000      0.6468000 
1 1 1 24 11 7  o 58.24000 0.4897000 58.33000 0.6935000 58.15000 0.6915000 0.1765000      0.9793000 
1 1 1 24 11 9  o 7.257000 0.5680000 7.446000 0.6784000 7.068000 0.9111000 0.3777000      1.136000  
1 1 1 24 11 11 o 23.40000 0.2718000 23.94000 0.3831000 22.85000 0.3856000 1.096000       0.5436000 
1 1 1 24 11 13 o 32.21000 0.3147000 31.75000 0.4721000 32.66000 0.4162000 -0.9090000     0.6294000 
1 1 1 24 11 15 o 15.71000 0.3215000 15.32000 0.4736000 16.09000 0.4348000 -0.7701000     0.6429000 
1 1 1 24 11 17 o 36.15000 0.3123000 35.76000 0.4385000 36.55000 0.4448000 -0.7812000     0.6246000 
1 1 1 24 11 19 o 3.628000 0.8583000 4.027000 1.214000  3.228000 1.213000  0.7991000      1.717000  
1 1 1 24 11 21 o 11.38000 0.4064000 11.63000 0.5276000 11.14000 0.6182000 0.4971000      0.8128000 
1 1 1 24 11 23 o 47.29000 0.4002000 47.62000 0.5300000 46.96000 0.5998000 0.6578000      0.8004000 
1 1 1 24 11 25 o 6.183000 0.9574000 6.701000 0.8390000 5.664000 1.721000  1.037000       1.915000  
1 1 1 24 11 27 o 19.68000 0.3416000 19.40000 0.4028000 19.96000 0.5519000 -0.5584000     0.6832000 
1 1 1 24 11 29 o 44.85000 0.3980000 44.93000 0.5143000 44.76000 0.6076000 0.1779000      0.7960000 
1 1 1 24 11 31 o 4.656000 1.052000  4.595000 1.456000  4.716000 1.518000  -0.1212000     2.103000  
1 1 1 24 11 33 o 26.79000 0.3267000 26.51000 0.3970000 27.08000 0.5191000 -0.5640000     0.6535000 
1 1 1 24 11 35 o 18.58000 0.3645000 18.73000 0.4679000 18.43000 0.5591000 0.3028000      0.7291000 
1 1 1 24 11 37 o 3.747000 0.9324000 4.561000 1.353000  2.933000 1.283000  1.628000       1.865000  
1 1 1 24 11 39 o 15.67000 0.4944000 15.34000 0.8406000 16.01000 0.5208000 -0.6642000     0.9889000 
1 1 1 24 11 41 o 9.623000 0.5491000 9.650000 0.8249000 9.596000 0.7251000 0.5437000E-01  1.098000  
1 1 1 24 11 43 o 3.593000 0.9507000 4.129000 1.361000  3.056000 1.328000  1.073000       1.901000  
1 1 1 24 11 45 o 11.88000 0.4544000 12.93000 0.6112000 10.82000 0.6726000 2.106000       0.9088000 
1 1 1 24 11 47 o 8.984000 0.5503000 8.719000 0.7787000 9.250000 0.7779000 -0.5309000     1.101000  
1 1 1 24 11 49 o 4.498000 1.056000  4.910000 1.625000  4.086000 1.350000  0.8240000      2.112000  
1 1 1 24 11 51 o 5.435000 0.9631000 4.623000 1.460000  6.246000 1.256000  -1.623000      1.926000  
1 1 1 24 11 53 o 4.417000 1.065000  4.632000 1.523000  4.201000 1.488000  0.4306000      2.129000  
1 1 1 24 11 55 o 4.330000 1.021000  4.955000 1.423000  3.704000 1.465000  1.251000       2.043000  
1 1 1 24 11 57 o 4.601000 0.9996000 5.297000 1.391000  3.904000 1.436000  1.393000       1.999000  
1 1 1 24 12 0  o 36.50000 0.4303000 36.50000 0.4303000 36.50000 0.4303000 0.000000       0.000000  
1 1 1 24 12 2  o 19.41000 0.2737000 19.35000 0.3835000 19.47000 0.3905000 -0.1188000     0.5474000 
1 1 1 24 12 4  o 22.04000 0.2707000 22.06000 0.3781000 22.03000 0.3876000 0.3551000E-01  0.5415000 
1 1 1 24 12 6  o 13.84000 0.3255000 14.12000 0.4574000 13.57000 0.4633000 0.5463000      0.6511000 
1 1 1 24 12 8  o 16.80000 0.2877000 16.52000 0.4050000 17.07000 0.4088000 -0.5536000     0.5754000 
1 1 1 24 12 10 o 22.96000 0.3015000 23.12000 0.4208000 22.80000 0.4319000 0.3221000      0.6030000 
1 1 1 24 12 12 o 4.910000 0.7524000 5.094000 1.030000  4.725000 1.097000  0.3688000      1.505000  
1 1 1 24 12 14 o 41.77000 0.4075000 42.13000 0.6630000 41.42000 0.4739000 0.7102000      0.8150000 
1 1 1 24 12 16 o 37.20000 0.3159000 37.02000 0.4463000 37.37000 0.4473000 -0.3546000     0.6318000 
1 1 1 24 12 18 o 33.28000 0.2997000 32.69000 0.4186000 33.86000 0.4291000 -1.163000      0.5995000 
1 1 1 24 12 20 o 15.98000 0.3281000 15.75000 0.4483000 16.21000 0.4792000 -0.4516000     0.6562000 
1 1 1 24 12 22 o 3.641000 0.9131000 3.377000 1.231000  3.905000 1.349000  -0.5279000     1.826000  
1 1 1 24 12 24 o 8.355000 0.6003000 8.313000 0.6450000 8.396000 1.013000  -0.8356000E-01 1.201000  
1 1 1 24 12 26 o 49.05000 0.4027000 49.39000 0.4894000 48.70000 0.6396000 0.6824000      0.8054000 
1 1 1 24 12 28 o 40.09000 0.3943000 40.06000 0.5465000 40.13000 0.5685000 -0.6381000E-01 0.7886000 
1 1 1 24 12 30 o 30.43000 0.3426000 30.41000 0.4372000 30.45000 0.5275000 -0.3912000E-01 0.6851000 
1 1 1 24 12 32 o 30.92000 0.3441000 30.54000 0.4450000 31.30000 0.5249000 -0.7680000     0.6881000 
1 1 1 24 12 34 o 22.43000 0.3468000 22.55000 0.4459000 22.31000 0.5312000 0.2390000      0.6936000 
1 1 1 24 12 36 o 20.71000 0.3456000 20.94000 0.4455000 20.48000 0.5284000 0.4561000      0.6912000 
1 1 1 24 12 38 o 23.07000 0.4294000 22.70000 0.6673000 23.43000 0.5405000 -0.7300000     0.8587000 
1 1 1 24 12 40 o 11.36000 0.4508000 11.38000 0.6251000 11.35000 0.6497000 0.3580000E-01  0.9016000 
1 1 1 24 12 42 o 3.960000 0.9935000 3.771000 1.333000  4.148000 1.474000  -0.3770000     1.987000  
1 1 1 24 12 44 o 10.26000 0.4956000 10.38000 0.6928000 10.15000 0.7089000 0.2369000      0.9912000 
1 1 1 24 12 46 o 13.47000 0.4275000 13.17000 0.6291000 13.76000 0.5790000 -0.5868000     0.8550000 
1 1 1 24 12 48 o 4.018000 0.9710000 4.234000 1.394000  3.801000 1.352000  0.4328000      1.942000  
1 1 1 24 12 50 o 7.217000 0.8702000 7.715000 1.248000  6.719000 1.213000  0.9955000      1.740000  
1 1 1 24 12 52 o 8.468000 0.6351000 7.730000 0.9524000 9.207000 0.8404000 -1.477000      1.270000  
1 1 1 24 12 54 o 5.576000 0.9536000 6.293000 1.273000  4.859000 1.420000  1.434000       1.907000  
1 1 1 24 12 56 o 3.138000 0.9415000 3.296000 1.368000  2.980000 1.294000  0.3168000      1.883000  
1 1 1 24 13 1  o 24.67000 0.2696000 24.56000 0.3828000 24.78000 0.3797000 -0.2217000     0.5392000 
1 1 1 24 13 3  o 28.99000 0.2798000 28.91000 0.3944000 29.08000 0.3971000 -0.1760000     0.5597000 
1 1 1 24 13 5  o 26.26000 0.2745000 26.55000 0.3889000 25.97000 0.3876000 0.5804000      0.5491000 
1 1 1 24 13 7  o 35.56000 0.3606000 36.00000 0.5800000 35.13000 0.4285000 0.8720000      0.7211000 
1 1 1 24 13 9  o 16.91000 0.3032000 17.44000 0.3915000 16.39000 0.4632000 1.056000       0.6065000 
1 1 1 24 13 11 o 23.01000 0.3055000 22.98000 0.3829000 23.04000 0.4761000 -0.6725000E-01 0.6109000 
1 1 1 24 13 13 o 28.46000 0.4214000 29.30000 0.7010000 27.63000 0.4677000 1.671000       0.8427000 
1 1 1 24 13 15 o 3.680000 0.9124000 3.348000 1.196000  4.012000 1.378000  -0.6638000     1.825000  
1 1 1 24 13 17 o 44.40000 0.3518000 44.14000 0.4957000 44.67000 0.4994000 -0.5255000     0.7036000 
1 1 1 24 13 19 o 18.66000 0.3382000 18.69000 0.4118000 18.63000 0.5365000 0.5883000E-01  0.6763000 
1 1 1 24 13 21 o 29.36000 0.3151000 29.53000 0.4141000 29.19000 0.4749000 0.3464000      0.6301000 
1 1 1 24 13 23 o 41.21000 0.3604000 40.34000 0.4254000 42.08000 0.5819000 -1.743000      0.7208000 
1 1 1 24 13 25 o 45.49000 0.4444000 45.52000 0.4601000 45.46000 0.7604000 0.6820000E-01  0.8887000 
1 1 1 24 13 27 o 13.68000 0.4405000 14.10000 0.4962000 13.25000 0.7281000 0.8472000      0.8811000 
1 1 1 24 13 29 o 22.57000 0.3304000 22.25000 0.3945000 22.89000 0.5301000 -0.6394000     0.6607000 
1 1 1 24 13 31 o 4.666000 0.9104000 5.485000 1.096000  3.847000 1.454000  1.638000       1.821000  
1 1 1 24 13 33 o 9.893000 0.5844000 9.164000 0.8238000 10.62000 0.8293000 -1.457000      1.169000  
1 1 1 24 13 35 o 3.666000 0.9427000 2.937000 1.219000  4.395000 1.438000  -1.457000      1.885000  
1 1 1 24 13 37 o 10.72000 0.5590000 10.31000 0.6842000 11.13000 0.8842000 -0.8118000     1.118000  
1 1 1 24 13 39 o 11.29000 0.4430000 11.04000 0.6275000 11.54000 0.6255000 -0.4999000     0.8861000 
1 1 1 24 13 41 o 17.28000 0.3979000 17.31000 0.5375000 17.26000 0.5867000 0.5075000E-01  0.7957000 
1 1 1 24 13 43 o 10.89000 0.4718000 11.37000 0.6462000 10.40000 0.6875000 0.9687000      0.9435000 
1 1 1 24 13 45 o 4.656000 0.9268000 5.211000 1.270000  4.101000 1.351000  1.110000       1.854000  
1 1 1 24 13 47 o 16.74000 0.3851000 17.12000 0.5664000 16.35000 0.5219000 0.7636000      0.7702000 
1 1 1 24 13 49 o 3.131000 0.9657000 2.860000 1.272000  3.403000 1.453000  -0.5427000     1.931000  
1 1 1 24 13 51 o 11.19000 0.6071000 12.12000 0.9146000 10.25000 0.7987000 1.872000       1.214000  
1 1 1 24 13 53 o 4.712000 1.002000  4.259000 1.401000  5.164000 1.434000  -0.9052000     2.005000  
1 1 1 24 13 55 o 5.130000 0.9644000 6.163000 1.316000  4.097000 1.410000  2.066000       1.929000  
1 1 1 24 13 57 o 5.035000 1.267000  5.510000 1.878000  4.560000 1.700000  0.9503000      2.534000  
1 1 1 24 14 0  o 57.14000 0.5923000 57.14000 0.5923000 57.14000 0.5923000 0.000000       0.000000  
1 1 1 24 14 2  o 29.92000 0.2817000 30.01000 0.4002000 29.83000 0.3966000 0.1836000      0.5634000 
1 1 1 24 14 4  o 87.91000 0.6144000 88.18000 0.8709000 87.64000 0.8668000 0.5370000      1.229000  
1 1 1 24 14 6  o 37.77000 0.3140000 37.98000 0.4447000 37.57000 0.4434000 0.4041000      0.6280000 
1 1 1 24 14 8  o 67.94000 0.5288000 67.74000 0.6884000 68.13000 0.8030000 -0.3880000     1.058000  
1 1 1 24 14 10 o 6.268000 0.8441000 6.403000 0.8291000 6.133000 1.470000  0.2705000      1.688000  
1 1 1 24 14 12 o 53.39000 0.4629000 53.82000 0.6499000 52.96000 0.6594000 0.8611000      0.9258000 
1 1 1 24 14 14 o 21.92000 0.3832000 22.26000 0.5010000 21.59000 0.5801000 0.6738000      0.7665000 
1 1 1 24 14 16 o 25.35000 0.3129000 25.43000 0.4008000 25.28000 0.4806000 0.1566000      0.6258000 
1 1 1 24 14 18 o 39.21000 0.5021000 39.03000 0.4586000 39.40000 0.8934000 -0.3727000     1.004000  
1 1 1 24 14 20 o 16.63000 0.3071000 16.88000 0.4298000 16.37000 0.4389000 0.5113000      0.6143000 
1 1 1 24 14 22 o 22.71000 0.3130000 22.52000 0.3611000 22.91000 0.5113000 -0.3871000     0.6260000 
1 1 1 24 14 24 o 27.92000 0.3290000 27.65000 0.4053000 28.20000 0.5183000 -0.5477000     0.6579000 
1 1 1 24 14 26 o 12.50000 0.4546000 12.63000 0.4594000 12.36000 0.7845000 0.2726000      0.9091000 
1 1 1 24 14 28 o 18.52000 0.3670000 18.32000 0.4488000 18.72000 0.5808000 -0.4008000     0.7341000 
1 1 1 24 14 30 o 12.90000 0.4282000 12.62000 0.5087000 13.17000 0.6891000 -0.5533000     0.8565000 
1 1 1 24 14 32 o 17.83000 0.3590000 17.69000 0.4282000 17.97000 0.5763000 -0.2825000     0.7180000 
1 1 1 24 14 34 o 5.584000 0.9694000 5.712000 1.372000  5.457000 1.370000  0.2550000      1.939000  
1 1 1 24 14 36 o 12.87000 0.4594000 12.74000 0.5093000 13.00000 0.7647000 -0.2657000     0.9188000 
1 1 1 24 14 38 o 4.666000 1.059000  4.263000 1.367000  5.069000 1.618000  -0.8061000     2.118000  
1 1 1 24 14 40 o 11.32000 0.4861000 11.50000 0.6112000 11.13000 0.7562000 0.3679000      0.9723000 
1 1 1 24 14 42 o 11.76000 0.4342000 12.28000 0.6065000 11.23000 0.6214000 1.046000       0.8683000 
1 1 1 24 14 44 o 6.259000 0.7910000 5.339000 1.256000  7.180000 0.9613000 -1.841000      1.582000  
1 1 1 24 14 46 o 3.615000 0.9621000 3.356000 1.343000  3.873000 1.378000  -0.5171000     1.924000  
1 1 1 24 14 48 o 10.17000 0.4950000 9.596000 0.7109000 10.75000 0.6889000 -1.150000      0.9900000 
1 1 1 24 14 50 o 8.769000 0.6349000 9.285000 0.8557000 8.254000 0.9381000 1.031000       1.270000  
1 1 1 24 14 52 f 7.413000 0.6968000 6.735000 1.043000  8.091000 0.9241000 -1.356000      1.394000  
1 1 1 24 14 54 o 4.611000 1.008000  3.915000 1.501000  5.308000 1.345000  -1.392000      2.016000  
1 1 1 24 14 56 o 5.160000 0.9431000 4.900000 1.400000  5.419000 1.264000  -0.5183000     1.886000  
1 1 1 24 15 1  o 43.29000 0.3403000 42.96000 0.4797000 43.63000 0.4829000 -0.6755000     0.6807000 
1 1 1 24 15 3  o 31.35000 0.2867000 31.92000 0.4065000 30.78000 0.4043000 1.141000       0.5734000 
1 1 1 24 15 5  o 34.97000 0.3279000 35.43000 0.4260000 34.51000 0.4985000 0.9228000      0.6558000 
1 1 1 24 15 7  o 30.32000 0.3132000 30.09000 0.3986000 30.55000 0.4832000 -0.4656000     0.6264000 
1 1 1 24 15 9  o 21.98000 0.2838000 22.05000 0.4221000 21.91000 0.3796000 0.1437000      0.5677000 
1 1 1 24 15 11 o 21.30000 0.2718000 21.60000 0.3952000 21.00000 0.3733000 0.6004000      0.5437000 
1 1 1 24 15 13 o 23.00000 0.2769000 23.12000 0.3890000 22.89000 0.3941000 0.2330000      0.5538000 
1 1 1 24 15 15 o 19.91000 0.3189000 19.38000 0.4387000 20.43000 0.4631000 -1.054000      0.6379000 
1 1 1 24 15 17 o 14.45000 0.3736000 14.08000 0.5041000 14.82000 0.5514000 -0.7395000     0.7471000 
1 1 1 24 15 19 o 15.67000 0.3632000 15.23000 0.4468000 16.10000 0.5728000 -0.8670000     0.7265000 
1 1 1 24 15 21 o 23.70000 0.3289000 23.63000 0.4137000 23.78000 0.5114000 -0.1497000     0.6578000 
1 1 1 24 15 23 o 10.02000 0.5210000 9.960000 0.5813000 10.08000 0.8648000 -0.1211000     1.042000  
1 1 1 24 15 25 o 4.841000 1.028000  3.535000 1.201000  6.146000 1.668000  -2.611000      2.056000  
1 1 1 24 15 27 f 9.090000 0.5993000 9.152000 0.5978000 9.028000 1.039000  0.1242000      1.199000  
1 1 1 24 15 29 o 27.22000 0.3207000 26.90000 0.3757000 27.53000 0.5197000 -0.6247000     0.6413000 
1 1 1 24 15 31 o 18.52000 0.3495000 18.72000 0.4176000 18.32000 0.5605000 0.3960000      0.6990000 
1 1 1 24 15 33 o 9.004000 0.7512000 9.889000 1.125000  8.120000 0.9953000 1.769000       1.502000  
1 1 1 24 15 35 f 13.57000 0.4342000 13.28000 0.5897000 13.86000 0.6374000 -0.5795000     0.8683000 
1 1 1 24 15 37 o 8.615000 0.5829000 8.783000 0.6526000 8.447000 0.9660000 0.3364000      1.166000  
1 1 1 24 15 39 o 22.70000 0.3722000 22.07000 0.5324000 23.32000 0.5205000 -1.244000      0.7445000 
1 1 1 24 15 41 o 20.71000 0.3427000 20.73000 0.5031000 20.69000 0.4654000 0.3981000E-01  0.6853000 
1 1 1 24 15 43 o 6.944000 0.6921000 7.874000 0.8414000 6.014000 1.099000  1.859000       1.384000  
1 1 1 24 15 45 o 9.208000 0.5439000 9.879000 0.7572000 8.537000 0.7811000 1.342000       1.088000  
1 1 1 24 15 47 o 6.705000 0.7238000 6.754000 1.085000  6.656000 0.9586000 0.9854000E-01  1.448000  
1 1 1 24 15 49 o 4.324000 1.073000  3.613000 1.480000  5.035000 1.555000  -1.422000      2.147000  
1 1 1 24 15 51 o 5.444000 0.9791000 5.576000 1.376000  5.311000 1.393000  0.2646000      1.958000  
1 1 1 24 15 53 o 4.788000 0.9894000 3.540000 1.367000  6.037000 1.431000  -2.497000      1.979000  
1 1 1 24 15 55 o 4.764000 1.061000  4.553000 1.407000  4.975000 1.589000  -0.4222000     2.123000  
1 1 1 24 16 0  o 34.73000 0.4199000 34.73000 0.4199000 34.73000 0.4199000 0.000000       0.000000  
1 1 1 24 16 2  o 25.93000 0.3024000 26.21000 0.3914000 25.64000 0.4610000 0.5728000      0.6047000 
1 1 1 24 16 4  o 38.93000 0.3489000 38.96000 0.4498000 38.90000 0.5335000 0.5621000E-01  0.6979000 
1 1 1 24 16 6  o 34.28000 0.3188000 34.44000 0.4813000 34.11000 0.4181000 0.3276000      0.6375000 
1 1 1 24 16 8  o 31.97000 0.3397000 32.36000 0.5424000 31.57000 0.4092000 0.7862000      0.6794000 
1 1 1 24 16 10 o 35.26000 0.3292000 35.52000 0.4317000 35.00000 0.4970000 0.5208000      0.6583000 
1 1 1 24 16 12 o 43.72000 0.3709000 43.49000 0.4895000 43.95000 0.5575000 -0.4585000     0.7419000 
1 1 1 24 16 14 o 31.83000 0.3348000 31.73000 0.4763000 31.92000 0.4707000 -0.1935000     0.6696000 
1 1 1 24 16 16 o 35.72000 0.3302000 35.82000 0.4395000 35.61000 0.4929000 0.2068000      0.6604000 
1 1 1 24 16 18 o 33.67000 0.3440000 33.27000 0.4863000 34.06000 0.4867000 -0.7948000     0.6880000 
1 1 1 24 16 20 o 19.03000 0.3245000 18.92000 0.3591000 19.14000 0.5406000 -0.2258000     0.6490000 
1 1 1 24 16 22 o 44.37000 0.4121000 44.19000 0.5692000 44.56000 0.5962000 -0.3707000     0.8243000 
1 1 1 24 16 24 o 33.81000 0.3308000 33.90000 0.3909000 33.71000 0.5337000 0.1929000      0.6615000 
1 1 1 24 16 26 o 24.22000 0.3162000 23.46000 0.3637000 24.99000 0.5173000 -1.526000      0.6323000 
1 1 1 24 16 28 o 17.83000 0.3550000 17.97000 0.4241000 17.68000 0.5695000 0.2904000      0.7101000 
1 1 1 24 16 30 o 7.674000 0.6922000 7.834000 0.7790000 7.515000 1.144000  0.3187000      1.384000  
1 1 1 24 16 32 o 14.94000 0.3931000 14.47000 0.4999000 15.41000 0.6067000 -0.9396000     0.7861000 
1 1 1 24 16 34 o 6.665000 0.7458000 5.971000 1.025000  7.358000 1.084000  -1.388000      1.492000  
1 1 1 24 16 36 o 15.41000 0.4265000 15.57000 0.5292000 15.25000 0.6690000 0.3195000      0.8530000 
1 1 1 24 16 38 o 6.303000 1.061000  7.142000 0.7908000 5.464000 1.970000  1.678000       2.123000  
1 1 1 24 16 40 o 9.576000 0.6217000 9.220000 1.022000  9.933000 0.7078000 -0.7137000     1.243000  
1 1 1 24 16 42 o 10.09000 0.4866000 10.10000 0.6687000 10.08000 0.7072000 0.1881000E-01  0.9733000 
1 1 1 24 16 44 o 13.05000 0.3985000 12.79000 0.5693000 13.31000 0.5577000 -0.5238000     0.7970000 
1 1 1 24 16 46 o 11.70000 0.4580000 11.52000 0.6607000 11.89000 0.6346000 -0.3787000     0.9161000 
1 1 1 24 16 48 o 17.80000 0.3625000 18.35000 0.4938000 17.24000 0.5308000 1.112000       0.7249000 
1 1 1 24 16 50 o 3.697000 0.9068000 2.527000 1.212000  4.868000 1.349000  -2.341000      1.814000  
1 1 1 24 16 52 o 8.505000 0.8442000 9.431000 0.8268000 7.579000 1.472000  1.852000       1.688000  
1 1 1 24 16 54 o 3.756000 1.036000  4.024000 1.448000  3.488000 1.483000  0.5365000      2.073000  
1 1 1 24 16 56 o 5.174000 1.127000  6.638000 1.625000  3.709000 1.563000  2.929000       2.255000  
1 1 1 24 17 1  o 22.01000 0.2916000 21.96000 0.4108000 22.07000 0.4141000 -0.1066000     0.5833000 
1 1 1 24 17 3  o 36.50000 0.3950000 36.73000 0.4981000 36.28000 0.6131000 0.4512000      0.7900000 
1 1 1 24 17 5  o 48.34000 0.4208000 48.06000 0.5941000 48.61000 0.5961000 -0.5482000     0.8416000 
1 1 1 24 17 7  o 28.79000 0.2960000 28.84000 0.3984000 28.74000 0.4378000 0.9646000E-01  0.5919000 
1 1 1 24 17 9  o 29.60000 0.3320000 29.96000 0.4922000 29.23000 0.4457000 0.7294000      0.6640000 
1 1 1 24 17 11 o 34.18000 0.3878000 34.26000 0.5149000 34.10000 0.5801000 0.1532000      0.7757000 
1 1 1 24 17 13 o 42.01000 0.3913000 41.89000 0.5680000 42.12000 0.5385000 -0.2259000     0.7827000 
1 1 1 24 17 15 o 9.203000 0.4988000 9.307000 0.7799000 9.100000 0.6223000 0.2074000      0.9977000 
1 1 1 24 17 17 o 7.187000 0.6845000 7.286000 1.148000  7.088000 0.7452000 0.1979000      1.369000  
1 1 1 24 17 19 o 39.28000 0.3581000 39.31000 0.4490000 39.25000 0.5581000 0.6435000E-01  0.7163000 
1 1 1 24 17 21 o 14.29000 0.4353000 14.07000 0.4301000 14.52000 0.7569000 -0.4488000     0.8706000 
1 1 1 24 17 23 o 21.51000 0.3231000 21.03000 0.3658000 21.99000 0.5327000 -0.9547000     0.6462000 
1 1 1 24 17 25 o 12.94000 0.5149000 12.86000 0.5401000 13.02000 0.8767000 -0.1575000     1.030000  
1 1 1 24 17 27 o 21.50000 0.3234000 21.29000 0.3658000 21.71000 0.5334000 -0.4243000     0.6468000 
1 1 1 24 17 29 o 4.258000 1.048000  4.015000 1.502000  4.500000 1.462000  -0.4853000     2.096000  
1 1 1 24 17 31 o 12.78000 0.4403000 13.23000 0.5250000 12.34000 0.7069000 0.8975000      0.8806000 
1 1 1 24 17 33 o 17.27000 0.3425000 17.21000 0.4118000 17.32000 0.5475000 -0.1094000     0.6851000 
1 1 1 24 17 35 o 4.588000 0.9288000 3.268000 1.206000  5.908000 1.413000  -2.640000      1.858000  
1 1 1 24 17 37 o 4.986000 1.026000  5.037000 1.294000  4.936000 1.592000  0.1004000      2.051000  
1 1 1 24 17 39 o 22.90000 0.3381000 22.73000 0.4302000 23.07000 0.5217000 -0.3310000     0.6762000 
1 1 1 24 17 41 o 8.428000 0.6352000 7.853000 0.9955000 9.003000 0.7891000 -1.150000      1.270000  
1 1 1 24 17 43 o 10.63000 0.4655000 10.78000 0.6292000 10.48000 0.6861000 0.2965000      0.9309000 
1 1 1 24 17 45 o 5.392000 0.8416000 4.193000 1.335000  6.590000 1.025000  -2.397000      1.683000  
1 1 1 24 17 47 o 13.14000 0.4201000 12.74000 0.5976000 13.55000 0.5907000 -0.8077000     0.8403000 
1 1 1 24 17 49 o 4.840000 0.9363000 5.832000 1.228000  3.849000 1.414000  1.983000       1.873000  
1 1 1 24 17 51 o 6.628000 1.048000  6.488000 1.558000  6.768000 1.403000  -0.2796000     2.097000  
1 1 1 24 17 53 o 5.772000 1.058000  4.579000 1.603000  6.966000 1.380000  -2.386000      2.115000  
1 1 1 24 17 55 o 4.168000 0.9913000 4.251000 1.423000  4.085000 1.381000  0.1656000      1.983000  
1 1 1 24 18 0  o 33.89000 0.4657000 33.89000 0.4657000 33.89000 0.4657000 0.000000       0.000000  
1 1 1 24 18 2  o 26.11000 0.3408000 25.96000 0.4159000 26.26000 0.5400000 -0.2968000     0.6816000 
1 1 1 24 18 4  o 28.47000 0.2959000 28.74000 0.3961000 28.19000 0.4398000 0.5577000      0.5919000 
1 1 1 24 18 6  o 45.60000 0.3782000 45.56000 0.5013000 45.63000 0.5664000 -0.6515000E-01 0.7564000 
1 1 1 24 18 8  o 49.68000 0.4129000 49.61000 0.6274000 49.76000 0.5370000 -0.1576000     0.8259000 
1 1 1 24 18 10 o 25.17000 0.2821000 25.24000 0.4176000 25.11000 0.3794000 0.1280000      0.5642000 
1 1 1 24 18 12 o 20.69000 0.2851000 20.84000 0.3860000 20.53000 0.4196000 0.3092000      0.5702000 
1 1 1 24 18 14 o 30.29000 0.3553000 30.11000 0.4539000 30.47000 0.5468000 -0.3595000     0.7107000 
1 1 1 24 18 16 o 20.99000 0.2720000 21.30000 0.3794000 20.69000 0.3899000 0.6007000      0.5440000 
1 1 1 24 18 18 f 19.02000 0.3550000 19.28000 0.4707000 18.76000 0.5317000 0.5162000      0.7101000 
1 1 1 24 18 20 o 8.915000 0.5706000 8.262000 0.7591000 9.569000 0.8521000 -1.306000      1.141000  
1 1 1 24 18 22 f 17.31000 0.4352000 17.58000 0.5148000 17.03000 0.7019000 0.5440000      0.8705000 
1 1 1 24 18 24 o 47.18000 0.4073000 47.50000 0.5356000 46.87000 0.6137000 0.6266000      0.8145000 
1 1 1 24 18 26 o 12.08000 0.4648000 12.37000 0.5711000 11.79000 0.7334000 0.5867000      0.9295000 
1 1 1 24 18 28 o 14.60000 0.3932000 14.02000 0.4890000 15.19000 0.6160000 -1.170000      0.7865000 
1 1 1 24 18 30 o 44.58000 0.3929000 45.50000 0.5118000 43.66000 0.5963000 1.836000       0.7858000 
1 1 1 24 18 32 o 15.98000 0.3626000 15.98000 0.4273000 15.98000 0.5859000 -0.2096000E-02 0.7252000 
1 1 1 24 18 34 o 4.976000 0.9190000 4.972000 1.094000  4.979000 1.477000  -0.7341000E-02 1.838000  
1 1 1 24 18 36 o 8.307000 0.6694000 7.662000 0.7186000 8.951000 1.130000  -1.289000      1.339000  
1 1 1 24 18 38 o 5.618000 0.9379000 6.551000 0.9478000 4.685000 1.619000  1.867000       1.876000  
1 1 1 24 18 40 o 13.91000 0.3829000 13.70000 0.5403000 14.13000 0.5427000 -0.4303000     0.7658000 
1 1 1 24 18 42 o 11.62000 0.4726000 11.46000 0.7165000 11.78000 0.6165000 -0.3151000     0.9452000 
1 1 1 24 18 44 o 5.736000 0.8194000 5.811000 1.163000  5.660000 1.155000  0.1506000      1.639000  
1 1 1 24 18 46 o 13.61000 0.4090000 13.87000 0.5929000 13.36000 0.5636000 0.5068000      0.8181000 
1 1 1 24 18 48 o 12.39000 0.4935000 12.55000 0.6284000 12.23000 0.7611000 0.3116000      0.9870000 
1 1 1 24 18 50 o 10.95000 0.6036000 11.30000 0.7228000 10.59000 0.9670000 0.7064000      1.207000  
1 1 1 24 18 52 o 14.63000 0.4730000 14.36000 0.6087000 14.91000 0.7241000 -0.5528000     0.9459000 
1 1 1 24 18 54 o 9.282000 0.7423000 8.598000 1.258000  9.966000 0.7886000 -1.368000      1.485000  
1 1 1 24 19 1  o 10.41000 0.4096000 9.980000 0.5345000 10.83000 0.6208000 -0.8534000     0.8192000 
1 1 1 24 19 3  o 10.17000 0.3860000 10.21000 0.5484000 10.13000 0.5434000 0.7322000E-01  0.7720000 
1 1 1 24 19 5  o 87.94000 0.6691000 88.98000 1.025000  86.89000 0.8606000 2.097000       1.338000  
1 1 1 24 19 7  o 28.33000 0.3341000 27.96000 0.4858000 28.71000 0.4586000 -0.7469000     0.6681000 
1 1 1 24 19 9  o 22.43000 0.2852000 22.17000 0.3819000 22.68000 0.4236000 -0.5126000     0.5703000 
1 1 1 24 19 11 f 27.96000 0.3287000 28.09000 0.3937000 27.82000 0.5264000 0.2747000      0.6574000 
1 1 1 24 19 13 o 26.85000 0.2730000 27.01000 0.3879000 26.70000 0.3842000 0.3040000      0.5459000 
1 1 1 24 19 15 o 54.78000 0.4930000 54.67000 0.7984000 54.89000 0.5786000 -0.2256000     0.9860000 
1 1 1 24 19 17 o 69.27000 0.5175000 69.42000 0.6283000 69.11000 0.8224000 0.3060000      1.035000  
1 1 1 24 19 19 o 28.81000 0.3065000 29.26000 0.3551000 28.35000 0.4995000 0.9132000      0.6129000 
1 1 1 24 19 21 o 52.87000 0.4187000 52.80000 0.5002000 52.93000 0.6716000 -0.1270000     0.8374000 
1 1 1 24 19 23 o 23.99000 0.3281000 23.93000 0.4173000 24.06000 0.5065000 -0.1366000     0.6563000 
1 1 1 24 19 25 o 7.591000 1.173000  8.223000 1.325000  6.959000 1.937000  1.265000       2.347000  
1 1 1 24 19 27 o 15.74000 0.3994000 16.11000 0.4758000 15.37000 0.6417000 0.7353000      0.7988000 
1 1 1 24 19 29 o 31.97000 0.3287000 32.19000 0.3913000 31.75000 0.5283000 0.4382000      0.6574000 
1 1 1 24 19 31 o 19.97000 0.3228000 20.29000 0.3715000 19.65000 0.5280000 0.6412000      0.6456000 
1 1 1 24 19 33 o 17.99000 0.3432000 18.26000 0.3878000 17.71000 0.5664000 0.5552000      0.6864000 
1 1 1 24 19 35 o 11.66000 0.5067000 11.71000 0.4968000 11.61000 0.8833000 0.1024000      1.013000  
1 1 1 24 19 37 o 14.40000 0.3791000 14.52000 0.4457000 14.27000 0.6134000 0.2453000      0.7582000 
1 1 1 24 19 39 o 9.705000 0.5073000 10.03000 0.6716000 9.382000 0.7604000 0.6469000      1.015000  
1 1 1 24 19 41 o 2.931000 0.8532000 2.951000 1.216000  2.912000 1.197000  0.3807000E-01  1.706000  
1 1 1 24 19 43 f 11.76000 0.4283000 11.41000 0.6216000 12.11000 0.5894000 -0.6952000     0.8566000 
1 1 1 24 19 45 o 4.400000 0.9733000 4.418000 1.399000  4.381000 1.354000  0.3696000E-01  1.947000  
1 1 1 24 19 47 o 8.298000 0.6255000 7.916000 0.9071000 8.680000 0.8616000 -0.7646000     1.251000  
1 1 1 24 19 49 o 9.524000 0.6294000 8.937000 0.8178000 10.11000 0.9569000 -1.175000      1.259000  
1 1 1 24 19 51 o 2.915000 0.8791000 2.703000 1.218000  3.126000 1.268000  -0.4225000     1.758000  
1 1 1 24 19 53 o 4.729000 0.9424000 6.044000 1.266000  3.414000 1.396000  2.629000       1.885000  
1 1 1 24 19 55 o 4.482000 1.252000  5.058000 1.920000  3.905000 1.609000  1.153000       2.505000  
1 1 1 24 20 0  o 20.24000 0.3674000 20.24000 0.3674000 20.24000 0.3674000 0.000000       0.000000  
1 1 1 24 20 2  o 28.31000 0.2763000 28.03000 0.3921000 28.59000 0.3894000 -0.5593000     0.5526000 
1 1 1 24 20 4  o 12.97000 0.3363000 13.00000 0.4591000 12.93000 0.4915000 0.6564000E-01  0.6726000 
1 1 1 24 20 6  o 43.17000 0.3961000 43.46000 0.5798000 42.88000 0.5398000 0.5833000      0.7921000 
1 1 1 24 20 8  o 48.70000 0.4641000 49.06000 0.7130000 48.33000 0.5944000 0.7290000      0.9283000 
1 1 1 24 20 10 o 27.06000 0.3022000 27.02000 0.4275000 27.09000 0.4274000 -0.6753000E-01 0.6045000 
1 1 1 24 20 12 o 15.76000 0.3153000 16.56000 0.4308000 14.97000 0.4605000 1.583000       0.6306000 
1 1 1 24 20 14 o 54.07000 0.4334000 54.06000 0.6512000 54.08000 0.5721000 -0.1667000E-01 0.8668000 
1 1 1 24 20 16 o 32.28000 0.3166000 33.18000 0.3724000 31.37000 0.5122000 1.807000       0.6332000 
1 1 1 24 20 18 o 32.21000 0.3142000 31.72000 0.3595000 32.70000 0.5155000 -0.9857000     0.6284000 
1 1 1 24 20 20 o 33.85000 0.3233000 34.63000 0.3831000 33.07000 0.5208000 1.566000       0.6465000 
1 1 1 24 20 22 o 14.73000 0.3900000 14.63000 0.4537000 14.83000 0.6345000 -0.2056000     0.7801000 
1 1 1 24 20 24 o 13.04000 0.4152000 12.65000 0.5347000 13.43000 0.6355000 -0.7800000     0.8305000 
1 1 1 24 20 26 o 5.257000 0.9789000 5.254000 1.004000  5.261000 1.681000  -0.7094000E-02 1.958000  
1 1 1 24 20 28 o 20.02000 0.3375000 19.95000 0.3929000 20.09000 0.5488000 -0.1363000     0.6749000 
1 1 1 24 20 30 o 17.02000 0.4272000 18.03000 0.4264000 16.01000 0.7405000 2.016000       0.8545000 
1 1 1 24 20 32 o 18.03000 0.3379000 17.72000 0.3799000 18.35000 0.5588000 -0.6249000     0.6758000 
1 1 1 24 20 34 o 18.93000 0.3314000 19.09000 0.3724000 18.77000 0.5483000 0.3126000      0.6628000 
1 1 1 24 20 36 o 4.672000 0.8766000 3.921000 1.168000  5.423000 1.307000  -1.501000      1.753000  
1 1 1 24 20 38 o 9.107000 0.5689000 8.418000 0.6565000 9.797000 0.9292000 -1.379000      1.138000  
1 1 1 24 20 40 o 2.856000 0.8730000 2.611000 1.215000  3.100000 1.254000  -0.4885000     1.746000  
1 1 1 24 20 42 o 4.008000 0.9098000 3.689000 1.279000  4.327000 1.294000  -0.6373000     1.820000  
1 1 1 24 20 44 o 3.243000 0.8829000 2.687000 1.192000  3.798000 1.303000  -1.112000      1.766000  
1 1 1 24 20 46 o 6.838000 0.7254000 6.486000 1.064000  7.189000 0.9860000 -0.7027000     1.451000  
1 1 1 24 20 48 o 6.254000 0.9938000 5.789000 1.184000  6.719000 1.597000  -0.9299000     1.988000  
1 1 1 24 20 50 o 4.630000 1.033000  5.046000 1.482000  4.215000 1.440000  0.8310000      2.066000  
1 1 1 24 20 52 o 8.864000 0.6490000 9.180000 0.8871000 8.548000 0.9475000 0.6323000      1.298000  
1 1 1 24 20 54 o 12.11000 0.5527000 12.33000 0.7520000 11.89000 0.8102000 0.4314000      1.105000  
1 1 1 24 21 1  o 14.66000 0.2879000 14.65000 0.3886000 14.66000 0.4249000 -0.1284000E-01 0.5758000 
1 1 1 24 21 3  o 12.74000 0.3266000 12.19000 0.4425000 13.30000 0.4805000 -1.118000      0.6533000 
1 1 1 24 21 5  o 93.22000 0.8371000 92.74000 1.295000  93.70000 1.060000  -0.9615000     1.674000  
1 1 1 24 21 7  o 39.49000 0.4109000 39.79000 0.5137000 39.20000 0.6413000 0.5935000      0.8217000 
1 1 1 24 21 9  o 41.53000 0.3530000 41.82000 0.5292000 41.23000 0.4673000 0.5981000      0.7060000 
1 1 1 24 21 11 o 30.65000 0.3276000 30.27000 0.4368000 31.02000 0.4884000 -0.7494000     0.6552000 
1 1 1 24 21 13 o 48.29000 0.3713000 48.64000 0.5288000 47.95000 0.5213000 0.6977000      0.7425000 
1 1 1 24 21 15 o 40.23000 0.3894000 40.36000 0.5444000 40.10000 0.5568000 0.2610000      0.7787000 
1 1 1 24 21 17 o 32.22000 0.3461000 33.01000 0.4723000 31.43000 0.5062000 1.577000       0.6923000 
1 1 1 24 21 19 o 30.42000 0.3060000 30.27000 0.3496000 30.57000 0.5023000 -0.2975000     0.6120000 
1 1 1 24 21 21 o 20.44000 0.3875000 20.50000 0.5707000 20.38000 0.5243000 0.1240000      0.7750000 
1 1 1 24 21 23 o 20.93000 0.3105000 20.39000 0.3350000 21.48000 0.5228000 -1.095000      0.6210000 
1 1 1 24 21 25 o 5.582000 0.9223000 4.613000 1.030000  6.550000 1.530000  -1.937000      1.845000  
1 1 1 24 21 27 o 44.42000 0.3977000 44.37000 0.5089000 44.47000 0.6112000 -0.1033000     0.7954000 
1 1 1 24 21 29 f 17.21000 0.4096000 17.42000 0.4311000 17.00000 0.6966000 0.4212000      0.8192000 
1 1 1 24 21 31 o 16.13000 0.3364000 16.71000 0.3763000 15.56000 0.5578000 1.146000       0.6729000 
1 1 1 24 21 33 o 8.562000 0.6206000 8.990000 0.5689000 8.134000 1.103000  0.8562000      1.241000  
1 1 1 24 21 35 o 12.03000 0.4027000 11.78000 0.4786000 12.27000 0.6479000 -0.4957000     0.8055000 
1 1 1 24 21 37 o 8.601000 0.6575000 9.083000 0.6007000 8.119000 1.170000  0.9645000      1.315000  
1 1 1 24 21 39 o 5.156000 0.8293000 5.080000 1.056000  5.232000 1.279000  -0.1521000     1.659000  
1 1 1 24 21 41 o 6.316000 0.7760000 6.563000 1.160000  6.070000 1.031000  0.4932000      1.552000  
1 1 1 24 21 43 o 3.167000 0.8777000 2.599000 1.152000  3.735000 1.324000  -1.136000      1.755000  
1 1 1 24 21 45 o 4.670000 0.8742000 3.484000 1.342000  5.857000 1.120000  -2.373000      1.748000  
1 1 1 24 21 47 o 9.260000 0.7769000 10.55000 0.6847000 7.966000 1.395000  2.589000       1.554000  
1 1 1 24 21 49 o 3.143000 0.9238000 2.695000 1.193000  3.590000 1.411000  -0.8947000     1.848000  
1 1 1 24 21 51 o 12.01000 0.4887000 11.49000 0.6981000 12.53000 0.6842000 -1.040000      0.9774000 
1 1 1 24 21 53 o 3.944000 0.9184000 3.136000 1.287000  4.751000 1.310000  -1.616000      1.837000  
1 1 1 24 22 0  o 38.55000 0.6162000 38.55000 0.6162000 38.55000 0.6162000 0.000000       0.000000  
1 1 1 24 22 2  o 23.76000 0.2817000 23.68000 0.4021000 23.85000 0.3946000 -0.1752000     0.5634000 
1 1 1 24 22 4  o 28.07000 0.3505000 28.72000 0.5748000 27.43000 0.4011000 1.284000       0.7010000 
1 1 1 24 22 6  o 46.95000 0.3840000 47.09000 0.5764000 46.81000 0.5075000 0.2824000      0.7680000 
1 1 1 24 22 8  o 49.47000 0.3783000 49.62000 0.5361000 49.31000 0.5339000 0.3168000      0.7565000 
1 1 1 24 22 10 o 9.013000 0.3748000 8.883000 0.5128000 9.142000 0.5467000 -0.2583000     0.7496000 
1 1 1 24 22 12 o 24.90000 0.2864000 25.09000 0.3733000 24.71000 0.4345000 0.3824000      0.5729000 
1 1 1 24 22 14 o 28.09000 0.3539000 28.46000 0.5051000 27.72000 0.4958000 0.7385000      0.7078000 
1 1 1 24 22 16 o 13.85000 0.4523000 14.27000 0.6490000 13.43000 0.6301000 0.8426000      0.9046000 
1 1 1 24 22 18 o 34.18000 0.3717000 33.60000 0.5258000 34.77000 0.5256000 -1.170000      0.7434000 
1 1 1 24 22 20 o 26.90000 0.3223000 27.37000 0.4080000 26.43000 0.4989000 0.9387000      0.6445000 
1 1 1 24 22 22 o 21.75000 0.3082000 20.82000 0.3188000 22.68000 0.5274000 -1.861000      0.6163000 
1 1 1 24 22 24 o 16.37000 0.3401000 16.06000 0.3426000 16.68000 0.5876000 -0.6204000     0.6802000 
1 1 1 24 22 26 o 32.26000 0.3311000 32.32000 0.4019000 32.21000 0.5263000 0.1155000      0.6622000 
1 1 1 24 22 28 o 5.799000 0.8783000 4.464000 1.368000  7.135000 1.102000  -2.671000      1.757000  
1 1 1 24 22 30 o 15.29000 0.4060000 15.54000 0.4087000 15.04000 0.7015000 0.5059000      0.8119000 
1 1 1 24 22 32 o 18.44000 0.3895000 18.53000 0.4517000 18.35000 0.6346000 0.1831000      0.7789000 
1 1 1 24 22 34 o 11.46000 0.4280000 11.37000 0.5229000 11.54000 0.6778000 -0.1720000     0.8560000 
1 1 1 24 22 36 o 12.26000 0.4003000 11.95000 0.4694000 12.56000 0.6484000 -0.6093000     0.8005000 
1 1 1 24 22 38 o 6.963000 0.6494000 6.936000 0.7609000 6.990000 1.052000  -0.5430000E-01 1.299000  
1 1 1 24 22 40 o 7.134000 0.6250000 6.686000 0.7919000 7.582000 0.9671000 -0.8959000     1.250000  
1 1 1 24 22 42 o 4.576000 0.9854000 4.894000 1.482000  4.259000 1.299000  0.6347000      1.971000  
1 1 1 24 22 44 o 3.022000 0.8929000 3.164000 1.308000  2.880000 1.216000  0.2832000      1.786000  
1 1 1 24 22 46 o 7.963000 0.7339000 7.330000 0.9118000 8.596000 1.150000  -1.266000      1.468000  
1 1 1 24 22 48 o 4.053000 1.017000  3.981000 1.349000  4.125000 1.521000  -0.1440000     2.033000  
1 1 1 24 22 50 o 6.894000 0.8453000 7.235000 1.216000  6.552000 1.174000  0.6833000      1.691000  
1 1 1 24 22 52 o 6.170000 0.8551000 6.210000 1.314000  6.131000 1.094000  0.7907000E-01  1.710000  
1 1 1 24 23 1  o 26.87000 0.2965000 26.63000 0.4547000 27.10000 0.3807000 -0.4701000     0.5930000 
1 1 1 24 23 3  o 31.95000 0.3187000 32.18000 0.4976000 31.72000 0.3984000 0.4571000      0.6374000 
1 1 1 24 23 5  o 23.31000 0.2657000 23.30000 0.3804000 23.32000 0.3710000 -0.2210000E-01 0.5314000 
1 1 1 24 23 7  o 38.17000 0.3167000 38.29000 0.4458000 38.04000 0.4499000 0.2446000      0.6333000 
1 1 1 24 23 9  o 60.08000 0.4401000 60.86000 0.6307000 59.31000 0.6139000 1.550000       0.8802000 
1 1 1 24 23 11 o 25.82000 0.4618000 24.60000 0.5848000 27.03000 0.7149000 -2.434000      0.9236000 
1 1 1 24 23 13 o 38.72000 0.3920000 38.85000 0.5536000 38.59000 0.5553000 0.2578000      0.7841000 
1 1 1 24 23 15 o 29.12000 0.4071000 29.74000 0.6439000 28.49000 0.4983000 1.244000       0.8142000 
1 1 1 24 23 17 o 16.93000 0.4150000 16.88000 0.5874000 16.98000 0.5865000 -0.1006000     0.8301000 
1 1 1 24 23 19 o 17.29000 0.4200000 17.62000 0.6126000 16.96000 0.5748000 0.6606000      0.8400000 
1 1 1 24 23 21 o 24.59000 0.3650000 23.89000 0.5289000 25.29000 0.5031000 -1.399000      0.7299000 
1 1 1 24 23 23 o 20.30000 0.3059000 20.52000 0.3130000 20.09000 0.5256000 0.4265000      0.6117000 
1 1 1 24 23 25 o 29.38000 0.3896000 29.51000 0.4257000 29.26000 0.6526000 0.2508000      0.7792000 
1 1 1 24 23 27 o 13.85000 0.3691000 13.63000 0.3973000 14.08000 0.6220000 -0.4559000     0.7381000 
1 1 1 24 23 29 o 13.87000 0.4376000 14.32000 0.4452000 13.43000 0.7536000 0.8920000      0.8752000 
1 1 1 24 23 31 o 18.34000 0.3513000 18.63000 0.3428000 18.06000 0.6133000 0.5661000      0.7026000 
1 1 1 24 23 33 o 26.86000 0.3974000 27.25000 0.4828000 26.47000 0.6314000 0.7815000      0.7949000 
1 1 1 24 23 35 f 11.71000 0.4059000 12.00000 0.4385000 11.41000 0.6833000 0.5980000      0.8119000 
1 1 1 24 23 37 o 5.892000 0.8410000 5.824000 0.8801000 5.959000 1.433000  -0.1357000     1.682000  
1 1 1 24 23 39 o 4.514000 0.8531000 5.149000 1.013000  3.879000 1.373000  1.270000       1.706000  
1 1 1 24 23 41 o 9.077000 0.5346000 10.81000 0.6337000 7.344000 0.8611000 3.465000       1.069000  
1 1 1 24 23 43 o 5.248000 0.9705000 4.914000 1.533000  5.582000 1.191000  -0.6686000     1.941000  
1 1 1 24 23 45 o 3.721000 0.9678000 3.694000 1.265000  3.749000 1.465000  -0.5490000E-01 1.936000  
1 1 1 24 23 47 o 5.199000 0.9292000 5.535000 1.217000  4.863000 1.405000  0.6715000      1.858000  
1 1 1 24 23 49 o 3.074000 0.9115000 3.467000 1.371000  2.682000 1.201000  0.7849000      1.823000  
1 1 1 24 23 51 o 3.287000 0.9675000 3.480000 1.375000  3.094000 1.361000  0.3860000      1.935000  
1 1 1 24 23 53 o 3.887000 1.129000  4.410000 1.715000  3.365000 1.471000  1.045000       2.259000  
1 1 1 24 24 0  f 13.02000 0.5435000 13.02000 0.5435000 13.02000 0.5435000 0.000000       0.000000  
1 1 1 24 24 2  o 13.55000 0.3479000 13.45000 0.5648000 13.65000 0.4064000 -0.1976000     0.6958000 
1 1 1 24 24 4  f 5.450000 0.6983000 5.462000 0.8962000 5.438000 1.071000  0.2405000E-01  1.397000  
1 1 1 24 24 6  o 40.72000 0.3287000 40.63000 0.4643000 40.81000 0.4655000 -0.1798000     0.6575000 
1 1 1 24 24 8  f 35.88000 0.3387000 36.34000 0.4876000 35.41000 0.4703000 0.9310000      0.6774000 
1 1 1 24 24 10 o 6.879000 0.8198000 7.453000 1.093000  6.305000 1.222000  1.147000       1.640000  
1 1 1 24 24 12 o 11.44000 0.6540000 12.31000 0.7111000 10.56000 1.098000  1.744000       1.308000  
1 1 1 24 24 14 o 22.31000 0.4091000 22.70000 0.5167000 21.93000 0.6345000 0.7744000      0.8182000 
1 1 1 24 24 16 o 25.05000 0.3615000 25.51000 0.5176000 24.59000 0.5048000 0.9196000      0.7230000 
1 1 1 24 24 18 o 23.65000 0.3715000 23.44000 0.5393000 23.87000 0.5110000 -0.4275000     0.7429000 
1 1 1 24 24 20 o 10.25000 0.6274000 10.06000 0.9533000 10.44000 0.8159000 -0.3856000     1.255000  
1 1 1 24 24 22 o 15.98000 0.4157000 15.97000 0.6100000 15.98000 0.5651000 -0.1915000E-01 0.8315000 
1 1 1 24 24 24 o 15.64000 0.4476000 15.28000 0.6659000 16.01000 0.5983000 -0.7312000     0.8952000 
1 1 1 24 24 26 f 23.94000 0.3441000 24.94000 0.4553000 22.94000 0.5161000 2.005000       0.6882000 
1 1 1 24 24 28 o 17.21000 0.3893000 16.72000 0.3671000 17.69000 0.6866000 -0.9636000     0.7786000 
1 1 1 24 24 30 o 17.30000 0.3638000 17.49000 0.3370000 17.11000 0.6449000 0.3774000      0.7276000 
1 1 1 24 24 32 o 7.309000 0.6221000 7.390000 0.6550000 7.227000 1.058000  0.1636000      1.244000  
1 1 1 24 24 34 o 7.486000 0.7430000 7.295000 0.8657000 7.677000 1.208000  -0.3816000     1.486000  
1 1 1 24 24 36 o 6.234000 0.7080000 5.791000 0.8568000 6.677000 1.127000  -0.8869000     1.416000  
1 1 1 24 24 38 o 3.560000 0.8971000 3.476000 1.161000  3.644000 1.368000  -0.1681000     1.794000  
1 1 1 24 24 40 o 3.974000 0.9118000 3.577000 1.226000  4.371000 1.350000  -0.7946000     1.824000  
1 1 1 24 24 42 o 7.595000 0.6200000 7.741000 0.8511000 7.449000 0.9019000 0.2917000      1.240000  
1 1 1 24 24 44 o 4.099000 1.045000  3.667000 1.466000  4.532000 1.490000  -0.8642000     2.090000  
1 1 1 24 24 46 o 4.543000 1.022000  5.410000 1.515000  3.677000 1.370000  1.733000       2.043000  
1 1 1 24 24 48 o 11.56000 0.5294000 10.90000 0.7054000 12.22000 0.7897000 -1.324000      1.059000  
1 1 1 24 24 50 o 7.306000 0.7802000 7.854000 1.035000  6.758000 1.167000  1.097000       1.560000  
1 1 1 24 24 52 o 4.817000 0.9773000 5.472000 1.354000  4.162000 1.410000  1.310000       1.955000  
1 1 1 24 25 1  o 31.49000 0.3127000 30.93000 0.4765000 32.06000 0.4050000 -1.128000      0.6254000 
1 1 1 24 25 3  o 32.16000 0.2913000 32.44000 0.4165000 31.89000 0.4073000 0.5508000      0.5826000 
1 1 1 24 25 5  o 14.19000 0.2975000 14.54000 0.4197000 13.83000 0.4218000 0.7097000      0.5950000 
1 1 1 24 25 7  o 51.62000 0.3896000 52.10000 0.5560000 51.14000 0.5460000 0.9585000      0.7793000 
1 1 1 24 25 9  o 54.42000 0.4802000 54.28000 0.6774000 54.57000 0.6808000 -0.2829000     0.9604000 
1 1 1 24 25 11 o 21.52000 0.4547000 21.25000 0.5237000 21.78000 0.7434000 -0.5315000     0.9093000 
1 1 1 24 25 13 o 11.46000 0.5263000 11.73000 0.7528000 11.18000 0.7357000 0.5464000      1.053000  
1 1 1 24 25 15 o 28.82000 0.4149000 28.70000 0.6452000 28.94000 0.5217000 -0.2449000     0.8298000 
1 1 1 24 25 17 o 56.65000 0.4980000 56.53000 0.7030000 56.76000 0.7054000 -0.2294000     0.9959000 
1 1 1 24 25 19 o 18.96000 0.3931000 19.03000 0.5716000 18.89000 0.5399000 0.1423000      0.7863000 
1 1 1 24 25 21 o 24.57000 0.3670000 24.07000 0.5197000 25.07000 0.5184000 -1.004000      0.7341000 
1 1 1 24 25 23 o 28.35000 0.3758000 28.10000 0.5448000 28.60000 0.5176000 -0.4968000     0.7515000 
1 1 1 24 25 25 o 14.16000 0.5882000 14.41000 0.8837000 13.90000 0.7765000 0.5103000      1.176000  
1 1 1 24 25 27 o 5.769000 0.7057000 3.995000 0.6410000 7.544000 1.257000  -3.549000      1.411000  
1 1 1 24 25 29 o 8.319000 0.5553000 7.644000 0.5054000 8.995000 0.9889000 -1.351000      1.111000  
1 1 1 24 25 31 o 9.907000 0.4509000 9.988000 0.4686000 9.827000 0.7704000 0.1606000      0.9017000 
1 1 1 24 25 33 f 4.121000 0.8765000 3.340000 1.115000  4.902000 1.353000  -1.563000      1.753000  
1 1 1 24 25 35 o 8.559000 0.5668000 8.677000 0.6984000 8.440000 0.8929000 0.2366000      1.134000  
1 1 1 24 25 37 f 11.60000 0.4716000 11.56000 0.4698000 11.64000 0.8179000 -0.8157000E-01 0.9432000 
1 1 1 24 25 39 o 15.94000 0.3693000 15.90000 0.4584000 15.98000 0.5792000 -0.8371000E-01 0.7387000 
1 1 1 24 25 41 o 8.804000 0.5843000 9.290000 0.6999000 8.319000 0.9359000 0.9707000      1.169000  
1 1 1 24 25 43 o 9.114000 0.5881000 9.051000 0.7312000 9.177000 0.9212000 -0.1263000     1.176000  
1 1 1 24 25 45 o 4.345000 1.038000  4.275000 1.505000  4.415000 1.431000  -0.1405000     2.076000  
1 1 1 24 25 47 o 3.529000 1.055000  3.289000 1.380000  3.770000 1.596000  -0.4819000     2.110000  
1 1 1 24 25 49 o 4.208000 1.023000  3.770000 1.461000  4.645000 1.432000  -0.8753000     2.046000  
1 1 1 24 25 51 o 2.747000 0.8480000 3.057000 1.267000  2.437000 1.127000  0.6200000      1.696000  
1 1 1 24 26 0  o 10.59000 0.5104000 10.59000 0.5104000 10.59000 0.5104000 0.000000       0.000000  
1 1 1 24 26 2  o 26.24000 0.3000000 26.98000 0.4674000 25.51000 0.3761000 1.464000       0.5999000 
1 1 1 24 26 4  o 27.72000 0.2780000 27.74000 0.3893000 27.71000 0.3970000 0.3196000E-01  0.5560000 
1 1 1 24 26 6  o 42.57000 0.3747000 42.70000 0.4805000 42.43000 0.5750000 0.2767000      0.7493000 
1 1 1 24 26 8  o 21.24000 0.3666000 21.29000 0.5257000 21.18000 0.5111000 0.1125000      0.7332000 
1 1 1 24 26 10 o 21.51000 0.4454000 21.49000 0.5283000 21.54000 0.7173000 -0.5394000E-01 0.8909000 
1 1 1 24 26 12 o 5.940000 1.101000  6.122000 1.349000  5.759000 1.740000  0.3630000      2.201000  
1 1 1 24 26 14 f 4.177000 0.9560000 2.866000 1.306000  5.488000 1.397000  -2.622000      1.912000  
1 1 1 24 26 16 o 30.28000 0.3722000 30.11000 0.5245000 30.46000 0.5283000 -0.3549000     0.7444000 
1 1 1 24 26 18 o 31.79000 0.3694000 31.54000 0.5302000 32.04000 0.5146000 -0.4967000     0.7389000 
1 1 1 24 26 20 o 22.62000 0.3758000 22.88000 0.5387000 22.35000 0.5241000 0.5293000      0.7515000 
1 1 1 24 26 22 o 13.01000 0.4992000 12.88000 0.7318000 13.14000 0.6790000 -0.2655000     0.9983000 
1 1 1 24 26 24 o 11.12000 0.6793000 11.72000 1.034000  10.51000 0.8816000 1.214000       1.359000  
1 1 1 24 26 26 o 17.96000 0.4412000 17.67000 0.6879000 18.25000 0.5526000 -0.5739000     0.8823000 
1 1 1 24 26 28 o 11.93000 0.4858000 11.00000 0.6495000 12.86000 0.7226000 -1.868000      0.9716000 
1 1 1 24 26 30 o 9.878000 0.4632000 9.623000 0.4997000 10.13000 0.7801000 -0.5102000     0.9264000 
1 1 1 24 26 32 o 8.608000 0.4909000 8.127000 0.5387000 9.089000 0.8208000 -0.9621000     0.9818000 
1 1 1 24 26 34 o 25.89000 0.3312000 26.33000 0.4316000 25.45000 0.5024000 0.8749000      0.6623000 
1 1 1 24 26 36 o 7.551000 0.6153000 8.165000 0.7492000 6.937000 0.9763000 1.227000       1.231000  
1 1 1 24 26 38 o 11.48000 0.5008000 11.43000 0.5326000 11.52000 0.8483000 -0.8156000E-01 1.002000  
1 1 1 24 26 40 o 4.396000 0.9170000 3.772000 1.209000  5.020000 1.379000  -1.248000      1.834000  
1 1 1 24 26 42 o 4.227000 1.005000  4.078000 1.383000  4.375000 1.458000  -0.2969000     2.009000  
1 1 1 24 26 44 o 5.396000 0.9147000 5.081000 1.248000  5.711000 1.337000  -0.6292000     1.829000  
1 1 1 24 26 46 o 4.566000 0.9588000 3.872000 1.390000  5.259000 1.321000  -1.386000      1.918000  
1 1 1 24 26 48 o 6.273000 0.9313000 5.589000 1.450000  6.956000 1.169000  -1.367000      1.863000  
1 1 1 24 26 50 o 3.161000 0.9156000 3.326000 1.347000  2.995000 1.241000  0.3308000      1.831000  
1 1 1 24 27 1  o 21.04000 0.3003000 20.72000 0.4706000 21.37000 0.3733000 -0.6517000     0.6006000 
1 1 1 24 27 3  o 42.27000 0.3371000 42.33000 0.4786000 42.20000 0.4748000 0.1287000      0.6742000 
1 1 1 24 27 5  o 33.79000 0.3254000 33.30000 0.4194000 34.28000 0.4976000 -0.9820000     0.6508000 
1 1 1 24 27 7  o 16.03000 0.4052000 16.07000 0.5762000 15.99000 0.5697000 0.8696000E-01  0.8103000 
1 1 1 24 27 9  o 29.94000 0.3584000 29.70000 0.5040000 30.18000 0.5096000 -0.4789000     0.7167000 
1 1 1 24 27 11 o 9.978000 0.5862000 10.65000 0.8096000 9.306000 0.8479000 1.343000       1.172000  
1 1 1 24 27 13 o 13.22000 0.4800000 12.77000 0.6924000 13.67000 0.6651000 -0.8917000     0.9601000 
1 1 1 24 27 15 o 20.51000 0.4371000 21.11000 0.6843000 19.91000 0.5442000 1.203000       0.8743000 
1 1 1 24 27 17 o 15.57000 0.4393000 15.72000 0.6274000 15.42000 0.6151000 0.2955000      0.8786000 
1 1 1 24 27 19 o 10.39000 0.5911000 9.948000 0.9041000 10.83000 0.7616000 -0.8781000     1.182000  
1 1 1 24 27 21 o 9.177000 0.6718000 7.997000 1.052000  10.36000 0.8355000 -2.362000      1.344000  
1 1 1 24 27 23 o 7.382000 1.038000  5.207000 1.794000  9.556000 1.043000  -4.349000      2.075000  
1 1 1 24 27 25 o 16.90000 0.3996000 16.55000 0.6188000 17.25000 0.5059000 -0.6906000     0.7993000 
1 1 1 24 27 27 o 18.76000 0.5404000 18.34000 0.8896000 19.18000 0.6139000 -0.8390000     1.081000  
1 1 1 24 27 29 o 6.061000 0.8666000 6.696000 1.057000  5.426000 1.373000  1.270000       1.733000  
1 1 1 24 27 31 o 13.91000 0.3840000 14.37000 0.4400000 13.44000 0.6295000 0.9348000      0.7680000 
1 1 1 24 27 33 o 5.585000 0.7114000 4.959000 0.8289000 6.211000 1.156000  -1.252000      1.423000  
1 1 1 24 27 35 o 7.171000 0.6615000 6.862000 0.8782000 7.479000 0.9894000 -0.6171000     1.323000  
1 1 1 24 27 37 o 3.960000 0.9432000 3.670000 1.266000  4.249000 1.398000  -0.5788000     1.886000  
1 1 1 24 27 39 o 5.099000 0.8634000 5.918000 0.9869000 4.279000 1.417000  1.640000       1.727000  
1 1 1 24 27 41 o 11.02000 0.5665000 10.73000 0.5624000 11.32000 0.9835000 -0.5885000     1.133000  
1 1 1 24 27 43 o 6.082000 0.8500000 7.116000 0.9436000 5.048000 1.414000  2.068000       1.700000  
1 1 1 24 27 45 o 5.377000 0.9327000 4.662000 1.399000  6.091000 1.233000  -1.429000      1.865000  
1 1 1 24 27 47 f 6.709000 0.8007000 6.553000 1.018000  6.866000 1.236000  -0.3130000     1.601000  
1 1 1 24 27 49 o 4.225000 1.028000  3.697000 1.569000  4.753000 1.328000  -1.056000      2.055000  
1 1 1 24 27 51 o 2.964000 1.366000  2.964000 1.366000  ?        ?         ?              ?         
1 1 1 24 28 0  o 3.009000 1.189000  3.009000 1.189000  3.009000 1.189000  0.000000       0.000000  
1 1 1 24 28 2  o 23.77000 0.3000000 23.82000 0.4661000 23.73000 0.3779000 0.8804000E-01  0.6000000 
1 1 1 24 28 4  o 24.26000 0.3412000 24.40000 0.4891000 24.12000 0.4759000 0.2826000      0.6824000 
1 1 1 24 28 6  o 17.69000 0.4091000 18.18000 0.6133000 17.21000 0.5418000 0.9643000      0.8183000 
1 1 1 24 28 8  o 14.02000 0.4581000 13.62000 0.6660000 14.42000 0.6293000 -0.7926000     0.9163000 
1 1 1 24 28 10 o 8.557000 0.7140000 8.999000 0.9428000 8.115000 1.073000  0.8836000      1.428000  
1 1 1 24 28 12 o 31.58000 0.4295000 31.04000 0.5108000 32.11000 0.6906000 -1.076000      0.8590000 
1 1 1 24 28 14 o 22.42000 0.3826000 22.53000 0.5328000 22.32000 0.5493000 0.2120000      0.7652000 
1 1 1 24 28 16 o 42.37000 0.4192000 41.94000 0.5828000 42.80000 0.6028000 -0.8618000     0.8385000 
1 1 1 24 28 18 o 22.13000 0.3938000 22.30000 0.5536000 21.96000 0.5602000 0.3415000      0.7876000 
1 1 1 24 28 20 o 32.02000 0.4651000 30.79000 0.6697000 33.24000 0.6456000 -2.450000      0.9302000 
1 1 1 24 28 22 o 34.47000 0.4738000 33.73000 0.6673000 35.20000 0.6728000 -1.463000      0.9477000 
1 1 1 24 28 24 o 6.694000 0.9253000 5.489000 1.363000  7.899000 1.252000  -2.410000      1.851000  
1 1 1 24 28 26 o 16.79000 0.4888000 16.17000 0.7463000 17.41000 0.6313000 -1.243000      0.9775000 
1 1 1 24 28 28 o 14.74000 0.4424000 14.16000 0.6496000 15.32000 0.6008000 -1.154000      0.8848000 
1 1 1 24 28 30 o 18.43000 0.3931000 18.50000 0.5644000 18.35000 0.5474000 0.1506000      0.7862000 
1 1 1 24 28 32 o 5.899000 0.8821000 6.351000 1.233000  5.448000 1.262000  0.9030000      1.764000  
1 1 1 24 28 34 o 9.055000 0.5213000 8.420000 0.6715000 9.689000 0.7976000 -1.269000      1.043000  
1 1 1 24 28 36 o 4.014000 0.9709000 4.450000 1.264000  3.578000 1.474000  0.8720000      1.942000  
1 1 1 24 28 38 o 8.644000 0.6618000 8.388000 0.9888000 8.900000 0.8800000 -0.5118000     1.324000  
1 1 1 24 28 40 o 4.840000 1.000000  4.391000 1.171000  5.289000 1.622000  -0.8982000     2.000000  
1 1 1 24 28 42 o 5.412000 0.9710000 6.042000 1.118000  4.781000 1.588000  1.262000       1.942000  
1 1 1 24 28 44 f 11.01000 0.4955000 11.17000 0.6671000 10.86000 0.7329000 0.3122000      0.9910000 
1 1 1 24 28 46 o 4.318000 0.9572000 4.478000 1.363000  4.158000 1.344000  0.3198000      1.914000  
1 1 1 24 28 48 o 12.75000 0.5294000 13.05000 0.7008000 12.45000 0.7936000 0.6049000      1.059000  
1 1 1 24 28 50 o 3.958000 1.117000  3.979000 1.757000  3.937000 1.380000  0.4174000E-01  2.234000  
1 1 1 24 29 1  o 14.04000 0.4085000 14.02000 0.5819000 14.05000 0.5734000 -0.2978000E-01 0.8170000 
1 1 1 24 29 3  o 23.02000 0.3098000 23.08000 0.4835000 22.96000 0.3876000 0.1209000      0.6197000 
1 1 1 24 29 5  o 6.377000 0.8351000 5.495000 1.292000  7.258000 1.059000  -1.763000      1.670000  
1 1 1 24 29 7  o 13.06000 0.4573000 13.09000 0.6477000 13.02000 0.6458000 0.6250000E-01  0.9146000 
1 1 1 24 29 9  o 27.12000 0.3577000 27.72000 0.5009000 26.52000 0.5109000 1.196000       0.7155000 
1 1 1 24 29 11 o 24.51000 0.4357000 24.85000 0.5058000 24.18000 0.7097000 0.6760000      0.8715000 
1 1 1 24 29 13 o 13.10000 0.5041000 12.78000 0.7351000 13.42000 0.6900000 -0.6465000     1.008000  
1 1 1 24 29 15 o 9.744000 0.7311000 9.586000 1.167000  9.902000 0.8814000 -0.3167000     1.462000  
1 1 1 24 29 17 o 16.40000 0.4286000 16.32000 0.5990000 16.48000 0.6132000 -0.1664000     0.8573000 
1 1 1 24 29 19 o 12.38000 0.6568000 12.67000 0.9479000 12.10000 0.9094000 0.5697000      1.314000  
1 1 1 24 29 21 o 18.63000 0.4407000 18.19000 0.7102000 19.07000 0.5219000 -0.8775000     0.8814000 
1 1 1 24 29 23 o 17.88000 0.3962000 17.86000 0.5726000 17.90000 0.5477000 -0.4179000E-01 0.7924000 
1 1 1 24 29 25 o 19.27000 0.4393000 19.55000 0.6317000 18.99000 0.6107000 0.5584000      0.8786000 
1 1 1 24 29 27 o 9.360000 0.6223000 9.103000 0.9532000 9.616000 0.8002000 -0.5132000     1.245000  
1 1 1 24 29 29 o 11.09000 0.5021000 11.47000 0.7112000 10.70000 0.7089000 0.7742000      1.004000  
1 1 1 24 29 31 o 9.167000 0.6010000 9.161000 0.8747000 9.173000 0.8244000 -0.1205000E-01 1.202000  
1 1 1 24 29 33 o 4.734000 0.9609000 5.320000 1.321000  4.148000 1.396000  1.172000       1.922000  
1 1 1 24 29 35 o 2.665000 0.8120000 2.282000 1.008000  3.049000 1.273000  -0.7670000     1.624000  
1 1 1 24 29 37 o 2.740000 0.8411000 2.724000 1.149000  2.756000 1.229000  -0.3193000E-01 1.682000  
1 1 1 24 29 39 o 7.824000 0.9002000 6.998000 0.7551000 8.651000 1.634000  -1.653000      1.800000  
1 1 1 24 29 41 f 10.96000 0.4538000 10.64000 0.5705000 11.29000 0.7060000 -0.6522000     0.9077000 
1 1 1 24 29 43 o 5.471000 0.9159000 4.603000 1.413000  6.340000 1.166000  -1.738000      1.832000  
1 1 1 24 29 45 o 2.836000 0.8964000 2.935000 1.307000  2.737000 1.227000  0.1977000      1.793000  
1 1 1 24 29 47 o 9.871000 0.6029000 9.683000 0.9223000 10.06000 0.7769000 -0.3760000     1.206000  
1 1 1 24 29 49 o 9.518000 0.9122000 9.814000 1.616000  9.223000 0.8461000 0.5910000      1.824000  
1 1 1 24 30 0  o 11.72000 0.6557000 11.72000 0.6557000 11.72000 0.6557000 0.000000       0.000000  
1 1 1 24 30 2  o 3.310000 0.9663000 4.016000 1.617000  2.604000 1.058000  1.412000       1.933000  
1 1 1 24 30 4  o 20.53000 0.3050000 20.92000 0.4969000 20.14000 0.3537000 0.7730000      0.6099000 
1 1 1 24 30 6  f 24.72000 0.3495000 25.27000 0.4895000 24.18000 0.4989000 1.094000       0.6990000 
1 1 1 24 30 8  o 13.25000 0.4679000 13.58000 0.6672000 12.92000 0.6562000 0.6597000      0.9358000 
1 1 1 24 30 10 o 27.75000 0.3632000 27.26000 0.5107000 28.23000 0.5166000 -0.9756000     0.7264000 
1 1 1 24 30 12 o 50.83000 0.5288000 50.58000 0.6479000 51.09000 0.8359000 -0.5065000     1.058000  
1 1 1 24 30 14 o 32.87000 0.4291000 32.79000 0.6716000 32.96000 0.5343000 -0.1640000     0.8583000 
1 1 1 24 30 16 o 8.376000 0.7418000 8.028000 0.9311000 8.725000 1.155000  -0.6971000     1.484000  
1 1 1 24 30 18 o 29.59000 0.4256000 30.05000 0.6554000 29.12000 0.5430000 0.9349000      0.8511000 
1 1 1 24 30 20 o 31.03000 0.4122000 31.25000 0.6301000 30.81000 0.5316000 0.4453000      0.8244000 
1 1 1 24 30 22 o 11.89000 0.5388000 11.94000 0.8553000 11.83000 0.6556000 0.1028000      1.078000  
1 1 1 24 30 24 o 10.10000 0.8449000 10.30000 0.9884000 9.897000 1.370000  0.4044000      1.690000  
1 1 1 24 30 26 o 17.79000 0.3917000 17.67000 0.5686000 17.90000 0.5388000 -0.2320000     0.7834000 
1 1 1 24 30 28 o 7.923000 0.6949000 7.403000 1.101000  8.444000 0.8487000 -1.041000      1.390000  
1 1 1 24 30 30 o 15.57000 0.4053000 16.37000 0.5487000 14.77000 0.5966000 1.596000       0.8105000 
1 1 1 24 30 32 o 3.123000 0.9005000 2.395000 1.106000  3.851000 1.421000  -1.457000      1.801000  
1 1 1 24 30 34 f 7.641000 0.7034000 8.232000 0.8772000 7.051000 1.100000  1.181000       1.407000  
1 1 1 24 30 36 o 7.357000 0.7615000 7.820000 0.6316000 6.894000 1.386000  0.9258000      1.523000  
1 1 1 24 30 38 o 9.592000 0.6540000 9.158000 0.7703000 10.03000 1.057000  -0.8688000     1.308000  
1 1 1 24 30 40 o 3.391000 0.8359000 3.869000 1.101000  2.913000 1.258000  0.9556000      1.672000  
1 1 1 24 30 42 o 5.262000 1.013000  4.862000 1.458000  5.662000 1.407000  -0.8001000     2.026000  
1 1 1 24 30 44 o 12.52000 0.5971000 12.32000 0.9948000 12.73000 0.6606000 -0.4081000     1.194000  
1 1 1 24 30 46 f 7.595000 0.9768000 8.078000 1.630000  7.111000 1.077000  0.9669000      1.954000  
1 1 1 24 30 48 o 6.706000 1.418000  7.213000 2.577000  6.199000 1.184000  1.014000       2.836000  
1 1 1 24 31 1  o 54.03000 0.4251000 53.85000 0.6777000 54.22000 0.5133000 -0.3699000     0.8502000 
1 1 1 24 31 3  o 16.05000 0.4585000 15.73000 0.8429000 16.36000 0.3612000 -0.6380000     0.9170000 
1 1 1 24 31 5  o 20.10000 0.5020000 19.58000 0.7095000 20.61000 0.7104000 -1.026000      1.004000  
1 1 1 24 31 7  o 43.22000 0.4188000 42.97000 0.5823000 43.47000 0.6021000 -0.5027000     0.8376000 
1 1 1 24 31 9  o 23.05000 0.3606000 23.42000 0.5067000 22.67000 0.5131000 0.7563000      0.7211000 
1 1 1 24 31 11 o 4.899000 1.189000  4.532000 1.524000  5.267000 1.826000  -0.7356000     2.378000  
1 1 1 24 31 13 o 9.373000 0.7083000 8.824000 0.9812000 9.922000 1.022000  -1.098000      1.417000  
1 1 1 24 31 15 o 16.39000 0.6739000 15.45000 1.155000  17.33000 0.6946000 -1.886000      1.348000  
1 1 1 24 31 17 o 21.47000 0.3782000 21.22000 0.5354000 21.72000 0.5343000 -0.5032000     0.7564000 
1 1 1 24 31 19 o 10.28000 0.5898000 9.774000 0.9095000 10.78000 0.7513000 -1.009000      1.180000  
1 1 1 24 31 21 o 23.77000 0.4098000 23.78000 0.6124000 23.77000 0.5448000 0.4160000E-02  0.8197000 
1 1 1 24 31 23 o 27.90000 0.4081000 28.35000 0.5286000 27.46000 0.6219000 0.8967000      0.8162000 
1 1 1 24 31 25 o 3.680000 0.9914000 3.917000 1.448000  3.443000 1.355000  0.4744000      1.983000  
1 1 1 24 31 27 o 11.08000 0.5513000 11.97000 0.8298000 10.19000 0.7261000 1.774000       1.103000  
1 1 1 24 31 29 o 2.704000 0.8654000 2.678000 1.221000  2.730000 1.227000  -0.5242000E-01 1.731000  
1 1 1 24 31 31 o 4.080000 1.018000  4.281000 1.464000  3.879000 1.414000  0.4017000      2.036000  
1 1 1 24 31 33 o 13.80000 0.4414000 13.75000 0.6159000 13.85000 0.6325000 -0.1006000     0.8828000 
1 1 1 24 31 35 o 4.544000 1.107000  4.929000 1.361000  4.160000 1.746000  0.7695000      2.214000  
1 1 1 24 31 37 o 4.420000 1.060000  4.776000 1.413000  4.064000 1.580000  0.7124000      2.120000  
1 1 1 24 31 39 o 6.116000 0.7962000 5.577000 1.104000  6.656000 1.148000  -1.079000      1.592000  
1 1 1 24 31 41 o 7.635000 0.8758000 8.100000 1.168000  7.171000 1.305000  0.9286000      1.752000  
1 1 1 24 31 43 o 3.999000 1.115000  4.287000 1.737000  3.710000 1.399000  0.5771000      2.230000  
1 1 1 24 31 45 o 4.683000 1.161000  5.879000 1.933000  3.486000 1.286000  2.393000       2.321000  
1 1 1 24 31 47 o 4.711000 1.283000  5.169000 1.989000  4.253000 1.620000  0.9162000      2.565000  
1 1 1 24 32 0  o 9.740000 0.6981000 9.740000 0.6981000 9.740000 0.6981000 0.000000       0.000000  
1 1 1 24 32 2  o 3.822000 0.8669000 3.733000 1.367000  3.911000 1.067000  -0.1779000     1.734000  
1 1 1 24 32 4  o 4.043000 0.8816000 5.457000 1.286000  2.630000 1.207000  2.827000       1.763000  
1 1 1 24 32 6  o 17.13000 0.4050000 17.24000 0.5622000 17.02000 0.5832000 0.2188000      0.8100000 
1 1 1 24 32 8  o 21.08000 0.4955000 21.80000 0.6634000 20.36000 0.7362000 1.440000       0.9910000 
1 1 1 24 32 10 o 19.47000 0.4253000 19.40000 0.5202000 19.54000 0.6731000 -0.1475000     0.8507000 
1 1 1 24 32 12 o 23.04000 0.4517000 22.73000 0.6429000 23.35000 0.6347000 -0.6228000     0.9034000 
1 1 1 24 32 14 o 9.193000 0.9137000 10.15000 1.555000  8.231000 0.9596000 1.924000       1.827000  
1 1 1 24 32 16 o 18.82000 0.3835000 18.88000 0.5346000 18.75000 0.5500000 0.1328000      0.7670000 
1 1 1 24 32 18 o 18.00000 0.4426000 18.10000 0.6797000 17.90000 0.5671000 0.2082000      0.8853000 
1 1 1 24 32 20 o 18.89000 0.4562000 18.37000 0.6579000 19.42000 0.6322000 -1.049000      0.9124000 
1 1 1 24 32 22 o 15.99000 0.4555000 15.53000 0.6266000 16.46000 0.6614000 -0.9274000     0.9111000 
1 1 1 24 32 24 o 20.15000 0.4232000 20.37000 0.5546000 19.93000 0.6394000 0.4410000      0.8464000 
1 1 1 24 32 26 o 9.065000 0.6815000 9.259000 1.073000  8.871000 0.8408000 0.3877000      1.363000  
1 1 1 24 32 28 o 10.82000 0.5017000 11.21000 0.7204000 10.43000 0.6985000 0.7744000      1.003000  
1 1 1 24 32 30 o 3.440000 0.8625000 4.593000 1.343000  2.287000 1.083000  2.306000       1.725000  
1 1 1 24 32 32 o 15.93000 0.4744000 15.85000 0.5749000 16.02000 0.7547000 -0.1745000     0.9487000 
1 1 1 24 32 34 o 5.969000 0.9632000 5.731000 1.449000  6.206000 1.269000  -0.4748000     1.926000  
1 1 1 24 32 36 o 9.455000 0.6567000 9.057000 0.8431000 9.853000 1.007000  -0.7967000     1.313000  
1 1 1 24 32 38 o 8.248000 0.7306000 7.149000 1.170000  9.347000 0.8756000 -2.198000      1.461000  
1 1 1 24 32 40 o 4.209000 1.095000  3.752000 1.522000  4.665000 1.575000  -0.9124000     2.190000  
1 1 1 24 32 42 o 4.984000 1.163000  5.428000 1.815000  4.541000 1.454000  0.8865000      2.325000  
1 1 1 24 32 44 f 7.155000 1.023000  6.751000 1.803000  7.559000 0.9671000 -0.8075000     2.046000  
1 1 1 24 32 46 o 5.887000 1.112000  6.298000 1.926000  5.477000 1.113000  0.8219000      2.224000  
1 1 1 24 33 1  o 7.523000 0.4651000 8.060000 0.6134000 6.986000 0.6993000 1.074000       0.9301000 
1 1 1 24 33 3  o 17.67000 0.3528000 17.25000 0.5056000 18.08000 0.4921000 -0.8347000     0.7056000 
1 1 1 24 33 5  o 20.17000 0.4742000 20.98000 0.7216000 19.36000 0.6155000 1.617000       0.9484000 
1 1 1 24 33 7  o 20.38000 0.4486000 20.96000 0.6118000 19.79000 0.6563000 1.173000       0.8972000 
1 1 1 24 33 9  o 6.202000 1.032000  4.994000 1.642000  7.409000 1.250000  -2.414000      2.064000  
1 1 1 24 33 11 o 19.46000 0.6244000 18.49000 1.019000  20.43000 0.7224000 -1.939000      1.249000  
1 1 1 24 33 13 o 11.75000 0.5234000 11.30000 0.7768000 12.20000 0.7018000 -0.9027000     1.047000  
1 1 1 24 33 15 o 4.205000 0.9948000 3.524000 1.406000  4.885000 1.407000  -1.361000      1.990000  
1 1 1 24 33 17 o 27.24000 0.3951000 27.97000 0.6029000 26.51000 0.5109000 1.464000       0.7903000 
1 1 1 24 33 19 o 8.473000 0.7022000 8.422000 0.9206000 8.523000 1.061000  -0.1004000     1.404000  
1 1 1 24 33 21 o 3.795000 0.9859000 3.404000 1.365000  4.186000 1.423000  -0.7822000     1.972000  
1 1 1 24 33 23 o 11.19000 0.6251000 11.19000 0.7819000 11.18000 0.9755000 0.6601000E-02  1.250000  
1 1 1 24 33 25 o 11.78000 0.5127000 11.40000 0.7933000 12.16000 0.6495000 -0.7612000     1.025000  
1 1 1 24 33 27 o 12.30000 0.4871000 12.43000 0.7028000 12.18000 0.6746000 0.2537000      0.9742000 
1 1 1 24 33 29 o 4.685000 0.9335000 5.566000 1.318000  3.804000 1.322000  1.762000       1.867000  
1 1 1 24 33 31 o 10.39000 0.6219000 10.64000 0.9753000 10.15000 0.7718000 0.4944000      1.244000  
1 1 1 24 33 33 o 9.741000 0.5797000 9.623000 0.7812000 9.860000 0.8567000 -0.2369000     1.159000  
1 1 1 24 33 35 o 4.315000 1.166000  3.561000 1.325000  5.069000 1.919000  -1.508000      2.333000  
1 1 1 24 33 37 o 4.097000 1.457000  ?        ?         4.097000 1.457000  ?              ?         
1 1 1 24 33 39 o 13.55000 0.5161000 13.76000 0.7794000 13.34000 0.6767000 0.4186000      1.032000  
1 1 1 24 33 41 o 13.55000 0.5355000 13.06000 0.8120000 14.04000 0.6985000 -0.9763000     1.071000  
1 1 1 24 33 43 o 6.975000 1.006000  6.996000 1.721000  6.954000 1.043000  0.4234000E-01  2.013000  
1 1 1 24 33 45 o 5.195000 1.165000  4.992000 1.911000  5.399000 1.335000  -0.4070000     2.331000  
1 1 1 24 34 0  o 16.94000 0.4175000 16.94000 0.4175000 16.94000 0.4175000 0.000000       0.000000  
1 1 1 24 34 2  o 20.34000 0.2887000 19.67000 0.4279000 21.01000 0.3877000 -1.339000      0.5775000 
1 1 1 24 34 4  o 11.74000 0.5420000 11.60000 0.5510000 11.89000 0.9336000 -0.2899000     1.084000  
1 1 1 24 34 6  o 3.153000 0.9922000 3.316000 1.407000  2.990000 1.400000  0.3252000      1.984000  
1 1 1 24 34 8  o 12.66000 0.4803000 12.36000 0.6705000 12.96000 0.6879000 -0.5987000     0.9606000 
1 1 1 24 34 10 o 2.752000 0.8681000 3.131000 1.319000  2.373000 1.129000  0.7580000      1.736000  
1 1 1 24 34 12 o 28.91000 0.3722000 28.27000 0.5125000 29.56000 0.5398000 -1.291000      0.7443000 
1 1 1 24 34 14 o 21.06000 0.5285000 20.97000 0.9146000 21.14000 0.5301000 -0.1699000     1.057000  
1 1 1 24 34 16 o 19.45000 0.5740000 19.33000 0.6850000 19.56000 0.9212000 -0.2294000     1.148000  
1 1 1 24 34 18 o 4.843000 0.9848000 5.759000 1.270000  3.927000 1.505000  1.832000       1.970000  
1 1 1 24 34 20 o 6.673000 0.7710000 6.456000 1.072000  6.890000 1.109000  -0.4345000     1.542000  
1 1 1 24 34 22 o 9.775000 0.6101000 9.132000 0.9165000 10.42000 0.8054000 -1.285000      1.220000  
1 1 1 24 34 24 o 2.935000 0.9107000 3.169000 1.343000  2.702000 1.230000  0.4673000      1.821000  
1 1 1 24 34 26 o 4.557000 1.027000  4.583000 1.550000  4.530000 1.348000  0.5374000E-01  2.054000  
1 1 1 24 34 28 o 6.741000 0.8242000 6.028000 1.279000  7.455000 1.040000  -1.427000      1.648000  
1 1 1 24 34 30 o 12.99000 0.4745000 13.06000 0.6769000 12.92000 0.6651000 0.1478000      0.9490000 
1 1 1 24 34 32 o 8.636000 0.6530000 8.420000 0.9855000 8.852000 0.8571000 -0.4326000     1.306000  
1 1 1 24 34 34 o 8.901000 0.6453000 9.151000 0.9005000 8.651000 0.9245000 0.5002000      1.291000  
1 1 1 24 34 36 o 4.037000 1.202000  4.546000 1.981000  3.528000 1.362000  1.018000       2.404000  
1 1 1 24 34 38 o 4.666000 1.059000  5.169000 1.561000  4.163000 1.430000  1.006000       2.117000  
1 1 1 24 34 40 o 3.404000 1.005000  3.811000 1.517000  2.998000 1.318000  0.8128000      2.010000  
1 1 1 24 34 42 o 6.431000 0.9103000 6.358000 1.213000  6.503000 1.358000  -0.1458000     1.821000  
1 1 1 24 34 44 o 5.506000 1.137000  6.397000 1.904000  4.616000 1.242000  1.781000       2.273000  
1 1 1 24 35 1  f 17.03000 0.2686000 17.04000 0.3865000 17.01000 0.3731000 0.2730000E-01  0.5372000 
1 1 1 24 35 3  o 13.73000 0.5025000 13.48000 0.5418000 13.98000 0.8465000 -0.5040000     1.005000  
1 1 1 24 35 5  o 11.01000 0.5449000 10.08000 0.5787000 11.94000 0.9234000 -1.864000      1.090000  
1 1 1 24 35 7  o 23.90000 0.3914000 24.25000 0.3972000 23.55000 0.6745000 0.7012000      0.7828000 
1 1 1 24 35 9  o 13.17000 0.4942000 13.19000 0.7347000 13.16000 0.6612000 0.2523000E-01  0.9884000 
1 1 1 24 35 11 o 9.228000 0.8192000 10.19000 0.9314000 8.265000 1.348000  1.926000       1.638000  
1 1 1 24 35 13 o 5.258000 0.9702000 5.616000 1.364000  4.901000 1.380000  0.7156000      1.940000  
1 1 1 24 35 15 o 10.29000 0.5989000 9.996000 0.8362000 10.58000 0.8575000 -0.5830000     1.198000  
1 1 1 24 35 17 o 4.899000 0.9865000 5.015000 1.406000  4.783000 1.384000  0.2326000      1.973000  
1 1 1 24 35 19 f 5.442000 1.115000  4.948000 1.602000  5.936000 1.553000  -0.9880000     2.231000  
1 1 1 24 35 21 o 4.843000 1.074000  5.027000 1.588000  4.660000 1.447000  0.3667000      2.148000  
1 1 1 24 35 23 o 3.045000 0.9425000 3.129000 1.295000  2.960000 1.370000  0.1686000      1.885000  
1 1 1 24 35 25 o 5.478000 0.9425000 5.986000 1.259000  4.971000 1.403000  1.015000       1.885000  
1 1 1 24 35 27 o 7.114000 0.8854000 5.636000 1.571000  8.593000 0.8163000 -2.956000      1.771000  
1 1 1 24 35 29 o 3.205000 0.9290000 3.801000 1.435000  2.608000 1.181000  1.192000       1.858000  
1 1 1 24 35 31 o 3.481000 1.032000  3.488000 1.425000  3.473000 1.493000  0.1440000E-01  2.064000  
1 1 1 24 35 33 o 3.287000 0.9545000 3.286000 1.351000  3.288000 1.349000  -0.1958000E-02 1.909000  
1 1 1 24 35 35 o 5.567000 1.200000  7.246000 1.951000  3.887000 1.398000  3.359000       2.400000  
1 1 1 24 35 37 o 10.42000 0.5382000 10.50000 0.7273000 10.35000 0.7934000 0.1451000      1.076000  
1 1 1 24 35 39 o 3.681000 0.9991000 3.070000 1.378000  4.291000 1.447000  -1.221000      1.998000  
1 1 1 24 35 41 o 5.006000 1.074000  5.312000 1.541000  4.700000 1.496000  0.6122000      2.148000  
1 1 1 24 35 43 o 4.064000 1.117000  4.349000 1.840000  3.779000 1.268000  0.5705000      2.235000  
1 1 1 24 35 45 o 5.904000 2.007000  5.904000 2.007000  ?        ?         ?              ?         
1 1 1 24 36 0  o 2.661000 1.038000  2.661000 1.038000  2.661000 1.038000  0.000000       0.000000  
1 1 1 24 36 2  o 3.356000 0.7410000 3.686000 1.121000  3.026000 0.9696000 0.6596000      1.482000  
1 1 1 24 36 4  o 21.82000 0.3920000 21.41000 0.4134000 22.22000 0.6662000 -0.8010000     0.7840000 
1 1 1 24 36 6  o 10.02000 0.5983000 10.17000 0.5999000 9.875000 1.035000  0.2968000      1.197000  
1 1 1 24 36 8  o 3.463000 1.041000  3.169000 1.241000  3.757000 1.673000  -0.5883000     2.083000  
1 1 1 24 36 10 o 7.738000 0.9945000 8.296000 0.7465000 7.181000 1.844000  1.115000       1.989000  
1 1 1 24 36 12 f 8.338000 0.6826000 8.517000 0.9225000 8.159000 1.006000  0.3585000      1.365000  
1 1 1 24 36 14 o 7.667000 0.7669000 8.678000 0.9932000 6.655000 1.169000  2.023000       1.534000  
1 1 1 24 36 16 o 7.598000 0.7114000 8.007000 0.9691000 7.188000 1.042000  0.8192000      1.423000  
1 1 1 24 36 18 o 6.902000 0.7616000 6.758000 1.164000  7.047000 0.9824000 -0.2890000     1.523000  
1 1 1 24 36 20 o 11.61000 0.5873000 11.85000 0.8649000 11.38000 0.7947000 0.4671000      1.175000  
1 1 1 24 36 22 o 12.03000 0.5211000 12.00000 0.6861000 12.06000 0.7846000 -0.5817000E-01 1.042000  
1 1 1 24 36 24 o 11.36000 1.033000  9.592000 1.738000  13.14000 1.115000  -3.544000      2.065000  
1 1 1 24 36 26 o 12.44000 0.5663000 11.88000 0.8776000 13.00000 0.7160000 -1.120000      1.133000  
1 1 1 24 36 28 o 8.489000 0.6887000 8.904000 0.9701000 8.074000 0.9778000 0.8291000      1.377000  
1 1 1 24 36 30 o 5.521000 1.035000  5.139000 1.399000  5.902000 1.524000  -0.7622000     2.069000  
1 1 1 24 36 32 o 6.628000 0.8256000 7.251000 1.060000  6.005000 1.266000  1.246000       1.651000  
1 1 1 24 36 34 o 11.81000 0.8464000 11.82000 1.412000  11.80000 0.9339000 0.2162000E-01  1.693000  
1 1 1 24 36 36 o 3.160000 0.9516000 3.627000 1.417000  2.693000 1.271000  0.9343000      1.903000  
1 1 1 24 36 38 o 3.527000 1.037000  3.659000 1.538000  3.394000 1.393000  0.2654000      2.075000  
1 1 1 24 36 40 o 6.190000 1.022000  6.155000 1.491000  6.225000 1.397000  -0.7013000E-01 2.043000  
1 1 1 24 36 42 o 5.639000 0.9355000 6.710000 1.176000  4.567000 1.455000  2.143000       1.871000  
1 1 1 24 36 44 o 8.550000 1.749000  8.550000 1.749000  ?        ?         ?              ?         
1 1 1 24 37 1  o 3.731000 0.7856000 4.226000 1.195000  3.236000 1.021000  0.9903000      1.571000  
1 1 1 24 37 3  o 13.35000 0.6416000 14.27000 0.5531000 12.42000 1.158000  1.845000       1.283000  
1 1 1 24 37 5  o 17.76000 0.5149000 17.22000 0.4167000 18.30000 0.9418000 -1.074000      1.030000  
1 1 1 24 37 7  o 30.35000 0.4983000 29.51000 0.4145000 31.20000 0.9064000 -1.688000      0.9967000 
1 1 1 24 37 9  o 6.970000 0.8964000 8.646000 0.6856000 5.294000 1.657000  3.351000       1.793000  
1 1 1 24 37 11 o 11.01000 0.6101000 11.06000 0.7180000 10.96000 0.9866000 0.9626000E-01  1.220000  
1 1 1 24 37 13 f 18.22000 0.4475000 18.21000 0.5310000 18.22000 0.7205000 -0.4213000E-02 0.8951000 
1 1 1 24 37 15 o 10.51000 0.5108000 10.86000 0.6573000 10.16000 0.7820000 0.7034000      1.022000  
1 1 1 24 37 17 o 3.673000 0.9203000 4.393000 1.340000  2.953000 1.262000  1.440000       1.841000  
1 1 1 24 37 19 f 2.991000 0.8895000 2.544000 1.141000  3.438000 1.365000  -0.8936000     1.779000  
1 1 1 24 37 21 o 2.933000 0.9112000 2.779000 1.221000  3.087000 1.353000  -0.3087000     1.822000  
1 1 1 24 37 23 o 5.073000 1.024000  5.399000 1.404000  4.746000 1.490000  0.6532000      2.047000  
1 1 1 24 37 25 o 7.651000 0.8788000 7.675000 1.423000  7.627000 1.032000  0.4828000E-01  1.758000  
1 1 1 24 37 27 o 4.779000 1.000000  5.750000 1.318000  3.808000 1.505000  1.942000       2.001000  
1 1 1 24 37 29 o 12.38000 0.8858000 14.48000 0.7929000 10.29000 1.584000  4.194000       1.772000  
1 1 1 24 37 31 o 4.085000 1.038000  3.637000 1.551000  4.533000 1.382000  -0.8957000     2.077000  
1 1 1 24 37 33 o 5.093000 1.085000  4.668000 1.728000  5.518000 1.313000  -0.8493000     2.170000  
1 1 1 24 37 35 o 3.120000 0.9358000 2.677000 1.207000  3.563000 1.431000  -0.8852000     1.872000  
1 1 1 24 37 37 o 10.54000 0.6119000 10.40000 0.8752000 10.68000 0.8553000 -0.2766000     1.224000  
1 1 1 24 37 39 f 8.152000 0.8248000 8.549000 1.138000  7.755000 1.194000  0.7939000      1.650000  
1 1 1 24 37 41 o 4.125000 1.072000  4.286000 1.562000  3.963000 1.468000  0.3237000      2.144000  
1 1 1 24 37 43 o 4.182000 1.755000  4.182000 1.755000  ?        ?         ?              ?         
1 1 1 24 38 0  o 2.898000 1.037000  2.898000 1.037000  2.898000 1.037000  0.000000       0.000000  
1 1 1 24 38 2  o 19.34000 0.4081000 20.02000 0.3742000 18.67000 0.7253000 1.354000       0.8162000 
1 1 1 24 38 4  o 12.50000 0.5210000 12.41000 0.4650000 12.58000 0.9324000 -0.1782000     1.042000  
1 1 1 24 38 6  o 5.383000 0.8936000 5.441000 0.9596000 5.325000 1.508000  0.1161000      1.787000  
1 1 1 24 38 8  o 16.58000 0.4529000 16.31000 0.4421000 16.85000 0.7905000 -0.5323000     0.9057000 
1 1 1 24 38 10 o 21.16000 0.4439000 20.88000 0.5079000 21.44000 0.7283000 -0.5604000     0.8879000 
1 1 1 24 38 12 o 6.867000 0.8970000 7.562000 0.7830000 6.173000 1.614000  1.389000       1.794000  
1 1 1 24 38 14 o 8.422000 0.6643000 8.327000 0.6537000 8.517000 1.157000  -0.1894000     1.329000  
1 1 1 24 38 16 o 12.67000 0.5178000 13.16000 0.6322000 12.18000 0.8202000 0.9803000      1.036000  
1 1 1 24 38 18 o 11.26000 0.5392000 10.84000 0.6862000 11.68000 0.8319000 -0.8357000     1.078000  
1 1 1 24 38 20 o 7.099000 0.8526000 6.349000 1.427000  7.849000 0.9330000 -1.500000      1.705000  
1 1 1 24 38 22 o 18.81000 0.4934000 18.95000 0.5624000 18.67000 0.8109000 0.2774000      0.9868000 
1 1 1 24 38 24 o 26.65000 0.4040000 26.63000 0.5603000 26.68000 0.5823000 -0.5472000E-01 0.8081000 
1 1 1 24 38 26 o 5.831000 1.110000  5.239000 1.349000  6.422000 1.763000  -1.183000      2.220000  
1 1 1 24 38 28 o 8.255000 0.7158000 8.106000 0.9855000 8.405000 1.038000  -0.2986000     1.432000  
1 1 1 24 38 30 o 5.035000 1.113000  5.385000 1.694000  4.686000 1.445000  0.6992000      2.227000  
1 1 1 24 38 32 o 4.081000 1.106000  4.786000 1.723000  3.377000 1.388000  1.408000       2.212000  
1 1 1 24 38 34 o 6.044000 1.031000  6.368000 1.318000  5.720000 1.586000  0.6484000      2.062000  
1 1 1 24 38 36 o 9.089000 0.7508000 9.932000 0.9321000 8.245000 1.177000  1.686000       1.502000  
1 1 1 24 38 38 o 5.176000 1.053000  4.169000 1.634000  6.182000 1.327000  -2.013000      2.105000  
1 1 1 24 38 40 o 5.450000 1.029000  5.118000 1.578000  5.781000 1.322000  -0.6628000     2.059000  
1 1 1 24 38 42 o 6.162000 2.316000  6.162000 2.316000  ?        ?         ?              ?         
1 1 1 24 39 1  o 10.23000 0.3446000 10.02000 0.5646000 10.43000 0.3952000 -0.4069000     0.6892000 
1 1 1 24 39 3  o 13.74000 0.5045000 13.85000 0.5079000 13.63000 0.8719000 0.2176000      1.009000  
1 1 1 24 39 5  o 36.12000 0.4255000 35.58000 0.4416000 36.66000 0.7274000 -1.077000      0.8509000 
1 1 1 24 39 7  o 40.26000 0.4330000 41.00000 0.4815000 39.52000 0.7199000 1.484000       0.8661000 
1 1 1 24 39 9  o 5.894000 0.9121000 5.499000 1.038000  6.289000 1.500000  -0.7904000     1.824000  
1 1 1 24 39 11 o 5.834000 1.010000  5.814000 1.091000  5.854000 1.701000  -0.4060000E-01 2.020000  
1 1 1 24 39 13 o 20.71000 0.4629000 20.04000 0.5074000 21.37000 0.7744000 -1.334000      0.9258000 
1 1 1 24 39 15 o 15.44000 0.4494000 14.92000 0.4929000 15.97000 0.7516000 -1.059000      0.8988000 
1 1 1 24 39 17 f 9.522000 0.6101000 9.039000 0.7782000 10.01000 0.9399000 -0.9663000     1.220000  
1 1 1 24 39 19 o 17.00000 0.5027000 17.39000 0.6592000 16.61000 0.7591000 0.7739000      1.005000  
1 1 1 24 39 21 o 7.943000 0.7317000 6.826000 1.163000  9.059000 0.8878000 -2.234000      1.463000  
1 1 1 24 39 23 o 13.02000 0.4988000 12.20000 0.7249000 13.83000 0.6855000 -1.629000      0.9977000 
1 1 1 24 39 25 o 4.468000 1.159000  4.404000 1.547000  4.532000 1.725000  -0.1280000     2.317000  
1 1 1 24 39 27 o 10.19000 0.5843000 10.02000 0.7801000 10.35000 0.8700000 -0.3289000     1.169000  
1 1 1 24 39 29 o 6.271000 1.061000  6.282000 1.264000  6.260000 1.704000  0.2212000E-01  2.122000  
1 1 1 24 39 31 o 3.329000 0.9699000 3.247000 1.362000  3.410000 1.381000  -0.1633000     1.940000  
1 1 1 24 39 33 o 6.547000 1.030000  6.534000 1.309000  6.559000 1.591000  -0.2525000E-01 2.060000  
1 1 1 24 39 35 o 10.11000 0.6598000 9.048000 0.9518000 11.18000 0.9140000 -2.131000      1.320000  
1 1 1 24 39 37 f 2.941000 0.9149000 3.058000 1.308000  2.823000 1.279000  0.2349000      1.830000  
1 1 1 24 39 39 o 4.791000 1.057000  4.539000 1.598000  5.043000 1.383000  -0.5040000     2.114000  
1 1 1 24 39 41 o 5.350000 2.173000  5.350000 2.173000  ?        ?         ?              ?         
1 1 1 24 40 0  o 2.158000 0.9223000 2.158000 0.9223000 2.158000 0.9223000 0.000000       0.000000  
1 1 1 24 40 2  o 4.745000 0.8407000 5.503000 0.8143000 3.987000 1.471000  1.516000       1.681000  
1 1 1 24 40 4  o 14.30000 0.4781000 14.82000 0.4228000 13.79000 0.8575000 1.033000       0.9561000 
1 1 1 24 40 6  o 9.472000 0.6391000 8.543000 0.6286000 10.40000 1.113000  -1.858000      1.278000  
1 1 1 24 40 8  o 14.15000 0.5302000 15.04000 0.4441000 13.25000 0.9630000 1.791000       1.060000  
1 1 1 24 40 10 o 7.141000 0.9258000 6.946000 1.006000  7.337000 1.555000  -0.3906000     1.852000  
1 1 1 24 40 12 o 7.566000 0.7765000 7.539000 0.7582000 7.594000 1.355000  -0.5447000E-01 1.553000  
1 1 1 24 40 14 o 9.263000 0.6834000 9.040000 0.6261000 9.486000 1.215000  -0.4454000     1.367000  
1 1 1 24 40 16 o 6.674000 0.8688000 6.457000 0.9188000 6.890000 1.475000  -0.4326000     1.738000  
1 1 1 24 40 18 o 5.939000 0.8985000 6.100000 1.013000  5.777000 1.484000  0.3229000      1.797000  
1 1 1 24 40 20 o 4.539000 1.068000  3.858000 1.312000  5.221000 1.686000  -1.363000      2.136000  
1 1 1 24 40 22 o 9.462000 0.5939000 9.384000 0.8258000 9.540000 0.8538000 -0.1557000     1.188000  
1 1 1 24 40 24 o 12.57000 0.6837000 12.57000 0.8542000 12.56000 1.068000  0.8864000E-02  1.367000  
1 1 1 24 40 26 o 7.862000 0.7123000 8.200000 0.9283000 7.524000 1.081000  0.6753000      1.425000  
1 1 1 24 40 28 o 5.545000 1.353000  7.040000 2.251000  4.050000 1.501000  2.990000       2.706000  
1 1 1 24 40 30 o 4.054000 1.031000  3.599000 1.359000  4.509000 1.551000  -0.9107000     2.062000  
1 1 1 24 40 32 o 6.122000 0.9068000 7.678000 1.099000  4.567000 1.442000  3.111000       1.814000  
1 1 1 24 40 34 o 7.329000 0.8461000 7.724000 1.121000  6.934000 1.268000  0.7902000      1.692000  
1 1 1 24 40 36 o 6.844000 0.9233000 7.629000 1.032000  6.059000 1.531000  1.570000       1.847000  
1 1 1 24 40 38 o 5.781000 1.030000  6.084000 1.410000  5.478000 1.502000  0.6058000      2.061000  
1 1 1 24 41 1  o 17.22000 0.2820000 17.65000 0.4626000 16.80000 0.3228000 0.8469000      0.5641000 
1 1 1 24 41 3  o 32.52000 0.4315000 32.07000 0.4954000 32.96000 0.7067000 -0.8909000     0.8630000 
1 1 1 24 41 5  o 17.09000 0.4331000 17.62000 0.4055000 16.56000 0.7655000 1.058000       0.8662000 
1 1 1 24 41 7  o 5.525000 0.9395000 5.285000 1.053000  5.764000 1.556000  -0.4789000     1.879000  
1 1 1 24 41 9  o 6.080000 0.9705000 5.951000 0.9944000 6.209000 1.667000  -0.2581000     1.941000  
1 1 1 24 41 11 f 7.756000 0.9801000 7.357000 0.8002000 8.155000 1.789000  -0.7973000     1.960000  
1 1 1 24 41 13 o 6.676000 0.9011000 5.892000 1.196000  7.461000 1.348000  -1.569000      1.802000  
1 1 1 24 41 15 o 12.90000 0.5222000 13.11000 0.5384000 12.70000 0.8949000 0.4155000      1.044000  
1 1 1 24 41 17 o 19.89000 0.4395000 20.50000 0.4478000 19.28000 0.7563000 1.216000       0.8789000 
1 1 1 24 41 19 o 15.86000 0.4958000 16.07000 0.5816000 15.65000 0.8031000 0.4236000      0.9916000 
1 1 1 24 41 21 o 4.183000 1.181000  4.083000 1.446000  4.283000 1.869000  -0.2004000     2.363000  
1 1 1 24 41 23 o 12.72000 0.5415000 11.32000 0.6534000 14.13000 0.8637000 -2.808000      1.083000  
1 1 1 24 41 25 o 8.516000 0.7479000 8.708000 0.8618000 8.324000 1.223000  0.3832000      1.496000  
1 1 1 24 41 27 o 3.947000 1.086000  4.094000 1.661000  3.800000 1.400000  0.2943000      2.173000  
1 1 1 24 41 29 o 2.853000 0.9076000 2.534000 1.169000  3.171000 1.388000  -0.6376000     1.815000  
1 1 1 24 41 31 o 5.506000 1.086000  4.888000 1.414000  6.124000 1.649000  -1.236000      2.172000  
1 1 1 24 41 33 o 5.477000 1.058000  6.205000 1.469000  4.748000 1.522000  1.457000       2.115000  
1 1 1 24 41 35 o 8.416000 0.7019000 7.917000 1.020000  8.916000 0.9644000 -0.9996000     1.404000  
1 1 1 24 41 37 o 3.345000 0.9726000 3.659000 1.424000  3.030000 1.325000  0.6287000      1.945000  
1 1 1 24 42 0  o 17.57000 0.3540000 17.57000 0.3540000 17.57000 0.3540000 0.000000       0.000000  
1 1 1 24 42 2  o 6.947000 0.8064000 7.504000 0.5729000 6.390000 1.508000  1.114000       1.613000  
1 1 1 24 42 4  o 6.952000 0.8704000 7.623000 0.6047000 6.281000 1.632000  1.342000       1.741000  
1 1 1 24 42 6  o 4.239000 0.9642000 4.624000 1.078000  3.854000 1.599000  0.7704000      1.928000  
1 1 1 24 42 8  f 6.866000 0.9126000 5.297000 1.060000  8.435000 1.486000  -3.138000      1.825000  
1 1 1 24 42 10 o 13.62000 0.5680000 14.51000 0.7385000 12.73000 0.8632000 1.781000       1.136000  
1 1 1 24 42 12 o 11.56000 0.6054000 11.39000 0.5905000 11.72000 1.057000  -0.3264000     1.211000  
1 1 1 24 42 14 o 14.68000 0.5350000 15.17000 0.5182000 14.19000 0.9361000 0.9859000      1.070000  
1 1 1 24 42 16 o 2.971000 0.9012000 2.759000 1.191000  3.183000 1.353000  -0.4241000     1.802000  
1 1 1 24 42 18 o 6.963000 1.177000  7.342000 0.9204000 6.585000 2.167000  0.7569000      2.354000  
1 1 1 24 42 20 o 5.297000 1.109000  5.806000 1.133000  4.788000 1.907000  1.018000       2.218000  
1 1 1 24 42 22 o 4.843000 1.050000  4.891000 1.209000  4.795000 1.717000  0.9657000E-01  2.100000  
1 1 1 24 42 24 o 5.208000 0.9743000 4.968000 1.362000  5.449000 1.394000  -0.4810000     1.949000  
1 1 1 24 42 26 o 5.913000 0.9657000 4.114000 1.459000  7.712000 1.265000  -3.598000      1.931000  
1 1 1 24 42 28 o 3.564000 1.030000  3.136000 1.304000  3.992000 1.595000  -0.8554000     2.060000  
1 1 1 24 42 30 o 2.770000 1.186000  2.770000 1.186000  ?        ?         ?              ?         
1 1 1 24 42 32 o 5.525000 1.130000  5.570000 1.479000  5.479000 1.708000  0.9160000E-01  2.259000  
1 1 1 24 42 34 o 4.861000 1.127000  5.043000 1.743000  4.678000 1.427000  0.3650000      2.253000  
1 1 1 24 42 36 o 4.727000 1.070000  5.006000 1.548000  4.448000 1.477000  0.5576000      2.140000  
1 1 1 24 43 1  o 4.225000 0.7616000 4.104000 1.255000  4.346000 0.8625000 -0.2421000     1.523000  
1 1 1 24 43 3  o 5.925000 0.8947000 5.984000 0.9003000 5.866000 1.546000  0.1183000      1.789000  
1 1 1 24 43 5  o 21.25000 0.4143000 21.89000 0.3934000 20.60000 0.7292000 1.296000       0.8286000 
1 1 1 24 43 7  o 6.661000 0.9024000 6.342000 0.9940000 6.981000 1.506000  -0.6387000     1.805000  
1 1 1 24 43 9  o 11.65000 0.5778000 11.63000 0.5718000 11.66000 1.004000  -0.2827000E-01 1.156000  
1 1 1 24 43 11 o 11.56000 0.5805000 11.64000 0.5483000 11.48000 1.023000  0.1681000      1.161000  
1 1 1 24 43 13 o 7.626000 0.8440000 7.741000 0.6596000 7.510000 1.554000  0.2318000      1.688000  
1 1 1 24 43 15 o 4.727000 0.9323000 4.965000 1.222000  4.488000 1.409000  0.4765000      1.865000  
1 1 1 24 43 17 o 12.08000 0.7538000 13.17000 0.5840000 10.98000 1.390000  2.194000       1.508000  
1 1 1 24 43 19 o 9.448000 0.6538000 9.406000 0.7433000 9.490000 1.076000  -0.8437000E-01 1.308000  
1 1 1 24 43 21 o 7.293000 0.8696000 7.762000 0.9161000 6.824000 1.478000  0.9378000      1.739000  
1 1 1 24 43 23 o 4.994000 1.044000  4.190000 1.503000  5.797000 1.448000  -1.607000      2.087000  
1 1 1 24 43 25 f 3.736000 0.9964000 3.115000 1.267000  4.357000 1.539000  -1.242000      1.993000  
1 1 1 24 43 27 o 3.619000 1.024000  3.810000 1.387000  3.427000 1.507000  0.3831000      2.048000  
1 1 1 24 43 29 o 4.915000 1.125000  3.714000 1.396000  6.116000 1.765000  -2.401000      2.251000  
1 1 1 24 43 31 o 4.517000 0.9540000 6.037000 1.353000  2.997000 1.346000  3.040000       1.908000  
1 1 1 24 43 33 o 9.517000 0.7180000 10.14000 0.6982000 8.900000 1.255000  1.235000       1.436000  
1 1 1 24 43 35 o 6.722000 0.9595000 7.949000 0.8625000 5.494000 1.714000  2.455000       1.919000  
1 1 1 24 44 0  o 4.115000 1.565000  4.115000 1.565000  4.115000 1.565000  0.000000       0.000000  
1 1 1 24 44 2  o 6.086000 0.8467000 6.215000 0.6737000 5.957000 1.554000  0.2586000      1.693000  
1 1 1 24 44 4  o 6.615000 1.008000  6.681000 0.7832000 6.548000 1.859000  0.1328000      2.017000  
1 1 1 24 44 6  o 3.651000 0.9890000 2.473000 1.067000  4.830000 1.665000  -2.357000      1.978000  
1 1 1 24 44 8  o 4.767000 0.9681000 4.888000 1.172000  4.647000 1.541000  0.2416000      1.936000  
1 1 1 24 44 10 o 6.421000 1.015000  5.929000 1.100000  6.914000 1.705000  -0.9855000     2.029000  
1 1 1 24 44 12 o 3.126000 0.9809000 2.564000 1.158000  3.687000 1.584000  -1.123000      1.962000  
1 1 1 24 44 14 o 9.013000 0.8227000 8.337000 0.7859000 9.690000 1.446000  -1.354000      1.645000  
1 1 1 24 44 16 o 7.041000 0.9423000 8.503000 0.7855000 5.579000 1.713000  2.924000       1.885000  
1 1 1 24 44 18 o 9.965000 0.5879000 9.418000 0.7148000 10.51000 0.9335000 -1.094000      1.176000  
1 1 1 24 44 20 o 11.29000 0.9122000 11.11000 1.497000  11.48000 1.043000  -0.3734000     1.824000  
1 1 1 24 44 22 o 3.362000 0.9847000 3.446000 1.402000  3.277000 1.383000  0.1691000      1.969000  
1 1 1 24 44 24 o 4.219000 1.072000  4.172000 1.362000  4.266000 1.656000  -0.9354000E-01 2.144000  
1 1 1 24 44 26 f 6.221000 1.135000  6.135000 1.083000  6.306000 1.996000  -0.1718000     2.270000  
1 1 1 24 44 28 o 4.231000 1.070000  4.383000 1.338000  4.079000 1.670000  0.3041000      2.139000  
1 1 1 24 44 30 o 5.613000 1.031000  5.678000 1.284000  5.547000 1.615000  0.1304000      2.063000  
1 1 1 24 44 32 o 4.158000 1.007000  4.460000 1.268000  3.855000 1.564000  0.6054000      2.013000  
1 1 1 24 44 34 o 4.403000 1.094000  4.541000 1.265000  4.264000 1.785000  0.2762000      2.188000  
1 1 1 24 45 1  o 4.573000 1.081000  2.943000 1.177000  6.204000 1.813000  -3.261000      2.162000  
1 1 1 24 45 3  o 6.113000 0.8449000 6.199000 0.8803000 6.027000 1.442000  0.1727000      1.690000  
1 1 1 24 45 5  o 13.46000 0.5023000 14.04000 0.4490000 12.88000 0.8988000 1.161000       1.005000  
1 1 1 24 45 7  o 11.80000 0.5317000 11.68000 0.5117000 11.93000 0.9322000 -0.2481000     1.063000  
1 1 1 24 45 9  o 9.420000 1.001000  9.010000 0.8532000 9.830000 1.810000  -0.8197000     2.001000  
1 1 1 24 45 11 o 3.806000 1.123000  2.661000 1.145000  4.951000 1.933000  -2.290000      2.247000  
1 1 1 24 45 13 o 9.547000 0.6721000 9.355000 0.7236000 9.739000 1.133000  -0.3837000     1.344000  
1 1 1 24 45 15 f 16.15000 0.4895000 17.38000 0.4979000 14.91000 0.8429000 2.468000       0.9790000 
1 1 1 24 45 17 o 9.110000 0.7597000 9.535000 1.020000  8.686000 1.126000  0.8487000      1.519000  
1 1 1 24 45 19 o 6.316000 1.001000  6.296000 1.213000  6.336000 1.593000  -0.4006000E-01 2.002000  
1 1 1 24 45 21 o 6.613000 0.8805000 7.122000 0.9866000 6.103000 1.459000  1.019000       1.761000  
1 1 1 24 45 23 o 3.418000 0.9996000 3.351000 1.349000  3.485000 1.476000  -0.1342000     1.999000  
1 1 1 24 45 25 o 3.747000 1.113000  2.895000 1.242000  4.600000 1.847000  -1.705000      2.225000  
1 1 1 24 45 27 o 3.342000 0.9379000 3.675000 1.301000  3.009000 1.351000  0.6669000      1.876000  
1 1 1 24 45 29 o 3.718000 1.016000  3.384000 1.314000  4.052000 1.551000  -0.6676000     2.032000  
1 1 1 24 45 31 o 4.776000 1.027000  2.802000 1.204000  6.751000 1.663000  -3.949000      2.053000  
1 1 1 24 45 33 o 4.407000 1.955000  ?        ?         4.407000 1.955000  ?              ?         
1 1 1 24 46 0  o 2.907000 1.094000  2.907000 1.094000  2.907000 1.094000  0.000000       0.000000  
1 1 1 24 46 2  o 4.317000 1.049000  4.600000 1.347000  4.033000 1.608000  0.5675000      2.098000  
1 1 1 24 46 4  o 3.258000 1.035000  2.121000 0.9620000 4.395000 1.832000  -2.275000      2.070000  
1 1 1 24 46 6  o 4.549000 1.115000  2.916000 1.163000  6.181000 1.902000  -3.266000      2.229000  
1 1 1 24 46 8  o 4.968000 1.130000  5.190000 1.076000  4.746000 1.987000  0.4436000      2.260000  
1 1 1 24 46 10 o 7.588000 0.8980000 7.212000 0.8495000 7.965000 1.582000  -0.7535000     1.796000  
1 1 1 24 46 12 o 2.956000 0.9187000 3.197000 1.338000  2.714000 1.259000  0.4831000      1.837000  
1 1 1 24 46 14 o 7.207000 1.029000  6.547000 1.341000  7.868000 1.562000  -1.321000      2.059000  
1 1 1 24 46 16 o 11.24000 0.6021000 10.80000 0.8462000 11.67000 0.8568000 -0.8694000     1.204000  
1 1 1 24 46 18 o 8.602000 0.7567000 8.319000 0.8153000 8.886000 1.275000  -0.5672000     1.513000  
1 1 1 24 46 20 o 3.851000 0.9959000 4.660000 1.456000  3.042000 1.359000  1.618000       1.992000  
1 1 1 24 46 22 o 13.78000 0.7214000 13.81000 0.7719000 13.74000 1.219000  0.6756000E-01  1.443000  
1 1 1 24 46 24 o 7.701000 1.075000  6.816000 0.9861000 8.585000 1.910000  -1.769000      2.150000  
1 1 1 24 46 26 o 6.214000 0.9537000 6.790000 1.027000  5.638000 1.607000  1.152000       1.907000  
1 1 1 24 46 28 o 7.196000 0.8714000 7.265000 0.8674000 7.127000 1.512000  0.1380000      1.743000  
1 1 1 24 46 30 o 4.297000 1.100000  3.389000 1.363000  5.205000 1.728000  -1.816000      2.201000  
1 1 1 24 47 1  o 12.93000 0.9534000 12.56000 1.412000  13.30000 1.281000  -0.7408000     1.907000  
1 1 1 24 47 3  o 5.009000 1.335000  3.641000 1.702000  6.377000 2.058000  -2.736000      2.670000  
1 1 1 24 47 5  o 13.61000 0.5397000 14.28000 0.5278000 12.94000 0.9415000 1.343000       1.079000  
1 1 1 24 47 7  o 8.765000 0.7739000 9.455000 0.6724000 8.075000 1.394000  1.380000       1.548000  
1 1 1 24 47 9  o 4.025000 1.090000  3.826000 1.514000  4.224000 1.567000  -0.3983000     2.179000  
1 1 1 24 47 11 o 6.303000 1.068000  5.534000 1.408000  7.073000 1.607000  -1.539000      2.136000  
1 1 1 24 47 13 o 3.449000 1.008000  2.928000 1.258000  3.970000 1.575000  -1.042000      2.016000  
1 1 1 24 47 15 o 7.552000 0.7924000 7.800000 0.7887000 7.305000 1.375000  0.4944000      1.585000  
1 1 1 24 47 17 o 4.343000 1.074000  3.691000 1.273000  4.994000 1.730000  -1.303000      2.148000  
1 1 1 24 47 19 o 5.552000 1.121000  5.239000 1.389000  5.865000 1.759000  -0.6260000     2.242000  
1 1 1 24 47 21 o 5.376000 1.204000  3.772000 1.336000  6.980000 2.003000  -3.208000      2.408000  
1 1 1 24 47 23 o 3.745000 1.052000  2.455000 1.094000  5.034000 1.798000  -2.579000      2.105000  
1 1 1 24 47 25 o 6.245000 0.8990000 6.919000 0.9394000 5.571000 1.533000  1.348000       1.798000  
1 1 1 24 47 27 o 4.001000 1.040000  2.737000 1.203000  5.266000 1.698000  -2.529000      2.081000  
1 1 1 24 47 29 o 8.405000 1.205000  8.445000 0.7832000 8.364000 2.278000  0.8099000E-01  2.409000  
1 1 1 24 48 0  o 2.455000 1.182000  2.455000 1.182000  2.455000 1.182000  0.000000       0.000000  
1 1 1 24 48 2  o 3.498000 0.8885000 4.291000 1.259000  2.704000 1.254000  1.586000       1.777000  
1 1 1 24 48 4  o 2.598000 0.8220000 2.595000 1.076000  2.602000 1.243000  -0.7254000E-02 1.644000  
1 1 1 24 48 6  o 3.803000 1.154000  2.939000 1.167000  4.668000 1.992000  -1.730000      2.309000  
1 1 1 24 48 8  o 4.874000 0.9598000 5.804000 1.055000  3.944000 1.604000  1.860000       1.920000  
1 1 1 24 48 10 o 2.694000 0.8636000 2.097000 0.9778000 3.290000 1.424000  -1.194000      1.727000  
1 1 1 24 48 12 o 5.386000 1.020000  5.046000 1.113000  5.726000 1.709000  -0.6790000     2.040000  
1 1 1 24 48 14 o 4.674000 0.9796000 5.354000 1.184000  3.994000 1.561000  1.360000       1.959000  
1 1 1 24 48 16 o 5.027000 1.064000  5.946000 1.062000  4.108000 1.845000  1.838000       2.129000  
1 1 1 24 48 18 o 5.814000 1.004000  6.608000 0.8918000 5.021000 1.799000  1.587000       2.007000  
1 1 1 24 48 20 o 6.622000 0.9809000 7.472000 0.8550000 5.773000 1.766000  1.699000       1.962000  
1 1 1 24 48 22 o 3.714000 1.048000  3.486000 1.330000  3.942000 1.620000  -0.4568000     2.096000  
1 1 1 24 48 24 o 6.702000 0.9282000 6.849000 0.9141000 6.555000 1.616000  0.2940000      1.856000  
1 1 1 24 48 26 o 3.476000 0.9909000 3.289000 1.259000  3.664000 1.530000  -0.3758000     1.982000  
1 1 1 24 49 1  o 4.278000 1.126000  3.789000 1.575000  4.768000 1.610000  -0.9784000     2.252000  
1 1 1 24 49 3  o 5.048000 1.270000  5.189000 1.927000  4.907000 1.654000  0.2819000      2.540000  
1 1 1 24 49 5  o 10.30000 0.9442000 10.35000 1.507000  10.24000 1.139000  0.1017000      1.888000  
1 1 1 24 49 7  o 3.782000 0.9868000 2.864000 1.243000  4.700000 1.533000  -1.836000      1.974000  
1 1 1 24 49 9  o 5.589000 1.421000  5.589000 1.421000  ?        ?         ?              ?         
1 1 1 24 49 11 o 5.466000 1.219000  5.087000 1.415000  5.844000 1.987000  -0.7561000     2.439000  
1 1 1 24 49 13 o 3.684000 1.032000  2.493000 1.110000  4.875000 1.741000  -2.382000      2.065000  
1 1 1 24 49 15 o 5.657000 1.104000  5.921000 1.037000  5.393000 1.948000  0.5272000      2.207000  
1 1 1 24 49 17 o 7.100000 0.8189000 6.533000 0.9473000 7.667000 1.336000  -1.135000      1.638000  
1 1 1 24 49 19 o 8.847000 0.8635000 9.651000 0.8257000 8.042000 1.517000  1.609000       1.727000  
1 1 1 24 49 21 o 3.923000 1.059000  3.760000 1.263000  4.087000 1.701000  -0.3260000     2.119000  
1 1 1 24 49 23 f 3.897000 0.9901000 4.343000 1.325000  3.451000 1.472000  0.8927000      1.980000  
1 1 1 24 49 25 o 4.197000 1.089000  4.029000 1.312000  4.364000 1.739000  -0.3346000     2.179000  
1 1 1 24 50 0  o 4.425000 1.547000  4.425000 1.547000  4.425000 1.547000  0.000000       0.000000  
1 1 1 24 50 2  o 5.169000 1.068000  6.127000 1.395000  4.212000 1.618000  1.915000       2.137000  
1 1 1 24 50 4  o 6.102000 1.216000  6.157000 1.563000  6.047000 1.863000  0.1102000      2.431000  
1 1 1 24 50 6  o 12.03000 0.6628000 10.75000 0.7713000 13.32000 1.078000  -2.573000      1.326000  
1 1 1 24 50 8  o 4.876000 0.8931000 6.832000 1.154000  2.920000 1.363000  3.912000       1.786000  
1 1 1 24 50 10 o 4.175000 1.048000  3.773000 1.252000  4.577000 1.681000  -0.8041000     2.096000  
1 1 1 24 50 12 o 4.451000 1.303000  3.547000 1.275000  5.354000 2.273000  -1.807000      2.606000  
1 1 1 24 50 14 f 3.905000 0.9587000 4.436000 1.208000  3.373000 1.489000  1.063000       1.917000  
1 1 1 24 50 16 o 3.011000 0.9200000 2.774000 1.166000  3.248000 1.423000  -0.4744000     1.840000  
1 1 1 24 50 18 o 4.103000 1.093000  4.410000 1.468000  3.796000 1.619000  0.6142000      2.186000  
1 1 1 24 50 20 o 3.841000 1.037000  3.881000 1.253000  3.802000 1.653000  0.7927000E-01  2.074000  
1 1 1 24 50 22 o 4.738000 0.9420000 5.775000 1.073000  3.701000 1.548000  2.074000       1.884000  
1 1 1 24 51 1  o 4.041000 1.130000  3.518000 1.523000  4.564000 1.670000  -1.046000      2.260000  
1 1 1 24 51 3  o 3.924000 1.135000  3.389000 1.432000  4.460000 1.763000  -1.070000      2.271000  
1 1 1 24 51 5  o 4.111000 1.069000  4.842000 1.591000  3.381000 1.427000  1.461000       2.137000  
1 1 1 24 51 7  o 4.280000 1.158000  4.521000 1.651000  4.040000 1.624000  0.4814000      2.316000  
1 1 1 24 51 9  o 4.910000 1.148000  4.294000 1.505000  5.525000 1.733000  -1.230000      2.296000  
1 1 1 24 51 11 o 6.326000 0.9402000 6.172000 1.159000  6.480000 1.481000  -0.3077000     1.880000  
1 1 1 24 51 13 o 8.091000 0.9423000 9.549000 0.6922000 6.632000 1.753000  2.916000       1.885000  
1 1 1 24 51 15 o 3.389000 1.071000  2.390000 1.098000  4.389000 1.839000  -1.999000      2.142000  
1 1 1 24 51 17 o 3.172000 0.9944000 2.430000 1.068000  3.914000 1.677000  -1.484000      1.989000  
1 1 1 24 51 19 o 2.913000 0.9009000 3.083000 1.223000  2.743000 1.323000  0.3403000      1.802000  
1 1 1 24 52 0  o 8.738000 1.369000  8.738000 1.369000  8.738000 1.369000  0.000000       0.000000  
1 1 1 24 52 2  o 4.369000 1.109000  3.653000 1.493000  5.085000 1.641000  -1.431000      2.219000  
1 1 1 24 52 4  o 7.419000 0.9467000 8.549000 1.137000  6.289000 1.514000  2.260000       1.893000  
1 1 1 24 52 6  o 9.500000 0.8606000 10.02000 1.060000  8.980000 1.356000  1.041000       1.721000  
1 1 1 24 52 8  o 6.007000 1.089000  6.056000 1.504000  5.957000 1.575000  0.9975000E-01  2.178000  
1 1 1 24 52 10 o 5.296000 1.098000  4.328000 1.542000  6.264000 1.565000  -1.936000      2.197000  
1 1 1 24 52 12 o 3.925000 1.037000  2.882000 1.232000  4.968000 1.667000  -2.086000      2.073000  
1 1 1 24 52 14 o 5.222000 0.9903000 5.758000 1.039000  4.686000 1.686000  1.071000       1.981000  
1 1 1 24 52 16 o 6.544000 0.9596000 7.354000 0.8698000 5.735000 1.711000  1.619000       1.919000  
1 1 1 24 53 1  o 6.607000 1.057000  4.993000 1.707000  8.220000 1.248000  -3.227000      2.115000  
1 1 1 24 53 3  o 10.37000 0.8284000 8.784000 1.373000  11.96000 0.9268000 -3.178000      1.657000  
1 1 1 24 53 5  o 3.342000 1.022000  3.188000 1.384000  3.497000 1.505000  -0.3089000     2.045000  
1 1 1 24 53 7  o 4.344000 1.161000  3.722000 1.530000  4.965000 1.747000  -1.243000      2.322000  
1 1 1 24 53 9  o 6.147000 1.145000  6.950000 1.630000  5.344000 1.610000  1.606000       2.291000  
1 1 1 24 53 11 f 3.757000 1.101000  3.727000 1.522000  3.787000 1.591000  -0.6002000E-01 2.202000  
1 1 1 24 53 13 o 4.720000 1.773000  ?        ?         4.720000 1.773000  ?              ?         
1 1 1 24 54 0  o 2.945000 1.352000  2.945000 1.352000  2.945000 1.352000  0.000000       0.000000  
1 1 1 24 54 2  o 5.222000 1.123000  4.964000 1.636000  5.479000 1.540000  -0.5155000     2.247000  
1 1 1 24 54 4  o 4.671000 1.312000  5.062000 1.986000  4.280000 1.714000  0.7818000      2.624000  
1 1 1 24 54 6  o 4.168000 1.783000  ?        ?         4.168000 1.783000  ?              ?         
1 1 1 25 0  1  o 46.50000 0.5845000 46.50000 0.5845000 46.50000 0.5845000 0.000000       0.000000  
1 1 1 25 0  3  f 73.20000 0.8489000 73.20000 0.8489000 73.20000 0.8489000 0.000000       0.000000  
1 1 1 25 0  5  o 49.04000 0.5275000 49.04000 0.5275000 49.04000 0.5275000 0.000000       0.000000  
1 1 1 25 0  7  o 33.62000 0.4200000 33.62000 0.4200000 33.62000 0.4200000 0.000000       0.000000  
1 1 1 25 0  9  o 18.60000 0.3963000 18.60000 0.3963000 18.60000 0.3963000 0.000000       0.000000  
1 1 1 25 0  11 o 4.405000 1.166000  4.405000 1.166000  4.405000 1.166000  0.000000       0.000000  
1 1 1 25 0  13 o 14.52000 0.4438000 14.52000 0.4438000 14.52000 0.4438000 0.000000       0.000000  
1 1 1 25 0  15 o 30.79000 0.4179000 30.79000 0.4179000 30.79000 0.4179000 0.000000       0.000000  
1 1 1 25 0  17 o 18.37000 0.4862000 18.37000 0.4862000 18.37000 0.4862000 0.000000       0.000000  
1 1 1 25 0  19 o 28.20000 0.4854000 28.20000 0.4854000 28.20000 0.4854000 0.000000       0.000000  
1 1 1 25 0  21 o 33.37000 0.5071000 33.37000 0.5071000 33.37000 0.5071000 0.000000       0.000000  
1 1 1 25 0  23 o 15.31000 0.6268000 15.31000 0.6268000 15.31000 0.6268000 0.000000       0.000000  
1 1 1 25 0  25 o 10.65000 0.7574000 10.65000 0.7574000 10.65000 0.7574000 0.000000       0.000000  
1 1 1 25 0  27 o 19.59000 0.5061000 19.59000 0.5061000 19.59000 0.5061000 0.000000       0.000000  
1 1 1 25 0  29 o 29.96000 0.4628000 29.96000 0.4628000 29.96000 0.4628000 0.000000       0.000000  
1 1 1 25 0  31 o 17.98000 0.5097000 17.98000 0.5097000 17.98000 0.5097000 0.000000       0.000000  
1 1 1 25 0  33 o 20.56000 0.5034000 20.56000 0.5034000 20.56000 0.5034000 0.000000       0.000000  
1 1 1 25 0  35 o 3.172000 1.330000  3.172000 1.330000  3.172000 1.330000  0.000000       0.000000  
1 1 1 25 0  37 o 4.615000 1.263000  4.615000 1.263000  4.615000 1.263000  0.000000       0.000000  
1 1 1 25 0  39 o 3.645000 1.394000  3.645000 1.394000  3.645000 1.394000  0.000000       0.000000  
1 1 1 25 0  41 o 10.53000 0.6650000 10.53000 0.6650000 10.53000 0.6650000 0.000000       0.000000  
1 1 1 25 0  43 o 11.23000 0.6667000 11.23000 0.6667000 11.23000 0.6667000 0.000000       0.000000  
1 1 1 25 0  45 o 3.468000 1.322000  3.468000 1.322000  3.468000 1.322000  0.000000       0.000000  
1 1 1 25 0  47 o 3.519000 1.345000  3.519000 1.345000  3.519000 1.345000  0.000000       0.000000  
1 1 1 25 0  49 o 3.062000 1.331000  3.062000 1.331000  3.062000 1.331000  0.000000       0.000000  
1 1 1 25 0  51 o 5.194000 1.357000  5.194000 1.357000  5.194000 1.357000  0.000000       0.000000  
1 1 1 25 0  53 o 5.020000 1.733000  5.020000 1.733000  5.020000 1.733000  0.000000       0.000000  
1 1 1 25 0  55 o 5.293000 1.367000  5.293000 1.367000  5.293000 1.367000  0.000000       0.000000  
1 1 1 25 0  57 o 4.146000 1.451000  4.146000 1.451000  4.146000 1.451000  0.000000       0.000000  
1 1 1 25 1  0  o 40.14000 0.5327000 40.14000 0.5327000 40.14000 0.5327000 0.000000       0.000000  
1 1 1 25 1  2  o 54.70000 0.4683000 55.31000 0.6679000 54.08000 0.6567000 1.230000       0.9367000 
1 1 1 25 1  4  o 46.53000 0.3871000 46.66000 0.5855000 46.41000 0.5066000 0.2502000      0.7743000 
1 1 1 25 1  6  o 13.46000 0.3194000 13.51000 0.4403000 13.40000 0.4629000 0.1124000      0.6389000 
1 1 1 25 1  8  o 27.92000 0.2828000 28.02000 0.3989000 27.83000 0.4011000 0.1897000      0.5657000 
1 1 1 25 1  10 o 10.42000 0.3784000 10.41000 0.5334000 10.43000 0.5368000 -0.2431000E-01 0.7568000 
1 1 1 25 1  12 f 28.68000 0.2836000 28.73000 0.4060000 28.63000 0.3960000 0.9691000E-01  0.5672000 
1 1 1 25 1  14 o 23.89000 0.2995000 23.49000 0.4547000 24.28000 0.3900000 -0.7839000     0.5991000 
1 1 1 25 1  16 o 22.64000 0.3012000 22.65000 0.4484000 22.64000 0.4023000 0.1340000E-01  0.6024000 
1 1 1 25 1  18 o 53.56000 0.4053000 54.09000 0.5774000 53.03000 0.5689000 1.065000       0.8106000 
1 1 1 25 1  20 o 15.22000 0.4288000 14.81000 0.5332000 15.62000 0.6717000 -0.8016000     0.8576000 
1 1 1 25 1  22 f 21.32000 0.3228000 21.09000 0.4255000 21.56000 0.4856000 -0.4641000     0.6456000 
1 1 1 25 1  24 o 18.44000 0.3633000 18.34000 0.4829000 18.54000 0.5429000 -0.1992000     0.7266000 
1 1 1 25 1  26 o 43.64000 0.4168000 43.27000 0.5841000 44.01000 0.5949000 -0.7371000     0.8337000 
1 1 1 25 1  28 o 35.11000 0.3372000 35.19000 0.4756000 35.02000 0.4781000 0.1745000      0.6744000 
1 1 1 25 1  30 o 16.44000 0.3932000 16.42000 0.5578000 16.47000 0.5542000 -0.4672000E-01 0.7863000 
1 1 1 25 1  32 o 16.09000 0.3861000 15.41000 0.4879000 16.76000 0.5986000 -1.356000      0.7722000 
1 1 1 25 1  34 o 30.51000 0.3333000 30.47000 0.4695000 30.55000 0.4732000 -0.8198000E-01 0.6666000 
1 1 1 25 1  36 o 8.244000 0.6903000 8.519000 0.9643000 7.969000 0.9881000 0.5506000      1.381000  
1 1 1 25 1  38 o 10.03000 0.4904000 9.190000 0.7098000 10.87000 0.6768000 -1.678000      0.9808000 
1 1 1 25 1  40 o 7.858000 0.6305000 8.207000 0.8561000 7.508000 0.9258000 0.6994000      1.261000  
1 1 1 25 1  42 o 12.13000 0.4296000 11.20000 0.6278000 13.05000 0.5866000 -1.848000      0.8592000 
1 1 1 25 1  44 o 5.260000 0.8606000 4.991000 1.282000  5.530000 1.148000  -0.5389000     1.721000  
1 1 1 25 1  46 f 8.089000 0.5958000 8.035000 0.8611000 8.143000 0.8236000 -0.1075000     1.192000  
1 1 1 25 1  48 o 3.627000 0.9691000 3.621000 1.397000  3.633000 1.343000  -0.1181000E-01 1.938000  
1 1 1 25 1  50 o 6.520000 0.8292000 5.587000 1.173000  7.454000 1.172000  -1.867000      1.658000  
1 1 1 25 1  52 o 2.833000 0.8920000 2.852000 1.301000  2.814000 1.221000  0.3754000E-01  1.784000  
1 1 1 25 1  54 o 4.046000 1.041000  5.005000 1.572000  3.086000 1.365000  1.919000       2.082000  
1 1 1 25 1  56 o 2.717000 0.8713000 2.707000 1.221000  2.728000 1.243000  -0.2174000E-01 1.743000  
1 1 1 25 2  1  o 76.13000 0.5823000 75.43000 0.8726000 76.83000 0.7713000 -1.398000      1.165000  
1 1 1 25 2  3  o 35.86000 0.3762000 35.96000 0.6158000 35.76000 0.4322000 0.1992000      0.7523000 
1 1 1 25 2  5  o 41.45000 0.5236000 41.29000 0.9357000 41.61000 0.4703000 -0.3193000     1.047000  
1 1 1 25 2  7  f 41.64000 0.4116000 41.56000 0.6742000 41.73000 0.4724000 -0.1717000     0.8232000 
1 1 1 25 2  9  o 71.51000 0.6290000 72.37000 1.035000  70.65000 0.7148000 1.717000       1.258000  
1 1 1 25 2  11 o 8.550000 0.5834000 8.351000 0.9868000 8.750000 0.6227000 -0.3989000     1.167000  
1 1 1 25 2  13 o 40.50000 0.4097000 40.69000 0.6743000 40.32000 0.4655000 0.3718000      0.8194000 
1 1 1 25 2  15 o 22.73000 0.2808000 22.60000 0.4007000 22.86000 0.3935000 -0.2623000     0.5616000 
1 1 1 25 2  17 o 38.64000 0.3740000 38.98000 0.5378000 38.30000 0.5198000 0.6793000      0.7480000 
1 1 1 25 2  19 o 10.42000 0.4497000 11.19000 0.6445000 9.661000 0.6272000 1.526000       0.8993000 
1 1 1 25 2  21 o 14.47000 0.3729000 15.01000 0.4879000 13.93000 0.5641000 1.078000       0.7458000 
1 1 1 25 2  23 o 31.03000 0.3387000 31.34000 0.4423000 30.73000 0.5130000 0.6087000      0.6773000 
1 1 1 25 2  25 o 39.72000 0.3694000 39.66000 0.5532000 39.77000 0.4897000 -0.1116000     0.7388000 
1 1 1 25 2  27 o 25.64000 0.3255000 25.40000 0.4569000 25.88000 0.4638000 -0.4771000     0.6510000 
1 1 1 25 2  29 o 26.54000 0.3718000 26.65000 0.5210000 26.44000 0.5305000 0.2159000      0.7436000 
1 1 1 25 2  31 o 23.50000 0.3346000 23.52000 0.4744000 23.47000 0.4719000 0.5463000E-01  0.6691000 
1 1 1 25 2  33 o 11.68000 0.5357000 12.18000 0.5766000 11.18000 0.9030000 0.9967000      1.071000  
1 1 1 25 2  35 o 20.01000 0.3538000 19.88000 0.5121000 20.14000 0.4883000 -0.2589000     0.7076000 
1 1 1 25 2  37 o 18.90000 0.3769000 18.55000 0.4988000 19.26000 0.5652000 -0.7111000     0.7538000 
1 1 1 25 2  39 o 12.40000 0.4473000 12.58000 0.5924000 12.23000 0.6704000 0.3478000      0.8947000 
1 1 1 25 2  41 o 10.38000 0.5064000 10.50000 0.7078000 10.27000 0.7245000 0.2241000      1.013000  
1 1 1 25 2  43 o 7.975000 0.6072000 8.546000 0.7903000 7.404000 0.9220000 1.142000       1.214000  
1 1 1 25 2  45 o 4.803000 0.8628000 3.458000 1.311000  6.148000 1.122000  -2.689000      1.726000  
1 1 1 25 2  47 o 12.51000 0.4482000 12.43000 0.6318000 12.59000 0.6359000 -0.1586000     0.8964000 
1 1 1 25 2  49 o 10.56000 0.6356000 10.37000 0.6452000 10.75000 1.095000  -0.3831000     1.271000  
1 1 1 25 2  51 o 10.84000 0.5298000 10.28000 0.8111000 11.40000 0.6819000 -1.115000      1.060000  
1 1 1 25 2  53 o 3.425000 0.9654000 3.142000 1.326000  3.709000 1.404000  -0.5673000     1.931000  
1 1 1 25 2  55 o 7.554000 0.9183000 7.053000 1.366000  8.054000 1.228000  -1.000000      1.837000  
1 1 1 25 2  57 o 5.941000 0.9008000 5.709000 1.352000  6.172000 1.191000  -0.4635000     1.802000  
1 1 1 25 3  0  o 47.18000 0.5142000 47.18000 0.5142000 47.18000 0.5142000 0.000000       0.000000  
1 1 1 25 3  2  o 44.38000 0.3777000 44.95000 0.5759000 43.82000 0.4890000 1.133000       0.7555000 
1 1 1 25 3  4  o 36.98000 0.3366000 36.31000 0.5042000 37.65000 0.4459000 -1.340000      0.6731000 
1 1 1 25 3  6  o 38.50000 0.5100000 39.21000 0.9188000 37.80000 0.4428000 1.410000       1.020000  
1 1 1 25 3  8  o 42.38000 0.3635000 41.98000 0.5456000 42.77000 0.4805000 -0.7919000     0.7270000 
1 1 1 25 3  10 f 63.60000 0.4981000 63.56000 0.7517000 63.65000 0.6537000 -0.8434000E-01 0.9962000 
1 1 1 25 3  12 f 21.29000 0.3167000 21.84000 0.4883000 20.73000 0.4035000 1.107000       0.6335000 
1 1 1 25 3  14 o 25.80000 0.3601000 26.04000 0.4747000 25.57000 0.5417000 0.4694000      0.7203000 
1 1 1 25 3  16 o 47.24000 0.4556000 48.03000 0.7525000 46.45000 0.5137000 1.586000       0.9111000 
1 1 1 25 3  18 o 10.52000 0.4014000 10.07000 0.5714000 10.98000 0.5639000 -0.9061000     0.8028000 
1 1 1 25 3  20 o 31.93000 0.3233000 31.27000 0.4858000 32.59000 0.4267000 -1.316000      0.6465000 
1 1 1 25 3  22 o 41.76000 0.3761000 41.41000 0.4874000 42.12000 0.5730000 -0.7108000     0.7523000 
1 1 1 25 3  24 o 43.48000 0.4335000 43.47000 0.5095000 43.50000 0.7015000 -0.2999000E-01 0.8670000 
1 1 1 25 3  26 o 55.59000 0.4559000 55.08000 0.6812000 56.10000 0.6061000 -1.017000      0.9118000 
1 1 1 25 3  28 o 34.97000 0.3355000 35.05000 0.4751000 34.89000 0.4739000 0.1652000      0.6711000 
1 1 1 25 3  30 o 51.00000 0.4036000 51.05000 0.5714000 50.96000 0.5701000 0.8159000E-01  0.8072000 
1 1 1 25 3  32 o 9.656000 0.6938000 9.391000 0.8048000 9.921000 1.130000  -0.5308000     1.388000  
1 1 1 25 3  34 o 14.46000 0.4561000 14.29000 0.5838000 14.63000 0.7011000 -0.3398000     0.9123000 
1 1 1 25 3  36 o 21.41000 0.3597000 21.74000 0.5266000 21.08000 0.4903000 0.6544000      0.7195000 
1 1 1 25 3  38 o 16.49000 0.3546000 16.65000 0.5066000 16.32000 0.4963000 0.3292000      0.7092000 
1 1 1 25 3  40 o 3.177000 0.9193000 3.043000 1.271000  3.311000 1.329000  -0.2678000     1.839000  
1 1 1 25 3  42 o 11.34000 0.4692000 10.87000 0.6695000 11.82000 0.6574000 -0.9503000     0.9383000 
1 1 1 25 3  44 o 5.417000 0.8636000 5.017000 1.307000  5.816000 1.129000  -0.7990000     1.727000  
1 1 1 25 3  46 o 7.793000 0.6491000 8.510000 0.8770000 7.075000 0.9572000 1.435000       1.298000  
1 1 1 25 3  48 o 8.415000 0.6878000 8.967000 1.005000  7.864000 0.9388000 1.103000       1.376000  
1 1 1 25 3  50 o 7.902000 0.6907000 7.703000 0.9353000 8.102000 1.017000  -0.3983000     1.381000  
1 1 1 25 3  52 o 5.482000 0.8933000 4.476000 1.420000  6.488000 1.084000  -2.013000      1.787000  
1 1 1 25 3  54 o 4.155000 0.9565000 4.888000 1.343000  3.422000 1.363000  1.465000       1.913000  
1 1 1 25 3  56 o 7.726000 0.7294000 8.521000 0.9800000 6.931000 1.081000  1.590000       1.459000  
1 1 1 25 4  1  o 56.63000 0.4861000 55.87000 0.6786000 57.40000 0.6962000 -1.535000      0.9722000 
1 1 1 25 4  3  o 34.89000 0.3007000 34.84000 0.4266000 34.94000 0.4239000 -0.1079000     0.6014000 
1 1 1 25 4  5  o 54.25000 0.4040000 54.05000 0.5693000 54.46000 0.5735000 -0.4152000     0.8081000 
1 1 1 25 4  7  o 14.72000 0.3316000 14.56000 0.4930000 14.89000 0.4435000 -0.3346000     0.6631000 
1 1 1 25 4  9  o 26.03000 0.2786000 26.17000 0.3925000 25.88000 0.3955000 0.2844000      0.5572000 
1 1 1 25 4  11 f 42.42000 0.3418000 42.56000 0.4850000 42.27000 0.4818000 0.2926000      0.6837000 
1 1 1 25 4  13 o 53.08000 0.4582000 53.03000 0.6498000 53.14000 0.6462000 -0.1119000     0.9164000 
1 1 1 25 4  15 o 25.57000 0.2860000 25.15000 0.3995000 25.98000 0.4093000 -0.8308000     0.5720000 
1 1 1 25 4  17 o 16.89000 0.3426000 16.91000 0.5311000 16.87000 0.4330000 0.4472000E-01  0.6852000 
1 1 1 25 4  19 o 18.50000 0.3979000 18.10000 0.6677000 18.91000 0.4331000 -0.8077000     0.7958000 
1 1 1 25 4  21 o 18.99000 0.3149000 18.82000 0.4528000 19.15000 0.4378000 -0.3266000     0.6298000 
1 1 1 25 4  23 o 38.55000 0.4017000 38.27000 0.4711000 38.83000 0.6508000 -0.5607000     0.8034000 
1 1 1 25 4  25 o 32.26000 0.3467000 31.91000 0.4572000 32.61000 0.5213000 -0.7037000     0.6934000 
1 1 1 25 4  27 o 23.08000 0.3285000 23.27000 0.4620000 22.89000 0.4672000 0.3785000      0.6570000 
1 1 1 25 4  29 o 24.88000 0.3374000 24.84000 0.4816000 24.92000 0.4726000 -0.8283000E-01 0.6747000 
1 1 1 25 4  31 o 7.661000 0.7739000 8.961000 0.7955000 6.361000 1.328000  2.600000       1.548000  
1 1 1 25 4  33 o 33.90000 0.3517000 34.28000 0.4319000 33.52000 0.5552000 0.7628000      0.7034000 
1 1 1 25 4  35 o 19.83000 0.4338000 19.47000 0.6542000 20.19000 0.5698000 -0.7204000     0.8675000 
1 1 1 25 4  37 o 12.13000 0.4727000 12.55000 0.6184000 11.72000 0.7152000 0.8258000      0.9454000 
1 1 1 25 4  39 o 19.35000 0.3444000 19.55000 0.4878000 19.15000 0.4863000 0.3994000      0.6888000 
1 1 1 25 4  41 o 12.43000 0.4413000 12.27000 0.6441000 12.59000 0.6035000 -0.3245000     0.8827000 
1 1 1 25 4  43 o 9.890000 0.4986000 8.894000 0.7429000 10.89000 0.6654000 -1.992000      0.9973000 
1 1 1 25 4  45 o 15.36000 0.3875000 15.31000 0.5659000 15.41000 0.5294000 -0.1012000     0.7749000 
1 1 1 25 4  47 o 3.339000 0.9322000 3.024000 1.273000  3.654000 1.362000  -0.6305000     1.864000  
1 1 1 25 4  49 o 4.010000 0.9700000 3.380000 1.324000  4.640000 1.418000  -1.260000      1.940000  
1 1 1 25 4  51 f 10.32000 0.6348000 10.31000 0.8685000 10.33000 0.9260000 -0.1347000E-01 1.270000  
1 1 1 25 4  53 o 11.88000 0.4924000 11.72000 0.7345000 12.04000 0.6559000 -0.3124000     0.9847000 
1 1 1 25 4  55 o 2.775000 0.8684000 2.359000 1.110000  3.191000 1.336000  -0.8318000     1.737000  
1 1 1 25 4  57 o 5.707000 0.8826000 6.994000 1.082000  4.421000 1.395000  2.574000       1.765000  
1 1 1 25 5  0  o 46.74000 0.7315000 46.74000 0.7315000 46.74000 0.7315000 0.000000       0.000000  
1 1 1 25 5  2  o 29.73000 0.3097000 30.11000 0.4038000 29.36000 0.4697000 0.7491000      0.6195000 
1 1 1 25 5  4  o 69.97000 0.5005000 70.39000 0.7111000 69.55000 0.7044000 0.8401000      1.001000  
1 1 1 25 5  6  o 36.77000 0.3113000 37.04000 0.4433000 36.50000 0.4372000 0.5461000      0.6226000 
1 1 1 25 5  8  o 29.49000 0.3099000 29.30000 0.4712000 29.68000 0.4027000 -0.3884000     0.6199000 
1 1 1 25 5  10 o 36.97000 0.4069000 37.05000 0.6418000 36.89000 0.5003000 0.1630000      0.8138000 
1 1 1 25 5  12 o 30.89000 0.2899000 30.50000 0.4111000 31.28000 0.4089000 -0.7789000     0.5798000 
1 1 1 25 5  14 o 5.976000 0.6402000 6.821000 0.7814000 5.130000 1.014000  1.691000       1.280000  
1 1 1 25 5  16 o 28.14000 0.3113000 28.61000 0.4119000 27.66000 0.4667000 0.9481000      0.6225000 
1 1 1 25 5  18 f 7.931000 0.5904000 8.219000 0.8503000 7.644000 0.8194000 0.5750000      1.181000  
1 1 1 25 5  20 o 35.51000 0.3707000 35.67000 0.5282000 35.35000 0.5202000 0.3223000      0.7414000 
1 1 1 25 5  22 o 47.26000 0.4549000 46.78000 0.5278000 47.73000 0.7410000 -0.9543000     0.9097000 
1 1 1 25 5  24 o 17.55000 0.3351000 17.19000 0.4795000 17.92000 0.4682000 -0.7323000     0.6702000 
1 1 1 25 5  26 o 21.09000 0.3440000 20.74000 0.5119000 21.43000 0.4596000 -0.6935000     0.6879000 
1 1 1 25 5  28 o 32.37000 0.3565000 32.38000 0.4700000 32.35000 0.5361000 0.2769000E-01  0.7130000 
1 1 1 25 5  30 o 36.58000 0.4140000 36.13000 0.4363000 37.04000 0.7038000 -0.9091000     0.8281000 
1 1 1 25 5  32 o 11.53000 0.5135000 11.64000 0.6281000 11.42000 0.8126000 0.2119000      1.027000  
1 1 1 25 5  34 o 16.89000 0.4034000 17.32000 0.4743000 16.47000 0.6527000 0.8528000      0.8068000 
1 1 1 25 5  36 o 18.49000 0.3524000 18.34000 0.5000000 18.65000 0.4968000 -0.3058000     0.7048000 
1 1 1 25 5  38 o 13.93000 0.4845000 13.86000 0.6218000 14.00000 0.7432000 -0.1392000     0.9690000 
1 1 1 25 5  40 o 12.75000 0.4477000 13.19000 0.6577000 12.32000 0.6076000 0.8687000      0.8954000 
1 1 1 25 5  42 o 14.05000 0.3841000 14.27000 0.5391000 13.82000 0.5473000 0.4472000      0.7682000 
1 1 1 25 5  44 o 8.242000 0.6309000 8.237000 0.9347000 8.248000 0.8475000 -0.1103000E-01 1.262000  
1 1 1 25 5  46 o 11.05000 0.6738000 10.85000 1.162000  11.25000 0.6823000 -0.3966000     1.348000  
1 1 1 25 5  48 o 3.814000 1.010000  4.136000 1.476000  3.492000 1.379000  0.6438000      2.020000  
1 1 1 25 5  50 o 10.96000 0.5841000 11.18000 0.7255000 10.74000 0.9156000 0.4416000      1.168000  
1 1 1 25 5  52 o 5.038000 0.8829000 6.641000 1.093000  3.436000 1.386000  3.205000       1.766000  
1 1 1 25 5  54 o 3.286000 0.9571000 3.417000 1.428000  3.156000 1.274000  0.2609000      1.914000  
1 1 1 25 5  56 o 2.854000 0.8968000 2.864000 1.282000  2.843000 1.254000  0.2091000E-01  1.794000  
1 1 1 25 6  1  o 47.70000 0.3658000 47.98000 0.5189000 47.41000 0.5159000 0.5693000      0.7317000 
1 1 1 25 6  3  o 59.90000 0.4744000 59.65000 0.6159000 60.15000 0.7217000 -0.5036000     0.9488000 
1 1 1 25 6  5  o 33.42000 0.2965000 33.34000 0.4176000 33.50000 0.4211000 -0.1540000     0.5930000 
1 1 1 25 6  7  o 43.90000 0.3968000 43.93000 0.5671000 43.88000 0.5550000 0.5315000E-01  0.7935000 
1 1 1 25 6  9  o 27.80000 0.2989000 28.01000 0.4547000 27.59000 0.3880000 0.4200000      0.5977000 
1 1 1 25 6  11 o 10.45000 0.3950000 10.77000 0.5265000 10.13000 0.5889000 0.6391000      0.7900000 
1 1 1 25 6  13 o 11.39000 0.3718000 11.36000 0.5431000 11.42000 0.5080000 -0.5627000E-01 0.7437000 
1 1 1 25 6  15 o 21.01000 0.2810000 20.82000 0.3938000 21.20000 0.4008000 -0.3862000     0.5619000 
1 1 1 25 6  17 o 41.71000 0.3660000 41.78000 0.5542000 41.64000 0.4783000 0.1345000      0.7320000 
1 1 1 25 6  19 o 44.85000 0.3581000 45.52000 0.5113000 44.18000 0.5016000 1.335000       0.7163000 
1 1 1 25 6  21 f 15.54000 0.3371000 15.38000 0.4694000 15.71000 0.4839000 -0.3347000     0.6741000 
1 1 1 25 6  23 o 8.391000 0.6824000 7.677000 1.103000  9.106000 0.8034000 -1.428000      1.365000  
1 1 1 25 6  25 o 11.25000 0.4532000 11.49000 0.6225000 11.01000 0.6587000 0.4742000      0.9064000 
1 1 1 25 6  27 o 26.07000 0.3390000 25.58000 0.5028000 26.55000 0.4548000 -0.9758000     0.6780000 
1 1 1 25 6  29 o 29.74000 0.3992000 29.93000 0.4572000 29.55000 0.6544000 0.3734000      0.7983000 
1 1 1 25 6  31 o 24.49000 0.3453000 24.49000 0.4159000 24.49000 0.5513000 0.2205000E-02  0.6906000 
1 1 1 25 6  33 o 12.33000 0.4781000 12.15000 0.5938000 12.51000 0.7495000 -0.3577000     0.9562000 
1 1 1 25 6  35 o 19.34000 0.3675000 19.19000 0.4704000 19.48000 0.5647000 -0.2931000     0.7349000 
1 1 1 25 6  37 o 9.145000 0.5819000 9.979000 0.7051000 8.311000 0.9259000 1.668000       1.164000  
1 1 1 25 6  39 o 7.867000 0.6521000 7.883000 0.9358000 7.851000 0.9085000 0.3194000E-01  1.304000  
1 1 1 25 6  41 f 4.050000 0.9384000 2.855000 1.264000  5.245000 1.387000  -2.390000      1.877000  
1 1 1 25 6  43 o 5.808000 0.8373000 6.454000 1.041000  5.163000 1.312000  1.291000       1.675000  
1 1 1 25 6  45 o 15.71000 0.4854000 15.81000 0.8070000 15.62000 0.5396000 0.1850000      0.9708000 
1 1 1 25 6  47 o 10.30000 0.5244000 10.24000 0.7385000 10.35000 0.7446000 -0.1108000     1.049000  
1 1 1 25 6  49 f 11.10000 0.6175000 10.25000 0.8056000 11.95000 0.9362000 -1.699000      1.235000  
1 1 1 25 6  51 o 3.341000 0.9576000 4.124000 1.505000  2.557000 1.185000  1.568000       1.915000  
1 1 1 25 6  53 o 4.234000 0.9818000 3.714000 1.381000  4.754000 1.396000  -1.040000      1.964000  
1 1 1 25 6  55 o 5.959000 0.9465000 6.302000 1.448000  5.615000 1.219000  0.6864000      1.893000  
1 1 1 25 6  57 f 6.978000 0.7569000 7.060000 1.123000  6.895000 1.015000  0.1651000      1.514000  
1 1 1 25 7  0  o 44.10000 0.4893000 44.10000 0.4893000 44.10000 0.4893000 0.000000       0.000000  
1 1 1 25 7  2  o 31.71000 0.2914000 31.74000 0.4089000 31.68000 0.4154000 0.6556000E-01  0.5829000 
1 1 1 25 7  4  o 34.62000 0.3853000 34.48000 0.4873000 34.75000 0.5969000 -0.2658000     0.7706000 
1 1 1 25 7  6  o 39.93000 0.3237000 39.81000 0.4569000 40.05000 0.4587000 -0.2437000     0.6474000 
1 1 1 25 7  8  o 39.84000 0.3242000 39.83000 0.4599000 39.86000 0.4571000 -0.2735000E-01 0.6484000 
1 1 1 25 7  10 o 15.36000 0.3216000 15.35000 0.4875000 15.38000 0.4195000 -0.3119000E-01 0.6431000 
1 1 1 25 7  12 o 24.32000 0.2754000 24.90000 0.3918000 23.75000 0.3872000 1.143000       0.5508000 
1 1 1 25 7  14 o 15.27000 0.3097000 15.41000 0.4255000 15.14000 0.4502000 0.2761000      0.6195000 
1 1 1 25 7  16 f 10.19000 0.4358000 10.64000 0.6319000 9.734000 0.6003000 0.9070000      0.8716000 
1 1 1 25 7  18 o 27.08000 0.2863000 27.32000 0.4052000 26.83000 0.4046000 0.4887000      0.5726000 
1 1 1 25 7  20 o 32.18000 0.3043000 31.98000 0.4279000 32.38000 0.4328000 -0.3934000     0.6086000 
1 1 1 25 7  22 o 26.49000 0.3143000 25.95000 0.4191000 27.03000 0.4684000 -1.079000      0.6285000 
1 1 1 25 7  24 o 31.67000 0.3727000 31.97000 0.5377000 31.36000 0.5161000 0.6184000      0.7453000 
1 1 1 25 7  26 o 31.88000 0.3171000 31.31000 0.4446000 32.46000 0.4521000 -1.151000      0.6341000 
1 1 1 25 7  28 o 59.45000 0.5286000 59.99000 0.5672000 58.90000 0.8923000 1.096000       1.057000  
1 1 1 25 7  30 o 4.946000 1.042000  4.891000 1.370000  5.001000 1.571000  -0.1100000     2.085000  
1 1 1 25 7  32 o 14.60000 0.4144000 14.38000 0.5122000 14.83000 0.6517000 -0.4465000     0.8289000 
1 1 1 25 7  34 o 12.44000 0.5021000 12.08000 0.6428000 12.81000 0.7714000 -0.7332000     1.004000  
1 1 1 25 7  36 f 12.13000 0.4594000 11.97000 0.6152000 12.29000 0.6823000 -0.3191000     0.9187000 
1 1 1 25 7  38 o 5.368000 0.9084000 4.263000 1.366000  6.473000 1.198000  -2.210000      1.817000  
1 1 1 25 7  40 o 18.56000 0.3628000 18.09000 0.5430000 19.04000 0.4815000 -0.9472000     0.7257000 
1 1 1 25 7  42 o 9.366000 0.5316000 9.306000 0.7670000 9.426000 0.7364000 -0.1198000     1.063000  
1 1 1 25 7  44 o 10.74000 0.5425000 10.07000 0.7996000 11.40000 0.7334000 -1.333000      1.085000  
1 1 1 25 7  46 o 4.020000 1.006000  4.519000 1.530000  3.521000 1.305000  0.9978000      2.011000  
1 1 1 25 7  48 o 13.08000 0.4920000 13.33000 0.6539000 12.83000 0.7352000 0.4933000      0.9839000 
1 1 1 25 7  50 o 7.348000 0.8253000 7.871000 0.9527000 6.825000 1.348000  1.047000       1.651000  
1 1 1 25 7  52 o 3.847000 0.9754000 3.171000 1.341000  4.523000 1.417000  -1.352000      1.951000  
1 1 1 25 7  54 o 4.177000 0.9770000 3.627000 1.366000  4.727000 1.397000  -1.100000      1.954000  
1 1 1 25 7  56 o 3.510000 1.008000  4.123000 1.565000  2.897000 1.272000  1.226000       2.017000  
1 1 1 25 8  1  o 16.08000 0.2986000 16.45000 0.4264000 15.71000 0.4182000 0.7384000      0.5972000 
1 1 1 25 8  3  o 51.17000 0.4441000 51.35000 0.6330000 51.00000 0.6231000 0.3540000      0.8882000 
1 1 1 25 8  5  o 27.41000 0.3013000 27.41000 0.3893000 27.41000 0.4599000 0.1274000E-02  0.6026000 
1 1 1 25 8  7  o 31.61000 0.2905000 31.72000 0.4127000 31.50000 0.4090000 0.2189000      0.5810000 
1 1 1 25 8  9  o 12.50000 0.3396000 12.64000 0.4900000 12.37000 0.4703000 0.2651000      0.6792000 
1 1 1 25 8  11 o 13.35000 0.3378000 13.29000 0.5055000 13.42000 0.4481000 -0.1250000     0.6755000 
1 1 1 25 8  13 o 12.44000 0.3504000 12.77000 0.4886000 12.11000 0.5024000 0.6595000      0.7008000 
1 1 1 25 8  15 o 12.51000 0.3674000 12.39000 0.5336000 12.63000 0.5051000 -0.2426000     0.7347000 
1 1 1 25 8  17 o 15.94000 0.3098000 15.81000 0.4406000 16.07000 0.4358000 -0.2634000     0.6197000 
1 1 1 25 8  19 o 30.62000 0.2997000 30.23000 0.4191000 31.01000 0.4286000 -0.7776000     0.5995000 
1 1 1 25 8  21 o 40.64000 0.3612000 40.02000 0.4707000 41.25000 0.5479000 -1.232000      0.7224000 
1 1 1 25 8  23 o 14.56000 0.3923000 14.57000 0.5084000 14.55000 0.5975000 0.1885000E-01  0.7846000 
1 1 1 25 8  25 o 28.82000 0.3431000 28.85000 0.5293000 28.79000 0.4368000 0.6414000E-01  0.6862000 
1 1 1 25 8  27 o 12.58000 0.5976000 12.26000 0.6602000 12.91000 0.9964000 -0.6565000     1.195000  
1 1 1 25 8  29 o 3.480000 0.9652000 3.787000 1.342000  3.173000 1.388000  0.6139000      1.930000  
1 1 1 25 8  31 o 28.72000 0.3721000 28.79000 0.5177000 28.66000 0.5346000 0.1292000      0.7441000 
1 1 1 25 8  33 o 14.50000 0.4125000 14.89000 0.4993000 14.10000 0.6567000 0.7836000      0.8250000 
1 1 1 25 8  35 o 14.95000 0.4053000 14.79000 0.4893000 15.12000 0.6462000 -0.3253000     0.8106000 
1 1 1 25 8  37 o 9.086000 0.6393000 8.532000 0.8278000 9.640000 0.9745000 -1.108000      1.279000  
1 1 1 25 8  39 o 6.060000 0.7809000 5.668000 1.169000  6.451000 1.035000  -0.7827000     1.562000  
1 1 1 25 8  41 o 14.99000 0.3811000 14.65000 0.5565000 15.33000 0.5209000 -0.6768000     0.7623000 
1 1 1 25 8  43 o 4.952000 0.8792000 5.681000 1.158000  4.223000 1.323000  1.459000       1.758000  
1 1 1 25 8  45 o 3.871000 1.013000  3.250000 1.313000  4.492000 1.542000  -1.242000      2.025000  
1 1 1 25 8  47 o 11.01000 0.7906000 10.85000 1.400000  11.18000 0.7346000 -0.3247000     1.581000  
1 1 1 25 8  49 o 3.434000 0.9682000 3.096000 1.317000  3.773000 1.420000  -0.6768000     1.936000  
1 1 1 25 8  51 o 3.673000 1.028000  3.421000 1.463000  3.925000 1.445000  -0.5031000     2.056000  
1 1 1 25 8  53 o 5.889000 0.8710000 5.986000 1.185000  5.793000 1.277000  0.1927000      1.742000  
1 1 1 25 8  55 o 4.195000 0.9914000 4.159000 1.400000  4.230000 1.404000  -0.7052000E-01 1.983000  
1 1 1 25 8  57 o 5.862000 1.102000  6.390000 1.526000  5.334000 1.589000  1.056000       2.203000  
1 1 1 25 9  0  o 7.125000 0.9661000 7.125000 0.9661000 7.125000 0.9661000 0.000000       0.000000  
1 1 1 25 9  2  o 63.78000 0.4621000 64.07000 0.6569000 63.49000 0.6501000 0.5772000      0.9242000 
1 1 1 25 9  4  o 3.371000 0.8567000 3.419000 1.233000  3.322000 1.190000  0.9691000E-01  1.713000  
1 1 1 25 9  6  o 13.03000 0.3580000 12.86000 0.4777000 13.19000 0.5334000 -0.3371000     0.7160000 
1 1 1 25 9  8  o 5.232000 0.7272000 5.782000 0.8839000 4.683000 1.155000  1.099000       1.454000  
1 1 1 25 9  10 o 9.124000 0.4622000 8.875000 0.7257000 9.373000 0.5727000 -0.4972000     0.9245000 
1 1 1 25 9  12 o 20.85000 0.2778000 20.87000 0.3923000 20.84000 0.3934000 0.3373000E-01  0.5556000 
1 1 1 25 9  14 o 48.53000 0.4013000 48.47000 0.6035000 48.60000 0.5291000 -0.1248000     0.8026000 
1 1 1 25 9  16 o 7.301000 0.5365000 6.875000 0.7975000 7.728000 0.7179000 -0.8532000     1.073000  
1 1 1 25 9  18 o 7.992000 0.5248000 8.260000 0.7168000 7.724000 0.7668000 0.5363000      1.050000  
1 1 1 25 9  20 o 22.29000 0.3089000 22.40000 0.4193000 22.17000 0.4536000 0.2341000      0.6178000 
1 1 1 25 9  22 o 13.84000 0.3584000 14.32000 0.4882000 13.37000 0.5249000 0.9544000      0.7169000 
1 1 1 25 9  24 o 11.61000 0.5175000 11.04000 0.6070000 12.18000 0.8383000 -1.136000      1.035000  
1 1 1 25 9  26 o 20.87000 0.3426000 20.94000 0.4632000 20.81000 0.5049000 0.1315000      0.6852000 
1 1 1 25 9  28 o 14.78000 0.4477000 14.39000 0.5823000 15.18000 0.6801000 -0.7912000     0.8954000 
1 1 1 25 9  30 o 46.25000 0.4073000 46.28000 0.5309000 46.23000 0.6177000 0.5239000E-01  0.8145000 
1 1 1 25 9  32 o 29.59000 0.3479000 29.90000 0.4578000 29.28000 0.5241000 0.6189000      0.6958000 
1 1 1 25 9  34 o 14.44000 0.4338000 15.21000 0.5122000 13.67000 0.7002000 1.548000       0.8675000 
1 1 1 25 9  36 f 9.572000 0.5288000 10.15000 0.6165000 8.998000 0.8594000 1.148000       1.058000  
1 1 1 25 9  38 o 13.25000 0.4028000 13.35000 0.5651000 13.16000 0.5741000 0.1870000      0.8056000 
1 1 1 25 9  40 o 14.80000 0.6466000 15.26000 1.169000  14.33000 0.5536000 0.9299000      1.293000  
1 1 1 25 9  42 o 5.965000 0.8069000 5.016000 1.269000  6.914000 0.9972000 -1.898000      1.614000  
1 1 1 25 9  44 o 12.67000 0.5184000 11.97000 0.7675000 13.38000 0.6970000 -1.410000      1.037000  
1 1 1 25 9  46 o 4.040000 0.9549000 4.314000 1.350000  3.766000 1.351000  0.5489000      1.910000  
1 1 1 25 9  48 o 7.668000 0.7623000 6.927000 1.260000  8.409000 0.8577000 -1.482000      1.525000  
1 1 1 25 9  50 o 9.689000 0.6371000 9.449000 0.9163000 9.928000 0.8853000 -0.4794000     1.274000  
1 1 1 25 9  52 o 3.905000 0.9708000 4.587000 1.410000  3.223000 1.335000  1.364000       1.942000  
1 1 1 25 9  54 o 6.648000 0.8100000 6.995000 1.069000  6.300000 1.217000  0.6948000      1.620000  
1 1 1 25 9  56 o 5.883000 0.9920000 5.887000 1.387000  5.879000 1.419000  0.8064000E-02  1.984000  
1 1 1 25 10 1  o 7.187000 0.5066000 7.495000 0.6924000 6.878000 0.7398000 0.6169000      1.013000  
1 1 1 25 10 3  o 35.05000 0.3459000 35.26000 0.4894000 34.85000 0.4890000 0.4039000      0.6918000 
1 1 1 25 10 5  o 59.78000 0.4381000 59.96000 0.6210000 59.60000 0.6180000 0.3563000      0.8762000 
1 1 1 25 10 7  o 89.86000 0.6800000 90.66000 0.8978000 89.07000 1.022000  1.586000       1.360000  
1 1 1 25 10 9  o 31.05000 0.2877000 31.40000 0.4101000 30.70000 0.4037000 0.6988000      0.5755000 
1 1 1 25 10 11 o 29.42000 0.3061000 29.38000 0.4623000 29.45000 0.4012000 -0.6772000E-01 0.6121000 
1 1 1 25 10 13 o 16.81000 0.3117000 16.79000 0.4639000 16.83000 0.4165000 -0.3878000E-01 0.6235000 
1 1 1 25 10 15 o 53.39000 0.4016000 52.59000 0.5610000 54.18000 0.5748000 -1.598000      0.8032000 
1 1 1 25 10 17 o 16.00000 0.3128000 16.43000 0.4291000 15.56000 0.4553000 0.8765000      0.6256000 
1 1 1 25 10 19 o 42.60000 0.3715000 42.33000 0.4899000 42.87000 0.5587000 -0.5331000     0.7430000 
1 1 1 25 10 21 o 27.68000 0.2956000 27.75000 0.4148000 27.61000 0.4212000 0.1351000      0.5912000 
1 1 1 25 10 23 o 55.41000 0.4506000 55.80000 0.5958000 55.02000 0.6761000 0.7809000      0.9012000 
1 1 1 25 10 25 o 16.68000 0.3463000 16.71000 0.4830000 16.65000 0.4966000 0.6065000E-01  0.6927000 
1 1 1 25 10 27 o 13.93000 0.4393000 13.65000 0.5496000 14.22000 0.6854000 -0.5694000     0.8786000 
1 1 1 25 10 29 o 22.36000 0.3891000 22.36000 0.5434000 22.37000 0.5570000 -0.8251000E-02 0.7781000 
1 1 1 25 10 31 o 18.96000 0.3621000 19.03000 0.4375000 18.89000 0.5772000 0.1328000      0.7242000 
1 1 1 25 10 33 o 21.59000 0.3773000 21.47000 0.5378000 21.70000 0.5293000 -0.2290000     0.7546000 
1 1 1 25 10 35 o 21.27000 0.3332000 21.43000 0.3944000 21.11000 0.5370000 0.3188000      0.6663000 
1 1 1 25 10 37 o 7.621000 0.9001000 7.045000 0.8022000 8.197000 1.612000  -1.153000      1.800000  
1 1 1 25 10 39 o 4.698000 1.009000  3.894000 1.615000  5.501000 1.208000  -1.607000      2.017000  
1 1 1 25 10 41 o 15.78000 0.3723000 15.51000 0.5327000 16.06000 0.5202000 -0.5444000     0.7446000 
1 1 1 25 10 43 f 16.31000 0.3953000 16.73000 0.4794000 15.89000 0.6286000 0.8340000      0.7906000 
1 1 1 25 10 45 o 8.379000 0.6820000 7.729000 1.112000  9.028000 0.7890000 -1.299000      1.364000  
1 1 1 25 10 47 o 12.82000 0.4921000 13.14000 0.7275000 12.49000 0.6628000 0.6467000      0.9842000 
1 1 1 25 10 49 o 5.452000 0.9158000 7.215000 1.039000  3.688000 1.508000  3.528000       1.832000  
1 1 1 25 10 51 o 3.870000 0.9939000 3.227000 1.379000  4.513000 1.431000  -1.286000      1.988000  
1 1 1 25 10 53 o 6.912000 0.8491000 7.821000 1.104000  6.003000 1.290000  1.819000       1.698000  
1 1 1 25 10 55 o 9.024000 0.6214000 9.142000 0.8710000 8.905000 0.8865000 0.2371000      1.243000  
1 1 1 25 11 0  f 67.97000 0.6896000 67.97000 0.6896000 67.97000 0.6896000 0.000000       0.000000  
1 1 1 25 11 2  o 27.46000 0.2778000 27.72000 0.3899000 27.19000 0.3958000 0.5254000      0.5556000 
1 1 1 25 11 4  o 23.28000 0.2887000 23.15000 0.3800000 23.40000 0.4347000 -0.2539000     0.5774000 
1 1 1 25 11 6  o 24.47000 0.3010000 24.77000 0.3952000 24.17000 0.4541000 0.5977000      0.6020000 
1 1 1 25 11 8  f 46.35000 0.3905000 46.26000 0.5095000 46.43000 0.5920000 -0.1628000     0.7811000 
1 1 1 25 11 10 o 53.00000 0.3976000 52.78000 0.5614000 53.23000 0.5633000 -0.4408000     0.7953000 
1 1 1 25 11 12 o 46.48000 0.4365000 46.53000 0.7101000 46.43000 0.5078000 0.1018000      0.8730000 
1 1 1 25 11 14 o 43.95000 0.3491000 44.07000 0.4966000 43.82000 0.4909000 0.2453000      0.6982000 
1 1 1 25 11 16 o 28.63000 0.2877000 28.71000 0.4056000 28.55000 0.4082000 0.1584000      0.5754000 
1 1 1 25 11 18 o 27.77000 0.3063000 27.36000 0.4077000 28.18000 0.4572000 -0.8138000     0.6125000 
1 1 1 25 11 20 o 33.10000 0.3064000 33.54000 0.4347000 32.67000 0.4318000 0.8651000      0.6127000 
1 1 1 25 11 22 o 6.693000 0.7174000 6.585000 0.9227000 6.802000 1.099000  -0.2168000     1.435000  
1 1 1 25 11 24 o 31.54000 0.3374000 31.04000 0.4391000 32.04000 0.5124000 -0.9984000     0.6748000 
1 1 1 25 11 26 o 47.01000 0.3944000 46.37000 0.4703000 47.66000 0.6332000 -1.291000      0.7888000 
1 1 1 25 11 28 o 54.20000 0.4497000 53.87000 0.5794000 54.54000 0.6880000 -0.6641000     0.8995000 
1 1 1 25 11 30 o 4.570000 1.014000  5.135000 1.386000  4.005000 1.481000  1.130000       2.028000  
1 1 1 25 11 32 o 31.34000 0.3322000 31.52000 0.4027000 31.15000 0.5285000 0.3671000      0.6644000 
1 1 1 25 11 34 o 19.84000 0.3556000 19.99000 0.4856000 19.68000 0.5195000 0.3065000      0.7111000 
1 1 1 25 11 36 o 8.364000 0.6335000 8.162000 0.7173000 8.566000 1.044000  -0.4039000     1.267000  
1 1 1 25 11 38 o 28.51000 0.3164000 28.27000 0.4461000 28.75000 0.4488000 -0.4772000     0.6328000 
1 1 1 25 11 40 o 10.60000 0.4830000 10.79000 0.7099000 10.40000 0.6551000 0.3883000      0.9660000 
1 1 1 25 11 42 o 3.136000 0.9104000 2.215000 1.049000  4.057000 1.489000  -1.843000      1.821000  
1 1 1 25 11 44 o 3.324000 0.9189000 3.193000 1.291000  3.455000 1.308000  -0.2615000     1.838000  
1 1 1 25 11 46 o 10.49000 0.5493000 10.51000 0.8385000 10.48000 0.7099000 0.2269000E-01  1.099000  
1 1 1 25 11 48 o 17.76000 0.3735000 18.05000 0.5457000 17.48000 0.5100000 0.5668000      0.7470000 
1 1 1 25 11 50 f 16.03000 0.3960000 16.16000 0.5631000 15.91000 0.5568000 0.2457000      0.7919000 
1 1 1 25 11 52 o 9.926000 0.5670000 9.646000 0.8005000 10.21000 0.8031000 -0.5601000     1.134000  
1 1 1 25 11 54 o 6.335000 0.8640000 6.021000 1.284000  6.649000 1.157000  -0.6278000     1.728000  
1 1 1 25 11 56 o 5.792000 0.8949000 6.457000 1.267000  5.126000 1.264000  1.331000       1.790000  
1 1 1 25 12 1  o 31.23000 0.2875000 31.39000 0.4070000 31.08000 0.4060000 0.3080000      0.5749000 
1 1 1 25 12 3  o 12.97000 0.3294000 12.82000 0.4496000 13.12000 0.4815000 -0.3074000     0.6588000 
1 1 1 25 12 5  o 31.14000 0.2892000 31.18000 0.4086000 31.10000 0.4095000 0.8045000E-01  0.5785000 
1 1 1 25 12 7  o 30.71000 0.3693000 30.33000 0.4505000 31.09000 0.5853000 -0.7637000     0.7386000 
1 1 1 25 12 9  o 16.99000 0.2931000 17.23000 0.4036000 16.76000 0.4250000 0.4752000      0.5861000 
1 1 1 25 12 11 o 28.05000 0.3010000 28.28000 0.4515000 27.82000 0.3982000 0.4569000      0.6020000 
1 1 1 25 12 13 o 3.652000 0.8155000 2.811000 1.137000  4.492000 1.170000  -1.681000      1.631000  
1 1 1 25 12 15 o 12.45000 0.3547000 12.63000 0.4831000 12.27000 0.5195000 0.3564000      0.7094000 
1 1 1 25 12 17 f 36.65000 0.3389000 36.61000 0.4466000 36.70000 0.5099000 -0.8765000E-01 0.6778000 
1 1 1 25 12 19 o 14.25000 0.3554000 14.46000 0.4613000 14.03000 0.5406000 0.4336000      0.7107000 
1 1 1 25 12 21 o 25.36000 0.3178000 24.68000 0.4255000 26.04000 0.4721000 -1.360000      0.6355000 
1 1 1 25 12 23 o 6.415000 0.6955000 5.637000 1.040000  7.192000 0.9236000 -1.554000      1.391000  
1 1 1 25 12 25 o 58.57000 0.4566000 58.32000 0.5531000 58.83000 0.7266000 -0.5176000     0.9131000 
1 1 1 25 12 27 o 23.13000 0.3653000 22.90000 0.4747000 23.36000 0.5554000 -0.4597000     0.7307000 
1 1 1 25 12 29 o 18.19000 0.3492000 18.56000 0.4103000 17.82000 0.5650000 0.7387000      0.6983000 
1 1 1 25 12 31 o 18.01000 0.3716000 17.80000 0.4805000 18.21000 0.5670000 -0.4119000     0.7433000 
1 1 1 25 12 33 o 16.89000 0.3764000 16.84000 0.4690000 16.94000 0.5890000 -0.9361000E-01 0.7529000 
1 1 1 25 12 35 o 3.177000 0.9194000 3.201000 1.256000  3.152000 1.343000  0.4831000E-01  1.839000  
1 1 1 25 12 37 o 4.300000 1.008000  3.946000 1.249000  4.654000 1.581000  -0.7085000     2.015000  
1 1 1 25 12 39 o 18.16000 0.3317000 18.21000 0.4652000 18.11000 0.4731000 0.1097000      0.6635000 
1 1 1 25 12 41 o 17.10000 0.3788000 17.05000 0.4834000 17.14000 0.5834000 -0.9296000E-01 0.7576000 
1 1 1 25 12 43 o 17.25000 0.3471000 17.33000 0.4829000 17.17000 0.4987000 0.1523000      0.6942000 
1 1 1 25 12 45 o 11.76000 0.4620000 11.88000 0.6475000 11.64000 0.6593000 0.2329000      0.9241000 
1 1 1 25 12 47 o 9.592000 0.6283000 9.100000 1.027000  10.08000 0.7235000 -0.9836000     1.257000  
1 1 1 25 12 49 o 2.746000 0.8876000 2.748000 1.232000  2.743000 1.278000  0.5173000E-02  1.775000  
1 1 1 25 12 51 o 5.537000 0.9482000 5.372000 1.371000  5.702000 1.311000  -0.3300000     1.896000  
1 1 1 25 12 53 o 4.950000 0.9805000 5.095000 1.348000  4.805000 1.424000  0.2903000      1.961000  
1 1 1 25 12 55 o 2.738000 0.8759000 2.727000 1.235000  2.749000 1.243000  -0.2144000E-01 1.752000  
1 1 1 25 13 0  o 48.16000 0.5200000 48.16000 0.5200000 48.16000 0.5200000 0.000000       0.000000  
1 1 1 25 13 2  o 18.55000 0.2781000 18.79000 0.3877000 18.31000 0.3989000 0.4826000      0.5563000 
1 1 1 25 13 4  o 48.05000 0.3682000 47.94000 0.5215000 48.17000 0.5200000 -0.2313000     0.7365000 
1 1 1 25 13 6  o 44.56000 0.3505000 44.71000 0.4971000 44.41000 0.4943000 0.3021000      0.7010000 
1 1 1 25 13 8  o 47.78000 0.5362000 48.12000 0.7548000 47.44000 0.7619000 0.6806000      1.072000  
1 1 1 25 13 10 o 3.647000 0.8174000 4.390000 1.154000  2.905000 1.158000  1.485000       1.635000  
1 1 1 25 13 12 o 13.10000 0.3591000 12.97000 0.5399000 13.22000 0.4736000 -0.2559000     0.7182000 
1 1 1 25 13 14 o 4.170000 0.8395000 3.926000 1.188000  4.413000 1.187000  -0.4862000     1.679000  
1 1 1 25 13 16 o 24.20000 0.3332000 24.48000 0.3953000 23.93000 0.5364000 0.5506000      0.6663000 
1 1 1 25 13 18 o 23.89000 0.3027000 24.27000 0.3980000 23.50000 0.4562000 0.7700000      0.6054000 
1 1 1 25 13 20 o 40.54000 0.3378000 40.79000 0.4800000 40.29000 0.4755000 0.4969000      0.6756000 
1 1 1 25 13 22 o 27.22000 0.3001000 27.46000 0.4254000 26.98000 0.4235000 0.4774000      0.6003000 
1 1 1 25 13 24 o 8.393000 0.7797000 9.015000 0.6651000 7.772000 1.411000  1.243000       1.559000  
1 1 1 25 13 26 o 25.04000 0.3254000 24.89000 0.3791000 25.18000 0.5291000 -0.2927000     0.6509000 
1 1 1 25 13 28 o 30.57000 0.3404000 31.11000 0.4335000 30.03000 0.5250000 1.085000       0.6809000 
1 1 1 25 13 30 o 41.52000 0.3643000 41.23000 0.4399000 41.81000 0.5809000 -0.5857000     0.7287000 
1 1 1 25 13 32 o 27.97000 0.3580000 27.96000 0.4996000 27.98000 0.5130000 -0.2199000E-01 0.7160000 
1 1 1 25 13 34 o 15.92000 0.4136000 16.02000 0.5993000 15.82000 0.5703000 0.2008000      0.8273000 
1 1 1 25 13 36 o 9.292000 0.5852000 8.965000 0.7256000 9.618000 0.9184000 -0.6533000     1.170000  
1 1 1 25 13 38 o 9.630000 0.5140000 9.610000 0.5979000 9.651000 0.8363000 -0.4050000E-01 1.028000  
1 1 1 25 13 40 o 5.640000 0.9267000 5.317000 1.268000  5.962000 1.352000  -0.6451000     1.853000  
1 1 1 25 13 42 o 2.948000 0.8660000 2.487000 1.126000  3.408000 1.316000  -0.9214000     1.732000  
1 1 1 25 13 44 o 4.863000 0.9491000 4.989000 1.311000  4.736000 1.373000  0.2531000      1.898000  
1 1 1 25 13 46 o 3.602000 0.9633000 3.287000 1.365000  3.917000 1.359000  -0.6307000     1.927000  
1 1 1 25 13 48 o 13.25000 0.5172000 13.23000 0.7913000 13.27000 0.6663000 -0.3910000E-01 1.034000  
1 1 1 25 13 50 o 13.93000 0.4524000 13.74000 0.6758000 14.12000 0.6016000 -0.3881000     0.9047000 
1 1 1 25 13 52 o 4.155000 1.001000  4.685000 1.412000  3.624000 1.421000  1.061000       2.003000  
1 1 1 25 13 54 o 7.020000 0.7962000 6.938000 1.106000  7.103000 1.146000  -0.1653000     1.592000  
1 1 1 25 13 56 o 4.048000 1.241000  3.154000 1.451000  4.943000 2.014000  -1.789000      2.482000  
1 1 1 25 14 1  o 27.20000 0.2773000 26.88000 0.3892000 27.51000 0.3952000 -0.6213000     0.5546000 
1 1 1 25 14 3  o 13.31000 0.3268000 13.40000 0.4497000 13.22000 0.4743000 0.1872000      0.6537000 
1 1 1 25 14 5  o 20.18000 0.2961000 20.22000 0.4372000 20.13000 0.3993000 0.9772000E-01  0.5921000 
1 1 1 25 14 7  o 38.33000 0.3430000 38.48000 0.5169000 38.18000 0.4511000 0.2985000      0.6860000 
1 1 1 25 14 9  o 30.18000 0.3286000 30.60000 0.4520000 29.76000 0.4770000 0.8381000      0.6571000 
1 1 1 25 14 11 o 22.86000 0.3084000 23.38000 0.4335000 22.34000 0.4387000 1.035000       0.6167000 
1 1 1 25 14 13 o 50.22000 0.4946000 50.85000 0.6319000 49.59000 0.7610000 1.262000       0.9892000 
1 1 1 25 14 15 o 36.65000 0.3738000 36.75000 0.4430000 36.56000 0.6022000 0.1892000      0.7476000 
1 1 1 25 14 17 o 42.60000 0.3450000 42.72000 0.4900000 42.47000 0.4858000 0.2549000      0.6900000 
1 1 1 25 14 19 o 38.01000 0.3271000 38.24000 0.4676000 37.77000 0.4575000 0.4630000      0.6542000 
1 1 1 25 14 21 o 33.53000 0.3118000 33.51000 0.4432000 33.56000 0.4385000 -0.5057000E-01 0.6235000 
1 1 1 25 14 23 o 23.74000 0.3359000 23.73000 0.4069000 23.75000 0.5345000 -0.1298000E-01 0.6717000 
1 1 1 25 14 25 o 16.00000 0.3561000 15.54000 0.4239000 16.47000 0.5724000 -0.9298000     0.7123000 
1 1 1 25 14 27 o 17.39000 0.3662000 16.65000 0.4536000 18.12000 0.5750000 -1.464000      0.7324000 
1 1 1 25 14 29 o 10.98000 0.4841000 10.86000 0.5559000 11.11000 0.7927000 -0.2539000     0.9682000 
1 1 1 25 14 31 o 16.23000 0.3949000 16.19000 0.5047000 16.27000 0.6076000 -0.7740000E-01 0.7898000 
1 1 1 25 14 33 o 24.44000 0.3315000 24.60000 0.4277000 24.28000 0.5066000 0.3168000      0.6630000 
1 1 1 25 14 35 f 17.81000 0.3737000 18.10000 0.4096000 17.52000 0.6251000 0.5758000      0.7473000 
1 1 1 25 14 37 o 7.853000 0.7720000 7.968000 0.8273000 7.739000 1.304000  0.2284000      1.544000  
1 1 1 25 14 39 o 8.336000 0.5907000 8.546000 0.7641000 8.125000 0.9011000 0.4214000      1.181000  
1 1 1 25 14 41 o 11.30000 0.4262000 11.14000 0.6135000 11.46000 0.5917000 -0.3246000     0.8524000 
1 1 1 25 14 43 o 10.05000 0.4843000 9.879000 0.7086000 10.23000 0.6603000 -0.3502000     0.9686000 
1 1 1 25 14 45 o 6.016000 0.8120000 6.778000 1.066000  5.255000 1.225000  1.523000       1.624000  
1 1 1 25 14 47 o 7.354000 0.7499000 6.707000 1.172000  8.001000 0.9363000 -1.294000      1.500000  
1 1 1 25 14 49 f 10.23000 0.5392000 9.913000 0.7575000 10.55000 0.7675000 -0.6393000     1.078000  
1 1 1 25 14 51 o 2.965000 0.9427000 3.202000 1.424000  2.728000 1.235000  0.4742000      1.885000  
1 1 1 25 14 53 o 4.480000 1.057000  4.115000 1.451000  4.846000 1.536000  -0.7314000     2.113000  
1 1 1 25 14 55 o 4.203000 1.017000  4.821000 1.374000  3.585000 1.501000  1.235000       2.035000  
1 1 1 25 15 0  o 7.753000 0.6661000 7.753000 0.6661000 7.753000 0.6661000 0.000000       0.000000  
1 1 1 25 15 2  o 24.13000 0.2876000 24.37000 0.4267000 23.89000 0.3856000 0.4783000      0.5752000 
1 1 1 25 15 4  o 9.694000 0.4219000 10.05000 0.5875000 9.334000 0.6057000 0.7202000      0.8438000 
1 1 1 25 15 6  o 15.52000 0.3203000 15.61000 0.4788000 15.43000 0.4257000 0.1804000      0.6407000 
1 1 1 25 15 8  o 37.87000 0.3924000 38.64000 0.4556000 37.09000 0.6389000 1.541000       0.7847000 
1 1 1 25 15 10 o 39.48000 0.5018000 38.81000 0.4580000 40.15000 0.8930000 -1.345000      1.004000  
1 1 1 25 15 12 o 35.21000 0.3814000 35.72000 0.4390000 34.71000 0.6238000 1.017000       0.7628000 
1 1 1 25 15 14 o 42.83000 0.5458000 42.77000 0.5513000 42.90000 0.9420000 -0.1307000     1.092000  
1 1 1 25 15 16 o 9.891000 0.4929000 9.999000 0.5764000 9.784000 0.7997000 0.2145000      0.9858000 
1 1 1 25 15 18 o 76.01000 0.5890000 75.74000 0.7637000 76.29000 0.8969000 -0.5485000     1.178000  
1 1 1 25 15 20 o 54.39000 0.4404000 54.22000 0.6620000 54.55000 0.5809000 -0.3227000     0.8808000 
1 1 1 25 15 22 o 46.67000 0.4014000 46.16000 0.5095000 47.17000 0.6205000 -1.017000      0.8029000 
1 1 1 25 15 24 o 23.03000 0.3713000 22.37000 0.3648000 23.70000 0.6468000 -1.322000      0.7426000 
1 1 1 25 15 26 o 47.09000 0.4053000 46.65000 0.5158000 47.54000 0.6253000 -0.8912000     0.8106000 
1 1 1 25 15 28 o 40.69000 0.3970000 40.78000 0.5447000 40.59000 0.5778000 0.1850000      0.7941000 
1 1 1 25 15 30 o 9.134000 0.6630000 8.800000 0.9777000 9.467000 0.8956000 -0.6668000     1.326000  
1 1 1 25 15 32 o 24.03000 0.3211000 24.21000 0.3884000 23.86000 0.5113000 0.3508000      0.6421000 
1 1 1 25 15 34 o 9.630000 0.5964000 10.26000 0.5512000 9.001000 1.058000  1.258000       1.193000  
1 1 1 25 15 36 o 7.147000 0.7192000 7.357000 0.7966000 6.936000 1.198000  0.4204000      1.438000  
1 1 1 25 15 38 o 14.75000 0.4822000 14.95000 0.5384000 14.56000 0.8001000 0.3847000      0.9644000 
1 1 1 25 15 40 o 8.560000 0.5702000 8.726000 0.8327000 8.393000 0.7792000 0.3328000      1.140000  
1 1 1 25 15 42 o 3.090000 0.8933000 3.148000 1.281000  3.033000 1.245000  0.1156000      1.787000  
1 1 1 25 15 44 o 3.432000 0.9101000 3.953000 1.343000  2.911000 1.228000  1.042000       1.820000  
1 1 1 25 15 46 o 4.482000 0.9622000 4.065000 1.396000  4.899000 1.325000  -0.8345000     1.924000  
1 1 1 25 15 48 o 15.58000 0.4781000 14.88000 0.6049000 16.27000 0.7407000 -1.387000      0.9563000 
1 1 1 25 15 50 o 5.432000 0.9440000 4.841000 1.445000  6.023000 1.216000  -1.182000      1.888000  
1 1 1 25 15 52 o 8.556000 0.7882000 8.332000 1.154000  8.780000 1.074000  -0.4475000     1.576000  
1 1 1 25 15 54 o 4.062000 1.039000  4.093000 1.412000  4.031000 1.525000  0.6173000E-01  2.079000  
1 1 1 25 16 1  f 49.19000 0.4276000 49.26000 0.6053000 49.13000 0.6041000 0.1310000      0.8551000 
1 1 1 25 16 3  o 20.80000 0.3005000 20.95000 0.4174000 20.66000 0.4325000 0.2943000      0.6010000 
1 1 1 25 16 5  o 10.92000 0.3883000 10.39000 0.5388000 11.45000 0.5593000 -1.068000      0.7766000 
1 1 1 25 16 7  o 53.14000 0.4932000 52.48000 0.5596000 53.80000 0.8122000 -1.316000      0.9863000 
1 1 1 25 16 9  o 49.72000 0.4943000 50.53000 0.6401000 48.92000 0.7534000 1.603000       0.9886000 
1 1 1 25 16 11 o 44.33000 0.4002000 44.19000 0.5665000 44.47000 0.5655000 -0.2796000     0.8005000 
1 1 1 25 16 13 o 7.216000 0.5899000 7.097000 0.8340000 7.335000 0.8345000 -0.2381000     1.180000  
1 1 1 25 16 15 o 22.15000 0.3060000 21.98000 0.3952000 22.31000 0.4674000 -0.3327000     0.6121000 
1 1 1 25 16 17 o 21.03000 0.3150000 20.61000 0.4086000 21.45000 0.4794000 -0.8396000     0.6299000 
1 1 1 25 16 19 o 34.43000 0.3615000 33.81000 0.4902000 35.05000 0.5315000 -1.240000      0.7231000 
1 1 1 25 16 21 o 14.62000 0.3988000 14.64000 0.4807000 14.59000 0.6365000 0.4685000E-01  0.7976000 
1 1 1 25 16 23 o 8.374000 0.6062000 8.266000 0.6735000 8.483000 1.008000  -0.2175000     1.212000  
1 1 1 25 16 25 o 12.00000 0.4197000 11.90000 0.4946000 12.10000 0.6781000 -0.2020000     0.8394000 
1 1 1 25 16 27 o 30.73000 0.3632000 30.29000 0.5024000 31.18000 0.5245000 -0.8851000     0.7263000 
1 1 1 25 16 29 o 9.243000 0.5475000 8.769000 0.6674000 9.718000 0.8680000 -0.9485000     1.095000  
1 1 1 25 16 31 o 14.47000 0.3843000 13.54000 0.4708000 15.40000 0.6075000 -1.866000      0.7686000 
1 1 1 25 16 33 o 15.24000 0.3784000 15.47000 0.4426000 15.01000 0.6140000 0.4629000      0.7568000 
1 1 1 25 16 35 o 15.67000 0.3679000 15.49000 0.4481000 15.85000 0.5837000 -0.3638000     0.7359000 
1 1 1 25 16 37 o 22.04000 0.5289000 21.67000 0.4680000 22.41000 0.9486000 -0.7424000     1.058000  
1 1 1 25 16 39 o 8.884000 0.5570000 9.340000 0.7059000 8.427000 0.8618000 0.9124000      1.114000  
1 1 1 25 16 41 o 3.993000 0.9150000 3.521000 1.312000  4.465000 1.276000  -0.9437000     1.830000  
1 1 1 25 16 43 o 11.06000 0.4450000 11.29000 0.6309000 10.83000 0.6276000 0.4610000      0.8899000 
1 1 1 25 16 45 o 10.30000 0.5079000 10.02000 0.7493000 10.58000 0.6858000 -0.5583000     1.016000  
1 1 1 25 16 47 o 6.367000 0.8394000 7.109000 1.004000  5.625000 1.346000  1.483000       1.679000  
1 1 1 25 16 49 o 8.190000 0.6588000 8.855000 0.8443000 7.525000 1.012000  1.330000       1.318000  
1 1 1 25 16 51 o 8.218000 0.7559000 8.329000 0.9572000 8.107000 1.170000  0.2222000      1.512000  
1 1 1 25 16 53 o 3.273000 1.009000  3.082000 1.386000  3.464000 1.466000  -0.3818000     2.017000  
1 1 1 25 16 55 o 3.423000 1.043000  3.932000 1.600000  2.915000 1.337000  1.017000       2.085000  
1 1 1 25 17 0  o 16.88000 0.4109000 16.88000 0.4109000 16.88000 0.4109000 0.000000       0.000000  
1 1 1 25 17 2  o 38.90000 0.3205000 39.02000 0.4537000 38.78000 0.4528000 0.2317000      0.6410000 
1 1 1 25 17 4  o 12.89000 0.3186000 13.07000 0.4606000 12.71000 0.4404000 0.3586000      0.6372000 
1 1 1 25 17 6  o 28.85000 0.3267000 28.88000 0.4462000 28.82000 0.4773000 0.6273000E-01  0.6534000 
1 1 1 25 17 8  o 43.67000 0.3485000 43.32000 0.4884000 44.03000 0.4973000 -0.7157000     0.6970000 
1 1 1 25 17 10 o 8.027000 0.5580000 7.452000 0.7670000 8.602000 0.8108000 -1.149000      1.116000  
1 1 1 25 17 12 o 19.01000 0.2923000 18.99000 0.4011000 19.03000 0.4252000 -0.4697000E-01 0.5845000 
1 1 1 25 17 14 o 41.21000 0.3615000 41.06000 0.5417000 41.35000 0.4790000 -0.2953000     0.7231000 
1 1 1 25 17 16 o 33.54000 0.3218000 33.46000 0.4789000 33.63000 0.4301000 -0.1703000     0.6437000 
1 1 1 25 17 18 o 15.87000 0.3364000 15.80000 0.4790000 15.94000 0.4724000 -0.1405000     0.6728000 
1 1 1 25 17 20 o 53.20000 0.4214000 53.65000 0.5122000 52.75000 0.6693000 0.9031000      0.8428000 
1 1 1 25 17 22 o 24.11000 0.3295000 23.76000 0.4140000 24.46000 0.5127000 -0.6973000     0.6590000 
1 1 1 25 17 24 o 19.15000 0.4145000 19.55000 0.4407000 18.76000 0.7021000 0.7887000      0.8290000 
1 1 1 25 17 26 o 29.87000 0.3692000 30.53000 0.5288000 29.22000 0.5153000 1.318000       0.7384000 
1 1 1 25 17 28 o 35.07000 0.3506000 35.20000 0.4454000 34.93000 0.5416000 0.2635000      0.7012000 
1 1 1 25 17 30 o 17.74000 0.3586000 18.21000 0.4285000 17.27000 0.5752000 0.9332000      0.7172000 
1 1 1 25 17 32 o 12.95000 0.4047000 12.81000 0.4614000 13.09000 0.6651000 -0.2736000     0.8094000 
1 1 1 25 17 34 o 9.366000 0.5605000 8.950000 0.6376000 9.783000 0.9219000 -0.8335000     1.121000  
1 1 1 25 17 36 o 7.422000 0.8033000 7.944000 0.7875000 6.899000 1.400000  1.046000       1.607000  
1 1 1 25 17 38 o 6.043000 0.7840000 5.534000 1.069000  6.552000 1.147000  -1.018000      1.568000  
1 1 1 25 17 40 o 8.083000 0.6879000 8.389000 1.072000  7.776000 0.8626000 0.6127000      1.376000  
1 1 1 25 17 42 o 3.200000 0.8838000 3.628000 1.288000  2.773000 1.210000  0.8550000      1.768000  
1 1 1 25 17 44 f 7.187000 0.6636000 7.076000 0.9067000 7.297000 0.9692000 -0.2207000     1.327000  
1 1 1 25 17 46 o 8.915000 0.5678000 8.555000 0.8338000 9.275000 0.7710000 -0.7201000     1.136000  
1 1 1 25 17 48 o 13.17000 0.4732000 12.67000 0.6133000 13.67000 0.7208000 -1.004000      0.9464000 
1 1 1 25 17 50 o 8.941000 0.7005000 9.005000 0.9169000 8.876000 1.059000  0.1296000      1.401000  
1 1 1 25 17 52 f 9.817000 0.6384000 10.35000 0.7768000 9.280000 1.013000  1.073000       1.277000  
1 1 1 25 17 54 o 6.330000 0.8389000 6.453000 1.139000  6.207000 1.232000  0.2469000      1.678000  
1 1 1 25 18 1  o 23.00000 0.2719000 22.72000 0.3816000 23.29000 0.3876000 -0.5684000     0.5439000 
1 1 1 25 18 3  f 20.81000 0.3005000 21.03000 0.3818000 20.60000 0.4642000 0.4291000      0.6010000 
1 1 1 25 18 5  o 49.82000 0.4125000 49.84000 0.5372000 49.80000 0.6261000 0.3732000E-01  0.8250000 
1 1 1 25 18 7  o 18.36000 0.3101000 18.40000 0.4584000 18.31000 0.4179000 0.9039000E-01  0.6203000 
1 1 1 25 18 9  o 21.49000 0.2893000 21.41000 0.3881000 21.58000 0.4290000 -0.1778000     0.5785000 
1 1 1 25 18 11 o 41.19000 0.3698000 41.91000 0.5715000 40.48000 0.4694000 1.430000       0.7396000 
1 1 1 25 18 13 o 45.85000 0.5786000 45.77000 1.039000  45.93000 0.5099000 -0.1598000     1.157000  
1 1 1 25 18 15 o 27.54000 0.3707000 27.63000 0.6266000 27.45000 0.3964000 0.1792000      0.7414000 
1 1 1 25 18 17 o 22.73000 0.3327000 22.72000 0.5375000 22.75000 0.3923000 -0.3186000E-01 0.6654000 
1 1 1 25 18 19 o 3.873000 0.9547000 3.222000 1.282000  4.524000 1.415000  -1.301000      1.909000  
1 1 1 25 18 21 o 8.628000 0.5968000 8.980000 0.5738000 8.276000 1.047000  0.7040000      1.194000  
1 1 1 25 18 23 o 21.88000 0.3241000 21.83000 0.3697000 21.94000 0.5325000 -0.1107000     0.6483000 
1 1 1 25 18 25 o 6.652000 0.9954000 5.660000 1.462000  7.644000 1.351000  -1.984000      1.991000  
1 1 1 25 18 27 o 11.07000 0.4686000 10.51000 0.5179000 11.64000 0.7810000 -1.135000      0.9372000 
1 1 1 25 18 29 o 8.787000 0.5769000 9.104000 0.6567000 8.469000 0.9486000 0.6347000      1.154000  
1 1 1 25 18 31 f 15.56000 0.3659000 15.84000 0.4123000 15.28000 0.6046000 0.5648000      0.7318000 
1 1 1 25 18 33 o 9.511000 0.5541000 10.14000 0.5358000 8.884000 0.9701000 1.254000       1.108000  
1 1 1 25 18 35 o 7.246000 0.7827000 7.643000 0.7105000 6.850000 1.395000  0.7922000      1.565000  
1 1 1 25 18 37 o 18.12000 0.4103000 18.41000 0.4106000 17.83000 0.7104000 0.5837000      0.8205000 
1 1 1 25 18 39 o 10.85000 0.4501000 10.91000 0.5628000 10.79000 0.7026000 0.1231000      0.9002000 
1 1 1 25 18 41 o 10.58000 0.5020000 10.16000 0.7704000 10.99000 0.6440000 -0.8301000     1.004000  
1 1 1 25 18 43 o 11.60000 0.4449000 12.24000 0.6073000 10.95000 0.6504000 1.286000       0.8899000 
1 1 1 25 18 45 o 6.995000 0.6778000 6.814000 0.9384000 7.177000 0.9783000 -0.3630000     1.356000  
1 1 1 25 18 47 o 10.17000 0.5680000 10.20000 0.7300000 10.14000 0.8705000 0.6441000E-01  1.136000  
1 1 1 25 18 49 o 3.886000 1.018000  3.435000 1.365000  4.337000 1.510000  -0.9020000     2.036000  
1 1 1 25 18 51 o 4.535000 1.054000  5.036000 1.546000  4.034000 1.434000  1.003000       2.109000  
1 1 1 25 18 53 o 8.759000 0.6500000 9.316000 0.8574000 8.202000 0.9773000 1.113000       1.300000  
1 1 1 25 19 0  o 12.11000 0.4675000 12.11000 0.4675000 12.11000 0.4675000 0.000000       0.000000  
1 1 1 25 19 2  o 14.49000 0.2922000 14.52000 0.4296000 14.46000 0.3961000 0.5721000E-01  0.5844000 
1 1 1 25 19 4  o 21.74000 0.2825000 21.62000 0.3853000 21.87000 0.4132000 -0.2508000     0.5650000 
1 1 1 25 19 6  o 36.18000 0.3730000 35.68000 0.4339000 36.68000 0.6069000 -1.008000      0.7460000 
1 1 1 25 19 8  o 20.51000 0.3592000 20.38000 0.5765000 20.63000 0.4285000 -0.2514000     0.7183000 
1 1 1 25 19 10 o 23.23000 0.3715000 23.84000 0.5886000 22.61000 0.4532000 1.231000       0.7429000 
1 1 1 25 19 12 o 18.18000 0.2921000 18.34000 0.4259000 18.02000 0.3999000 0.3134000      0.5842000 
1 1 1 25 19 14 o 17.22000 0.3001000 17.15000 0.4507000 17.28000 0.3963000 -0.1239000     0.6001000 
1 1 1 25 19 16 o 7.130000 0.5433000 7.290000 0.7473000 6.971000 0.7888000 0.3191000      1.087000  
1 1 1 25 19 18 o 18.08000 0.3263000 17.87000 0.3505000 18.28000 0.5504000 -0.4050000     0.6525000 
1 1 1 25 19 20 o 53.50000 0.4428000 54.02000 0.5797000 52.98000 0.6694000 1.035000       0.8856000 
1 1 1 25 19 22 o 29.83000 0.4466000 29.52000 0.6279000 30.14000 0.6353000 -0.6216000     0.8932000 
1 1 1 25 19 24 o 17.67000 0.4024000 17.14000 0.3925000 18.20000 0.7026000 -1.062000      0.8048000 
1 1 1 25 19 26 o 25.74000 0.3395000 26.02000 0.4430000 25.46000 0.5145000 0.5604000      0.6790000 
1 1 1 25 19 28 o 42.22000 0.4002000 42.65000 0.5478000 41.78000 0.5837000 0.8650000      0.8004000 
1 1 1 25 19 30 o 19.03000 0.3313000 19.50000 0.3675000 18.55000 0.5513000 0.9515000      0.6626000 
1 1 1 25 19 32 o 18.27000 0.3703000 18.58000 0.3728000 17.96000 0.6399000 0.6206000      0.7406000 
1 1 1 25 19 34 o 25.57000 0.3243000 25.70000 0.3751000 25.43000 0.5291000 0.2714000      0.6486000 
1 1 1 25 19 36 o 23.53000 0.3163000 24.16000 0.3764000 22.89000 0.5085000 1.276000       0.6326000 
1 1 1 25 19 38 o 16.72000 0.3476000 17.03000 0.4075000 16.41000 0.5632000 0.6130000      0.6952000 
1 1 1 25 19 40 o 21.18000 0.3184000 21.49000 0.3904000 20.88000 0.5031000 0.6176000      0.6368000 
1 1 1 25 19 42 o 11.08000 0.4747000 11.07000 0.7374000 11.08000 0.5980000 -0.3993000E-02 0.9494000 
1 1 1 25 19 44 o 5.334000 0.8554000 4.829000 1.349000  5.840000 1.052000  -1.012000      1.711000  
1 1 1 25 19 46 o 6.928000 0.7885000 7.412000 0.9390000 6.444000 1.267000  0.9683000      1.577000  
1 1 1 25 19 48 o 5.228000 1.030000  6.183000 1.167000  4.272000 1.697000  1.911000       2.060000  
1 1 1 25 19 50 o 2.996000 0.9037000 2.411000 1.136000  3.580000 1.406000  -1.169000      1.807000  
1 1 1 25 19 52 o 4.361000 1.052000  4.113000 1.507000  4.609000 1.469000  -0.4952000     2.104000  
1 1 1 25 19 54 o 4.564000 1.195000  4.086000 1.750000  5.042000 1.627000  -0.9562000     2.389000  
1 1 1 25 20 1  o 16.64000 0.2987000 16.90000 0.4192000 16.39000 0.4257000 0.5057000      0.5975000 
1 1 1 25 20 3  f 26.57000 0.3048000 26.09000 0.4238000 27.06000 0.4383000 -0.9640000     0.6097000 
1 1 1 25 20 5  o 25.34000 0.2846000 25.36000 0.4183000 25.32000 0.3859000 0.3720000E-01  0.5691000 
1 1 1 25 20 7  o 26.87000 0.3449000 26.73000 0.5709000 27.00000 0.3870000 -0.2667000     0.6898000 
1 1 1 25 20 9  o 10.11000 0.3968000 9.523000 0.5952000 10.70000 0.5249000 -1.180000      0.7936000 
1 1 1 25 20 11 o 26.13000 0.2769000 26.19000 0.3865000 26.08000 0.3966000 0.1133000      0.5538000 
1 1 1 25 20 13 o 19.73000 0.2733000 19.81000 0.3859000 19.64000 0.3872000 0.1699000      0.5466000 
1 1 1 25 20 15 o 66.19000 0.4794000 66.77000 0.6832000 65.61000 0.6726000 1.162000       0.9587000 
1 1 1 25 20 17 o 43.76000 0.4316000 43.89000 0.4352000 43.62000 0.7454000 0.2640000      0.8632000 
1 1 1 25 20 19 o 20.38000 0.3130000 21.05000 0.3426000 19.72000 0.5239000 1.332000       0.6260000 
1 1 1 25 20 21 o 36.68000 0.3896000 36.39000 0.5548000 36.96000 0.5471000 -0.5778000     0.7792000 
1 1 1 25 20 23 o 8.598000 0.5975000 8.485000 0.7655000 8.711000 0.9176000 -0.2261000     1.195000  
1 1 1 25 20 25 o 20.97000 0.3302000 21.26000 0.4110000 20.68000 0.5169000 0.5790000      0.6604000 
1 1 1 25 20 27 o 11.82000 0.4641000 12.48000 0.5546000 11.17000 0.7443000 1.313000       0.9282000 
1 1 1 25 20 29 o 9.383000 0.5292000 8.959000 0.6754000 9.808000 0.8148000 -0.8489000     1.058000  
1 1 1 25 20 31 o 13.89000 0.5257000 13.44000 0.4240000 14.34000 0.9621000 -0.8991000     1.051000  
1 1 1 25 20 33 o 9.878000 0.4913000 9.224000 0.5979000 10.53000 0.7796000 -1.307000      0.9825000 
1 1 1 25 20 35 o 11.76000 0.4098000 11.55000 0.4633000 11.96000 0.6760000 -0.4093000     0.8195000 
1 1 1 25 20 37 o 9.300000 0.5661000 9.395000 0.5704000 9.204000 0.9780000 0.1914000      1.132000  
1 1 1 25 20 39 o 4.818000 0.8672000 5.176000 1.070000  4.460000 1.365000  0.7159000      1.734000  
1 1 1 25 20 41 o 7.252000 0.5906000 7.549000 0.8275000 6.955000 0.8428000 0.5945000      1.181000  
1 1 1 25 20 43 o 9.505000 0.5949000 10.40000 0.9103000 8.610000 0.7661000 1.791000       1.190000  
1 1 1 25 20 45 o 3.224000 0.8961000 3.574000 1.290000  2.874000 1.244000  0.6993000      1.792000  
1 1 1 25 20 47 o 8.286000 0.7198000 8.164000 0.8601000 8.407000 1.154000  -0.2423000     1.440000  
1 1 1 25 20 49 o 4.236000 1.001000  4.633000 1.371000  3.838000 1.459000  0.7950000      2.002000  
1 1 1 25 20 51 o 3.391000 0.9144000 2.486000 1.157000  4.296000 1.416000  -1.810000      1.829000  
1 1 1 25 20 53 o 5.737000 1.047000  6.688000 1.590000  4.786000 1.364000  1.901000       2.095000  
1 1 1 25 21 0  o 10.33000 0.5199000 10.33000 0.5199000 10.33000 0.5199000 0.000000       0.000000  
1 1 1 25 21 2  o 28.01000 0.3030000 28.12000 0.3853000 27.90000 0.4677000 0.2182000      0.6060000 
1 1 1 25 21 4  o 10.89000 0.3629000 10.71000 0.5202000 11.08000 0.5060000 -0.3710000     0.7257000 
1 1 1 25 21 6  o 50.50000 0.4204000 50.27000 0.6406000 50.74000 0.5444000 -0.4646000     0.8407000 
1 1 1 25 21 8  o 54.39000 0.4065000 54.03000 0.5715000 54.75000 0.5784000 -0.7224000     0.8131000 
1 1 1 25 21 10 o 32.77000 0.3258000 32.28000 0.4144000 33.26000 0.5028000 -0.9866000     0.6516000 
1 1 1 25 21 12 o 3.224000 0.8412000 2.888000 1.143000  3.560000 1.234000  -0.6721000     1.682000  
1 1 1 25 21 14 o 25.98000 0.3079000 25.71000 0.4436000 26.25000 0.4271000 -0.5391000     0.6158000 
1 1 1 25 21 16 o 18.80000 0.3223000 19.09000 0.3320000 18.51000 0.5527000 0.5751000      0.6447000 
1 1 1 25 21 18 o 11.70000 0.5222000 11.15000 0.7698000 12.24000 0.7057000 -1.093000      1.044000  
1 1 1 25 21 20 o 20.14000 0.3098000 20.50000 0.3338000 19.77000 0.5219000 0.7220000      0.6195000 
1 1 1 25 21 22 o 31.52000 0.3166000 30.86000 0.3560000 32.18000 0.5237000 -1.323000      0.6332000 
1 1 1 25 21 24 o 27.87000 0.3695000 27.88000 0.3533000 27.86000 0.6492000 0.2054000E-01  0.7391000 
1 1 1 25 21 26 o 27.04000 0.4099000 27.06000 0.5324000 27.02000 0.6234000 0.3539000E-01  0.8197000 
1 1 1 25 21 28 o 27.34000 0.4139000 27.24000 0.6518000 27.44000 0.5102000 -0.1994000     0.8277000 
1 1 1 25 21 30 o 7.745000 0.7499000 9.717000 0.6395000 5.774000 1.357000  3.942000       1.500000  
1 1 1 25 21 32 o 14.68000 0.3722000 14.87000 0.4036000 14.49000 0.6254000 0.3777000      0.7443000 
1 1 1 25 21 34 o 12.84000 0.3955000 13.00000 0.4732000 12.68000 0.6339000 0.3161000      0.7911000 
1 1 1 25 21 36 o 8.848000 0.5069000 8.890000 0.5870000 8.806000 0.8265000 0.8368000E-01  1.014000  
1 1 1 25 21 38 o 17.02000 0.3408000 17.12000 0.4170000 16.92000 0.5393000 0.1924000      0.6817000 
1 1 1 25 21 40 o 16.53000 0.3453000 16.57000 0.4153000 16.48000 0.5517000 0.8787000E-01  0.6905000 
1 1 1 25 21 42 o 10.92000 0.4447000 11.13000 0.5977000 10.70000 0.6588000 0.4340000      0.8895000 
1 1 1 25 21 44 f 3.264000 0.8747000 2.277000 1.099000  4.251000 1.361000  -1.974000      1.749000  
1 1 1 25 21 46 o 4.663000 0.9886000 3.992000 1.325000  5.333000 1.467000  -1.341000      1.977000  
1 1 1 25 21 48 o 4.157000 0.9864000 3.922000 1.370000  4.393000 1.419000  -0.4710000     1.973000  
1 1 1 25 21 50 o 3.596000 0.9615000 3.144000 1.317000  4.049000 1.401000  -0.9047000     1.923000  
1 1 1 25 21 52 o 7.309000 0.7664000 7.562000 1.108000  7.056000 1.059000  0.5063000      1.533000  
1 1 1 25 22 1  o 11.42000 0.3865000 11.80000 0.4551000 11.04000 0.6247000 0.7573000      0.7729000 
1 1 1 25 22 3  o 31.70000 0.2911000 31.32000 0.4050000 32.07000 0.4182000 -0.7572000     0.5822000 
1 1 1 25 22 5  o 68.75000 0.5381000 68.81000 0.8189000 68.70000 0.6984000 0.1083000      1.076000  
1 1 1 25 22 7  o 7.208000 0.5183000 7.153000 0.6764000 7.263000 0.7856000 -0.1095000     1.037000  
1 1 1 25 22 9  o 14.56000 0.2899000 14.96000 0.4068000 14.17000 0.4132000 0.7815000      0.5799000 
1 1 1 25 22 11 o 30.57000 0.3214000 30.67000 0.4006000 30.47000 0.5027000 0.2001000      0.6428000 
1 1 1 25 22 13 o 41.20000 0.3749000 41.12000 0.5730000 41.27000 0.4835000 -0.1556000     0.7498000 
1 1 1 25 22 15 o 21.33000 0.3254000 20.97000 0.3994000 21.69000 0.5139000 -0.7171000     0.6508000 
1 1 1 25 22 17 o 24.82000 0.3210000 24.98000 0.3909000 24.66000 0.5093000 0.3242000      0.6420000 
1 1 1 25 22 19 o 33.58000 0.3391000 34.10000 0.4355000 33.07000 0.5199000 1.026000       0.6782000 
1 1 1 25 22 21 o 18.21000 0.3324000 17.57000 0.4017000 18.85000 0.5297000 -1.277000      0.6648000 
1 1 1 25 22 23 o 9.974000 0.4597000 9.928000 0.4345000 10.02000 0.8103000 -0.9204000E-01 0.9194000 
1 1 1 25 22 25 o 20.73000 0.3241000 21.12000 0.3540000 20.34000 0.5431000 0.7868000      0.6483000 
1 1 1 25 22 27 o 20.56000 0.3452000 20.74000 0.4447000 20.38000 0.5282000 0.3616000      0.6905000 
1 1 1 25 22 29 o 26.47000 0.3578000 26.50000 0.3545000 26.45000 0.6217000 0.4907000E-01  0.7156000 
1 1 1 25 22 31 o 15.79000 0.3695000 16.03000 0.4576000 15.54000 0.5803000 0.4948000      0.7390000 
1 1 1 25 22 33 o 13.67000 0.3885000 13.57000 0.4515000 13.78000 0.6323000 -0.2028000     0.7769000 
1 1 1 25 22 35 o 16.57000 0.3404000 16.49000 0.3965000 16.65000 0.5533000 -0.1664000     0.6807000 
1 1 1 25 22 37 o 7.044000 0.7224000 6.860000 0.7246000 7.228000 1.250000  -0.3684000     1.445000  
1 1 1 25 22 39 o 4.109000 0.9412000 3.638000 1.258000  4.580000 1.400000  -0.9421000     1.882000  
1 1 1 25 22 41 o 4.248000 0.9105000 3.426000 1.279000  5.069000 1.296000  -1.643000      1.821000  
1 1 1 25 22 43 o 6.752000 0.7085000 5.874000 1.081000  7.630000 0.9165000 -1.756000      1.417000  
1 1 1 25 22 45 o 5.315000 1.062000  4.987000 1.419000  5.643000 1.582000  -0.6569000     2.125000  
1 1 1 25 22 47 o 4.020000 1.004000  3.692000 1.354000  4.349000 1.483000  -0.6569000     2.008000  
1 1 1 25 22 49 o 6.134000 0.9020000 6.415000 1.253000  5.852000 1.298000  0.5639000      1.804000  
1 1 1 25 22 51 o 9.420000 0.5764000 9.613000 0.8371000 9.227000 0.7927000 0.3864000      1.153000  
1 1 1 25 23 0  o 28.56000 0.4637000 28.56000 0.4637000 28.56000 0.4637000 0.000000       0.000000  
1 1 1 25 23 2  o 22.35000 0.2660000 22.83000 0.3799000 21.88000 0.3725000 0.9469000      0.5320000 
1 1 1 25 23 4  o 24.35000 0.3438000 24.24000 0.4914000 24.47000 0.4810000 -0.2281000     0.6876000 
1 1 1 25 23 6  f 9.958000 0.3708000 9.949000 0.5060000 9.967000 0.5421000 -0.1832000E-01 0.7415000 
1 1 1 25 23 8  o 16.26000 0.2968000 16.49000 0.3873000 16.03000 0.4498000 0.4639000      0.5936000 
1 1 1 25 23 10 o 20.23000 0.3300000 20.38000 0.3681000 20.08000 0.5477000 0.3023000      0.6599000 
1 1 1 25 23 12 o 38.08000 0.3582000 37.71000 0.5505000 38.46000 0.4583000 -0.7441000     0.7163000 
1 1 1 25 23 14 o 25.16000 0.4128000 24.74000 0.6443000 25.58000 0.5163000 -0.8423000     0.8257000 
1 1 1 25 23 16 o 46.28000 0.4320000 46.10000 0.6137000 46.46000 0.6083000 -0.3527000     0.8641000 
1 1 1 25 23 18 o 17.69000 0.4054000 17.59000 0.5948000 17.78000 0.5510000 -0.1828000     0.8108000 
1 1 1 25 23 20 o 24.07000 0.3675000 23.79000 0.5249000 24.36000 0.5144000 -0.5677000     0.7349000 
1 1 1 25 23 22 o 31.03000 0.3309000 30.93000 0.4125000 31.13000 0.5174000 -0.1996000     0.6618000 
1 1 1 25 23 24 o 28.79000 0.3818000 28.52000 0.3783000 29.06000 0.6633000 -0.5405000     0.7636000 
1 1 1 25 23 26 o 27.95000 0.3105000 28.00000 0.3514000 27.90000 0.5121000 0.1077000      0.6210000 
1 1 1 25 23 28 o 13.46000 0.4174000 13.73000 0.3747000 13.20000 0.7459000 0.5345000      0.8348000 
1 1 1 25 23 30 o 18.58000 0.3704000 19.30000 0.3730000 17.86000 0.6402000 1.446000       0.7409000 
1 1 1 25 23 32 o 3.964000 0.8774000 3.579000 1.047000  4.348000 1.408000  -0.7696000     1.755000  
1 1 1 25 23 34 o 17.00000 0.3338000 17.33000 0.3705000 16.67000 0.5553000 0.6636000      0.6676000 
1 1 1 25 23 36 o 4.293000 0.8523000 4.359000 1.086000  4.227000 1.314000  0.1324000      1.705000  
1 1 1 25 23 38 o 10.48000 0.4442000 10.74000 0.5082000 10.23000 0.7288000 0.5096000      0.8885000 
1 1 1 25 23 40 o 11.26000 0.4502000 11.12000 0.5374000 11.39000 0.7225000 -0.2644000     0.9004000 
1 1 1 25 23 42 o 13.40000 0.4198000 13.29000 0.6215000 13.52000 0.5646000 -0.2286000     0.8397000 
1 1 1 25 23 44 f 5.285000 0.9895000 5.509000 1.158000  5.061000 1.605000  0.4477000      1.979000  
1 1 1 25 23 46 o 7.717000 0.7725000 7.041000 1.244000  8.393000 0.9157000 -1.352000      1.545000  
1 1 1 25 23 48 o 6.522000 0.7934000 6.958000 1.045000  6.087000 1.194000  0.8708000      1.587000  
1 1 1 25 23 50 o 8.551000 0.6406000 8.508000 0.8817000 8.595000 0.9296000 -0.8733000E-01 1.281000  
1 1 1 25 23 52 o 4.020000 1.083000  4.244000 1.651000  3.797000 1.402000  0.4477000      2.166000  
1 1 1 25 24 1  o 34.98000 0.3012000 35.19000 0.4257000 34.76000 0.4263000 0.4221000      0.6024000 
1 1 1 25 24 3  o 39.93000 0.3612000 39.66000 0.5527000 40.21000 0.4650000 -0.5474000     0.7224000 
1 1 1 25 24 5  o 16.62000 0.2839000 16.86000 0.3968000 16.39000 0.4062000 0.4722000      0.5678000 
1 1 1 25 24 7  f 21.97000 0.3449000 22.57000 0.5679000 21.37000 0.3915000 1.194000       0.6898000 
1 1 1 25 24 9  o 13.11000 0.2909000 12.95000 0.4062000 13.27000 0.4165000 -0.3234000     0.5818000 
1 1 1 25 24 11 f 15.19000 0.5547000 15.56000 0.5933000 14.81000 0.9376000 0.7524000      1.109000  
1 1 1 25 24 13 o 10.36000 0.5898000 11.14000 0.7923000 9.587000 0.8740000 1.550000       1.180000  
1 1 1 25 24 15 o 15.44000 0.4467000 15.59000 0.6279000 15.30000 0.6355000 0.2918000      0.8934000 
1 1 1 25 24 17 o 27.26000 0.3596000 27.27000 0.5128000 27.25000 0.5043000 0.1920000E-01  0.7192000 
1 1 1 25 24 19 o 18.58000 0.3901000 18.53000 0.5687000 18.64000 0.5340000 -0.1138000     0.7801000 
1 1 1 25 24 21 o 13.34000 0.5145000 12.50000 0.8092000 14.18000 0.6355000 -1.681000      1.029000  
1 1 1 25 24 23 f 13.41000 0.5930000 13.31000 0.9941000 13.52000 0.6467000 -0.2159000     1.186000  
1 1 1 25 24 25 o 23.49000 0.4168000 23.75000 0.5554000 23.23000 0.6218000 0.5170000      0.8337000 
1 1 1 25 24 27 o 10.32000 0.4327000 10.50000 0.3939000 10.14000 0.7706000 0.3629000      0.8654000 
1 1 1 25 24 29 o 13.08000 0.4140000 13.51000 0.3650000 12.66000 0.7432000 0.8468000      0.8280000 
1 1 1 25 24 31 o 14.24000 0.3837000 13.90000 0.5018000 14.58000 0.5806000 -0.6818000     0.7674000 
1 1 1 25 24 33 o 21.04000 0.3203000 21.36000 0.3448000 20.72000 0.5399000 0.6364000      0.6406000 
1 1 1 25 24 35 o 5.364000 0.7429000 4.858000 0.9114000 5.870000 1.174000  -1.012000      1.486000  
1 1 1 25 24 37 f 14.81000 0.3635000 14.85000 0.4113000 14.78000 0.5994000 0.6528000E-01  0.7270000 
1 1 1 25 24 39 o 17.06000 0.3518000 16.83000 0.4303000 17.29000 0.5568000 -0.4560000     0.7037000 
1 1 1 25 24 41 o 6.058000 0.7799000 6.194000 0.8757000 5.922000 1.291000  0.2724000      1.560000  
1 1 1 25 24 43 o 4.003000 0.8875000 5.081000 1.218000  2.926000 1.291000  2.155000       1.775000  
1 1 1 25 24 45 o 9.744000 0.5245000 9.904000 0.7295000 9.584000 0.7538000 0.3194000      1.049000  
1 1 1 25 24 47 o 4.132000 1.042000  3.473000 1.410000  4.792000 1.536000  -1.319000      2.085000  
1 1 1 25 24 49 o 6.604000 0.8835000 7.219000 1.187000  5.988000 1.309000  1.231000       1.767000  
1 1 1 25 24 51 o 10.53000 0.5381000 11.70000 0.7125000 9.350000 0.8065000 2.354000       1.076000  
1 1 1 25 25 0  o 2.880000 1.143000  2.880000 1.143000  2.880000 1.143000  0.000000       0.000000  
1 1 1 25 25 2  o 22.70000 0.3385000 22.79000 0.5656000 22.60000 0.3719000 0.1907000      0.6769000 
1 1 1 25 25 4  o 14.36000 0.3054000 14.12000 0.4222000 14.60000 0.4414000 -0.4750000     0.6108000 
1 1 1 25 25 6  o 24.09000 0.2687000 24.07000 0.3805000 24.11000 0.3796000 -0.3582000E-01 0.5375000 
1 1 1 25 25 8  o 8.517000 0.4063000 8.118000 0.6141000 8.917000 0.5323000 -0.7994000     0.8127000 
1 1 1 25 25 10 o 9.866000 0.5995000 10.10000 0.8418000 9.634000 0.8537000 0.4636000      1.199000  
1 1 1 25 25 12 o 17.63000 0.3958000 17.52000 0.5555000 17.74000 0.5641000 -0.2200000     0.7917000 
1 1 1 25 25 14 o 22.57000 0.4181000 22.54000 0.6551000 22.61000 0.5197000 -0.6737000E-01 0.8362000 
1 1 1 25 25 16 o 44.75000 0.4295000 44.65000 0.6032000 44.84000 0.6118000 -0.1868000     0.8591000 
1 1 1 25 25 18 o 33.02000 0.3704000 32.50000 0.5183000 33.54000 0.5293000 -1.042000      0.7408000 
1 1 1 25 25 20 o 22.65000 0.3693000 22.73000 0.5408000 22.58000 0.5031000 0.1495000      0.7386000 
1 1 1 25 25 22 o 22.95000 0.5621000 22.56000 0.9955000 23.34000 0.5223000 -0.7825000     1.124000  
1 1 1 25 25 24 o 22.19000 0.5618000 22.57000 0.5675000 21.81000 0.9698000 0.7600000      1.124000  
1 1 1 25 25 26 o 13.04000 0.4915000 13.57000 0.7204000 12.51000 0.6688000 1.056000       0.9830000 
1 1 1 25 25 28 o 10.97000 0.4213000 10.26000 0.3641000 11.68000 0.7600000 -1.424000      0.8427000 
1 1 1 25 25 30 o 3.234000 0.8490000 3.400000 1.083000  3.069000 1.308000  0.3308000      1.698000  
1 1 1 25 25 32 o 5.637000 0.7819000 5.413000 0.9624000 5.860000 1.233000  -0.4475000     1.564000  
1 1 1 25 25 34 o 15.82000 0.3991000 16.09000 0.4148000 15.56000 0.6820000 0.5326000      0.7982000 
1 1 1 25 25 36 o 10.95000 0.5094000 11.26000 0.4621000 10.64000 0.9079000 0.6209000      1.019000  
1 1 1 25 25 38 o 12.38000 0.3933000 12.03000 0.4791000 12.74000 0.6238000 -0.7129000     0.7866000 
1 1 1 25 25 40 o 4.718000 0.8206000 5.822000 0.8925000 3.613000 1.377000  2.209000       1.641000  
1 1 1 25 25 42 o 3.469000 0.9426000 3.390000 1.293000  3.548000 1.372000  -0.1581000     1.885000  
1 1 1 25 25 44 o 8.378000 0.6410000 7.654000 0.8582000 9.102000 0.9523000 -1.448000      1.282000  
1 1 1 25 25 46 o 4.126000 1.007000  3.847000 1.410000  4.404000 1.438000  -0.5570000     2.014000  
1 1 1 25 25 48 f 3.468000 0.9843000 3.667000 1.470000  3.270000 1.310000  0.3973000      1.969000  
1 1 1 25 25 50 o 6.076000 1.060000  6.618000 1.676000  5.534000 1.297000  1.085000       2.119000  
1 1 1 25 26 1  o 25.64000 0.3029000 24.98000 0.4679000 26.30000 0.3848000 -1.315000      0.6058000 
1 1 1 25 26 3  o 23.03000 0.2781000 23.32000 0.3851000 22.74000 0.4012000 0.5820000      0.5561000 
1 1 1 25 26 5  o 27.94000 0.2791000 28.54000 0.4040000 27.35000 0.3851000 1.190000       0.5582000 
1 1 1 25 26 7  o 38.72000 0.3893000 38.97000 0.5596000 38.47000 0.5414000 0.5072000      0.7787000 
1 1 1 25 26 9  o 57.26000 0.5018000 57.42000 0.7099000 57.10000 0.7094000 0.3229000      1.004000  
1 1 1 25 26 11 o 47.43000 0.5063000 46.49000 0.6107000 48.36000 0.8077000 -1.864000      1.013000  
1 1 1 25 26 13 o 4.172000 1.056000  4.151000 1.512000  4.192000 1.476000  -0.4043000E-01 2.113000  
1 1 1 25 26 15 o 8.901000 0.6717000 8.346000 1.025000  9.456000 0.8679000 -1.110000      1.343000  
1 1 1 25 26 17 o 6.952000 0.8486000 6.692000 1.206000  7.212000 1.194000  -0.5200000     1.697000  
1 1 1 25 26 19 o 14.52000 0.4775000 14.05000 0.7125000 15.00000 0.6359000 -0.9482000     0.9550000 
1 1 1 25 26 21 o 24.68000 0.5373000 25.41000 0.9475000 23.95000 0.5070000 1.460000       1.075000  
1 1 1 25 26 23 o 7.091000 0.9157000 6.800000 1.210000  7.382000 1.374000  -0.5819000     1.831000  
1 1 1 25 26 25 o 6.610000 0.8157000 7.261000 1.086000  5.959000 1.217000  1.302000       1.631000  
1 1 1 25 26 27 o 8.775000 0.9149000 7.900000 1.591000  9.651000 0.9033000 -1.751000      1.830000  
1 1 1 25 26 29 o 8.902000 0.6372000 8.773000 0.9644000 9.032000 0.8330000 -0.2594000     1.274000  
1 1 1 25 26 31 o 5.988000 0.7008000 5.816000 0.7181000 6.160000 1.204000  -0.3433000     1.402000  
1 1 1 25 26 33 o 8.333000 0.5147000 8.231000 0.5243000 8.435000 0.8859000 -0.2045000     1.029000  
1 1 1 25 26 35 o 8.554000 0.6393000 9.005000 0.5999000 8.103000 1.129000  0.9021000      1.279000  
1 1 1 25 26 37 o 6.013000 0.7338000 5.966000 0.7313000 6.060000 1.272000  -0.9395000E-01 1.468000  
1 1 1 25 26 39 o 9.746000 0.4954000 9.318000 0.5937000 10.17000 0.7932000 -0.8556000     0.9908000 
1 1 1 25 26 41 o 5.104000 0.9672000 4.114000 1.224000  6.094000 1.498000  -1.980000      1.934000  
1 1 1 25 26 43 o 12.33000 0.4879000 12.48000 0.5893000 12.17000 0.7777000 0.3036000      0.9758000 
1 1 1 25 26 45 o 7.653000 0.6725000 7.622000 0.8866000 7.685000 1.011000  -0.6348000E-01 1.345000  
1 1 1 25 26 47 o 4.647000 0.9910000 3.998000 1.354000  5.295000 1.447000  -1.298000      1.982000  
1 1 1 25 26 49 o 3.419000 0.9034000 2.732000 1.213000  4.105000 1.339000  -1.373000      1.807000  
1 1 1 25 27 0  o 13.89000 0.4440000 13.89000 0.4440000 13.89000 0.4440000 0.000000       0.000000  
1 1 1 25 27 2  o 18.02000 0.3187000 17.43000 0.5107000 18.61000 0.3814000 -1.172000      0.6374000 
1 1 1 25 27 4  o 27.95000 0.3492000 28.26000 0.4981000 27.63000 0.4895000 0.6249000      0.6983000 
1 1 1 25 27 6  o 27.95000 0.3153000 27.94000 0.3901000 27.96000 0.4956000 -0.2158000E-01 0.6306000 
1 1 1 25 27 8  o 23.19000 0.3641000 23.28000 0.5179000 23.10000 0.5119000 0.1793000      0.7282000 
1 1 1 25 27 10 o 7.492000 0.8008000 8.840000 0.8932000 6.144000 1.329000  2.697000       1.602000  
1 1 1 25 27 12 o 39.80000 0.4029000 39.68000 0.5658000 39.91000 0.5737000 -0.2254000     0.8058000 
1 1 1 25 27 14 f 17.63000 0.4708000 17.79000 0.7417000 17.47000 0.5801000 0.3206000      0.9416000 
1 1 1 25 27 16 o 16.62000 0.4131000 16.17000 0.5909000 17.06000 0.5775000 -0.8912000     0.8263000 
1 1 1 25 27 18 o 6.308000 0.8697000 6.931000 1.088000  5.685000 1.357000  1.246000       1.739000  
1 1 1 25 27 20 o 23.88000 0.4724000 23.89000 0.6975000 23.87000 0.6373000 0.1444000E-01  0.9448000 
1 1 1 25 27 22 f 17.44000 0.4490000 17.19000 0.7077000 17.69000 0.5528000 -0.5062000     0.8980000 
1 1 1 25 27 24 o 17.04000 0.4567000 17.46000 0.5798000 16.62000 0.7058000 0.8413000      0.9134000 
1 1 1 25 27 26 o 4.073000 1.062000  3.812000 1.514000  4.335000 1.490000  -0.5236000     2.124000  
1 1 1 25 27 28 o 7.694000 0.7366000 7.119000 1.161000  8.268000 0.9061000 -1.149000      1.473000  
1 1 1 25 27 30 o 12.69000 0.4549000 12.70000 0.6389000 12.68000 0.6477000 0.2416000E-01  0.9097000 
1 1 1 25 27 32 o 3.109000 0.8434000 2.257000 0.9546000 3.961000 1.391000  -1.704000      1.687000  
1 1 1 25 27 34 o 9.661000 0.4993000 9.550000 0.5849000 9.771000 0.8094000 -0.2208000     0.9986000 
1 1 1 25 27 36 o 6.600000 0.8818000 6.863000 0.9227000 6.338000 1.503000  0.5244000      1.764000  
1 1 1 25 27 38 o 4.779000 1.262000  5.347000 2.118000  4.211000 1.374000  1.135000       2.524000  
1 1 1 25 27 40 o 3.860000 1.010000  3.425000 1.216000  4.294000 1.614000  -0.8685000     2.020000  
1 1 1 25 27 42 o 5.650000 0.9091000 6.718000 0.9186000 4.582000 1.569000  2.136000       1.818000  
1 1 1 25 27 44 o 5.167000 0.8853000 6.286000 1.065000  4.049000 1.415000  2.237000       1.771000  
1 1 1 25 27 46 o 7.418000 0.7706000 6.650000 1.105000  8.186000 1.074000  -1.536000      1.541000  
1 1 1 25 27 48 o 3.502000 0.9529000 3.147000 1.349000  3.856000 1.346000  -0.7084000     1.906000  
1 1 1 25 28 1  o 18.97000 0.4472000 20.28000 0.7349000 17.66000 0.5097000 2.616000       0.8944000 
1 1 1 25 28 3  o 40.83000 0.3378000 41.25000 0.4781000 40.41000 0.4773000 0.8425000      0.6755000 
1 1 1 25 28 5  o 18.45000 0.2748000 18.48000 0.3928000 18.43000 0.3844000 0.4954000E-01  0.5496000 
1 1 1 25 28 7  o 31.54000 0.3627000 31.79000 0.5097000 31.29000 0.5162000 0.4971000      0.7254000 
1 1 1 25 28 9  o 10.31000 0.5642000 9.455000 0.8620000 11.17000 0.7283000 -1.716000      1.128000  
1 1 1 25 28 11 o 21.70000 0.4568000 21.70000 0.5246000 21.70000 0.7480000 -0.4442000E-02 0.9136000 
1 1 1 25 28 13 o 14.89000 0.4274000 14.83000 0.6140000 14.95000 0.5947000 -0.1191000     0.8548000 
1 1 1 25 28 15 o 3.337000 0.9773000 3.635000 1.439000  3.040000 1.323000  0.5951000      1.955000  
1 1 1 25 28 17 o 26.16000 0.4437000 25.82000 0.6344000 26.49000 0.6205000 -0.6667000     0.8874000 
1 1 1 25 28 19 o 6.286000 0.9598000 5.365000 1.409000  7.207000 1.304000  -1.842000      1.920000  
1 1 1 25 28 21 o 4.187000 1.003000  3.952000 1.402000  4.423000 1.435000  -0.4713000     2.007000  
1 1 1 25 28 23 o 9.286000 0.5589000 9.996000 0.8608000 8.575000 0.7131000 1.421000       1.118000  
1 1 1 25 28 25 o 19.81000 0.4183000 20.17000 0.6521000 19.45000 0.5242000 0.7145000      0.8367000 
1 1 1 25 28 27 o 8.598000 0.7061000 8.130000 1.170000  9.065000 0.7910000 -0.9351000     1.412000  
1 1 1 25 28 29 o 13.34000 0.4696000 13.04000 0.6997000 13.63000 0.6265000 -0.5885000     0.9392000 
1 1 1 25 28 31 o 5.124000 0.9723000 5.452000 1.346000  4.796000 1.404000  0.6559000      1.945000  
1 1 1 25 28 33 o 2.639000 0.8061000 1.877000 0.8864000 3.401000 1.347000  -1.525000      1.612000  
1 1 1 25 28 35 o 8.668000 0.5585000 9.325000 0.6268000 8.012000 0.9246000 1.313000       1.117000  
1 1 1 25 28 37 o 6.944000 0.7130000 6.731000 0.9625000 7.156000 1.052000  -0.4250000     1.426000  
1 1 1 25 28 39 o 10.64000 0.9905000 12.01000 1.649000  9.276000 1.098000  2.732000       1.981000  
1 1 1 25 28 41 o 12.54000 0.4068000 12.22000 0.4874000 12.86000 0.6513000 -0.6463000     0.8135000 
1 1 1 25 28 43 o 4.391000 1.027000  4.779000 1.429000  4.002000 1.475000  0.7773000      2.054000  
1 1 1 25 28 45 o 4.674000 0.8960000 6.672000 1.352000  2.677000 1.176000  3.995000       1.792000  
1 1 1 25 28 47 o 3.196000 0.9407000 2.715000 1.246000  3.677000 1.410000  -0.9621000     1.881000  
1 1 1 25 28 49 o 3.415000 1.056000  4.452000 1.800000  2.377000 1.104000  2.075000       2.112000  
1 1 1 25 29 0  o 2.933000 1.171000  2.933000 1.171000  2.933000 1.171000  0.000000       0.000000  
1 1 1 25 29 2  o 18.20000 0.3403000 17.85000 0.4860000 18.55000 0.4766000 -0.6982000     0.6807000 
1 1 1 25 29 4  o 33.55000 0.3390000 33.94000 0.5294000 33.16000 0.4235000 0.7794000      0.6780000 
1 1 1 25 29 6  o 23.47000 0.3573000 23.21000 0.5022000 23.72000 0.5083000 -0.5079000     0.7145000 
1 1 1 25 29 8  o 4.971000 0.9935000 5.681000 1.318000  4.260000 1.486000  1.422000       1.987000  
1 1 1 25 29 10 o 25.42000 0.3659000 24.74000 0.5145000 26.09000 0.5204000 -1.347000      0.7318000 
1 1 1 25 29 12 o 4.944000 1.014000  5.833000 1.368000  4.054000 1.497000  1.779000       2.028000  
1 1 1 25 29 14 o 18.17000 0.5465000 17.40000 0.8459000 18.94000 0.6922000 -1.542000      1.093000  
1 1 1 25 29 16 o 25.96000 0.4487000 26.17000 0.6283000 25.75000 0.6406000 0.4162000      0.8973000 
1 1 1 25 29 18 o 35.34000 0.3925000 35.20000 0.5473000 35.48000 0.5627000 -0.2889000     0.7850000 
1 1 1 25 29 20 o 28.55000 0.3961000 28.33000 0.5129000 28.77000 0.6038000 -0.4382000     0.7922000 
1 1 1 25 29 22 o 6.506000 0.9813000 6.877000 1.402000  6.135000 1.373000  0.7413000      1.963000  
1 1 1 25 29 24 o 7.763000 0.8221000 6.722000 1.283000  8.804000 1.028000  -2.082000      1.644000  
1 1 1 25 29 26 o 18.19000 0.4355000 18.01000 0.6982000 18.36000 0.5206000 -0.3503000     0.8709000 
1 1 1 25 29 28 o 5.255000 0.8499000 3.926000 1.369000  6.585000 1.007000  -2.659000      1.700000  
1 1 1 25 29 30 o 9.629000 0.5683000 10.15000 0.7857000 9.108000 0.8212000 1.043000       1.137000  
1 1 1 25 29 32 o 11.77000 0.5025000 11.91000 0.6799000 11.64000 0.7401000 0.2727000      1.005000  
1 1 1 25 29 34 o 7.839000 0.6983000 8.593000 0.9126000 7.084000 1.057000  1.509000       1.397000  
1 1 1 25 29 36 o 18.69000 0.4039000 18.43000 0.5898000 18.95000 0.5520000 -0.5252000     0.8078000 
1 1 1 25 29 38 f 10.31000 0.6335000 10.31000 0.8090000 10.30000 0.9750000 0.1365000E-01  1.267000  
1 1 1 25 29 40 o 2.810000 0.8492000 2.285000 1.054000  3.336000 1.332000  -1.051000      1.698000  
1 1 1 25 29 42 o 5.006000 0.9695000 4.770000 1.351000  5.241000 1.391000  -0.4707000     1.939000  
1 1 1 25 29 44 o 6.093000 1.030000  5.135000 1.820000  7.051000 0.9673000 -1.916000      2.061000  
1 1 1 25 29 46 o 5.480000 1.184000  5.862000 1.857000  5.097000 1.470000  0.7648000      2.368000  
1 1 1 25 29 48 o 10.65000 0.7641000 10.06000 1.358000  11.25000 0.7017000 -1.188000      1.528000  
1 1 1 25 30 1  o 16.05000 0.2974000 15.91000 0.4248000 16.19000 0.4164000 -0.2857000     0.5949000 
1 1 1 25 30 3  o 10.95000 0.3915000 11.78000 0.6328000 10.12000 0.4613000 1.660000       0.7831000 
1 1 1 25 30 5  o 12.56000 0.6773000 12.43000 0.9205000 12.69000 0.9939000 -0.2595000     1.355000  
1 1 1 25 30 7  o 6.214000 0.9107000 5.646000 1.368000  6.783000 1.203000  -1.137000      1.821000  
1 1 1 25 30 9  o 11.35000 0.5093000 11.85000 0.6774000 10.84000 0.7608000 1.009000       1.019000  
1 1 1 25 30 11 o 23.13000 0.5735000 23.08000 0.5020000 23.19000 1.031000  -0.1175000     1.147000  
1 1 1 25 30 13 o 21.22000 0.4570000 20.84000 0.6553000 21.59000 0.6371000 -0.7466000     0.9140000 
1 1 1 25 30 15 o 19.34000 0.4509000 19.36000 0.6826000 19.32000 0.5895000 0.3928000E-01  0.9019000 
1 1 1 25 30 17 o 3.699000 0.9785000 4.065000 1.379000  3.333000 1.389000  0.7314000      1.957000  
1 1 1 25 30 19 o 19.10000 0.3955000 19.13000 0.5570000 19.07000 0.5616000 0.6173000E-01  0.7910000 
1 1 1 25 30 21 o 16.02000 0.4868000 15.60000 0.7229000 16.43000 0.6521000 -0.8353000     0.9735000 
1 1 1 25 30 23 o 17.06000 0.4757000 16.94000 0.6249000 17.19000 0.7174000 -0.2444000     0.9514000 
1 1 1 25 30 25 o 13.68000 0.4530000 13.10000 0.7084000 14.27000 0.5649000 -1.170000      0.9060000 
1 1 1 25 30 27 o 18.49000 0.3868000 18.57000 0.5587000 18.42000 0.5353000 0.1496000      0.7737000 
1 1 1 25 30 29 o 9.037000 0.6071000 9.052000 0.9406000 9.022000 0.7679000 0.2983000E-01  1.214000  
1 1 1 25 30 31 o 13.84000 0.4366000 13.56000 0.6430000 14.11000 0.5908000 -0.5523000     0.8732000 
1 1 1 25 30 33 o 3.420000 0.9684000 3.618000 1.408000  3.222000 1.330000  0.3963000      1.937000  
1 1 1 25 30 35 o 12.72000 0.5605000 12.65000 0.7356000 12.79000 0.8459000 -0.1482000     1.121000  
1 1 1 25 30 37 o 13.55000 0.4945000 12.01000 0.6059000 15.10000 0.7816000 -3.090000      0.9889000 
1 1 1 25 30 39 o 4.062000 1.031000  3.906000 1.320000  4.217000 1.583000  -0.3107000     2.061000  
1 1 1 25 30 41 o 12.59000 0.5784000 13.77000 0.8598000 11.41000 0.7738000 2.360000       1.157000  
1 1 1 25 30 43 o 6.834000 1.118000  5.257000 1.816000  8.411000 1.303000  -3.154000      2.235000  
1 1 1 25 30 45 o 7.329000 0.9497000 7.297000 1.633000  7.361000 0.9691000 -0.6394000E-01 1.899000  
1 1 1 25 30 47 o 7.672000 1.363000  7.704000 2.524000  7.641000 1.031000  0.6262000E-01  2.726000  
1 1 1 25 31 0  o 6.607000 1.112000  6.607000 1.112000  6.607000 1.112000  0.000000       0.000000  
1 1 1 25 31 2  o 19.42000 0.3962000 19.78000 0.7243000 19.06000 0.3215000 0.7183000      0.7924000 
1 1 1 25 31 4  o 15.19000 0.4072000 15.81000 0.5541000 14.58000 0.5968000 1.233000       0.8144000 
1 1 1 25 31 6  o 13.08000 0.4489000 13.77000 0.6134000 12.38000 0.6556000 1.392000       0.8978000 
1 1 1 25 31 8  o 8.255000 1.408000  9.813000 1.761000  6.697000 2.198000  3.115000       2.816000  
1 1 1 25 31 10 f 11.16000 0.6848000 11.00000 0.9753000 11.32000 0.9617000 -0.3204000     1.370000  
1 1 1 25 31 12 o 13.67000 0.5124000 13.34000 0.7791000 14.00000 0.6656000 -0.6661000     1.025000  
1 1 1 25 31 14 o 26.34000 0.4197000 26.25000 0.6589000 26.44000 0.5201000 -0.1937000     0.8394000 
1 1 1 25 31 16 o 25.77000 0.3714000 26.26000 0.5090000 25.29000 0.5411000 0.9683000      0.7429000 
1 1 1 25 31 18 o 12.79000 0.5329000 12.88000 0.8132000 12.71000 0.6888000 0.1694000      1.066000  
1 1 1 25 31 20 f 10.64000 0.5864000 11.10000 0.7522000 10.18000 0.8999000 0.9181000      1.173000  
1 1 1 25 31 22 o 6.525000 0.8324000 7.042000 1.165000  6.008000 1.190000  1.034000       1.665000  
1 1 1 25 31 24 o 12.64000 0.4805000 12.04000 0.7372000 13.24000 0.6165000 -1.198000      0.9610000 
1 1 1 25 31 26 o 28.50000 0.4209000 28.99000 0.6679000 28.00000 0.5124000 0.9823000      0.8418000 
1 1 1 25 31 28 o 12.19000 0.4785000 12.38000 0.6889000 12.00000 0.6642000 0.3803000      0.9570000 
1 1 1 25 31 30 o 13.58000 0.4572000 13.62000 0.6753000 13.53000 0.6166000 0.9354000E-01  0.9144000 
1 1 1 25 31 32 o 7.256000 0.7187000 7.273000 1.054000  7.238000 0.9774000 0.3588000E-01  1.437000  
1 1 1 25 31 34 f 16.00000 0.4426000 16.46000 0.6059000 15.54000 0.6453000 0.9186000      0.8852000 
1 1 1 25 31 36 o 13.13000 0.6118000 13.90000 0.8784000 12.35000 0.8518000 1.557000       1.224000  
1 1 1 25 31 38 o 5.637000 1.232000  5.906000 2.000000  5.368000 1.439000  0.5377000      2.464000  
1 1 1 25 31 40 o 5.817000 1.066000  5.338000 1.478000  6.296000 1.536000  -0.9576000     2.132000  
1 1 1 25 31 42 o 5.220000 1.042000  5.698000 1.484000  4.742000 1.463000  0.9561000      2.083000  
1 1 1 25 31 44 o 7.196000 0.9841000 7.423000 1.715000  6.969000 0.9651000 0.4540000      1.968000  
1 1 1 25 31 46 o 9.195000 0.8537000 10.07000 1.459000  8.325000 0.8860000 1.741000       1.707000  
1 1 1 25 32 1  o 30.45000 0.3737000 30.07000 0.5919000 30.82000 0.4563000 -0.7452000     0.7473000 
1 1 1 25 32 3  o 12.91000 0.3984000 12.94000 0.6545000 12.89000 0.4545000 0.4168000E-01  0.7968000 
1 1 1 25 32 5  o 6.595000 0.9479000 7.918000 1.117000  5.271000 1.532000  2.647000       1.896000  
1 1 1 25 32 7  o 18.61000 0.4639000 18.91000 0.6296000 18.30000 0.6814000 0.6052000      0.9277000 
1 1 1 25 32 9  o 29.78000 0.3714000 29.57000 0.5094000 29.99000 0.5407000 -0.4139000     0.7428000 
1 1 1 25 32 11 f 36.33000 0.4539000 37.23000 0.5521000 35.44000 0.7206000 1.792000       0.9078000 
1 1 1 25 32 13 o 17.81000 0.5186000 18.25000 0.6455000 17.36000 0.8120000 0.8926000      1.037000  
1 1 1 25 32 15 o 9.143000 0.7330000 8.743000 1.209000  9.542000 0.8294000 -0.7990000     1.466000  
1 1 1 25 32 17 o 4.883000 1.085000  4.610000 1.580000  5.156000 1.488000  -0.5457000     2.171000  
1 1 1 25 32 19 o 11.69000 0.5284000 11.49000 0.7685000 11.89000 0.7255000 -0.3973000     1.057000  
1 1 1 25 32 21 o 13.32000 0.4752000 12.54000 0.6902000 14.09000 0.6534000 -1.550000      0.9504000 
1 1 1 25 32 23 o 21.54000 0.4955000 20.83000 0.5538000 22.25000 0.8218000 -1.426000      0.9910000 
1 1 1 25 32 25 o 3.368000 0.9402000 2.734000 1.247000  4.002000 1.407000  -1.268000      1.880000  
1 1 1 25 32 27 o 9.884000 0.5314000 9.643000 0.8052000 10.12000 0.6938000 -0.4805000     1.063000  
1 1 1 25 32 29 o 5.961000 0.8089000 5.172000 1.230000  6.749000 1.051000  -1.577000      1.618000  
1 1 1 25 32 31 o 5.103000 0.9458000 4.701000 1.351000  5.504000 1.324000  -0.8038000     1.892000  
1 1 1 25 32 33 o 4.359000 0.9137000 5.800000 1.283000  2.918000 1.301000  2.883000       1.827000  
1 1 1 25 32 35 o 8.731000 1.178000  8.731000 1.178000  ?        ?         ?              ?         
1 1 1 25 32 37 o 11.38000 0.7499000 11.47000 1.298000  11.29000 0.7505000 0.1844000      1.500000  
1 1 1 25 32 39 o 7.191000 0.9567000 6.957000 1.378000  7.424000 1.327000  -0.4664000     1.913000  
1 1 1 25 32 41 o 4.028000 1.031000  4.483000 1.536000  3.573000 1.376000  0.9102000      2.062000  
1 1 1 25 32 43 o 5.674000 1.091000  5.679000 1.851000  5.670000 1.157000  0.9027000E-02  2.183000  
1 1 1 25 32 45 o 4.615000 1.200000  5.646000 1.938000  3.583000 1.414000  2.064000       2.399000  
1 1 1 25 33 0  o 9.536000 0.7450000 9.536000 0.7450000 9.536000 0.7450000 0.000000       0.000000  
1 1 1 25 33 2  o 9.361000 0.3747000 9.698000 0.5413000 9.025000 0.5182000 0.6731000      0.7493000 
1 1 1 25 33 4  o 13.86000 0.4060000 14.05000 0.5605000 13.66000 0.5875000 0.3824000      0.8119000 
1 1 1 25 33 6  o 21.73000 0.3530000 22.55000 0.4880000 20.90000 0.5102000 1.654000       0.7060000 
1 1 1 25 33 8  o 21.23000 0.3618000 21.70000 0.4895000 20.77000 0.5330000 0.9307000      0.7237000 
1 1 1 25 33 10 o 4.079000 0.9843000 4.588000 1.377000  3.569000 1.407000  1.019000       1.969000  
1 1 1 25 33 12 o 10.61000 0.6034000 10.42000 0.9311000 10.80000 0.7678000 -0.3860000     1.207000  
1 1 1 25 33 14 o 6.400000 1.064000  6.510000 1.640000  6.290000 1.356000  0.2200000      2.128000  
1 1 1 25 33 16 o 22.19000 0.5406000 21.90000 0.6297000 22.48000 0.8789000 -0.5798000     1.081000  
1 1 1 25 33 18 o 8.569000 0.6763000 8.715000 0.9466000 8.422000 0.9661000 0.2934000      1.353000  
1 1 1 25 33 20 o 4.307000 1.028000  4.673000 1.488000  3.940000 1.418000  0.7326000      2.055000  
1 1 1 25 33 22 f 7.543000 0.7237000 7.485000 1.053000  7.602000 0.9934000 -0.1173000     1.447000  
1 1 1 25 33 24 o 8.872000 0.6348000 8.748000 0.9726000 8.996000 0.8160000 -0.2480000     1.270000  
1 1 1 25 33 26 o 11.06000 0.5815000 10.89000 0.9464000 11.24000 0.6760000 -0.3519000     1.163000  
1 1 1 25 33 28 o 4.851000 0.9240000 5.247000 1.243000  4.454000 1.368000  0.7936000      1.848000  
1 1 1 25 33 30 o 4.321000 0.9376000 5.216000 1.317000  3.427000 1.335000  1.788000       1.875000  
1 1 1 25 33 32 o 10.68000 0.7385000 10.35000 0.7782000 11.01000 1.255000  -0.6595000     1.477000  
1 1 1 25 33 34 o 4.912000 1.161000  4.237000 1.649000  5.588000 1.634000  -1.352000      2.322000  
1 1 1 25 33 36 o 8.497000 0.8965000 7.829000 1.559000  9.165000 0.8863000 -1.336000      1.793000  
1 1 1 25 33 38 o 4.932000 1.005000  6.655000 1.433000  3.208000 1.409000  3.447000       2.010000  
1 1 1 25 33 40 o 7.843000 0.7503000 7.729000 1.083000  7.957000 1.039000  -0.2280000     1.501000  
1 1 1 25 33 42 o 4.051000 1.039000  3.582000 1.439000  4.520000 1.500000  -0.9375000     2.079000  
1 1 1 25 33 44 o 5.829000 1.141000  6.395000 1.920000  5.264000 1.234000  1.130000       2.282000  
1 1 1 25 34 1  o 31.97000 0.3381000 32.53000 0.4593000 31.42000 0.4962000 1.107000       0.6762000 
1 1 1 25 34 3  o 26.57000 0.4114000 26.74000 0.4754000 26.40000 0.6715000 0.3367000      0.8227000 
1 1 1 25 34 5  o 11.06000 0.4638000 10.59000 0.6596000 11.52000 0.6521000 -0.9261000     0.9275000 
1 1 1 25 34 7  o 10.40000 0.5043000 10.54000 0.6592000 10.26000 0.7633000 0.2741000      1.009000  
1 1 1 25 34 9  o 3.572000 0.9469000 4.529000 1.470000  2.616000 1.194000  1.912000       1.894000  
1 1 1 25 34 11 o 25.24000 0.5415000 25.64000 0.5868000 24.84000 0.9103000 0.8012000      1.083000  
1 1 1 25 34 13 o 10.39000 0.6072000 10.01000 0.8243000 10.77000 0.8919000 -0.7563000     1.214000  
1 1 1 25 34 15 o 5.663000 0.9003000 6.719000 1.152000  4.607000 1.384000  2.113000       1.801000  
1 1 1 25 34 17 o 3.771000 0.9681000 3.152000 1.292000  4.391000 1.442000  -1.239000      1.936000  
1 1 1 25 34 19 o 12.03000 0.5997000 12.90000 0.6404000 11.17000 1.014000  1.726000       1.199000  
1 1 1 25 34 21 o 17.68000 0.5874000 17.80000 0.9101000 17.55000 0.7429000 0.2567000      1.175000  
1 1 1 25 34 23 o 4.571000 1.021000  5.399000 1.304000  3.744000 1.571000  1.654000       2.042000  
1 1 1 25 34 25 o 8.277000 0.6130000 8.830000 0.8782000 7.724000 0.8556000 1.106000       1.226000  
1 1 1 25 34 27 o 9.066000 0.5895000 9.297000 0.7956000 8.836000 0.8701000 0.4609000      1.179000  
1 1 1 25 34 29 o 6.831000 0.7710000 6.781000 1.044000  6.881000 1.135000  -0.1006000     1.542000  
1 1 1 25 34 31 o 8.819000 0.7333000 9.486000 0.9750000 8.151000 1.096000  1.335000       1.467000  
1 1 1 25 34 33 o 11.59000 0.6359000 11.01000 1.072000  12.17000 0.6849000 -1.160000      1.272000  
1 1 1 25 34 35 o 6.436000 0.9617000 4.497000 1.663000  8.375000 0.9657000 -3.877000      1.923000  
1 1 1 25 34 37 o 8.744000 0.7658000 9.321000 0.9220000 8.166000 1.223000  1.154000       1.532000  
1 1 1 25 34 39 o 4.876000 1.041000  4.736000 1.478000  5.017000 1.465000  -0.2807000     2.081000  
1 1 1 25 34 41 o 6.137000 0.9683000 5.538000 1.457000  6.737000 1.276000  -1.199000      1.937000  
1 1 1 25 34 43 o 7.118000 1.139000  8.214000 1.862000  6.023000 1.313000  2.191000       2.278000  
1 1 1 25 35 0  f 4.651000 0.9625000 4.651000 0.9625000 4.651000 0.9625000 0.000000       0.000000  
1 1 1 25 35 2  o 8.254000 0.3927000 8.251000 0.6278000 8.258000 0.4719000 -0.6562000E-02 0.7854000 
1 1 1 25 35 4  o 6.239000 1.031000  7.003000 0.7822000 5.475000 1.908000  1.528000       2.062000  
1 1 1 25 35 6  o 30.77000 0.5087000 31.90000 0.4638000 29.64000 0.9055000 2.262000       1.017000  
1 1 1 25 35 8  o 27.06000 0.4769000 27.92000 0.4923000 26.19000 0.8169000 1.731000       0.9538000 
1 1 1 25 35 10 o 7.130000 0.8614000 7.325000 1.030000  6.935000 1.381000  0.3896000      1.723000  
1 1 1 25 35 12 o 11.38000 0.5049000 11.31000 0.7065000 11.46000 0.7215000 -0.1453000     1.010000  
1 1 1 25 35 14 o 10.16000 0.5748000 10.07000 0.9252000 10.26000 0.6824000 -0.1953000     1.150000  
1 1 1 25 35 16 o 3.707000 0.9476000 3.616000 1.325000  3.797000 1.355000  -0.1803000     1.895000  
1 1 1 25 35 18 o 13.54000 0.4519000 14.23000 0.6244000 12.86000 0.6534000 1.369000       0.9038000 
1 1 1 25 35 20 o 17.43000 0.4403000 17.84000 0.6569000 17.02000 0.5863000 0.8173000      0.8805000 
1 1 1 25 35 22 o 21.43000 0.4516000 21.39000 0.5204000 21.47000 0.7381000 -0.7721000E-01 0.9031000 
1 1 1 25 35 24 o 18.54000 0.4555000 18.84000 0.5564000 18.25000 0.7213000 0.5903000      0.9110000 
1 1 1 25 35 26 o 13.60000 0.5541000 14.85000 0.7362000 12.36000 0.8284000 2.495000       1.108000  
1 1 1 25 35 28 o 12.54000 0.5376000 12.23000 0.6726000 12.86000 0.8388000 -0.6268000     1.075000  
1 1 1 25 35 30 o 14.71000 0.5054000 14.62000 0.5986000 14.80000 0.8145000 -0.1843000     1.011000  
1 1 1 25 35 32 o 6.927000 0.8705000 6.478000 1.391000  7.377000 1.047000  -0.8996000     1.741000  
1 1 1 25 35 34 o 3.576000 1.031000  3.601000 1.488000  3.550000 1.427000  0.5151000E-01  2.062000  
1 1 1 25 35 36 o 5.993000 1.068000  4.846000 1.581000  7.139000 1.437000  -2.294000      2.137000  
1 1 1 25 35 38 o 3.085000 0.9580000 3.550000 1.484000  2.620000 1.212000  0.9300000      1.916000  
1 1 1 25 35 40 o 8.458000 0.7234000 7.836000 1.085000  9.081000 0.9569000 -1.245000      1.447000  
1 1 1 25 35 42 o 6.315000 0.9467000 6.580000 1.451000  6.050000 1.216000  0.5300000      1.893000  
1 1 1 25 36 1  o 4.373000 0.7432000 5.251000 1.037000  3.494000 1.065000  1.756000       1.486000  
1 1 1 25 36 3  o 28.41000 0.5154000 29.03000 0.4936000 27.78000 0.9049000 1.253000       1.031000  
1 1 1 25 36 5  o 9.995000 0.5895000 9.923000 0.5659000 10.07000 1.034000  -0.1445000     1.179000  
1 1 1 25 36 7  o 10.88000 0.5379000 10.60000 0.5488000 11.15000 0.9253000 -0.5515000     1.076000  
1 1 1 25 36 9  o 3.763000 0.9504000 4.375000 1.264000  3.151000 1.420000  1.224000       1.901000  
1 1 1 25 36 11 o 14.77000 0.5332000 15.56000 0.5611000 13.97000 0.9069000 1.598000       1.066000  
1 1 1 25 36 13 o 10.41000 0.5357000 10.72000 0.7458000 10.10000 0.7691000 0.6262000      1.071000  
1 1 1 25 36 15 o 11.89000 0.4916000 11.05000 0.7335000 12.73000 0.6548000 -1.672000      0.9833000 
1 1 1 25 36 17 o 9.476000 0.5893000 9.197000 0.9116000 9.756000 0.7471000 -0.5588000     1.179000  
1 1 1 25 36 19 o 4.593000 0.9923000 4.934000 1.420000  4.251000 1.386000  0.6829000      1.985000  
1 1 1 25 36 21 o 3.442000 0.9708000 3.373000 1.336000  3.512000 1.409000  -0.1386000     1.942000  
1 1 1 25 36 23 o 6.472000 0.8370000 6.989000 1.130000  5.956000 1.235000  1.033000       1.674000  
1 1 1 25 36 25 o 20.44000 0.4988000 20.29000 0.7225000 20.59000 0.6880000 -0.2946000     0.9976000 
1 1 1 25 36 27 o 4.884000 1.034000  6.246000 1.523000  3.522000 1.398000  2.724000       2.068000  
1 1 1 25 36 29 o 6.082000 1.037000  6.738000 1.079000  5.425000 1.771000  1.313000       2.074000  
1 1 1 25 36 31 o 2.993000 0.9617000 3.272000 1.441000  2.715000 1.274000  0.5563000      1.923000  
1 1 1 25 36 33 o 4.968000 1.056000  4.758000 1.517000  5.178000 1.470000  -0.4198000     2.112000  
1 1 1 25 36 35 o 5.715000 1.095000  5.478000 1.464000  5.952000 1.630000  -0.4741000     2.191000  
1 1 1 25 36 37 f 10.97000 0.6196000 9.998000 0.9644000 11.94000 0.7782000 -1.944000      1.239000  
1 1 1 25 36 39 o 6.779000 0.8806000 6.941000 1.193000  6.616000 1.296000  0.3253000      1.761000  
1 1 1 25 36 41 o 3.322000 0.9860000 3.597000 1.467000  3.048000 1.318000  0.5485000      1.972000  
1 1 1 25 37 0  f 5.546000 0.7675000 5.546000 0.7675000 5.546000 0.7675000 0.000000       0.000000  
1 1 1 25 37 2  o 10.22000 0.5946000 9.956000 0.5293000 10.48000 1.065000  -0.5190000     1.189000  
1 1 1 25 37 4  o 23.98000 0.4083000 23.60000 0.3892000 24.36000 0.7179000 -0.7588000     0.8166000 
1 1 1 25 37 6  o 17.11000 0.4362000 17.12000 0.4171000 17.10000 0.7663000 0.2327000E-01  0.8724000 
1 1 1 25 37 8  o 15.02000 0.4515000 15.31000 0.4398000 14.74000 0.7886000 0.5733000      0.9029000 
1 1 1 25 37 10 f 15.38000 0.4622000 15.75000 0.5171000 15.01000 0.7662000 0.7463000      0.9244000 
1 1 1 25 37 12 o 13.39000 0.4298000 12.90000 0.6281000 13.88000 0.5868000 -0.9776000     0.8596000 
1 1 1 25 37 14 o 12.63000 0.4657000 11.95000 0.6493000 13.30000 0.6678000 -1.350000      0.9314000 
1 1 1 25 37 16 o 10.17000 0.5687000 10.65000 0.7998000 9.696000 0.8087000 0.9541000      1.137000  
1 1 1 25 37 18 o 10.93000 0.5033000 11.48000 0.7066000 10.39000 0.7169000 1.090000       1.007000  
1 1 1 25 37 20 o 4.594000 0.9781000 4.831000 1.361000  4.357000 1.405000  0.4740000      1.956000  
1 1 1 25 37 22 o 4.186000 1.050000  4.441000 1.471000  3.931000 1.498000  0.5099000      2.100000  
1 1 1 25 37 24 o 3.592000 1.010000  2.630000 1.262000  4.554000 1.577000  -1.925000      2.020000  
1 1 1 25 37 26 o 5.703000 1.177000  5.471000 1.566000  5.936000 1.756000  -0.4654000     2.353000  
1 1 1 25 37 28 o 10.99000 0.5806000 10.86000 0.8083000 11.11000 0.8337000 -0.2565000     1.161000  
1 1 1 25 37 30 o 10.11000 0.9832000 10.62000 1.761000  9.610000 0.8757000 1.005000       1.966000  
1 1 1 25 37 32 o 3.337000 0.9383000 2.761000 1.242000  3.912000 1.406000  -1.151000      1.877000  
1 1 1 25 37 34 o 6.883000 1.007000  7.289000 1.153000  6.478000 1.651000  0.8108000      2.014000  
1 1 1 25 37 36 o 7.059000 1.019000  8.008000 1.023000  6.109000 1.763000  1.899000       2.039000  
1 1 1 25 37 38 o 5.747000 1.233000  5.833000 1.717000  5.660000 1.771000  0.1725000      2.467000  
1 1 1 25 37 40 o 4.378000 1.046000  4.525000 1.505000  4.231000 1.453000  0.2945000      2.092000  
1 1 1 25 38 1  o 4.334000 0.7073000 4.579000 1.120000  4.089000 0.8641000 0.4901000      1.415000  
1 1 1 25 38 3  o 6.736000 0.8092000 6.448000 0.9323000 7.024000 1.323000  -0.5754000     1.618000  
1 1 1 25 38 5  o 4.107000 0.9591000 4.014000 1.100000  4.201000 1.572000  -0.1874000     1.918000  
1 1 1 25 38 7  o 15.25000 0.4490000 15.97000 0.4258000 14.53000 0.7907000 1.440000       0.8980000 
1 1 1 25 38 9  o 7.499000 0.7654000 7.219000 0.7404000 7.778000 1.340000  -0.5592000     1.531000  
1 1 1 25 38 11 o 5.811000 0.9382000 6.480000 0.8672000 5.142000 1.664000  1.338000       1.876000  
1 1 1 25 38 13 o 6.653000 0.9071000 7.145000 0.8150000 6.162000 1.621000  0.9837000      1.814000  
1 1 1 25 38 15 o 8.506000 0.5796000 8.136000 0.8267000 8.876000 0.8125000 -0.7401000     1.159000  
1 1 1 25 38 17 o 15.37000 0.4056000 15.38000 0.5640000 15.37000 0.5830000 0.1370000E-01  0.8112000 
1 1 1 25 38 19 o 11.52000 0.4935000 10.93000 0.7201000 12.11000 0.6751000 -1.181000      0.9871000 
1 1 1 25 38 21 o 11.48000 0.5574000 11.28000 0.7995000 11.68000 0.7770000 -0.4011000     1.115000  
1 1 1 25 38 23 o 12.16000 0.5513000 12.02000 0.7621000 12.29000 0.7967000 -0.2737000     1.103000  
1 1 1 25 38 25 f 3.103000 0.9816000 2.391000 1.120000  3.815000 1.612000  -1.424000      1.963000  
1 1 1 25 38 27 o 9.860000 0.6393000 9.514000 0.9396000 10.21000 0.8671000 -0.6911000     1.279000  
1 1 1 25 38 29 o 5.061000 1.326000  6.026000 2.152000  4.096000 1.549000  1.930000       2.652000  
1 1 1 25 38 31 o 6.405000 0.8999000 5.714000 1.325000  7.097000 1.218000  -1.383000      1.800000  
1 1 1 25 38 33 o 4.488000 1.164000  4.495000 1.428000  4.480000 1.838000  0.1561000E-01  2.328000  
1 1 1 25 38 35 o 6.207000 0.9915000 4.770000 1.653000  7.644000 1.095000  -2.874000      1.983000  
1 1 1 25 38 37 o 3.606000 1.012000  3.193000 1.403000  4.019000 1.460000  -0.8255000     2.024000  
1 1 1 25 38 39 o 5.525000 0.9488000 4.476000 1.445000  6.574000 1.231000  -2.099000      1.898000  
1 1 1 25 39 0  o 17.99000 0.3510000 17.99000 0.3510000 17.99000 0.3510000 0.000000       0.000000  
1 1 1 25 39 2  f 6.598000 0.8252000 6.203000 0.7762000 6.993000 1.456000  -0.7903000     1.650000  
1 1 1 25 39 4  o 11.28000 0.5959000 11.63000 0.4976000 10.94000 1.083000  0.6948000      1.192000  
1 1 1 25 39 6  o 6.005000 0.9172000 6.543000 0.8043000 5.466000 1.649000  1.077000       1.834000  
1 1 1 25 39 8  o 20.30000 0.3829000 20.80000 0.4123000 19.81000 0.6454000 0.9864000      0.7659000 
1 1 1 25 39 10 o 6.439000 0.9422000 5.336000 1.306000  7.543000 1.358000  -2.208000      1.884000  
1 1 1 25 39 12 o 12.31000 0.5796000 13.06000 0.5138000 11.56000 1.039000  1.495000       1.159000  
1 1 1 25 39 14 o 8.757000 0.7228000 8.070000 0.6964000 9.444000 1.267000  -1.374000      1.446000  
1 1 1 25 39 16 o 7.146000 0.6999000 7.256000 0.7332000 7.036000 1.192000  0.2206000      1.400000  
1 1 1 25 39 18 o 8.972000 0.6432000 9.170000 0.7813000 8.774000 1.022000  0.3966000      1.286000  
1 1 1 25 39 20 o 5.079000 1.007000  5.274000 1.503000  4.885000 1.340000  0.3890000      2.014000  
1 1 1 25 39 22 o 5.072000 1.267000  4.166000 1.427000  5.979000 2.094000  -1.813000      2.534000  
1 1 1 25 39 24 o 8.158000 0.8428000 7.387000 1.369000  8.929000 0.9838000 -1.542000      1.686000  
1 1 1 25 39 26 o 5.521000 1.014000  5.130000 1.426000  5.913000 1.443000  -0.7828000     2.029000  
1 1 1 25 39 28 o 6.759000 1.204000  7.189000 1.969000  6.330000 1.385000  0.8592000      2.407000  
1 1 1 25 39 30 o 3.563000 0.9701000 4.414000 1.480000  2.713000 1.255000  1.701000       1.940000  
1 1 1 25 39 32 o 5.190000 1.069000  5.404000 1.327000  4.975000 1.675000  0.4293000      2.137000  
1 1 1 25 39 34 o 8.826000 0.6570000 8.391000 0.9143000 9.261000 0.9437000 -0.8702000     1.314000  
1 1 1 25 39 36 o 5.062000 1.013000  4.303000 1.506000  5.822000 1.355000  -1.518000      2.026000  
1 1 1 25 39 38 o 3.415000 0.9688000 4.341000 1.551000  2.490000 1.161000  1.851000       1.938000  
1 1 1 25 40 1  o 3.781000 0.7548000 3.801000 1.228000  3.761000 0.8784000 0.3972000E-01  1.510000  
1 1 1 25 40 3  o 5.436000 0.9327000 6.114000 0.9834000 4.757000 1.585000  1.356000       1.865000  
1 1 1 25 40 5  f 11.00000 0.5993000 11.52000 0.5091000 10.48000 1.085000  1.045000       1.199000  
1 1 1 25 40 7  o 17.79000 0.4110000 18.09000 0.4181000 17.49000 0.7078000 0.5963000      0.8221000 
1 1 1 25 40 9  o 17.61000 0.4604000 18.07000 0.4430000 17.15000 0.8072000 0.9123000      0.9208000 
1 1 1 25 40 11 o 5.501000 0.9192000 6.550000 0.9002000 4.452000 1.603000  2.098000       1.838000  
1 1 1 25 40 13 o 8.782000 0.7706000 9.610000 0.7150000 7.955000 1.365000  1.655000       1.541000  
1 1 1 25 40 15 o 12.63000 0.5003000 13.52000 0.5206000 11.73000 0.8546000 1.795000       1.001000  
1 1 1 25 40 17 o 21.62000 0.4330000 22.30000 0.5052000 20.94000 0.7033000 1.358000       0.8660000 
1 1 1 25 40 19 o 9.417000 0.6495000 10.19000 0.6402000 8.640000 1.130000  1.552000       1.299000  
1 1 1 25 40 21 o 11.21000 0.8403000 10.33000 0.7652000 12.08000 1.496000  -1.743000      1.681000  
1 1 1 25 40 23 o 10.73000 0.5410000 10.32000 0.7356000 11.14000 0.7935000 -0.8163000     1.082000  
1 1 1 25 40 25 o 4.604000 1.209000  4.353000 1.890000  4.854000 1.508000  -0.5012000     2.418000  
1 1 1 25 40 27 f 4.696000 1.051000  3.930000 1.420000  5.463000 1.549000  -1.533000      2.101000  
1 1 1 25 40 29 o 9.445000 0.6497000 10.41000 0.8192000 8.480000 1.009000  1.930000       1.299000  
1 1 1 25 40 31 o 10.69000 0.6306000 11.10000 0.7768000 10.27000 0.9937000 0.8298000      1.261000  
1 1 1 25 40 33 o 7.989000 0.8138000 8.473000 0.9268000 7.505000 1.338000  0.9684000      1.628000  
1 1 1 25 40 35 o 4.866000 1.068000  5.596000 1.525000  4.136000 1.497000  1.460000       2.137000  
1 1 1 25 40 37 o 3.610000 1.038000  4.038000 1.564000  3.182000 1.365000  0.8559000      2.076000  
1 1 1 25 41 0  o 26.40000 0.4554000 26.40000 0.4554000 26.40000 0.4554000 0.000000       0.000000  
1 1 1 25 41 2  o 7.991000 0.7108000 7.721000 0.6007000 8.261000 1.288000  -0.5400000     1.422000  
1 1 1 25 41 4  o 15.98000 0.4442000 15.91000 0.4315000 16.06000 0.7766000 -0.1546000     0.8884000 
1 1 1 25 41 6  o 8.451000 0.6474000 7.750000 0.7430000 9.152000 1.060000  -1.402000      1.295000  
1 1 1 25 41 8  o 6.633000 0.8765000 7.623000 0.6947000 5.643000 1.610000  1.980000       1.753000  
1 1 1 25 41 10 o 8.795000 0.8495000 10.29000 0.7207000 7.297000 1.539000  2.995000       1.699000  
1 1 1 25 41 12 o 9.699000 0.7412000 10.84000 0.5740000 8.554000 1.367000  2.291000       1.482000  
1 1 1 25 41 14 o 12.44000 0.7382000 12.79000 0.5985000 12.09000 1.350000  0.7060000      1.476000  
1 1 1 25 41 16 o 9.838000 0.7439000 11.29000 0.6203000 8.389000 1.352000  2.898000       1.488000  
1 1 1 25 41 18 o 8.823000 1.063000  9.912000 0.7137000 7.734000 2.003000  2.178000       2.126000  
1 1 1 25 41 20 o 3.306000 0.9684000 3.471000 1.291000  3.142000 1.444000  0.3296000      1.937000  
1 1 1 25 41 22 o 15.59000 0.4671000 14.77000 0.5389000 16.41000 0.7630000 -1.638000      0.9341000 
1 1 1 25 41 24 o 15.74000 0.8256000 ?        ?         15.74000 0.8256000 ?              ?         
1 1 1 25 41 26 o 15.27000 0.5010000 14.30000 0.6402000 16.23000 0.7707000 -1.924000      1.002000  
1 1 1 25 41 28 o 9.612000 0.6311000 9.999000 0.8480000 9.224000 0.9348000 0.7754000      1.262000  
1 1 1 25 41 30 f 3.953000 1.038000  4.450000 1.529000  3.456000 1.405000  0.9939000      2.076000  
1 1 1 25 41 32 f 3.692000 1.043000  4.258000 1.548000  3.125000 1.398000  1.134000       2.086000  
1 1 1 25 41 34 f 5.652000 1.018000  6.360000 1.451000  4.943000 1.428000  1.417000       2.036000  
1 1 1 25 41 36 o 3.274000 0.9707000 3.220000 1.374000  3.328000 1.372000  -0.1076000     1.941000  
1 1 1 25 42 1  o 15.96000 0.4378000 16.83000 0.4684000 15.08000 0.7398000 1.748000       0.8756000 
1 1 1 25 42 3  o 13.21000 0.4806000 12.73000 0.5315000 13.70000 0.8009000 -0.9706000     0.9612000 
1 1 1 25 42 5  o 5.759000 0.8949000 5.125000 1.027000  6.393000 1.466000  -1.268000      1.790000  
1 1 1 25 42 7  o 10.55000 0.6034000 10.26000 0.5925000 10.85000 1.051000  -0.5903000     1.207000  
1 1 1 25 42 9  f 12.11000 0.5601000 12.49000 0.5347000 11.74000 0.9843000 0.7529000      1.120000  
1 1 1 25 42 11 o 12.98000 0.6948000 12.54000 0.5386000 13.42000 1.281000  -0.8762000     1.390000  
1 1 1 25 42 13 f 12.48000 0.5830000 12.38000 0.6278000 12.58000 0.9826000 -0.2063000     1.166000  
1 1 1 25 42 15 o 4.492000 1.146000  3.208000 1.252000  5.776000 1.919000  -2.568000      2.292000  
1 1 1 25 42 17 o 4.249000 1.191000  3.628000 1.297000  4.869000 1.999000  -1.241000      2.383000  
1 1 1 25 42 19 o 5.568000 0.9929000 6.123000 1.005000  5.012000 1.713000  1.111000       1.986000  
1 1 1 25 42 21 o 7.577000 1.145000  8.902000 1.759000  6.253000 1.467000  2.649000       2.291000  
1 1 1 25 42 23 o 9.257000 0.7461000 8.237000 0.9887000 10.28000 1.118000  -2.040000      1.492000  
1 1 1 25 42 25 o 4.764000 1.078000  4.976000 1.353000  4.551000 1.679000  0.4250000      2.157000  
1 1 1 25 42 27 o 14.15000 0.5712000 13.71000 0.5702000 14.59000 0.9900000 -0.8806000     1.142000  
1 1 1 25 42 29 o 13.84000 0.4974000 14.19000 0.6742000 13.49000 0.7314000 0.7036000      0.9948000 
1 1 1 25 42 31 o 14.46000 0.5808000 14.33000 0.7706000 14.60000 0.8692000 -0.2725000     1.162000  
1 1 1 25 42 33 o 10.98000 0.6361000 11.26000 0.7766000 10.69000 1.008000  0.5665000      1.272000  
1 1 1 25 42 35 o 6.213000 0.9850000 6.196000 1.274000  6.230000 1.502000  -0.3347000E-01 1.970000  
1 1 1 25 43 0  o 3.498000 1.183000  3.498000 1.183000  3.498000 1.183000  0.000000       0.000000  
1 1 1 25 43 2  o 4.297000 0.9142000 3.857000 1.021000  4.736000 1.517000  -0.8787000     1.828000  
1 1 1 25 43 4  o 4.415000 0.9828000 3.769000 1.128000  5.060000 1.610000  -1.291000      1.966000  
1 1 1 25 43 6  o 11.20000 0.5569000 10.04000 0.5706000 12.35000 0.9564000 -2.313000      1.114000  
1 1 1 25 43 8  f 3.957000 1.064000  3.607000 1.201000  4.306000 1.758000  -0.6990000     2.129000  
1 1 1 25 43 10 o 3.443000 1.056000  3.474000 1.471000  3.413000 1.516000  0.6170000E-01  2.112000  
1 1 1 25 43 12 o 4.202000 1.104000  2.696000 1.164000  5.708000 1.875000  -3.012000      2.207000  
1 1 1 25 43 14 o 10.06000 0.9895000 10.13000 0.7031000 9.985000 1.850000  0.1460000      1.979000  
1 1 1 25 43 16 o 5.179000 0.9599000 3.912000 1.339000  6.446000 1.375000  -2.534000      1.920000  
1 1 1 25 43 18 o 3.007000 0.9402000 2.953000 1.251000  3.061000 1.404000  -0.1084000     1.880000  
1 1 1 25 43 20 o 4.913000 1.246000  5.227000 1.966000  4.599000 1.531000  0.6282000      2.492000  
1 1 1 25 43 22 o 12.77000 0.5527000 12.45000 0.6176000 13.09000 0.9167000 -0.6399000     1.105000  
1 1 1 25 43 24 o 9.016000 0.7642000 8.722000 0.8820000 9.310000 1.248000  -0.5881000     1.528000  
1 1 1 25 43 26 o 3.991000 1.069000  3.562000 1.368000  4.420000 1.643000  -0.8579000     2.138000  
1 1 1 25 43 28 o 3.743000 1.029000  3.306000 1.297000  4.179000 1.599000  -0.8728000     2.059000  
1 1 1 25 43 30 o 5.864000 1.002000  7.038000 1.008000  4.691000 1.732000  2.348000       2.004000  
1 1 1 25 43 32 f 4.427000 1.124000  3.057000 1.260000  5.797000 1.861000  -2.740000      2.247000  
1 1 1 25 43 34 o 4.515000 1.179000  4.684000 1.366000  4.346000 1.923000  0.3381000      2.359000  
1 1 1 25 44 1  o 3.947000 0.9345000 3.449000 1.131000  4.445000 1.488000  -0.9958000     1.869000  
1 1 1 25 44 3  o 3.190000 0.9000000 3.375000 1.183000  3.005000 1.356000  0.3699000      1.800000  
1 1 1 25 44 5  o 4.290000 0.9200000 4.863000 1.003000  3.718000 1.543000  1.145000       1.840000  
1 1 1 25 44 7  o 4.752000 1.011000  4.360000 1.265000  5.144000 1.579000  -0.7842000     2.023000  
1 1 1 25 44 9  o 7.820000 1.114000  9.022000 0.7112000 6.618000 2.112000  2.403000       2.229000  
1 1 1 25 44 11 o 8.031000 1.131000  9.324000 0.6662000 6.739000 2.163000  2.585000       2.263000  
1 1 1 25 44 13 o 12.50000 0.5320000 11.25000 0.5893000 13.76000 0.8860000 -2.503000      1.064000  
1 1 1 25 44 15 o 6.373000 0.9677000 6.060000 1.230000  6.687000 1.495000  -0.6276000     1.935000  
1 1 1 25 44 17 o 3.623000 1.034000  4.196000 1.513000  3.051000 1.408000  1.145000       2.067000  
1 1 1 25 44 19 o 8.609000 0.6757000 8.009000 0.8404000 9.210000 1.058000  -1.201000      1.351000  
1 1 1 25 44 21 o 6.949000 0.9509000 7.956000 0.8432000 5.943000 1.705000  2.013000       1.902000  
1 1 1 25 44 23 o 8.323000 0.9824000 5.950000 1.282000  10.70000 1.489000  -4.746000      1.965000  
1 1 1 25 44 25 o 3.383000 0.9630000 2.830000 1.242000  3.936000 1.473000  -1.105000      1.926000  
1 1 1 25 44 27 f 5.221000 1.129000  4.728000 1.392000  5.713000 1.777000  -0.9855000     2.257000  
1 1 1 25 44 29 o 4.702000 1.100000  4.855000 1.276000  4.549000 1.792000  0.3065000      2.200000  
1 1 1 25 44 31 o 5.150000 1.071000  3.776000 1.432000  6.523000 1.593000  -2.747000      2.142000  
1 1 1 25 44 33 o 6.368000 2.106000  ?        ?         6.368000 2.106000  ?              ?         
1 1 1 25 45 0  o 6.219000 0.6420000 6.219000 0.6420000 6.219000 0.6420000 0.000000       0.000000  
1 1 1 25 45 2  o 3.133000 0.9520000 3.048000 1.160000  3.218000 1.510000  -0.1705000     1.904000  
1 1 1 25 45 4  o 4.016000 1.115000  2.823000 1.256000  5.209000 1.842000  -2.387000      2.230000  
1 1 1 25 45 6  o 4.173000 1.174000  2.573000 1.064000  5.773000 2.092000  -3.200000      2.347000  
1 1 1 25 45 8  o 6.751000 0.8020000 5.853000 0.9099000 7.650000 1.321000  -1.797000      1.604000  
1 1 1 25 45 10 o 13.01000 0.5590000 12.94000 0.6368000 13.08000 0.9189000 -0.1353000     1.118000  
1 1 1 25 45 12 o 5.020000 1.157000  5.241000 1.495000  4.799000 1.766000  0.4426000      2.314000  
1 1 1 25 45 14 o 10.61000 0.6908000 10.85000 0.8542000 10.37000 1.086000  0.4721000      1.382000  
1 1 1 25 45 16 o 11.12000 0.6713000 12.34000 0.5988000 9.902000 1.202000  2.436000       1.343000  
1 1 1 25 45 18 o 7.145000 0.8260000 7.152000 0.9268000 7.138000 1.368000  0.1414000E-01  1.652000  
1 1 1 25 45 20 o 5.149000 1.251000  4.495000 1.536000  5.804000 1.975000  -1.310000      2.502000  
1 1 1 25 45 22 o 13.46000 0.6699000 12.90000 0.6233000 14.01000 1.186000  -1.103000      1.340000  
1 1 1 25 45 24 f 9.349000 0.6990000 9.126000 0.7584000 9.571000 1.174000  -0.4455000     1.398000  
1 1 1 25 45 26 o 5.676000 1.031000  5.475000 1.232000  5.877000 1.655000  -0.4016000     2.063000  
1 1 1 25 45 28 o 5.641000 1.093000  4.032000 1.365000  7.250000 1.707000  -3.218000      2.185000  
1 1 1 25 45 30 o 5.750000 1.060000  6.641000 1.217000  4.858000 1.736000  1.783000       2.120000  
1 1 1 25 46 1  o 10.16000 1.538000  10.16000 1.538000  ?        ?         ?              ?         
1 1 1 25 46 3  o 5.176000 1.269000  4.545000 1.918000  5.808000 1.661000  -1.263000      2.538000  
1 1 1 25 46 5  o 4.214000 1.027000  3.841000 1.196000  4.588000 1.671000  -0.7471000     2.055000  
1 1 1 25 46 7  o 8.004000 0.6951000 7.934000 0.7344000 8.073000 1.180000  -0.1388000     1.390000  
1 1 1 25 46 9  o 9.738000 0.7701000 9.836000 0.8156000 9.640000 1.307000  0.1960000      1.540000  
1 1 1 25 46 11 o 8.902000 0.8499000 9.837000 0.7873000 7.967000 1.507000  1.870000       1.700000  
1 1 1 25 46 13 o 4.902000 1.038000  5.273000 1.277000  4.532000 1.637000  0.7403000      2.077000  
1 1 1 25 46 15 o 5.095000 1.083000  4.850000 1.302000  5.340000 1.731000  -0.4893000     2.166000  
1 1 1 25 46 17 o 4.356000 1.012000  4.761000 1.228000  3.952000 1.608000  0.8084000      2.023000  
1 1 1 25 46 19 o 6.018000 1.157000  4.696000 1.270000  7.340000 1.935000  -2.645000      2.314000  
1 1 1 25 46 21 o 6.469000 0.9644000 7.244000 0.9392000 5.694000 1.685000  1.550000       1.929000  
1 1 1 25 46 23 o 4.057000 1.033000  4.293000 1.341000  3.821000 1.572000  0.4722000      2.067000  
1 1 1 25 46 25 o 4.296000 1.093000  2.928000 1.228000  5.663000 1.808000  -2.734000      2.186000  
1 1 1 25 46 27 o 6.156000 0.9780000 5.060000 1.235000  7.253000 1.516000  -2.193000      1.956000  
1 1 1 25 46 29 o 5.637000 1.263000  4.211000 1.362000  7.064000 2.129000  -2.853000      2.527000  
1 1 1 25 47 0  o 4.781000 1.666000  4.781000 1.666000  4.781000 1.666000  0.000000       0.000000  
1 1 1 25 47 2  f 6.780000 0.7947000 5.382000 1.019000  8.179000 1.220000  -2.797000      1.589000  
1 1 1 25 47 4  o 4.756000 0.9445000 4.255000 0.9724000 5.258000 1.620000  -1.003000      1.889000  
1 1 1 25 47 6  o 9.336000 0.6242000 9.154000 0.6046000 9.518000 1.092000  -0.3632000     1.248000  
1 1 1 25 47 8  o 6.629000 0.9101000 6.358000 0.9517000 6.900000 1.552000  -0.5413000     1.820000  
1 1 1 25 47 10 o 6.088000 0.9746000 4.551000 1.202000  7.625000 1.534000  -3.073000      1.949000  
1 1 1 25 47 12 o 3.293000 0.9527000 3.504000 1.319000  3.083000 1.375000  0.4215000      1.905000  
1 1 1 25 47 14 o 7.364000 1.099000  7.441000 0.8737000 7.288000 2.016000  0.1528000      2.197000  
1 1 1 25 47 16 o 5.891000 1.044000  6.287000 1.108000  5.495000 1.771000  0.7914000      2.089000  
1 1 1 25 47 18 o 3.320000 0.9925000 2.366000 1.083000  4.274000 1.664000  -1.908000      1.985000  
1 1 1 25 47 20 o 3.960000 1.058000  2.998000 1.234000  4.921000 1.719000  -1.924000      2.116000  
1 1 1 25 47 22 o 3.986000 1.044000  2.806000 1.232000  5.165000 1.686000  -2.359000      2.088000  
1 1 1 25 47 24 o 5.094000 1.031000  5.565000 1.153000  4.623000 1.709000  0.9419000      2.061000  
1 1 1 25 47 26 o 4.286000 1.097000  2.963000 1.217000  5.610000 1.825000  -2.646000      2.194000  
1 1 1 25 48 1  o 11.78000 0.9485000 12.65000 1.261000  10.90000 1.418000  1.754000       1.897000  
1 1 1 25 48 3  o 3.206000 1.425000  3.206000 1.425000  ?        ?         ?              ?         
1 1 1 25 48 5  o 5.067000 1.097000  4.299000 1.277000  5.835000 1.784000  -1.535000      2.194000  
1 1 1 25 48 7  o 7.374000 1.122000  8.526000 0.8306000 6.222000 2.084000  2.303000       2.244000  
1 1 1 25 48 9  o 3.827000 1.123000  3.552000 1.385000  4.102000 1.768000  -0.5493000     2.246000  
1 1 1 25 48 11 o 4.157000 1.018000  4.496000 1.245000  3.819000 1.610000  0.6774000      2.035000  
1 1 1 25 48 13 o 9.797000 0.7392000 10.17000 0.6796000 9.423000 1.313000  0.7483000      1.478000  
1 1 1 25 48 15 o 3.951000 0.9463000 4.529000 1.251000  3.374000 1.420000  1.156000       1.893000  
1 1 1 25 48 17 o 2.864000 0.9458000 2.226000 1.038000  3.501000 1.582000  -1.276000      1.892000  
1 1 1 25 48 19 o 3.978000 1.007000  2.530000 1.188000  5.427000 1.626000  -2.898000      2.014000  
1 1 1 25 48 21 o 3.245000 0.9883000 2.914000 1.217000  3.577000 1.557000  -0.6629000     1.977000  
1 1 1 25 48 23 o 5.452000 1.079000  4.624000 1.229000  6.281000 1.774000  -1.657000      2.158000  
1 1 1 25 48 25 o 3.491000 1.073000  2.944000 1.235000  4.038000 1.755000  -1.094000      2.146000  
1 1 1 25 49 0  o 5.953000 1.621000  5.953000 1.621000  5.953000 1.621000  0.000000       0.000000  
1 1 1 25 49 2  o 6.468000 1.090000  7.237000 1.470000  5.698000 1.611000  1.538000       2.181000  
1 1 1 25 49 4  o 3.651000 0.9939000 2.672000 1.216000  4.630000 1.573000  -1.958000      1.988000  
1 1 1 25 49 6  o 4.166000 1.180000  3.833000 1.335000  4.499000 1.947000  -0.6662000     2.360000  
1 1 1 25 49 8  o 5.154000 1.126000  5.338000 1.478000  4.970000 1.700000  0.3686000      2.253000  
1 1 1 25 49 10 o 6.541000 0.8874000 8.030000 0.7439000 5.052000 1.611000  2.978000       1.775000  
1 1 1 25 49 12 o 6.363000 0.9362000 5.803000 1.003000  6.923000 1.581000  -1.120000      1.872000  
1 1 1 25 49 14 o 5.909000 0.9543000 6.451000 1.000000  5.367000 1.626000  1.083000       1.909000  
1 1 1 25 49 16 o 4.708000 1.039000  4.836000 1.245000  4.580000 1.662000  0.2567000      2.077000  
1 1 1 25 49 18 o 3.556000 1.006000  2.746000 1.178000  4.367000 1.631000  -1.622000      2.012000  
1 1 1 25 49 20 o 4.037000 1.039000  2.891000 1.230000  5.184000 1.675000  -2.293000      2.078000  
1 1 1 25 49 22 o 3.637000 1.066000  2.923000 1.205000  4.352000 1.760000  -1.430000      2.133000  
1 1 1 25 50 1  o 7.614000 1.055000  8.325000 1.336000  6.902000 1.634000  1.422000       2.111000  
1 1 1 25 50 3  o 7.376000 1.045000  8.203000 1.377000  6.549000 1.573000  1.654000       2.091000  
1 1 1 25 50 5  f 4.773000 1.172000  4.502000 1.622000  5.045000 1.691000  -0.5431000     2.343000  
1 1 1 25 50 7  o 4.588000 1.116000  3.431000 1.427000  5.745000 1.717000  -2.314000      2.233000  
1 1 1 25 50 9  o 6.366000 1.210000  6.404000 1.214000  6.327000 2.094000  0.7682000E-01  2.420000  
1 1 1 25 50 11 o 7.822000 0.9498000 8.146000 1.058000  7.499000 1.578000  0.6466000      1.900000  
1 1 1 25 50 13 o 8.994000 0.6903000 8.906000 0.7351000 9.082000 1.169000  -0.1758000     1.381000  
1 1 1 25 50 15 o 5.678000 0.9392000 7.363000 0.8389000 3.994000 1.681000  3.369000       1.878000  
1 1 1 25 50 17 o 4.323000 0.9978000 3.365000 1.264000  5.281000 1.544000  -1.916000      1.996000  
1 1 1 25 50 19 o 4.573000 1.098000  3.916000 1.263000  5.229000 1.797000  -1.314000      2.196000  
1 1 1 25 51 0  o 4.756000 1.664000  4.756000 1.664000  4.756000 1.664000  0.000000       0.000000  
1 1 1 25 51 2  o 4.003000 1.098000  5.100000 1.757000  2.906000 1.318000  2.194000       2.197000  
1 1 1 25 51 4  o 5.586000 1.208000  6.027000 1.570000  5.146000 1.836000  0.8811000      2.416000  
1 1 1 25 51 6  f 9.216000 0.8338000 9.622000 1.124000  8.810000 1.232000  0.8121000      1.668000  
1 1 1 25 51 8  o 6.591000 0.9567000 9.155000 1.089000  4.028000 1.574000  5.126000       1.913000  
1 1 1 25 51 10 o 9.229000 0.8029000 8.379000 0.9932000 10.08000 1.262000  -1.700000      1.606000  
1 1 1 25 51 12 o 5.744000 1.288000  5.998000 1.489000  5.491000 2.103000  0.5064000      2.577000  
1 1 1 25 51 14 o 3.786000 1.065000  3.462000 1.297000  4.111000 1.689000  -0.6483000     2.129000  
1 1 1 25 51 16 o 3.827000 1.017000  3.098000 1.240000  4.555000 1.612000  -1.457000      2.034000  
1 1 1 25 52 1  o 8.713000 0.8414000 8.729000 1.142000  8.697000 1.236000  0.3231000E-01  1.683000  
1 1 1 25 52 3  f 9.052000 0.9146000 9.066000 1.321000  9.038000 1.265000  0.2776000E-01  1.829000  
1 1 1 25 52 5  o 3.919000 1.156000  4.203000 1.690000  3.635000 1.578000  0.5689000      2.312000  
1 1 1 25 52 7  o 4.035000 1.107000  4.587000 1.625000  3.483000 1.504000  1.104000       2.214000  
1 1 1 25 52 9  o 5.293000 1.194000  4.607000 1.649000  5.979000 1.727000  -1.372000      2.388000  
1 1 1 25 52 11 f 3.342000 1.027000  3.343000 1.447000  3.340000 1.458000  0.3287000E-02  2.054000  
1 1 1 25 52 13 o 4.058000 1.180000  3.476000 1.646000  4.640000 1.691000  -1.164000      2.360000  
1 1 1 25 53 0  o 3.207000 1.432000  3.207000 1.432000  3.207000 1.432000  0.000000       0.000000  
1 1 1 25 53 2  o 4.598000 1.149000  5.045000 1.627000  4.151000 1.622000  0.8944000      2.298000  
1 1 1 25 53 4  o 4.454000 1.121000  3.089000 1.405000  5.819000 1.748000  -2.729000      2.242000  
1 1 1 25 53 6  o 3.657000 1.093000  3.392000 1.528000  3.921000 1.563000  -0.5287000     2.186000  
1 1 1 26 0  0  o 35.09000 0.8600000 35.09000 0.8600000 35.09000 0.8600000 0.000000       0.000000  
1 1 1 26 0  2  o 19.30000 0.4646000 19.30000 0.4646000 19.30000 0.4646000 0.000000       0.000000  
1 1 1 26 0  4  o 43.88000 0.5681000 43.88000 0.5681000 43.88000 0.5681000 0.000000       0.000000  
1 1 1 26 0  6  o 46.69000 0.5907000 46.69000 0.5907000 46.69000 0.5907000 0.000000       0.000000  
1 1 1 26 0  8  o 5.890000 1.051000  5.890000 1.051000  5.890000 1.051000  0.000000       0.000000  
1 1 1 26 0  10 o 33.55000 0.4836000 33.55000 0.4836000 33.55000 0.4836000 0.000000       0.000000  
1 1 1 26 0  12 o 38.06000 0.5244000 38.06000 0.5244000 38.06000 0.5244000 0.000000       0.000000  
1 1 1 26 0  14 o 14.01000 0.5486000 14.01000 0.5486000 14.01000 0.5486000 0.000000       0.000000  
1 1 1 26 0  16 o 3.998000 1.395000  3.998000 1.395000  3.998000 1.395000  0.000000       0.000000  
1 1 1 26 0  18 o 36.11000 0.4492000 36.11000 0.4492000 36.11000 0.4492000 0.000000       0.000000  
1 1 1 26 0  20 o 10.91000 0.5625000 10.91000 0.5625000 10.91000 0.5625000 0.000000       0.000000  
1 1 1 26 0  22 o 22.32000 0.4447000 22.32000 0.4447000 22.32000 0.4447000 0.000000       0.000000  
1 1 1 26 0  24 o 27.35000 0.4984000 27.35000 0.4984000 27.35000 0.4984000 0.000000       0.000000  
1 1 1 26 0  26 o 12.55000 0.7595000 12.55000 0.7595000 12.55000 0.7595000 0.000000       0.000000  
1 1 1 26 0  28 o 30.27000 0.5232000 30.27000 0.5232000 30.27000 0.5232000 0.000000       0.000000  
1 1 1 26 0  30 f 27.74000 0.4632000 27.74000 0.4632000 27.74000 0.4632000 0.000000       0.000000  
1 1 1 26 0  32 o 14.51000 0.5924000 14.51000 0.5924000 14.51000 0.5924000 0.000000       0.000000  
1 1 1 26 0  34 o 4.873000 1.397000  4.873000 1.397000  4.873000 1.397000  0.000000       0.000000  
1 1 1 26 0  36 o 19.73000 0.5859000 19.73000 0.5859000 19.73000 0.5859000 0.000000       0.000000  
1 1 1 26 0  38 o 6.267000 1.257000  6.267000 1.257000  6.267000 1.257000  0.000000       0.000000  
1 1 1 26 0  40 o 14.56000 0.6475000 14.56000 0.6475000 14.56000 0.6475000 0.000000       0.000000  
1 1 1 26 0  42 o 20.09000 0.4748000 20.09000 0.4748000 20.09000 0.4748000 0.000000       0.000000  
1 1 1 26 0  44 o 5.997000 1.158000  5.997000 1.158000  5.997000 1.158000  0.000000       0.000000  
1 1 1 26 0  46 o 3.180000 1.286000  3.180000 1.286000  3.180000 1.286000  0.000000       0.000000  
1 1 1 26 0  48 f 7.893000 1.012000  7.893000 1.012000  7.893000 1.012000  0.000000       0.000000  
1 1 1 26 0  50 o 4.895000 1.699000  4.895000 1.699000  4.895000 1.699000  0.000000       0.000000  
1 1 1 26 0  52 o 3.693000 1.393000  3.693000 1.393000  3.693000 1.393000  0.000000       0.000000  
1 1 1 26 0  54 o 3.021000 1.303000  3.021000 1.303000  3.021000 1.303000  0.000000       0.000000  
1 1 1 26 0  56 o 3.006000 1.303000  3.006000 1.303000  3.006000 1.303000  0.000000       0.000000  
1 1 1 26 1  1  o 49.72000 0.4370000 49.77000 0.6186000 49.66000 0.6174000 0.1119000      0.8740000 
1 1 1 26 1  3  o 89.08000 0.6737000 88.81000 1.016000  89.35000 0.8854000 -0.5322000     1.347000  
1 1 1 26 1  5  o 45.88000 0.3857000 45.60000 0.5805000 46.16000 0.5081000 -0.5582000     0.7715000 
1 1 1 26 1  7  o 29.52000 0.3072000 29.39000 0.4658000 29.65000 0.4007000 -0.2628000     0.6144000 
1 1 1 26 1  9  o 37.63000 0.3425000 37.71000 0.5192000 37.55000 0.4467000 0.1591000      0.6849000 
1 1 1 26 1  11 o 25.10000 0.3005000 25.03000 0.4538000 25.17000 0.3940000 -0.1412000     0.6010000 
1 1 1 26 1  13 o 34.24000 0.3282000 34.06000 0.4978000 34.42000 0.4280000 -0.3542000     0.6564000 
1 1 1 26 1  15 o 28.95000 0.2889000 28.94000 0.4112000 28.95000 0.4060000 -0.1211000E-01 0.5779000 
1 1 1 26 1  17 o 53.44000 0.4391000 52.72000 0.5664000 54.16000 0.6711000 -1.444000      0.8782000 
1 1 1 26 1  19 o 39.25000 0.4322000 39.52000 0.5500000 38.98000 0.6670000 0.5363000      0.8645000 
1 1 1 26 1  21 o 41.77000 0.3476000 41.25000 0.4875000 42.29000 0.4958000 -1.038000      0.6953000 
1 1 1 26 1  23 o 18.30000 0.3804000 17.91000 0.5382000 18.69000 0.5376000 -0.7847000     0.7607000 
1 1 1 26 1  25 o 27.73000 0.3358000 28.02000 0.5055000 27.44000 0.4420000 0.5767000      0.6715000 
1 1 1 26 1  27 o 35.40000 0.3339000 35.04000 0.4724000 35.75000 0.4720000 -0.7022000     0.6678000 
1 1 1 26 1  29 o 7.794000 0.8022000 7.534000 1.172000  8.053000 1.096000  -0.5187000     1.604000  
1 1 1 26 1  31 o 10.07000 0.5504000 9.610000 0.8104000 10.52000 0.7450000 -0.9096000     1.101000  
1 1 1 26 1  33 o 12.02000 0.4917000 11.53000 0.6176000 12.50000 0.7653000 -0.9685000     0.9834000 
1 1 1 26 1  35 o 21.80000 0.4396000 22.67000 0.5400000 20.93000 0.6937000 1.740000       0.8791000 
1 1 1 26 1  37 f 5.492000 0.9781000 5.176000 1.554000  5.808000 1.189000  -0.6322000     1.956000  
1 1 1 26 1  39 o 13.80000 0.4335000 14.05000 0.5567000 13.56000 0.6646000 0.4823000      0.8669000 
1 1 1 26 1  41 f 8.933000 0.5595000 7.958000 0.8283000 9.908000 0.7523000 -1.950000      1.119000  
1 1 1 26 1  43 o 3.667000 0.9491000 3.410000 1.328000  3.924000 1.356000  -0.5144000     1.898000  
1 1 1 26 1  45 o 4.734000 0.9164000 4.562000 1.292000  4.907000 1.300000  -0.3452000     1.833000  
1 1 1 26 1  47 o 8.807000 0.5877000 9.177000 0.8250000 8.437000 0.8371000 0.7401000      1.175000  
1 1 1 26 1  49 o 6.860000 0.7578000 6.127000 1.183000  7.593000 0.9472000 -1.467000      1.516000  
1 1 1 26 1  51 o 4.017000 1.050000  4.181000 1.551000  3.853000 1.415000  0.3275000      2.099000  
1 1 1 26 1  53 o 7.897000 0.6787000 8.007000 0.9407000 7.788000 0.9786000 0.2189000      1.357000  
1 1 1 26 1  55 f 7.487000 0.7567000 7.537000 1.081000  7.438000 1.059000  0.9929000E-01  1.513000  
1 1 1 26 2  0  o 50.74000 0.5456000 50.74000 0.5456000 50.74000 0.5456000 0.000000       0.000000  
1 1 1 26 2  2  o 52.66000 0.4280000 52.38000 0.6434000 52.95000 0.5645000 -0.5749000     0.8559000 
1 1 1 26 2  4  o 51.81000 0.3907000 51.65000 0.5527000 51.96000 0.5524000 -0.3128000     0.7814000 
1 1 1 26 2  6  o 20.83000 0.2745000 20.95000 0.3921000 20.71000 0.3843000 0.2393000      0.5491000 
1 1 1 26 2  8  o 22.35000 0.2795000 22.33000 0.3937000 22.37000 0.3969000 -0.3913000E-01 0.5590000 
1 1 1 26 2  10 o 3.515000 0.8554000 3.537000 1.192000  3.494000 1.227000  0.4371000E-01  1.711000  
1 1 1 26 2  12 o 3.415000 0.8175000 4.267000 1.215000  2.563000 1.094000  1.704000       1.635000  
1 1 1 26 2  14 o 46.20000 0.3619000 46.12000 0.5113000 46.29000 0.5123000 -0.1620000     0.7238000 
1 1 1 26 2  16 o 15.66000 0.3204000 15.81000 0.4627000 15.50000 0.4433000 0.3046000      0.6408000 
1 1 1 26 2  18 o 14.55000 0.3727000 14.84000 0.5729000 14.27000 0.4768000 0.5773000      0.7453000 
1 1 1 26 2  20 o 39.60000 0.5248000 39.76000 0.4805000 39.44000 0.9331000 0.3234000      1.050000  
1 1 1 26 2  22 o 37.78000 0.3838000 37.22000 0.5411000 38.34000 0.5444000 -1.121000      0.7676000 
1 1 1 26 2  24 o 42.85000 0.3836000 43.06000 0.5798000 42.64000 0.5025000 0.4231000      0.7673000 
1 1 1 26 2  26 o 26.79000 0.3200000 26.92000 0.4531000 26.67000 0.4519000 0.2502000      0.6400000 
1 1 1 26 2  28 o 27.19000 0.3239000 27.20000 0.4566000 27.18000 0.4595000 0.2050000E-01  0.6478000 
1 1 1 26 2  30 o 18.97000 0.3646000 18.44000 0.5144000 19.51000 0.5168000 -1.074000      0.7292000 
1 1 1 26 2  32 o 11.54000 0.5986000 11.77000 0.6371000 11.31000 1.014000  0.4627000      1.197000  
1 1 1 26 2  34 o 29.78000 0.3441000 30.62000 0.4608000 28.95000 0.5111000 1.670000       0.6881000 
1 1 1 26 2  36 o 5.327000 0.9559000 4.795000 1.354000  5.859000 1.350000  -1.064000      1.912000  
1 1 1 26 2  38 o 10.20000 0.7363000 9.424000 1.175000  10.97000 0.8883000 -1.550000      1.473000  
1 1 1 26 2  40 o 4.965000 0.9430000 4.582000 1.338000  5.348000 1.329000  -0.7663000     1.886000  
1 1 1 26 2  42 o 9.044000 0.5267000 8.971000 0.7699000 9.116000 0.7190000 -0.1443000     1.053000  
1 1 1 26 2  44 o 5.328000 0.8941000 5.206000 1.328000  5.450000 1.198000  -0.2440000     1.788000  
1 1 1 26 2  46 o 2.975000 0.8920000 3.381000 1.358000  2.570000 1.157000  0.8116000      1.784000  
1 1 1 26 2  48 o 4.754000 0.9861000 3.854000 1.455000  5.655000 1.332000  -1.801000      1.972000  
1 1 1 26 2  50 o 3.224000 0.9445000 3.657000 1.453000  2.790000 1.207000  0.8672000      1.889000  
1 1 1 26 2  52 o 8.956000 0.6985000 8.819000 0.9573000 9.093000 1.017000  -0.2736000     1.397000  
1 1 1 26 2  54 o 6.206000 0.9896000 5.620000 1.320000  6.793000 1.474000  -1.173000      1.979000  
1 1 1 26 2  56 o 6.898000 0.8086000 6.428000 1.275000  7.367000 0.9948000 -0.9386000     1.617000  
1 1 1 26 3  1  o 14.58000 0.3186000 14.67000 0.4465000 14.50000 0.4547000 0.1698000      0.6373000 
1 1 1 26 3  3  o 39.78000 0.3528000 39.69000 0.5317000 39.88000 0.4638000 -0.1907000     0.7056000 
1 1 1 26 3  5  o 69.99000 0.5411000 70.04000 0.8184000 69.94000 0.7080000 0.1077000      1.082000  
1 1 1 26 3  7  o 42.68000 0.3701000 42.94000 0.5622000 42.42000 0.4814000 0.5224000      0.7402000 
1 1 1 26 3  9  o 38.76000 0.3508000 38.31000 0.5296000 39.21000 0.4600000 -0.9028000     0.7015000 
1 1 1 26 3  11 o 15.79000 0.3355000 15.79000 0.5152000 15.78000 0.4299000 0.1417000E-01  0.6710000 
1 1 1 26 3  13 o 52.77000 0.3994000 52.99000 0.5677000 52.55000 0.5620000 0.4415000      0.7988000 
1 1 1 26 3  15 o 19.90000 0.2893000 19.49000 0.4076000 20.31000 0.4105000 -0.8141000     0.5785000 
1 1 1 26 3  17 o 4.989000 0.8450000 4.779000 1.317000  5.200000 1.059000  -0.4209000     1.690000  
1 1 1 26 3  19 o 19.01000 0.3265000 19.62000 0.4876000 18.39000 0.4342000 1.230000       0.6529000 
1 1 1 26 3  21 o 18.44000 0.3963000 18.26000 0.4407000 18.62000 0.6588000 -0.3557000     0.7926000 
1 1 1 26 3  23 o 15.58000 0.3902000 15.57000 0.4951000 15.59000 0.6034000 -0.1704000E-01 0.7805000 
1 1 1 26 3  25 o 19.56000 0.3578000 19.38000 0.5341000 19.75000 0.4762000 -0.3724000     0.7156000 
1 1 1 26 3  27 o 17.63000 0.3591000 17.57000 0.4989000 17.70000 0.5168000 -0.1281000     0.7183000 
1 1 1 26 3  29 o 14.58000 0.4127000 14.52000 0.5858000 14.63000 0.5814000 -0.1059000     0.8254000 
1 1 1 26 3  31 o 24.87000 0.3556000 24.75000 0.4625000 24.98000 0.5402000 -0.2229000     0.7111000 
1 1 1 26 3  33 o 23.53000 0.3482000 23.69000 0.4228000 23.38000 0.5534000 0.3036000      0.6965000 
1 1 1 26 3  35 o 5.663000 0.8945000 5.482000 1.265000  5.845000 1.265000  -0.3624000     1.789000  
1 1 1 26 3  37 o 5.493000 0.9168000 6.790000 1.003000  4.196000 1.535000  2.594000       1.834000  
1 1 1 26 3  39 o 6.032000 0.9756000 6.199000 1.548000  5.866000 1.187000  0.3326000      1.951000  
1 1 1 26 3  41 o 24.95000 0.3229000 25.57000 0.4591000 24.34000 0.4542000 1.229000       0.6459000 
1 1 1 26 3  43 o 3.214000 0.9145000 3.325000 1.296000  3.103000 1.291000  0.2222000      1.829000  
1 1 1 26 3  45 o 6.012000 0.8294000 6.652000 1.044000  5.372000 1.289000  1.280000       1.659000  
1 1 1 26 3  47 o 6.471000 1.192000  6.804000 2.050000  6.138000 1.218000  0.6665000      2.384000  
1 1 1 26 3  49 o 3.510000 0.9801000 3.589000 1.382000  3.431000 1.390000  0.1582000      1.960000  
1 1 1 26 3  51 o 5.721000 0.9756000 5.132000 1.382000  6.309000 1.377000  -1.177000      1.951000  
1 1 1 26 3  53 o 9.770000 0.6586000 9.020000 1.107000  10.52000 0.7133000 -1.500000      1.317000  
1 1 1 26 3  55 o 4.276000 1.156000  4.499000 1.557000  4.052000 1.709000  0.4476000      2.312000  
1 1 1 26 4  0  o 13.89000 0.4721000 13.89000 0.4721000 13.89000 0.4721000 0.000000       0.000000  
1 1 1 26 4  2  o 11.56000 0.3654000 11.82000 0.4959000 11.31000 0.5368000 0.5160000      0.7308000 
1 1 1 26 4  4  o 16.32000 0.3791000 16.37000 0.6250000 16.27000 0.4293000 0.9847000E-01  0.7582000 
1 1 1 26 4  6  o 38.16000 0.3921000 37.56000 0.6390000 38.76000 0.4546000 -1.203000      0.7842000 
1 1 1 26 4  8  o 37.81000 0.3455000 38.00000 0.5259000 37.62000 0.4483000 0.3856000      0.6910000 
1 1 1 26 4  10 o 26.27000 0.3074000 26.06000 0.4748000 26.47000 0.3905000 -0.4129000     0.6147000 
1 1 1 26 4  12 o 18.72000 0.3248000 18.45000 0.5050000 18.99000 0.4085000 -0.5341000     0.6495000 
1 1 1 26 4  14 o 21.77000 0.3359000 21.21000 0.4862000 22.32000 0.4637000 -1.116000      0.6719000 
1 1 1 26 4  16 o 21.06000 0.3849000 20.98000 0.6071000 21.14000 0.4734000 -0.1558000     0.7699000 
1 1 1 26 4  18 o 15.38000 0.3344000 15.52000 0.4568000 15.24000 0.4885000 0.2808000      0.6688000 
1 1 1 26 4  20 o 8.937000 0.5051000 9.460000 0.6883000 8.414000 0.7393000 1.046000       1.010000  
1 1 1 26 4  22 o 25.60000 0.3219000 25.63000 0.4278000 25.58000 0.4812000 0.4399000E-01  0.6439000 
1 1 1 26 4  24 o 53.90000 0.4476000 53.63000 0.5844000 54.17000 0.6782000 -0.5379000     0.8952000 
1 1 1 26 4  26 o 19.00000 0.3415000 18.96000 0.4756000 19.04000 0.4903000 -0.8315000E-01 0.6831000 
1 1 1 26 4  28 o 19.14000 0.3503000 19.27000 0.5027000 19.01000 0.4882000 0.2665000      0.7007000 
1 1 1 26 4  30 o 4.798000 0.9538000 6.144000 1.274000  3.451000 1.420000  2.693000       1.908000  
1 1 1 26 4  32 o 13.68000 0.4593000 13.71000 0.5453000 13.66000 0.7394000 0.4593000E-01  0.9187000 
1 1 1 26 4  34 o 33.85000 0.3551000 33.91000 0.4673000 33.79000 0.5348000 0.1180000      0.7102000 
1 1 1 26 4  36 o 25.86000 0.3992000 26.16000 0.4650000 25.57000 0.6489000 0.5908000      0.7983000 
1 1 1 26 4  38 o 5.240000 0.9713000 5.803000 1.306000  4.677000 1.438000  1.125000       1.943000  
1 1 1 26 4  40 o 8.015000 0.7216000 7.970000 1.145000  8.061000 0.8789000 -0.9099000E-01 1.443000  
1 1 1 26 4  42 o 22.30000 0.3355000 22.35000 0.4715000 22.25000 0.4776000 0.1054000      0.6711000 
1 1 1 26 4  44 o 5.369000 0.8823000 5.914000 1.191000  4.824000 1.302000  1.091000       1.765000  
1 1 1 26 4  46 o 6.403000 0.8921000 5.732000 1.474000  7.074000 1.005000  -1.342000      1.784000  
1 1 1 26 4  48 o 10.45000 0.5778000 10.61000 0.7368000 10.29000 0.8902000 0.3172000      1.156000  
1 1 1 26 4  50 o 4.512000 0.9874000 5.899000 1.426000  3.125000 1.367000  2.774000       1.975000  
1 1 1 26 4  52 o 5.965000 0.9019000 5.898000 1.349000  6.032000 1.198000  -0.1342000     1.804000  
1 1 1 26 4  54 o 3.528000 0.9620000 3.998000 1.450000  3.057000 1.264000  0.9405000      1.924000  
1 1 1 26 4  56 o 5.794000 1.206000  5.120000 1.631000  6.468000 1.776000  -1.348000      2.412000  
1 1 1 26 5  1  o 35.11000 0.3313000 34.65000 0.4992000 35.57000 0.4356000 -0.9204000     0.6625000 
1 1 1 26 5  3  o 28.08000 0.3070000 27.89000 0.4693000 28.27000 0.3960000 -0.3747000     0.6141000 
1 1 1 26 5  5  o 49.10000 0.4056000 49.27000 0.6140000 48.93000 0.5302000 0.3419000      0.8112000 
1 1 1 26 5  7  f 60.27000 0.4773000 60.71000 0.7252000 59.83000 0.6209000 0.8728000      0.9547000 
1 1 1 26 5  9  o 30.73000 0.2894000 30.92000 0.4106000 30.54000 0.4080000 0.3770000      0.5789000 
1 1 1 26 5  11 o 29.17000 0.2887000 29.43000 0.4080000 28.91000 0.4086000 0.5250000      0.5775000 
1 1 1 26 5  13 f 9.528000 0.4865000 9.822000 0.6779000 9.234000 0.6979000 0.5881000      0.9730000 
1 1 1 26 5  15 o 44.06000 0.3772000 43.50000 0.5641000 44.62000 0.5009000 -1.121000      0.7544000 
1 1 1 26 5  17 o 4.303000 0.9255000 4.864000 1.323000  3.741000 1.295000  1.123000       1.851000  
1 1 1 26 5  19 o 28.33000 0.3251000 28.18000 0.4928000 28.49000 0.4242000 -0.3051000     0.6502000 
1 1 1 26 5  21 o 55.01000 0.5095000 54.35000 0.5839000 55.68000 0.8350000 -1.329000      1.019000  
1 1 1 26 5  23 o 27.04000 0.3089000 27.38000 0.4459000 26.70000 0.4276000 0.6834000      0.6178000 
1 1 1 26 5  25 o 23.34000 0.3683000 23.64000 0.4973000 23.03000 0.5435000 0.6112000      0.7367000 
1 1 1 26 5  27 o 8.303000 0.6235000 8.439000 0.8700000 8.167000 0.8933000 0.2721000      1.247000  
1 1 1 26 5  29 o 17.82000 0.3915000 18.26000 0.5157000 17.38000 0.5893000 0.8817000      0.7831000 
1 1 1 26 5  31 o 22.91000 0.3505000 23.52000 0.4196000 22.30000 0.5615000 1.229000       0.7009000 
1 1 1 26 5  33 o 6.848000 0.8101000 6.726000 0.9985000 6.969000 1.276000  -0.2431000     1.620000  
1 1 1 26 5  35 o 2.780000 0.8701000 2.442000 1.109000  3.118000 1.341000  -0.6757000     1.740000  
1 1 1 26 5  37 o 12.27000 0.4756000 11.83000 0.6538000 12.70000 0.6909000 -0.8773000     0.9512000 
1 1 1 26 5  39 o 5.670000 0.8880000 4.449000 1.442000  6.891000 1.036000  -2.442000      1.776000  
1 1 1 26 5  41 o 5.770000 1.045000  5.571000 1.664000  5.968000 1.266000  -0.3973000     2.091000  
1 1 1 26 5  43 o 7.659000 0.6370000 7.628000 0.9445000 7.691000 0.8549000 -0.6256000E-01 1.274000  
1 1 1 26 5  45 o 7.203000 0.7172000 7.139000 1.083000  7.268000 0.9408000 -0.1285000     1.434000  
1 1 1 26 5  47 o 5.973000 0.8822000 7.406000 1.154000  4.540000 1.335000  2.867000       1.764000  
1 1 1 26 5  49 o 6.006000 0.9843000 6.196000 1.304000  5.816000 1.474000  0.3804000      1.969000  
1 1 1 26 5  51 o 6.944000 0.7587000 6.884000 1.080000  7.004000 1.066000  -0.1197000     1.517000  
1 1 1 26 5  53 o 7.591000 0.6995000 7.587000 0.9558000 7.594000 1.021000  -0.7136000E-02 1.399000  
1 1 1 26 5  55 o 3.228000 0.9137000 2.717000 1.241000  3.739000 1.341000  -1.021000      1.827000  
1 1 1 26 6  0  o 35.66000 0.5122000 35.66000 0.5122000 35.66000 0.5122000 0.000000       0.000000  
1 1 1 26 6  2  o 41.13000 0.3618000 41.35000 0.5508000 40.90000 0.4693000 0.4555000      0.7236000 
1 1 1 26 6  4  o 61.16000 0.4471000 61.09000 0.6314000 61.24000 0.6331000 -0.1437000     0.8941000 
1 1 1 26 6  6  o 25.83000 0.2983000 25.96000 0.4463000 25.70000 0.3958000 0.2637000      0.5965000 
1 1 1 26 6  8  o 12.36000 0.3470000 12.73000 0.4698000 11.99000 0.5107000 0.7412000      0.6939000 
1 1 1 26 6  10 o 12.98000 0.3713000 12.88000 0.5329000 13.09000 0.5173000 -0.2081000     0.7427000 
1 1 1 26 6  12 o 15.42000 0.3101000 15.34000 0.4304000 15.49000 0.4467000 -0.1490000     0.6203000 
1 1 1 26 6  14 o 20.07000 0.2826000 20.32000 0.4011000 19.83000 0.3982000 0.4857000      0.5652000 
1 1 1 26 6  16 o 23.55000 0.3058000 23.32000 0.4613000 23.78000 0.4014000 -0.4612000     0.6115000 
1 1 1 26 6  18 o 30.82000 0.2990000 30.78000 0.4207000 30.86000 0.4251000 -0.8775000E-01 0.5981000 
1 1 1 26 6  20 o 26.40000 0.3428000 26.52000 0.4985000 26.28000 0.4708000 0.2425000      0.6857000 
1 1 1 26 6  22 o 53.26000 0.4438000 52.91000 0.5794000 53.62000 0.6725000 -0.7119000     0.8876000 
1 1 1 26 6  24 o 33.25000 0.3250000 33.12000 0.4599000 33.38000 0.4593000 -0.2624000     0.6500000 
1 1 1 26 6  26 o 15.91000 0.3715000 16.08000 0.5119000 15.73000 0.5385000 0.3436000      0.7430000 
1 1 1 26 6  28 o 28.13000 0.4008000 28.10000 0.4513000 28.16000 0.6624000 -0.5488000E-01 0.8015000 
1 1 1 26 6  30 o 41.75000 0.3720000 41.68000 0.4564000 41.83000 0.5876000 -0.1535000     0.7440000 
1 1 1 26 6  32 o 25.38000 0.3561000 25.73000 0.4571000 25.03000 0.5461000 0.7052000      0.7121000 
1 1 1 26 6  34 o 9.229000 0.5689000 8.396000 0.8033000 10.06000 0.8059000 -1.666000      1.138000  
1 1 1 26 6  36 f 15.34000 0.4459000 15.35000 0.4753000 15.34000 0.7547000 0.1304000E-01  0.8919000 
1 1 1 26 6  38 o 18.41000 0.3500000 18.26000 0.4982000 18.57000 0.4918000 -0.3132000     0.7000000 
1 1 1 26 6  40 o 18.24000 0.3433000 18.30000 0.5013000 18.18000 0.4691000 0.1164000      0.6865000 
1 1 1 26 6  42 o 12.47000 0.4733000 12.07000 0.7368000 12.87000 0.5941000 -0.8040000     0.9465000 
1 1 1 26 6  44 o 20.92000 0.4015000 20.43000 0.5826000 21.40000 0.5525000 -0.9661000     0.8029000 
1 1 1 26 6  46 o 8.690000 0.6721000 8.340000 0.9421000 9.040000 0.9587000 -0.6997000     1.344000  
1 1 1 26 6  48 o 3.100000 0.9194000 3.356000 1.337000  2.843000 1.262000  0.5122000      1.839000  
1 1 1 26 6  50 o 5.826000 0.9552000 6.166000 1.385000  5.487000 1.316000  0.6793000      1.910000  
1 1 1 26 6  52 o 4.180000 0.9974000 3.752000 1.423000  4.608000 1.398000  -0.8568000     1.995000  
1 1 1 26 6  54 o 4.370000 1.008000  3.917000 1.410000  4.822000 1.442000  -0.9050000     2.017000  
1 1 1 26 6  56 o 4.412000 1.035000  4.246000 1.477000  4.579000 1.449000  -0.3329000     2.069000  
1 1 1 26 7  1  o 26.53000 0.3030000 26.47000 0.3881000 26.58000 0.4653000 -0.1017000     0.6060000 
1 1 1 26 7  3  o 28.79000 0.2837000 28.47000 0.3981000 29.10000 0.4042000 -0.6313000     0.5673000 
1 1 1 26 7  5  o 35.73000 0.3094000 35.97000 0.4394000 35.49000 0.4357000 0.4882000      0.6188000 
1 1 1 26 7  7  o 27.62000 0.3218000 28.55000 0.4645000 26.69000 0.4455000 1.859000       0.6436000 
1 1 1 26 7  9  o 15.73000 0.3311000 16.00000 0.4991000 15.47000 0.4352000 0.5280000      0.6623000 
1 1 1 26 7  11 o 25.66000 0.2793000 25.89000 0.3983000 25.42000 0.3916000 0.4696000      0.5586000 
1 1 1 26 7  13 o 25.93000 0.2791000 25.79000 0.3953000 26.06000 0.3941000 -0.2664000     0.5582000 
1 1 1 26 7  15 o 16.00000 0.3371000 15.63000 0.4982000 16.38000 0.4544000 -0.7528000     0.6743000 
1 1 1 26 7  17 o 11.97000 0.3768000 12.08000 0.5106000 11.85000 0.5542000 0.2335000      0.7536000 
1 1 1 26 7  19 o 14.87000 0.3567000 14.73000 0.4838000 15.01000 0.5243000 -0.2819000     0.7134000 
1 1 1 26 7  21 o 20.67000 0.3592000 20.14000 0.5594000 21.20000 0.4507000 -1.056000      0.7183000 
1 1 1 26 7  23 o 30.73000 0.3494000 30.25000 0.5347000 31.22000 0.4500000 -0.9752000     0.6989000 
1 1 1 26 7  25 o 16.40000 0.3772000 16.53000 0.5754000 16.27000 0.4878000 0.2576000      0.7544000 
1 1 1 26 7  27 f 4.566000 1.026000  4.511000 1.357000  4.621000 1.540000  -0.1105000     2.053000  
1 1 1 26 7  29 o 17.96000 0.3931000 17.50000 0.5036000 18.41000 0.6039000 -0.9111000     0.7863000 
1 1 1 26 7  31 o 7.263000 0.7998000 6.783000 1.103000  7.744000 1.158000  -0.9612000     1.600000  
1 1 1 26 7  33 o 14.79000 0.4178000 14.34000 0.5329000 15.24000 0.6435000 -0.8983000     0.8355000 
1 1 1 26 7  35 o 10.12000 0.5223000 10.33000 0.6169000 9.899000 0.8431000 0.4351000      1.045000  
1 1 1 26 7  37 o 3.900000 0.9297000 4.442000 1.334000  3.359000 1.295000  1.082000       1.859000  
1 1 1 26 7  39 f 4.167000 0.9969000 4.513000 1.455000  3.821000 1.363000  0.6924000      1.994000  
1 1 1 26 7  41 o 12.44000 0.5724000 12.34000 0.9805000 12.54000 0.5908000 -0.1978000     1.145000  
1 1 1 26 7  43 o 6.822000 0.7128000 6.843000 1.020000  6.800000 0.9962000 0.4267000E-01  1.426000  
1 1 1 26 7  45 o 23.74000 0.3980000 24.00000 0.5631000 23.48000 0.5627000 0.5130000      0.7960000 
1 1 1 26 7  47 o 5.263000 0.9803000 4.224000 1.460000  6.302000 1.308000  -2.078000      1.961000  
1 1 1 26 7  49 o 4.046000 1.063000  3.582000 1.458000  4.509000 1.547000  -0.9273000     2.126000  
1 1 1 26 7  51 o 2.663000 0.8502000 2.163000 1.047000  3.163000 1.340000  -0.9999000     1.700000  
1 1 1 26 7  53 o 3.844000 0.9606000 3.466000 1.349000  4.221000 1.368000  -0.7551000     1.921000  
1 1 1 26 7  55 o 6.567000 0.9570000 7.021000 1.461000  6.113000 1.237000  0.9083000      1.914000  
1 1 1 26 8  0  o 28.75000 0.3993000 28.75000 0.3993000 28.75000 0.3993000 0.000000       0.000000  
1 1 1 26 8  2  o 17.59000 0.3251000 17.61000 0.4035000 17.57000 0.5098000 0.3717000E-01  0.6502000 
1 1 1 26 8  4  o 38.32000 0.3197000 38.47000 0.4528000 38.17000 0.4514000 0.2998000      0.6394000 
1 1 1 26 8  6  f 22.26000 0.3123000 22.53000 0.4508000 21.99000 0.4322000 0.5321000      0.6245000 
1 1 1 26 8  8  o 42.78000 0.3702000 42.96000 0.5607000 42.59000 0.4835000 0.3769000      0.7404000 
1 1 1 26 8  10 o 40.31000 0.3305000 40.25000 0.4678000 40.38000 0.4671000 -0.1309000     0.6611000 
1 1 1 26 8  12 o 35.44000 0.3322000 35.72000 0.5032000 35.16000 0.4340000 0.5596000      0.6645000 
1 1 1 26 8  14 o 43.10000 0.3723000 43.27000 0.5617000 42.94000 0.4888000 0.3299000      0.7445000 
1 1 1 26 8  16 o 4.921000 0.8065000 5.091000 1.125000  4.750000 1.156000  0.3411000      1.613000  
1 1 1 26 8  18 o 26.52000 0.3064000 26.59000 0.4059000 26.45000 0.4592000 0.1439000      0.6129000 
1 1 1 26 8  20 o 4.048000 0.9110000 3.564000 1.299000  4.532000 1.278000  -0.9681000     1.822000  
1 1 1 26 8  22 o 25.54000 0.3310000 24.63000 0.4262000 26.45000 0.5065000 -1.821000      0.6619000 
1 1 1 26 8  24 o 29.22000 0.3657000 29.48000 0.5228000 28.96000 0.5115000 0.5181000      0.7314000 
1 1 1 26 8  26 o 31.16000 0.3360000 31.66000 0.5055000 30.66000 0.4427000 1.007000       0.6719000 
1 1 1 26 8  28 o 10.98000 0.5045000 10.63000 0.6011000 11.34000 0.8104000 -0.7105000     1.009000  
1 1 1 26 8  30 o 28.53000 0.3741000 28.19000 0.5237000 28.87000 0.5345000 -0.6811000     0.7483000 
1 1 1 26 8  32 o 23.05000 0.3524000 23.26000 0.4547000 22.85000 0.5385000 0.4135000      0.7048000 
1 1 1 26 8  34 o 9.177000 0.5399000 9.040000 0.7015000 9.315000 0.8209000 -0.2751000     1.080000  
1 1 1 26 8  36 o 19.92000 0.4838000 20.37000 0.4116000 19.46000 0.8758000 0.9111000      0.9677000 
1 1 1 26 8  38 o 6.310000 0.7759000 6.106000 1.111000  6.513000 1.083000  -0.4070000     1.552000  
1 1 1 26 8  40 o 11.00000 0.5204000 10.18000 0.8464000 11.82000 0.6057000 -1.636000      1.041000  
1 1 1 26 8  42 o 4.085000 0.9382000 4.071000 1.352000  4.098000 1.301000  -0.2687000E-01 1.876000  
1 1 1 26 8  44 o 14.78000 0.4242000 14.12000 0.5809000 15.44000 0.6183000 -1.313000      0.8484000 
1 1 1 26 8  46 o 15.35000 0.4413000 15.30000 0.6972000 15.40000 0.5412000 -0.1004000     0.8826000 
1 1 1 26 8  48 o 5.565000 0.9998000 4.763000 1.395000  6.366000 1.432000  -1.603000      2.000000  
1 1 1 26 8  50 f 5.696000 0.9403000 6.273000 1.297000  5.120000 1.362000  1.153000       1.881000  
1 1 1 26 8  52 o 7.568000 0.8221000 7.412000 1.183000  7.724000 1.142000  -0.3119000     1.644000  
1 1 1 26 8  54 o 5.339000 0.9646000 5.255000 1.361000  5.423000 1.367000  -0.1682000     1.929000  
1 1 1 26 8  56 o 7.832000 0.8467000 7.968000 1.320000  7.696000 1.061000  0.2720000      1.693000  
1 1 1 26 9  1  o 20.53000 0.2813000 20.66000 0.4044000 20.41000 0.3911000 0.2529000      0.5625000 
1 1 1 26 9  3  o 20.35000 0.3534000 20.23000 0.4395000 20.46000 0.5537000 -0.2323000     0.7069000 
1 1 1 26 9  5  f 54.37000 0.4056000 55.06000 0.5799000 53.67000 0.5673000 1.387000       0.8112000 
1 1 1 26 9  7  o 39.18000 0.3247000 39.52000 0.4623000 38.85000 0.4560000 0.6699000      0.6493000 
1 1 1 26 9  9  o 20.55000 0.3029000 20.56000 0.4562000 20.55000 0.3985000 0.6405000E-02  0.6058000 
1 1 1 26 9  11 o 31.86000 0.3157000 31.64000 0.4752000 32.08000 0.4157000 -0.4364000     0.6313000 
1 1 1 26 9  13 o 30.36000 0.3129000 30.26000 0.4693000 30.47000 0.4138000 -0.2062000     0.6257000 
1 1 1 26 9  15 o 34.93000 0.3107000 34.43000 0.4343000 35.43000 0.4445000 -1.003000      0.6215000 
1 1 1 26 9  17 o 7.813000 0.5266000 7.803000 0.7398000 7.823000 0.7497000 -0.1981000E-01 1.053000  
1 1 1 26 9  19 o 32.06000 0.3081000 32.56000 0.4407000 31.57000 0.4308000 0.9954000      0.6163000 
1 1 1 26 9  21 o 31.43000 0.3116000 31.77000 0.4384000 31.09000 0.4429000 0.6727000      0.6232000 
1 1 1 26 9  23 f 6.390000 0.8842000 6.186000 1.060000  6.594000 1.416000  -0.4085000     1.768000  
1 1 1 26 9  25 o 24.28000 0.3486000 24.17000 0.5415000 24.39000 0.4391000 -0.2210000     0.6972000 
1 1 1 26 9  27 o 35.04000 0.3860000 35.02000 0.5549000 35.06000 0.5368000 -0.4075000E-01 0.7720000 
1 1 1 26 9  29 o 9.431000 0.5996000 8.862000 0.7818000 10.00000 0.9093000 -1.139000      1.199000  
1 1 1 26 9  31 o 5.440000 0.9824000 5.096000 1.367000  5.783000 1.412000  -0.6870000     1.965000  
1 1 1 26 9  33 o 7.693000 0.6384000 7.002000 0.8641000 8.384000 0.9401000 -1.382000      1.277000  
1 1 1 26 9  35 o 8.720000 0.5967000 9.497000 0.6665000 7.943000 0.9900000 1.555000       1.193000  
1 1 1 26 9  37 o 7.383000 0.6452000 6.714000 0.8890000 8.052000 0.9354000 -1.338000      1.290000  
1 1 1 26 9  39 o 8.684000 0.6065000 8.709000 0.9348000 8.659000 0.7730000 0.4946000E-01  1.213000  
1 1 1 26 9  41 o 14.69000 0.3865000 14.48000 0.5502000 14.90000 0.5429000 -0.4281000     0.7730000 
1 1 1 26 9  43 o 7.911000 0.6836000 8.112000 0.7862000 7.710000 1.119000  0.4018000      1.367000  
1 1 1 26 9  45 o 19.32000 0.3544000 18.79000 0.5089000 19.85000 0.4934000 -1.050000      0.7088000 
1 1 1 26 9  47 o 12.00000 0.5157000 12.67000 0.7669000 11.33000 0.6895000 1.333000       1.031000  
1 1 1 26 9  49 o 4.028000 0.9642000 4.564000 1.366000  3.492000 1.361000  1.072000       1.928000  
1 1 1 26 9  51 o 4.196000 0.9967000 3.729000 1.420000  4.663000 1.399000  -0.9340000     1.993000  
1 1 1 26 9  53 o 2.945000 0.8891000 2.471000 1.164000  3.418000 1.344000  -0.9470000     1.778000  
1 1 1 26 9  55 o 3.946000 1.055000  3.833000 1.450000  4.059000 1.533000  -0.2256000     2.110000  
1 1 1 26 10 0  o 23.83000 0.5034000 23.83000 0.5034000 23.83000 0.5034000 0.000000       0.000000  
1 1 1 26 10 2  o 15.42000 0.3015000 15.30000 0.4239000 15.55000 0.4289000 -0.2537000     0.6030000 
1 1 1 26 10 4  o 19.40000 0.3090000 19.55000 0.3935000 19.26000 0.4766000 0.2863000      0.6180000 
1 1 1 26 10 6  o 37.06000 0.3148000 37.59000 0.4469000 36.54000 0.4436000 1.048000       0.6297000 
1 1 1 26 10 8  o 21.68000 0.2835000 21.68000 0.4038000 21.69000 0.3981000 -0.3757000E-02 0.5670000 
1 1 1 26 10 10 o 34.37000 0.3671000 34.57000 0.5985000 34.17000 0.4253000 0.4082000      0.7342000 
1 1 1 26 10 12 o 13.85000 0.3251000 13.56000 0.4501000 14.14000 0.4693000 -0.5788000     0.6503000 
1 1 1 26 10 14 o 48.54000 0.3757000 48.73000 0.5316000 48.36000 0.5309000 0.3667000      0.7513000 
1 1 1 26 10 16 o 24.18000 0.2871000 24.05000 0.4047000 24.32000 0.4074000 -0.2776000     0.5742000 
1 1 1 26 10 18 o 18.54000 0.3180000 18.89000 0.4268000 18.20000 0.4715000 0.6950000      0.6360000 
1 1 1 26 10 20 o 31.11000 0.3301000 31.48000 0.4335000 30.74000 0.4979000 0.7415000      0.6602000 
1 1 1 26 10 22 o 37.16000 0.4264000 36.96000 0.5329000 37.36000 0.6658000 -0.4003000     0.8529000 
1 1 1 26 10 24 o 43.82000 0.3610000 43.64000 0.5117000 43.99000 0.5093000 -0.3463000     0.7220000 
1 1 1 26 10 26 o 14.83000 0.4035000 14.58000 0.6207000 15.09000 0.5157000 -0.5166000     0.8070000 
1 1 1 26 10 28 o 16.63000 0.4297000 16.26000 0.6203000 17.00000 0.5949000 -0.7378000     0.8594000 
1 1 1 26 10 30 o 7.331000 0.7429000 7.308000 0.8538000 7.355000 1.216000  -0.4710000E-01 1.486000  
1 1 1 26 10 32 f 3.546000 0.9881000 3.536000 1.397000  3.556000 1.398000  -0.2021000E-01 1.976000  
1 1 1 26 10 34 o 23.84000 0.3210000 24.05000 0.3914000 23.64000 0.5090000 0.4191000      0.6421000 
1 1 1 26 10 36 o 16.10000 0.4358000 16.26000 0.4865000 15.93000 0.7231000 0.3316000      0.8716000 
1 1 1 26 10 38 o 10.03000 0.5149000 10.52000 0.7094000 9.545000 0.7465000 0.9777000      1.030000  
1 1 1 26 10 40 o 13.50000 0.3864000 13.54000 0.5377000 13.47000 0.5551000 0.7469000E-01  0.7728000 
1 1 1 26 10 42 o 8.835000 0.5907000 8.809000 0.7494000 8.861000 0.9133000 -0.5146000E-01 1.181000  
1 1 1 26 10 44 o 8.171000 0.6002000 7.619000 0.8868000 8.723000 0.8092000 -1.104000      1.200000  
1 1 1 26 10 46 o 11.19000 0.5219000 11.78000 0.7200000 10.60000 0.7557000 1.183000       1.044000  
1 1 1 26 10 48 o 6.600000 1.004000  6.523000 1.393000  6.678000 1.446000  -0.1553000     2.008000  
1 1 1 26 10 50 f 4.769000 1.025000  4.542000 1.507000  4.996000 1.389000  -0.4544000     2.049000  
1 1 1 26 10 52 f 5.981000 0.8719000 6.371000 1.111000  5.591000 1.344000  0.7798000      1.744000  
1 1 1 26 10 54 o 4.559000 0.9815000 3.792000 1.409000  5.327000 1.366000  -1.536000      1.963000  
1 1 1 26 11 1  o 30.51000 0.3259000 30.64000 0.4590000 30.39000 0.4627000 0.2494000      0.6517000 
1 1 1 26 11 3  o 48.55000 0.3726000 48.51000 0.5268000 48.59000 0.5270000 -0.8678000E-01 0.7452000 
1 1 1 26 11 5  o 25.34000 0.3055000 25.61000 0.3922000 25.06000 0.4684000 0.5457000      0.6109000 
1 1 1 26 11 7  o 43.60000 0.3485000 43.93000 0.4954000 43.27000 0.4903000 0.6572000      0.6970000 
1 1 1 26 11 9  o 33.02000 0.3211000 32.68000 0.4831000 33.36000 0.4231000 -0.6763000     0.6422000 
1 1 1 26 11 11 o 14.89000 0.3165000 14.88000 0.4306000 14.90000 0.4640000 -0.2349000E-01 0.6330000 
1 1 1 26 11 13 o 27.70000 0.2861000 27.98000 0.4036000 27.42000 0.4056000 0.5582000      0.5722000 
1 1 1 26 11 15 o 9.732000 0.4233000 9.493000 0.6029000 9.971000 0.5943000 -0.4777000     0.8466000 
1 1 1 26 11 17 o 22.55000 0.3086000 23.29000 0.4062000 21.81000 0.4648000 1.480000       0.6173000 
1 1 1 26 11 19 o 9.378000 0.4961000 8.697000 0.6861000 10.06000 0.7168000 -1.362000      0.9922000 
1 1 1 26 11 21 o 13.97000 0.3620000 13.79000 0.5139000 14.15000 0.5099000 -0.3614000     0.7240000 
1 1 1 26 11 23 o 13.30000 0.4120000 13.38000 0.5468000 13.23000 0.6164000 0.1500000      0.8239000 
1 1 1 26 11 25 o 19.54000 0.3429000 19.32000 0.5238000 19.76000 0.4427000 -0.4408000     0.6858000 
1 1 1 26 11 27 o 21.36000 0.3523000 20.91000 0.4483000 21.81000 0.5435000 -0.8977000     0.7045000 
1 1 1 26 11 29 o 23.75000 0.3525000 23.83000 0.4636000 23.67000 0.5312000 0.1631000      0.7051000 
1 1 1 26 11 31 o 19.82000 0.3565000 19.48000 0.4556000 20.16000 0.5485000 -0.6797000     0.7130000 
1 1 1 26 11 33 o 10.03000 0.5052000 9.505000 0.6707000 10.56000 0.7557000 -1.058000      1.010000  
1 1 1 26 11 35 o 12.15000 0.5163000 12.45000 0.7042000 11.86000 0.7552000 0.5907000      1.033000  
1 1 1 26 11 37 o 6.455000 0.6864000 6.343000 0.8539000 6.568000 1.075000  -0.2253000     1.373000  
1 1 1 26 11 39 o 7.771000 0.6445000 6.667000 1.053000  8.874000 0.7427000 -2.207000      1.289000  
1 1 1 26 11 41 o 12.69000 0.4435000 12.04000 0.5686000 13.33000 0.6807000 -1.294000      0.8869000 
1 1 1 26 11 43 o 4.000000 0.9476000 3.656000 1.353000  4.344000 1.327000  -0.6885000     1.895000  
1 1 1 26 11 45 o 7.417000 0.7172000 8.190000 0.9382000 6.643000 1.085000  1.547000       1.434000  
1 1 1 26 11 47 o 9.982000 0.5272000 10.20000 0.7257000 9.758000 0.7650000 0.4469000      1.054000  
1 1 1 26 11 49 o 4.849000 1.062000  4.820000 1.618000  4.879000 1.376000  -0.5872000E-01 2.124000  
1 1 1 26 11 51 o 7.382000 0.7688000 6.656000 1.211000  8.108000 0.9473000 -1.452000      1.538000  
1 1 1 26 11 53 o 6.051000 0.8943000 5.764000 1.323000  6.338000 1.203000  -0.5745000     1.789000  
1 1 1 26 11 55 o 8.502000 0.6594000 8.250000 0.9789000 8.755000 0.8839000 -0.5053000     1.319000  
1 1 1 26 12 0  o 22.06000 0.3891000 22.06000 0.3891000 22.06000 0.3891000 0.000000       0.000000  
1 1 1 26 12 2  o 13.16000 0.3366000 13.31000 0.4566000 13.02000 0.4948000 0.2853000      0.6733000 
1 1 1 26 12 4  o 15.51000 0.3528000 15.75000 0.4780000 15.28000 0.5190000 0.4671000      0.7056000 
1 1 1 26 12 6  o 44.31000 0.4059000 44.40000 0.5672000 44.22000 0.5807000 0.1820000      0.8117000 
1 1 1 26 12 8  o 10.45000 0.4086000 10.85000 0.5752000 10.05000 0.5804000 0.7981000      0.8171000 
1 1 1 26 12 10 o 47.23000 0.3971000 47.89000 0.6056000 46.58000 0.5139000 1.307000       0.7942000 
1 1 1 26 12 12 o 63.36000 0.4619000 63.53000 0.6544000 63.19000 0.6521000 0.3397000      0.9238000 
1 1 1 26 12 14 o 50.96000 0.4198000 50.31000 0.5443000 51.60000 0.6393000 -1.290000      0.8396000 
1 1 1 26 12 16 o 27.11000 0.3359000 28.06000 0.4115000 26.15000 0.5310000 1.902000       0.6718000 
1 1 1 26 12 18 o 43.46000 0.3788000 43.00000 0.4928000 43.92000 0.5755000 -0.9145000     0.7576000 
1 1 1 26 12 20 f 21.39000 0.3040000 21.53000 0.4301000 21.24000 0.4297000 0.2923000      0.6080000 
1 1 1 26 12 22 o 25.51000 0.3012000 25.39000 0.4302000 25.63000 0.4216000 -0.2402000     0.6024000 
1 1 1 26 12 24 o 23.20000 0.3228000 23.16000 0.4768000 23.23000 0.4353000 -0.7087000E-01 0.6456000 
1 1 1 26 12 26 o 12.40000 0.4698000 12.42000 0.5684000 12.37000 0.7481000 0.5275000E-01  0.9395000 
1 1 1 26 12 28 o 22.03000 0.3346000 21.77000 0.3909000 22.29000 0.5433000 -0.5237000     0.6693000 
1 1 1 26 12 30 o 37.74000 0.3651000 37.43000 0.4736000 38.04000 0.5559000 -0.6042000     0.7303000 
1 1 1 26 12 32 o 28.61000 0.3215000 28.98000 0.3954000 28.24000 0.5072000 0.7436000      0.6431000 
1 1 1 26 12 34 o 3.578000 0.9733000 2.882000 1.183000  4.275000 1.546000  -1.393000      1.947000  
1 1 1 26 12 36 o 3.815000 0.8928000 2.992000 1.198000  4.638000 1.324000  -1.645000      1.786000  
1 1 1 26 12 38 o 6.315000 0.7415000 6.568000 0.8386000 6.062000 1.223000  0.5065000      1.483000  
1 1 1 26 12 40 o 4.281000 0.9297000 3.146000 1.239000  5.416000 1.387000  -2.270000      1.859000  
1 1 1 26 12 42 o 5.900000 0.7776000 5.926000 1.108000  5.874000 1.092000  0.5186000E-01  1.555000  
1 1 1 26 12 44 o 8.011000 0.6338000 8.757000 0.8220000 7.265000 0.9648000 1.492000       1.268000  
1 1 1 26 12 46 o 9.728000 0.5148000 9.331000 0.7563000 10.12000 0.6985000 -0.7922000     1.030000  
1 1 1 26 12 48 o 10.58000 0.5470000 10.97000 0.7276000 10.20000 0.8169000 0.7675000      1.094000  
1 1 1 26 12 50 o 4.395000 1.074000  4.720000 1.629000  4.071000 1.401000  0.6488000      2.149000  
1 1 1 26 12 52 o 3.504000 0.9827000 3.467000 1.367000  3.540000 1.412000  -0.7263000E-01 1.965000  
1 1 1 26 12 54 o 3.182000 0.9237000 2.677000 1.208000  3.687000 1.398000  -1.010000      1.847000  
1 1 1 26 13 1  o 13.87000 0.3150000 13.98000 0.4394000 13.75000 0.4514000 0.2356000      0.6299000 
1 1 1 26 13 3  o 21.13000 0.3013000 21.28000 0.4458000 20.98000 0.4054000 0.3045000      0.6026000 
1 1 1 26 13 5  f 16.84000 0.3170000 16.89000 0.4677000 16.80000 0.4279000 0.8870000E-01  0.6339000 
1 1 1 26 13 7  f 23.24000 0.3140000 22.67000 0.4296000 23.80000 0.4579000 -1.130000      0.6279000 
1 1 1 26 13 9  o 38.98000 0.3243000 39.47000 0.4610000 38.49000 0.4562000 0.9727000      0.6486000 
1 1 1 26 13 11 o 10.23000 0.4803000 10.74000 0.6489000 9.711000 0.7084000 1.034000       0.9607000 
1 1 1 26 13 13 o 43.66000 0.4189000 42.93000 0.4886000 44.38000 0.6805000 -1.446000      0.8377000 
1 1 1 26 13 15 o 40.21000 0.3984000 39.97000 0.4692000 40.45000 0.6439000 -0.4841000     0.7967000 
1 1 1 26 13 17 o 51.09000 0.4262000 51.04000 0.5538000 51.14000 0.6479000 -0.9978000E-01 0.8523000 
1 1 1 26 13 19 o 26.11000 0.2928000 25.70000 0.4128000 26.53000 0.4153000 -0.8349000     0.5855000 
1 1 1 26 13 21 o 45.78000 0.3664000 46.21000 0.5240000 45.35000 0.5123000 0.8579000      0.7328000 
1 1 1 26 13 23 o 10.49000 0.5130000 11.17000 0.6889000 9.818000 0.7602000 1.353000       1.026000  
1 1 1 26 13 25 o 7.163000 0.7081000 6.769000 0.8559000 7.558000 1.128000  -0.7891000     1.416000  
1 1 1 26 13 27 o 21.93000 0.3280000 21.67000 0.3817000 22.20000 0.5335000 -0.5372000     0.6559000 
1 1 1 26 13 29 o 13.65000 0.4164000 13.46000 0.4736000 13.84000 0.6851000 -0.3838000     0.8329000 
1 1 1 26 13 31 o 5.190000 0.9719000 5.574000 1.340000  4.806000 1.409000  0.7678000      1.944000  
1 1 1 26 13 33 o 15.53000 0.3635000 15.40000 0.4383000 15.66000 0.5799000 -0.2512000     0.7269000 
1 1 1 26 13 35 o 9.199000 0.4996000 9.034000 0.6134000 9.363000 0.7887000 -0.3289000     0.9992000 
1 1 1 26 13 37 o 6.782000 0.7773000 6.217000 0.8887000 7.346000 1.275000  -1.128000      1.555000  
1 1 1 26 13 39 o 11.22000 0.5667000 10.89000 0.6869000 11.55000 0.9015000 -0.6561000     1.133000  
1 1 1 26 13 41 o 10.61000 0.4716000 10.03000 0.6811000 11.18000 0.6524000 -1.153000      0.9431000 
1 1 1 26 13 43 o 10.41000 0.4927000 10.37000 0.6917000 10.45000 0.7017000 -0.7686000E-01 0.9854000 
1 1 1 26 13 45 o 5.154000 0.9610000 5.062000 1.421000  5.245000 1.295000  -0.1830000     1.922000  
1 1 1 26 13 47 o 10.80000 0.5869000 11.03000 0.8314000 10.56000 0.8286000 0.4688000      1.174000  
1 1 1 26 13 49 o 7.103000 0.7964000 6.811000 1.223000  7.396000 1.020000  -0.5847000     1.593000  
1 1 1 26 13 51 o 3.287000 0.9125000 4.039000 1.394000  2.535000 1.178000  1.504000       1.825000  
1 1 1 26 13 53 o 5.446000 1.047000  5.302000 1.432000  5.591000 1.529000  -0.2892000     2.095000  
1 1 1 26 13 55 o 7.067000 1.349000  5.790000 1.798000  8.345000 2.013000  -2.555000      2.699000  
1 1 1 26 14 0  o 10.12000 0.6150000 10.12000 0.6150000 10.12000 0.6150000 0.000000       0.000000  
1 1 1 26 14 2  f 13.96000 0.3628000 14.41000 0.4946000 13.51000 0.5310000 0.9063000      0.7257000 
1 1 1 26 14 4  o 21.22000 0.3112000 21.63000 0.4362000 20.81000 0.4439000 0.8221000      0.6224000 
1 1 1 26 14 6  o 7.470000 0.5770000 7.253000 0.7816000 7.688000 0.8490000 -0.4349000     1.154000  
1 1 1 26 14 8  o 13.44000 0.3744000 13.66000 0.5128000 13.22000 0.5457000 0.4409000      0.7488000 
1 1 1 26 14 10 o 46.87000 0.4500000 47.32000 0.5242000 46.41000 0.7317000 0.9120000      0.9001000 
1 1 1 26 14 12 o 55.04000 0.5236000 55.15000 0.6754000 54.93000 0.8002000 0.2258000      1.047000  
1 1 1 26 14 14 o 45.77000 0.3639000 45.87000 0.5129000 45.67000 0.5165000 0.2012000      0.7279000 
1 1 1 26 14 16 o 27.32000 0.2966000 27.08000 0.4157000 27.56000 0.4231000 -0.4818000     0.5931000 
1 1 1 26 14 18 o 37.70000 0.3261000 37.34000 0.4589000 38.06000 0.4635000 -0.7287000     0.6523000 
1 1 1 26 14 20 o 35.07000 0.3363000 35.00000 0.5045000 35.15000 0.4450000 -0.1507000     0.6727000 
1 1 1 26 14 22 o 34.15000 0.3406000 34.48000 0.5167000 33.83000 0.4438000 0.6434000      0.6811000 
1 1 1 26 14 24 o 26.49000 0.3379000 27.03000 0.4455000 25.95000 0.5080000 1.076000       0.6757000 
1 1 1 26 14 26 o 10.52000 0.5221000 10.36000 0.6370000 10.67000 0.8275000 -0.3043000     1.044000  
1 1 1 26 14 28 o 5.586000 0.8527000 4.541000 1.211000  6.631000 1.201000  -2.090000      1.705000  
1 1 1 26 14 30 o 11.23000 0.5206000 10.87000 0.7411000 11.59000 0.7314000 -0.7194000     1.041000  
1 1 1 26 14 32 o 21.11000 0.3266000 20.74000 0.3918000 21.49000 0.5226000 -0.7467000     0.6532000 
1 1 1 26 14 34 o 13.59000 0.4291000 13.71000 0.4685000 13.48000 0.7189000 0.2306000      0.8581000 
1 1 1 26 14 36 o 4.138000 0.8692000 4.698000 1.104000  3.579000 1.343000  1.120000       1.738000  
1 1 1 26 14 38 o 9.602000 0.5837000 8.520000 0.6632000 10.68000 0.9608000 -2.165000      1.167000  
1 1 1 26 14 40 o 4.371000 0.8947000 4.087000 1.306000  4.654000 1.223000  -0.5677000     1.789000  
1 1 1 26 14 42 o 8.567000 0.5445000 8.751000 0.7691000 8.383000 0.7709000 0.3674000      1.089000  
1 1 1 26 14 44 o 5.621000 0.8496000 5.265000 1.341000  5.978000 1.043000  -0.7126000     1.699000  
1 1 1 26 14 46 o 5.787000 0.8262000 7.680000 0.9590000 3.894000 1.346000  3.786000       1.652000  
1 1 1 26 14 48 o 14.87000 0.4798000 14.16000 0.7233000 15.58000 0.6307000 -1.422000      0.9597000 
1 1 1 26 14 50 o 5.646000 0.8920000 5.328000 1.261000  5.964000 1.262000  -0.6359000     1.784000  
1 1 1 26 14 52 o 6.710000 0.8879000 5.799000 1.278000  7.622000 1.233000  -1.823000      1.776000  
1 1 1 26 14 54 o 3.877000 1.040000  3.578000 1.413000  4.175000 1.528000  -0.5978000     2.081000  
1 1 1 26 15 1  o 6.840000 0.5911000 7.133000 0.7475000 6.548000 0.9160000 0.5855000      1.182000  
1 1 1 26 15 3  o 19.00000 0.3031000 19.22000 0.3951000 18.79000 0.4597000 0.4326000      0.6061000 
1 1 1 26 15 5  o 32.78000 0.3188000 32.51000 0.4198000 33.04000 0.4800000 -0.5224000     0.6376000 
1 1 1 26 15 7  o 21.69000 0.3104000 21.92000 0.3996000 21.47000 0.4752000 0.4444000      0.6209000 
1 1 1 26 15 9  o 44.57000 0.3800000 45.36000 0.5055000 43.78000 0.5677000 1.580000       0.7601000 
1 1 1 26 15 11 o 22.07000 0.4196000 22.66000 0.5100000 21.47000 0.6665000 1.195000       0.8392000 
1 1 1 26 15 13 o 15.21000 0.3128000 15.64000 0.4292000 14.78000 0.4551000 0.8543000      0.6256000 
1 1 1 26 15 15 o 27.92000 0.2927000 28.08000 0.4126000 27.76000 0.4152000 0.3169000      0.5854000 
1 1 1 26 15 17 o 27.11000 0.3068000 27.12000 0.4541000 27.10000 0.4127000 0.2847000E-01  0.6136000 
1 1 1 26 15 19 o 23.11000 0.3126000 23.33000 0.4625000 22.90000 0.4206000 0.4365000      0.6251000 
1 1 1 26 15 21 o 18.62000 0.3129000 18.59000 0.4466000 18.66000 0.4384000 -0.7016000E-01 0.6258000 
1 1 1 26 15 23 o 24.28000 0.3688000 24.22000 0.3785000 24.33000 0.6330000 -0.1100000     0.7376000 
1 1 1 26 15 25 o 17.34000 0.3512000 17.08000 0.4094000 17.59000 0.5707000 -0.5142000     0.7023000 
1 1 1 26 15 27 o 14.70000 0.4233000 14.30000 0.5706000 15.09000 0.6253000 -0.7842000     0.8465000 
1 1 1 26 15 29 o 13.26000 0.4162000 12.87000 0.5330000 13.64000 0.6394000 -0.7703000     0.8324000 
1 1 1 26 15 31 o 25.16000 0.3193000 25.09000 0.3786000 25.23000 0.5143000 -0.1386000     0.6386000 
1 1 1 26 15 33 o 16.51000 0.3896000 16.86000 0.4130000 16.16000 0.6608000 0.7004000      0.7792000 
1 1 1 26 15 35 o 5.788000 0.8631000 5.874000 1.078000  5.701000 1.348000  0.1733000      1.726000  
1 1 1 26 15 37 o 14.36000 0.4322000 14.51000 0.4510000 14.21000 0.7374000 0.2949000      0.8644000 
1 1 1 26 15 39 o 2.324000 0.7600000 2.429000 1.088000  2.220000 1.062000  0.2095000      1.520000  
1 1 1 26 15 41 o 3.730000 0.9114000 3.953000 1.295000  3.507000 1.283000  0.4463000      1.823000  
1 1 1 26 15 43 o 6.369000 0.7193000 6.556000 0.9816000 6.182000 1.052000  0.3746000      1.439000  
1 1 1 26 15 45 o 5.674000 0.8357000 5.634000 1.200000  5.715000 1.164000  -0.8115000E-01 1.671000  
1 1 1 26 15 47 o 8.664000 0.5751000 8.692000 0.8255000 8.636000 0.8011000 0.5585000E-01  1.150000  
1 1 1 26 15 49 o 20.08000 0.4088000 20.04000 0.6129000 20.12000 0.5413000 -0.7845000E-01 0.8177000 
1 1 1 26 15 51 o 6.330000 0.9326000 7.059000 1.075000  5.600000 1.524000  1.458000       1.865000  
1 1 1 26 15 53 o 3.725000 1.028000  3.989000 1.448000  3.461000 1.459000  0.5282000      2.055000  
1 1 1 26 16 0  o 7.153000 0.7682000 7.153000 0.7682000 7.153000 0.7682000 0.000000       0.000000  
1 1 1 26 16 2  o 7.889000 0.5056000 8.515000 0.6403000 7.264000 0.7825000 1.251000       1.011000  
1 1 1 26 16 4  o 5.206000 0.7699000 5.543000 1.047000  4.869000 1.129000  0.6745000      1.540000  
1 1 1 26 16 6  o 17.94000 0.2985000 17.90000 0.4231000 17.99000 0.4211000 -0.9385000E-01 0.5970000 
1 1 1 26 16 8  o 24.67000 0.3475000 24.80000 0.3924000 24.55000 0.5737000 0.2442000      0.6951000 
1 1 1 26 16 10 o 20.02000 0.4464000 21.06000 0.3954000 18.97000 0.8005000 2.097000       0.8928000 
1 1 1 26 16 12 o 9.755000 0.5105000 10.43000 0.6151000 9.080000 0.8148000 1.351000       1.021000  
1 1 1 26 16 14 o 20.24000 0.3476000 20.08000 0.4476000 20.40000 0.5319000 -0.3159000     0.6951000 
1 1 1 26 16 16 o 25.90000 0.3458000 25.77000 0.4544000 26.04000 0.5213000 -0.2675000     0.6916000 
1 1 1 26 16 18 o 9.709000 0.5478000 10.10000 0.5897000 9.316000 0.9233000 0.7870000      1.096000  
1 1 1 26 16 20 f 35.67000 0.3517000 35.32000 0.4514000 36.01000 0.5395000 -0.6854000     0.7034000 
1 1 1 26 16 22 o 32.35000 0.3344000 32.83000 0.4241000 31.87000 0.5170000 0.9620000      0.6687000 
1 1 1 26 16 24 o 18.37000 0.3971000 17.87000 0.4125000 18.88000 0.6786000 -1.005000      0.7941000 
1 1 1 26 16 26 o 28.97000 0.4276000 28.73000 0.6772000 29.22000 0.5223000 -0.4926000     0.8552000 
1 1 1 26 16 28 o 4.024000 0.9479000 3.906000 1.243000  4.143000 1.432000  -0.2373000     1.896000  
1 1 1 26 16 30 o 16.81000 0.3478000 16.51000 0.4014000 17.10000 0.5680000 -0.5940000     0.6955000 
1 1 1 26 16 32 o 17.37000 0.3856000 17.81000 0.3960000 16.93000 0.6617000 0.8868000      0.7711000 
1 1 1 26 16 34 o 13.02000 0.4077000 12.74000 0.4761000 13.31000 0.6619000 -0.5615000     0.8154000 
1 1 1 26 16 36 o 6.303000 1.105000  5.577000 1.091000  7.030000 1.923000  -1.453000      2.211000  
1 1 1 26 16 38 o 8.846000 0.5116000 8.458000 0.6877000 9.234000 0.7577000 -0.7759000     1.023000  
1 1 1 26 16 40 f 11.49000 0.4494000 11.31000 0.5968000 11.67000 0.6719000 -0.3568000     0.8987000 
1 1 1 26 16 42 o 10.38000 0.4698000 10.79000 0.6527000 9.978000 0.6759000 0.8085000      0.9397000 
1 1 1 26 16 44 o 4.056000 0.9663000 4.400000 1.384000  3.712000 1.349000  0.6873000      1.933000  
1 1 1 26 16 46 o 6.348000 0.8426000 7.109000 0.9414000 5.586000 1.398000  1.523000       1.685000  
1 1 1 26 16 48 f 5.173000 0.9923000 5.588000 1.297000  4.758000 1.502000  0.8302000      1.985000  
1 1 1 26 16 50 o 3.720000 1.017000  4.410000 1.540000  3.030000 1.329000  1.379000       2.034000  
1 1 1 26 16 52 f 4.401000 0.9566000 3.403000 1.362000  5.400000 1.344000  -1.997000      1.913000  
1 1 1 26 16 54 o 4.572000 1.182000  4.932000 1.690000  4.212000 1.653000  0.7193000      2.364000  
1 1 1 26 17 1  o 13.76000 0.3255000 13.39000 0.4580000 14.13000 0.4628000 -0.7378000     0.6511000 
1 1 1 26 17 3  o 29.80000 0.2886000 30.27000 0.4045000 29.33000 0.4119000 0.9463000      0.5773000 
1 1 1 26 17 5  o 16.17000 0.3161000 16.35000 0.4229000 15.98000 0.4700000 0.3723000      0.6322000 
1 1 1 26 17 7  o 35.72000 0.3783000 35.91000 0.4364000 35.53000 0.6180000 0.3827000      0.7565000 
1 1 1 26 17 9  o 46.89000 0.4661000 47.14000 0.5161000 46.64000 0.7764000 0.4968000      0.9322000 
1 1 1 26 17 11 o 26.03000 0.2948000 26.15000 0.4342000 25.92000 0.3990000 0.2340000      0.5897000 
1 1 1 26 17 13 o 26.58000 0.2959000 26.56000 0.4319000 26.61000 0.4047000 -0.4894000E-01 0.5919000 
1 1 1 26 17 15 o 63.73000 0.6009000 63.35000 0.7496000 64.10000 0.9394000 -0.7475000     1.202000  
1 1 1 26 17 17 o 43.60000 0.3527000 43.15000 0.4980000 44.06000 0.4995000 -0.9084000     0.7053000 
1 1 1 26 17 19 o 34.17000 0.3109000 33.90000 0.4350000 34.45000 0.4442000 -0.5494000     0.6217000 
1 1 1 26 17 21 o 42.07000 0.3802000 41.47000 0.4906000 42.66000 0.5811000 -1.188000      0.7605000 
1 1 1 26 17 23 o 46.15000 0.4644000 45.85000 0.5264000 46.45000 0.7653000 -0.5999000     0.9288000 
1 1 1 26 17 25 o 20.09000 0.3324000 19.70000 0.3997000 20.47000 0.5313000 -0.7721000     0.6649000 
1 1 1 26 17 27 o 7.037000 0.7349000 7.304000 0.8475000 6.770000 1.201000  0.5337000      1.470000  
1 1 1 26 17 29 o 5.389000 0.8247000 5.995000 0.8469000 4.784000 1.415000  1.210000       1.649000  
1 1 1 26 17 31 o 8.556000 0.5602000 8.659000 0.5962000 8.453000 0.9485000 0.2066000      1.120000  
1 1 1 26 17 33 o 16.09000 0.3749000 16.28000 0.4190000 15.90000 0.6218000 0.3754000      0.7498000 
1 1 1 26 17 35 o 14.86000 0.3752000 15.42000 0.4308000 14.30000 0.6145000 1.117000       0.7504000 
1 1 1 26 17 37 o 3.730000 0.9656000 3.760000 1.355000  3.701000 1.376000  0.5922000E-01  1.931000  
1 1 1 26 17 39 o 9.814000 0.5081000 9.926000 0.6366000 9.701000 0.7922000 0.2250000      1.016000  
1 1 1 26 17 41 o 11.59000 0.4332000 11.01000 0.6423000 12.16000 0.5813000 -1.147000      0.8663000 
1 1 1 26 17 43 o 11.93000 0.4591000 12.38000 0.6725000 11.48000 0.6251000 0.8936000      0.9181000 
1 1 1 26 17 45 o 14.15000 0.3931000 14.42000 0.5302000 13.88000 0.5804000 0.5420000      0.7861000 
1 1 1 26 17 47 o 4.190000 0.9813000 3.316000 1.316000  5.063000 1.456000  -1.748000      1.963000  
1 1 1 26 17 49 o 4.945000 1.044000  4.009000 1.443000  5.881000 1.509000  -1.872000      2.087000  
1 1 1 26 17 51 o 9.856000 0.6389000 8.636000 1.051000  11.08000 0.7264000 -2.441000      1.278000  
1 1 1 26 17 53 o 3.100000 0.9452000 2.845000 1.329000  3.355000 1.345000  -0.5094000     1.890000  
1 1 1 26 18 0  o 24.61000 0.4264000 24.61000 0.4264000 24.61000 0.4264000 0.000000       0.000000  
1 1 1 26 18 2  o 45.05000 0.4025000 44.89000 0.5640000 45.20000 0.5743000 -0.3134000     0.8049000 
1 1 1 26 18 4  o 42.68000 0.3822000 42.45000 0.5364000 42.92000 0.5446000 -0.4729000     0.7644000 
1 1 1 26 18 6  f 26.41000 0.3268000 27.17000 0.4334000 25.65000 0.4891000 1.525000       0.6535000 
1 1 1 26 18 8  o 24.98000 0.3251000 25.13000 0.4294000 24.83000 0.4883000 0.2984000      0.6502000 
1 1 1 26 18 10 o 28.94000 0.3056000 28.72000 0.4487000 29.16000 0.4150000 -0.4457000     0.6112000 
1 1 1 26 18 12 o 48.09000 0.4013000 48.06000 0.6044000 48.13000 0.5280000 -0.7859000E-01 0.8026000 
1 1 1 26 18 14 o 40.35000 0.3358000 39.77000 0.4690000 40.93000 0.4808000 -1.162000      0.6716000 
1 1 1 26 18 16 o 36.20000 0.3182000 36.42000 0.4522000 35.98000 0.4478000 0.4435000      0.6364000 
1 1 1 26 18 18 o 13.09000 0.3589000 12.78000 0.5124000 13.41000 0.5026000 -0.6235000     0.7178000 
1 1 1 26 18 20 o 11.27000 0.4443000 11.01000 0.5344000 11.53000 0.7100000 -0.5143000     0.8887000 
1 1 1 26 18 22 o 19.95000 0.4443000 19.56000 0.7128000 20.34000 0.5307000 -0.7822000     0.8886000 
1 1 1 26 18 24 f 26.96000 0.3860000 27.87000 0.4235000 26.06000 0.6454000 1.808000       0.7719000 
1 1 1 26 18 26 o 5.193000 0.8648000 4.220000 1.179000  6.166000 1.265000  -1.945000      1.730000  
1 1 1 26 18 28 f 29.17000 0.3159000 29.39000 0.3723000 28.95000 0.5104000 0.4396000      0.6318000 
1 1 1 26 18 30 o 30.59000 0.3229000 31.06000 0.3728000 30.12000 0.5272000 0.9368000      0.6457000 
1 1 1 26 18 32 o 31.07000 0.3828000 30.97000 0.3772000 31.18000 0.6662000 -0.2110000     0.7656000 
1 1 1 26 18 34 o 30.91000 0.3270000 31.00000 0.3881000 30.82000 0.5264000 0.1754000      0.6540000 
1 1 1 26 18 36 o 12.98000 0.4631000 12.08000 0.4882000 13.87000 0.7871000 -1.787000      0.9263000 
1 1 1 26 18 38 o 14.16000 0.3994000 13.97000 0.5485000 14.35000 0.5808000 -0.3763000     0.7988000 
1 1 1 26 18 40 o 25.51000 0.3236000 25.87000 0.3980000 25.14000 0.5104000 0.7279000      0.6473000 
1 1 1 26 18 42 o 14.96000 0.3630000 14.57000 0.5129000 15.36000 0.5138000 -0.7927000     0.7259000 
1 1 1 26 18 44 o 10.06000 0.4774000 10.06000 0.6672000 10.07000 0.6831000 -0.1546000E-01 0.9548000 
1 1 1 26 18 46 o 7.280000 0.7072000 7.569000 0.8942000 6.991000 1.096000  0.5778000      1.414000  
1 1 1 26 18 48 o 13.28000 0.4963000 13.26000 0.5755000 13.29000 0.8088000 -0.2832000E-01 0.9926000 
1 1 1 26 18 50 o 4.092000 1.016000  4.477000 1.432000  3.708000 1.441000  0.7691000      2.032000  
1 1 1 26 18 52 o 10.81000 0.5179000 10.44000 0.7911000 11.18000 0.6688000 -0.7348000     1.036000  
1 1 1 26 19 1  o 37.35000 0.3317000 37.97000 0.4977000 36.73000 0.4385000 1.245000       0.6634000 
1 1 1 26 19 3  o 27.87000 0.3226000 28.03000 0.4987000 27.72000 0.4093000 0.3063000      0.6451000 
1 1 1 26 19 5  o 38.50000 0.3701000 39.01000 0.5105000 37.99000 0.5361000 1.026000       0.7403000 
1 1 1 26 19 7  o 40.23000 0.3524000 40.47000 0.5279000 39.99000 0.4668000 0.4808000      0.7047000 
1 1 1 26 19 9  o 36.69000 0.3473000 36.73000 0.4430000 36.65000 0.5351000 0.8017000E-01  0.6947000 
1 1 1 26 19 11 o 37.71000 0.3562000 37.70000 0.5462000 37.71000 0.4573000 -0.1094000E-01 0.7123000 
1 1 1 26 19 13 o 15.57000 0.4717000 15.57000 0.7762000 15.57000 0.5362000 0.1770000E-02  0.9434000 
1 1 1 26 19 15 o 67.91000 0.5347000 67.65000 0.8102000 68.16000 0.6980000 -0.5063000     1.069000  
1 1 1 26 19 17 o 29.54000 0.3384000 29.76000 0.5337000 29.32000 0.4163000 0.4365000      0.6768000 
1 1 1 26 19 19 o 36.20000 0.5622000 35.39000 0.9075000 37.01000 0.6639000 -1.627000      1.124000  
1 1 1 26 19 21 o 39.72000 0.3726000 39.45000 0.4806000 39.98000 0.5694000 -0.5301000     0.7451000 
1 1 1 26 19 23 o 22.06000 0.3769000 21.87000 0.3862000 22.25000 0.6474000 -0.3834000     0.7538000 
1 1 1 26 19 25 o 23.09000 0.3225000 22.21000 0.3669000 23.97000 0.5305000 -1.753000      0.6450000 
1 1 1 26 19 27 o 23.31000 0.3891000 23.44000 0.5902000 23.19000 0.5074000 0.2430000      0.7783000 
1 1 1 26 19 29 o 7.814000 0.5655000 7.578000 0.6563000 8.051000 0.9211000 -0.4725000     1.131000  
1 1 1 26 19 31 o 5.379000 0.9561000 5.897000 0.8095000 4.860000 1.732000  1.037000       1.912000  
1 1 1 26 19 33 o 10.65000 0.4547000 10.93000 0.5034000 10.37000 0.7575000 0.5603000      0.9095000 
1 1 1 26 19 35 o 12.04000 0.4193000 11.77000 0.5422000 12.32000 0.6398000 -0.5425000     0.8386000 
1 1 1 26 19 37 o 10.89000 0.4519000 10.92000 0.5630000 10.85000 0.7070000 0.7588000E-01  0.9038000 
1 1 1 26 19 39 o 5.534000 0.8717000 5.989000 1.139000  5.078000 1.320000  0.9110000      1.743000  
1 1 1 26 19 41 f 3.363000 0.8707000 4.182000 1.297000  2.543000 1.162000  1.639000       1.741000  
1 1 1 26 19 43 o 8.201000 0.5800000 8.316000 0.8117000 8.086000 0.8288000 0.2304000      1.160000  
1 1 1 26 19 45 o 7.317000 0.7124000 6.322000 1.030000  8.313000 0.9842000 -1.991000      1.425000  
1 1 1 26 19 47 o 5.668000 1.016000  6.179000 1.061000  5.157000 1.732000  1.022000       2.031000  
1 1 1 26 19 49 o 10.13000 0.6275000 9.511000 0.8999000 10.74000 0.8748000 -1.232000      1.255000  
1 1 1 26 19 51 o 7.756000 0.7338000 7.262000 1.066000  8.251000 1.009000  -0.9895000     1.468000  
1 1 1 26 19 53 o 4.309000 1.193000  4.885000 1.793000  3.733000 1.574000  1.152000       2.386000  
1 1 1 26 20 0  o 24.17000 0.4749000 24.17000 0.4749000 24.17000 0.4749000 0.000000       0.000000  
1 1 1 26 20 2  o 43.92000 0.3456000 43.70000 0.4858000 44.15000 0.4917000 -0.4515000     0.6912000 
1 1 1 26 20 4  o 57.24000 0.4608000 58.02000 0.6073000 56.47000 0.6932000 1.557000       0.9216000 
1 1 1 26 20 6  o 39.86000 0.3287000 39.55000 0.4611000 40.17000 0.4686000 -0.6251000     0.6574000 
1 1 1 26 20 8  o 15.60000 0.3546000 16.00000 0.5525000 15.19000 0.4447000 0.8153000      0.7092000 
1 1 1 26 20 10 o 13.51000 0.4216000 13.71000 0.6570000 13.31000 0.5285000 0.3979000      0.8432000 
1 1 1 26 20 12 o 4.976000 0.7829000 4.718000 1.158000  5.235000 1.054000  -0.5163000     1.566000  
1 1 1 26 20 14 o 20.69000 0.2869000 20.80000 0.4135000 20.58000 0.3979000 0.2234000      0.5738000 
1 1 1 26 20 16 o 50.44000 0.3884000 50.24000 0.5484000 50.64000 0.5501000 -0.3981000     0.7767000 
1 1 1 26 20 18 o 27.68000 0.3658000 27.32000 0.5221000 28.05000 0.5125000 -0.7309000     0.7316000 
1 1 1 26 20 20 o 41.54000 0.3586000 42.17000 0.4323000 40.90000 0.5724000 1.273000       0.7173000 
1 1 1 26 20 22 o 12.45000 0.4264000 11.63000 0.5424000 13.28000 0.6582000 -1.650000      0.8529000 
1 1 1 26 20 24 o 28.81000 0.3751000 28.70000 0.3662000 28.92000 0.6548000 -0.2218000     0.7503000 
1 1 1 26 20 26 o 18.73000 0.3335000 18.41000 0.3980000 19.05000 0.5353000 -0.6453000     0.6671000 
1 1 1 26 20 28 f 7.097000 0.6837000 6.523000 0.9641000 7.672000 0.9697000 -1.149000      1.367000  
1 1 1 26 20 30 o 6.242000 0.8959000 5.958000 0.7967000 6.525000 1.605000  -0.5670000     1.792000  
1 1 1 26 20 32 o 18.71000 0.3282000 18.47000 0.3622000 18.96000 0.5474000 -0.4936000     0.6564000 
1 1 1 26 20 34 o 12.67000 0.4033000 12.66000 0.4756000 12.69000 0.6516000 -0.2477000E-01 0.8067000 
1 1 1 26 20 36 o 4.199000 0.9440000 4.246000 1.140000  4.151000 1.505000  0.9561000E-01  1.888000  
1 1 1 26 20 38 o 3.398000 0.8878000 2.920000 1.157000  3.877000 1.347000  -0.9570000     1.776000  
1 1 1 26 20 40 o 5.324000 0.8888000 5.333000 1.236000  5.315000 1.278000  0.1755000E-01  1.778000  
1 1 1 26 20 42 o 12.72000 0.4185000 12.95000 0.5857000 12.49000 0.5978000 0.4640000      0.8369000 
1 1 1 26 20 44 f 16.12000 0.3909000 15.88000 0.4864000 16.35000 0.6121000 -0.4719000     0.7818000 
1 1 1 26 20 46 o 4.003000 0.9910000 3.666000 1.314000  4.340000 1.484000  -0.6740000     1.982000  
1 1 1 26 20 48 o 4.210000 1.029000  3.816000 1.352000  4.603000 1.551000  -0.7872000     2.058000  
1 1 1 26 20 50 o 8.500000 0.6492000 7.646000 0.9549000 9.355000 0.8798000 -1.708000      1.298000  
1 1 1 26 20 52 o 6.248000 0.8835000 7.160000 1.136000  5.335000 1.354000  1.825000       1.767000  
1 1 1 26 21 1  o 13.21000 0.3211000 13.03000 0.4529000 13.40000 0.4554000 -0.3759000     0.6422000 
1 1 1 26 21 3  o 9.506000 0.4727000 9.006000 0.5962000 10.01000 0.7336000 -1.001000      0.9453000 
1 1 1 26 21 5  o 16.54000 0.3328000 16.56000 0.4101000 16.52000 0.5244000 0.4092000E-01  0.6657000 
1 1 1 26 21 7  o 20.70000 0.3559000 19.94000 0.5151000 21.45000 0.4914000 -1.509000      0.7119000 
1 1 1 26 21 9  o 13.49000 0.3534000 13.79000 0.4469000 13.19000 0.5476000 0.5970000      0.7068000 
1 1 1 26 21 11 o 20.28000 0.2833000 20.48000 0.3925000 20.08000 0.4085000 0.4021000      0.5665000 
1 1 1 26 21 13 o 17.51000 0.3071000 17.95000 0.4511000 17.07000 0.4170000 0.8769000      0.6143000 
1 1 1 26 21 15 o 19.62000 0.3858000 19.79000 0.5700000 19.46000 0.5200000 0.3303000      0.7716000 
1 1 1 26 21 17 o 17.68000 0.3231000 17.62000 0.3527000 17.74000 0.5414000 -0.1224000     0.6461000 
1 1 1 26 21 19 f 36.15000 0.3361000 36.62000 0.3946000 35.67000 0.5442000 0.9439000      0.6722000 
1 1 1 26 21 21 o 13.90000 0.3751000 14.12000 0.3697000 13.67000 0.6528000 0.4460000      0.7502000 
1 1 1 26 21 23 o 15.32000 0.4307000 15.77000 0.4766000 14.87000 0.7176000 0.8967000      0.8614000 
1 1 1 26 21 25 f 12.56000 0.4468000 12.50000 0.5804000 12.62000 0.6793000 -0.1178000     0.8935000 
1 1 1 26 21 27 o 7.543000 0.5754000 6.889000 0.7055000 8.197000 0.9092000 -1.308000      1.151000  
1 1 1 26 21 29 o 12.11000 0.6070000 12.30000 0.5707000 11.91000 1.071000  0.3925000      1.214000  
1 1 1 26 21 31 o 7.113000 0.6514000 6.985000 0.7057000 7.241000 1.095000  -0.2563000     1.303000  
1 1 1 26 21 33 o 4.331000 0.8736000 4.389000 1.084000  4.274000 1.370000  0.1154000      1.747000  
1 1 1 26 21 35 o 7.663000 0.5762000 7.486000 0.6403000 7.840000 0.9582000 -0.3543000     1.152000  
1 1 1 26 21 37 o 7.196000 0.6352000 7.245000 0.7218000 7.147000 1.045000  0.9863000E-01  1.270000  
1 1 1 26 21 39 o 3.555000 0.8918000 3.613000 1.185000  3.497000 1.333000  0.1162000      1.784000  
1 1 1 26 21 41 f 8.532000 0.6017000 8.293000 0.8381000 8.771000 0.8637000 -0.4780000     1.203000  
1 1 1 26 21 43 o 10.12000 0.4994000 10.33000 0.6670000 9.909000 0.7433000 0.4218000      0.9987000 
1 1 1 26 21 45 o 8.264000 0.5536000 8.426000 0.7795000 8.102000 0.7864000 0.3240000      1.107000  
1 1 1 26 21 47 o 4.363000 1.014000  3.790000 1.339000  4.936000 1.524000  -1.145000      2.028000  
1 1 1 26 21 49 o 10.28000 0.5635000 9.641000 0.8540000 10.91000 0.7353000 -1.273000      1.127000  
1 1 1 26 21 51 o 4.260000 0.9978000 4.912000 1.464000  3.607000 1.356000  1.306000       1.996000  
1 1 1 26 22 0  o 11.54000 0.6236000 11.54000 0.6236000 11.54000 0.6236000 0.000000       0.000000  
1 1 1 26 22 2  o 15.40000 0.3324000 15.70000 0.4041000 15.09000 0.5279000 0.6161000      0.6648000 
1 1 1 26 22 4  f 10.96000 0.3712000 10.93000 0.5287000 10.98000 0.5211000 -0.5040000E-01 0.7423000 
1 1 1 26 22 6  o 25.37000 0.3169000 24.93000 0.4993000 25.82000 0.3904000 -0.8934000     0.6337000 
1 1 1 26 22 8  o 30.82000 0.2924000 30.78000 0.4128000 30.86000 0.4143000 -0.7715000E-01 0.5849000 
1 1 1 26 22 10 o 29.26000 0.3167000 29.63000 0.4070000 28.88000 0.4853000 0.7535000      0.6334000 
1 1 1 26 22 12 o 27.55000 0.2889000 27.22000 0.4005000 27.89000 0.4165000 -0.6758000     0.5778000 
1 1 1 26 22 14 f 23.57000 0.3296000 23.28000 0.3907000 23.85000 0.5311000 -0.5707000     0.6593000 
1 1 1 26 22 16 f 21.19000 0.3357000 20.90000 0.4138000 21.47000 0.5288000 -0.5741000     0.6715000 
1 1 1 26 22 18 o 21.76000 0.3011000 21.85000 0.3241000 21.67000 0.5075000 0.1839000      0.6021000 
1 1 1 26 22 20 o 7.053000 0.5888000 6.778000 0.5887000 7.329000 1.020000  -0.5507000     1.178000  
1 1 1 26 22 22 o 18.09000 0.3479000 17.42000 0.4156000 18.77000 0.5580000 -1.358000      0.6958000 
1 1 1 26 22 24 o 28.59000 0.4028000 28.44000 0.4658000 28.75000 0.6573000 -0.3106000     0.8056000 
1 1 1 26 22 26 o 24.86000 0.3088000 24.74000 0.3627000 24.98000 0.4998000 -0.2403000     0.6175000 
1 1 1 26 22 28 o 7.377000 0.8977000 7.530000 0.5597000 7.224000 1.706000  0.3063000      1.795000  
1 1 1 26 22 30 o 13.13000 0.3754000 12.87000 0.4100000 13.38000 0.6289000 -0.5127000     0.7507000 
1 1 1 26 22 32 o 17.81000 0.3308000 17.93000 0.3796000 17.70000 0.5419000 0.2250000      0.6616000 
1 1 1 26 22 34 o 4.174000 0.8337000 4.686000 0.9723000 3.662000 1.355000  1.024000       1.667000  
1 1 1 26 22 36 o 4.917000 0.8996000 5.134000 0.8962000 4.700000 1.560000  0.4345000      1.799000  
1 1 1 26 22 38 o 4.880000 0.8429000 5.967000 0.9813000 3.794000 1.371000  2.173000       1.686000  
1 1 1 26 22 40 o 10.07000 0.4692000 9.708000 0.5958000 10.44000 0.7249000 -0.7307000     0.9384000 
1 1 1 26 22 42 o 13.32000 0.4260000 13.44000 0.6361000 13.20000 0.5668000 0.2324000      0.8520000 
1 1 1 26 22 44 o 7.197000 0.8902000 7.937000 0.8336000 6.458000 1.573000  1.479000       1.780000  
1 1 1 26 22 46 f 4.261000 0.9391000 4.842000 1.237000  3.680000 1.413000  1.162000       1.878000  
1 1 1 26 22 48 o 3.295000 0.9342000 3.229000 1.299000  3.361000 1.343000  -0.1319000     1.868000  
1 1 1 26 22 50 o 3.290000 0.8862000 2.699000 1.201000  3.881000 1.303000  -1.181000      1.772000  
1 1 1 26 23 1  o 21.76000 0.2992000 21.92000 0.3753000 21.60000 0.4660000 0.3280000      0.5983000 
1 1 1 26 23 3  o 11.89000 0.3592000 12.27000 0.4915000 11.51000 0.5239000 0.7632000      0.7184000 
1 1 1 26 23 5  o 12.04000 0.4095000 11.68000 0.6729000 12.40000 0.4668000 -0.7246000     0.8190000 
1 1 1 26 23 7  o 22.70000 0.2741000 22.84000 0.3783000 22.57000 0.3967000 0.2771000      0.5481000 
1 1 1 26 23 9  o 39.41000 0.3266000 39.59000 0.4644000 39.22000 0.4593000 0.3697000      0.6532000 
1 1 1 26 23 11 o 23.36000 0.3719000 23.80000 0.5196000 22.93000 0.5323000 0.8750000      0.7438000 
1 1 1 26 23 13 o 26.35000 0.3284000 26.22000 0.4414000 26.47000 0.4863000 -0.2486000     0.6568000 
1 1 1 26 23 15 o 24.62000 0.3763000 24.88000 0.5321000 24.36000 0.5324000 0.5169000      0.7527000 
1 1 1 26 23 17 o 9.814000 0.6231000 10.79000 0.8202000 8.842000 0.9382000 1.944000       1.246000  
1 1 1 26 23 19 o 25.50000 0.3624000 25.51000 0.5176000 25.49000 0.5075000 0.1977000E-01  0.7249000 
1 1 1 26 23 21 o 33.50000 0.3268000 33.40000 0.3915000 33.60000 0.5232000 -0.1947000     0.6535000 
1 1 1 26 23 23 o 7.261000 0.6360000 7.938000 0.4875000 6.583000 1.175000  1.355000       1.272000  
1 1 1 26 23 25 o 14.32000 0.5973000 14.53000 0.3410000 14.12000 1.145000  0.4148000      1.195000  
1 1 1 26 23 27 o 33.80000 0.4884000 33.71000 0.4496000 33.89000 0.8672000 -0.1730000     0.9768000 
1 1 1 26 23 29 o 29.36000 0.3286000 29.68000 0.4230000 29.03000 0.5029000 0.6459000      0.6572000 
1 1 1 26 23 31 o 22.49000 0.3150000 22.96000 0.3759000 22.02000 0.5056000 0.9467000      0.6300000 
1 1 1 26 23 33 o 7.656000 0.6102000 7.897000 0.7097000 7.415000 0.9928000 0.4816000      1.220000  
1 1 1 26 23 35 o 5.367000 0.7808000 5.238000 0.8985000 5.496000 1.277000  -0.2571000     1.562000  
1 1 1 26 23 37 o 6.000000 0.7134000 5.608000 0.8545000 6.391000 1.142000  -0.7823000     1.427000  
1 1 1 26 23 39 o 8.564000 0.5324000 8.396000 0.6610000 8.731000 0.8347000 -0.3342000     1.065000  
1 1 1 26 23 41 o 6.680000 0.6944000 6.934000 0.8231000 6.425000 1.119000  0.5094000      1.389000  
1 1 1 26 23 43 o 7.193000 0.9312000 7.369000 1.087000  7.017000 1.512000  0.3522000      1.862000  
1 1 1 26 23 45 o 6.595000 0.7701000 7.053000 0.9500000 6.137000 1.212000  0.9168000      1.540000  
1 1 1 26 23 47 o 4.156000 0.9484000 4.471000 1.330000  3.842000 1.353000  0.6292000      1.897000  
1 1 1 26 23 49 o 9.273000 0.5860000 9.321000 0.8077000 9.225000 0.8492000 0.9661000E-01  1.172000  
1 1 1 26 23 51 f 5.883000 1.061000  5.172000 1.663000  6.594000 1.319000  -1.422000      2.123000  
1 1 1 26 24 0  o 35.44000 0.4297000 35.44000 0.4297000 35.44000 0.4297000 0.000000       0.000000  
1 1 1 26 24 2  o 17.36000 0.3219000 17.55000 0.4098000 17.17000 0.4964000 0.3815000      0.6437000 
1 1 1 26 24 4  o 23.93000 0.3112000 23.63000 0.4879000 24.23000 0.3865000 -0.5997000     0.6224000 
1 1 1 26 24 6  o 19.37000 0.2764000 19.86000 0.3848000 18.88000 0.3969000 0.9894000      0.5528000 
1 1 1 26 24 8  o 6.482000 0.8720000 5.235000 1.431000  7.730000 0.9971000 -2.495000      1.744000  
1 1 1 26 24 10 o 19.14000 0.4152000 18.71000 0.3751000 19.57000 0.7409000 -0.8625000     0.8305000 
1 1 1 26 24 12 o 18.97000 0.3942000 18.89000 0.5647000 19.04000 0.5503000 -0.1542000     0.7885000 
1 1 1 26 24 14 o 47.32000 0.4996000 47.22000 0.7705000 47.42000 0.6362000 -0.1970000     0.9992000 
1 1 1 26 24 16 o 50.72000 0.6599000 50.63000 0.6473000 50.81000 1.150000  -0.1753000     1.320000  
1 1 1 26 24 18 o 19.95000 0.3871000 19.53000 0.5480000 20.38000 0.5468000 -0.8501000     0.7741000 
1 1 1 26 24 20 o 38.02000 0.4429000 38.69000 0.6895000 37.35000 0.5561000 1.347000       0.8858000 
1 1 1 26 24 22 o 23.16000 0.4060000 22.12000 0.6356000 24.20000 0.5054000 -2.079000      0.8120000 
1 1 1 26 24 24 o 46.14000 0.6313000 46.78000 0.6302000 45.51000 1.094000  1.273000       1.263000  
1 1 1 26 24 26 o 27.17000 0.3713000 26.98000 0.4372000 27.35000 0.6003000 -0.3705000     0.7426000 
1 1 1 26 24 28 o 3.116000 0.8265000 2.897000 0.9844000 3.336000 1.328000  -0.4395000     1.653000  
1 1 1 26 24 30 o 12.30000 0.3645000 12.29000 0.3841000 12.31000 0.6196000 -0.1980000E-01 0.7290000 
1 1 1 26 24 32 o 6.947000 0.5784000 6.488000 0.6718000 7.406000 0.9417000 -0.9178000     1.157000  
1 1 1 26 24 34 o 5.419000 0.7822000 5.156000 1.003000  5.682000 1.201000  -0.5269000     1.564000  
1 1 1 26 24 36 o 5.036000 0.9402000 4.246000 1.222000  5.825000 1.429000  -1.579000      1.880000  
1 1 1 26 24 38 o 18.50000 0.3457000 18.57000 0.4154000 18.42000 0.5528000 0.1505000      0.6915000 
1 1 1 26 24 40 o 5.589000 0.8212000 6.223000 0.9131000 4.955000 1.365000  1.268000       1.642000  
1 1 1 26 24 42 o 6.032000 1.068000  5.798000 0.9793000 6.266000 1.898000  -0.4683000     2.136000  
1 1 1 26 24 44 o 3.502000 0.9679000 3.071000 1.347000  3.933000 1.390000  -0.8614000     1.936000  
1 1 1 26 24 46 o 9.686000 0.5667000 9.294000 0.7530000 10.08000 0.8473000 -0.7837000     1.133000  
1 1 1 26 24 48 o 8.042000 0.6653000 8.043000 0.9374000 8.040000 0.9444000 0.2281000E-02  1.331000  
1 1 1 26 24 50 o 10.79000 0.5700000 12.27000 0.8272000 9.300000 0.7846000 2.971000       1.140000  
1 1 1 26 25 1  o 18.87000 0.2738000 18.30000 0.3902000 19.45000 0.3842000 -1.145000      0.5476000 
1 1 1 26 25 3  o 11.38000 0.4669000 11.10000 0.7640000 11.66000 0.5371000 -0.5629000     0.9339000 
1 1 1 26 25 5  f 9.175000 0.3870000 9.280000 0.5568000 9.069000 0.5375000 0.2107000      0.7739000 
1 1 1 26 25 7  o 24.15000 0.3134000 23.62000 0.3847000 24.69000 0.4949000 -1.066000      0.6269000 
1 1 1 26 25 9  o 14.05000 0.2976000 13.70000 0.4074000 14.41000 0.4338000 -0.7070000     0.5951000 
1 1 1 26 25 11 o 35.08000 0.3773000 34.70000 0.5281000 35.46000 0.5389000 -0.7589000     0.7545000 
1 1 1 26 25 13 o 30.31000 0.4238000 29.38000 0.6558000 31.25000 0.5368000 -1.871000      0.8475000 
1 1 1 26 25 15 o 38.46000 0.3996000 37.74000 0.5575000 39.18000 0.5726000 -1.443000      0.7992000 
1 1 1 26 25 17 o 28.03000 0.3973000 27.73000 0.5147000 28.32000 0.6054000 -0.5888000     0.7946000 
1 1 1 26 25 19 o 21.60000 0.4179000 22.24000 0.6413000 20.96000 0.5361000 1.285000       0.8359000 
1 1 1 26 25 21 o 11.31000 0.5840000 11.00000 0.7994000 11.62000 0.8515000 -0.6153000     1.168000  
1 1 1 26 25 23 o 7.009000 1.056000  6.165000 1.364000  7.853000 1.613000  -1.688000      2.112000  
1 1 1 26 25 25 o 15.53000 0.4541000 15.70000 0.6472000 15.37000 0.6373000 0.3303000      0.9082000 
1 1 1 26 25 27 o 3.535000 1.014000  3.937000 1.565000  3.133000 1.288000  0.8042000      2.027000  
1 1 1 26 25 29 o 3.161000 0.8500000 2.342000 0.9447000 3.980000 1.413000  -1.638000      1.700000  
1 1 1 26 25 31 o 5.995000 0.7983000 5.955000 0.7082000 6.034000 1.431000  -0.7896000E-01 1.597000  
1 1 1 26 25 33 o 5.144000 0.8801000 5.556000 1.091000  4.732000 1.381000  0.8236000      1.760000  
1 1 1 26 25 35 o 12.48000 0.4811000 12.17000 0.5474000 12.80000 0.7914000 -0.6261000     0.9622000 
1 1 1 26 25 37 o 11.78000 0.4074000 11.96000 0.4680000 11.60000 0.6670000 0.3625000      0.8148000 
1 1 1 26 25 39 o 4.764000 0.9008000 4.119000 1.225000  5.409000 1.321000  -1.291000      1.802000  
1 1 1 26 25 41 o 11.95000 0.4905000 11.84000 0.5166000 12.06000 0.8340000 -0.2164000     0.9810000 
1 1 1 26 25 43 o 11.33000 0.4675000 11.58000 0.6423000 11.07000 0.6794000 0.5092000      0.9350000 
1 1 1 26 25 45 o 4.259000 1.035000  4.942000 1.540000  3.577000 1.383000  1.365000       2.070000  
1 1 1 26 25 47 o 3.067000 0.8932000 3.563000 1.351000  2.570000 1.169000  0.9935000      1.786000  
1 1 1 26 25 49 o 3.725000 1.002000  4.884000 1.631000  2.565000 1.164000  2.319000       2.004000  
1 1 1 26 26 0  o 24.66000 0.4645000 24.66000 0.4645000 24.66000 0.4645000 0.000000       0.000000  
1 1 1 26 26 2  o 26.10000 0.2808000 26.47000 0.4040000 25.73000 0.3902000 0.7378000      0.5617000 
1 1 1 26 26 4  o 13.70000 0.3199000 13.96000 0.4379000 13.45000 0.4663000 0.5057000      0.6397000 
1 1 1 26 26 6  o 16.85000 0.2934000 16.17000 0.4018000 17.54000 0.4275000 -1.371000      0.5867000 
1 1 1 26 26 8  o 13.82000 0.2937000 14.25000 0.4021000 13.40000 0.4282000 0.8532000      0.5874000 
1 1 1 26 26 10 o 21.23000 0.4448000 21.12000 0.5271000 21.35000 0.7165000 -0.2216000     0.8896000 
1 1 1 26 26 12 o 32.45000 0.3704000 32.35000 0.5218000 32.55000 0.5258000 -0.1991000     0.7408000 
1 1 1 26 26 14 o 11.88000 0.5648000 11.59000 0.8943000 12.16000 0.6900000 -0.5672000     1.130000  
1 1 1 26 26 16 o 14.42000 0.4548000 14.83000 0.6358000 14.02000 0.6505000 0.8176000      0.9096000 
1 1 1 26 26 18 o 20.67000 0.4480000 19.94000 0.6512000 21.39000 0.6155000 -1.451000      0.8960000 
1 1 1 26 26 20 o 37.53000 0.4352000 38.12000 0.5607000 36.94000 0.6657000 1.178000       0.8704000 
1 1 1 26 26 22 o 9.281000 0.6187000 7.726000 0.9936000 10.84000 0.7376000 -3.109000      1.237000  
1 1 1 26 26 24 o 18.32000 0.4597000 17.92000 0.6950000 18.72000 0.6018000 -0.8016000     0.9193000 
1 1 1 26 26 26 o 9.265000 0.8107000 9.140000 1.417000  9.390000 0.7884000 -0.2508000     1.621000  
1 1 1 26 26 28 o 8.653000 0.6075000 9.212000 0.8207000 8.094000 0.8961000 1.118000       1.215000  
1 1 1 26 26 30 o 15.71000 0.3549000 15.62000 0.4296000 15.79000 0.5649000 -0.1637000     0.7097000 
1 1 1 26 26 32 o 7.426000 0.5744000 7.079000 0.5531000 7.773000 1.007000  -0.6938000     1.149000  
1 1 1 26 26 34 o 6.887000 0.7165000 6.389000 0.9626000 7.384000 1.062000  -0.9948000     1.433000  
1 1 1 26 26 36 o 8.801000 0.5771000 9.521000 0.6715000 8.081000 0.9386000 1.440000       1.154000  
1 1 1 26 26 38 o 6.373000 0.7257000 6.368000 0.8710000 6.378000 1.161000  -0.1022000E-01 1.451000  
1 1 1 26 26 40 o 7.124000 0.7578000 7.413000 0.7283000 6.835000 1.329000  0.5781000      1.516000  
1 1 1 26 26 42 o 7.138000 0.6707000 6.838000 0.8012000 7.438000 1.076000  -0.6007000     1.341000  
1 1 1 26 26 44 f 4.809000 0.9381000 4.826000 1.290000  4.792000 1.362000  0.3442000E-01  1.876000  
1 1 1 26 26 46 o 5.782000 1.006000  4.977000 1.496000  6.587000 1.344000  -1.609000      2.011000  
1 1 1 26 26 48 o 3.130000 0.9544000 2.936000 1.382000  3.323000 1.317000  -0.3868000     1.909000  
1 1 1 26 27 1  f 32.80000 0.3968000 33.33000 0.6716000 32.27000 0.4227000 1.056000       0.7936000 
1 1 1 26 27 3  o 22.79000 0.3190000 23.07000 0.3923000 22.52000 0.5031000 0.5463000      0.6380000 
1 1 1 26 27 5  o 17.82000 0.2809000 17.80000 0.3990000 17.85000 0.3954000 -0.4980000E-01 0.5617000 
1 1 1 26 27 7  o 15.46000 0.2855000 15.94000 0.3930000 14.99000 0.4143000 0.9471000      0.5711000 
1 1 1 26 27 9  o 29.75000 0.3651000 29.30000 0.5153000 30.20000 0.5175000 -0.9085000     0.7303000 
1 1 1 26 27 11 o 34.63000 0.4457000 34.05000 0.5321000 35.20000 0.7151000 -1.150000      0.8914000 
1 1 1 26 27 13 o 13.22000 0.5735000 13.06000 0.9165000 13.38000 0.6899000 -0.3181000     1.147000  
1 1 1 26 27 15 o 22.14000 0.4275000 22.14000 0.6657000 22.14000 0.5363000 -0.2520000E-02 0.8549000 
1 1 1 26 27 17 o 16.74000 0.5023000 17.14000 0.6881000 16.33000 0.7320000 0.8110000      1.005000  
1 1 1 26 27 19 o 20.76000 0.3715000 21.79000 0.5341000 19.72000 0.5166000 2.069000       0.7430000 
1 1 1 26 27 21 o 12.35000 0.4911000 12.28000 0.7155000 12.43000 0.6729000 -0.1480000     0.9822000 
1 1 1 26 27 23 o 12.97000 0.6593000 11.97000 0.9239000 13.97000 0.9409000 -2.004000      1.319000  
1 1 1 26 27 25 o 7.966000 0.7806000 7.920000 1.316000  8.012000 0.8392000 -0.9179000E-01 1.561000  
1 1 1 26 27 27 o 3.973000 0.8803000 5.463000 1.358000  2.482000 1.121000  2.982000       1.761000  
1 1 1 26 27 29 o 24.31000 0.3570000 24.54000 0.5073000 24.07000 0.5024000 0.4669000      0.7140000 
1 1 1 26 27 31 o 18.82000 0.3698000 18.64000 0.5307000 19.01000 0.5150000 -0.3682000     0.7395000 
1 1 1 26 27 33 f 8.548000 0.5544000 8.473000 0.6186000 8.623000 0.9202000 -0.1500000     1.109000  
1 1 1 26 27 35 o 7.187000 1.013000  7.411000 0.9468000 6.962000 1.791000  0.4490000      2.026000  
1 1 1 26 27 37 o 14.02000 0.4324000 13.81000 0.5976000 14.24000 0.6251000 -0.4292000     0.8648000 
1 1 1 26 27 39 o 3.025000 0.8827000 3.084000 1.132000  2.966000 1.355000  0.1181000      1.765000  
1 1 1 26 27 41 o 10.39000 0.5804000 10.74000 0.5391000 10.03000 1.028000  0.7135000      1.161000  
1 1 1 26 27 43 o 16.63000 0.3986000 16.81000 0.5836000 16.45000 0.5432000 0.3565000      0.7973000 
1 1 1 26 27 45 o 10.44000 0.5722000 10.90000 0.8099000 9.973000 0.8084000 0.9291000      1.144000  
1 1 1 26 27 47 o 7.137000 1.077000  8.417000 1.754000  5.857000 1.252000  2.560000       2.154000  
1 1 1 26 28 0  o 10.63000 0.5548000 10.63000 0.5548000 10.63000 0.5548000 0.000000       0.000000  
1 1 1 26 28 2  o 13.35000 0.5212000 13.15000 0.8817000 13.55000 0.5561000 -0.4083000     1.042000  
1 1 1 26 28 4  o 17.07000 0.2871000 17.25000 0.4031000 16.90000 0.4089000 0.3547000      0.5741000 
1 1 1 26 28 6  o 33.97000 0.3373000 34.28000 0.4289000 33.67000 0.5207000 0.6073000      0.6746000 
1 1 1 26 28 8  o 38.20000 0.3938000 38.43000 0.5604000 37.96000 0.5535000 0.4697000      0.7877000 
1 1 1 26 28 10 o 39.65000 0.4640000 38.50000 0.5565000 40.80000 0.7426000 -2.300000      0.9280000 
1 1 1 26 28 12 o 26.16000 0.4021000 26.24000 0.6206000 26.09000 0.5115000 0.1541000      0.8042000 
1 1 1 26 28 14 o 12.30000 0.8368000 12.01000 1.454000  12.59000 0.8281000 -0.5824000     1.674000  
1 1 1 26 28 16 o 23.51000 0.4075000 23.61000 0.5050000 23.40000 0.6396000 0.2111000      0.8150000 
1 1 1 26 28 18 o 15.46000 0.4199000 15.74000 0.5648000 15.18000 0.6215000 0.5615000      0.8397000 
1 1 1 26 28 20 o 15.22000 0.4562000 15.36000 0.6002000 15.08000 0.6872000 0.2862000      0.9124000 
1 1 1 26 28 22 o 7.151000 0.8930000 7.548000 1.345000  6.754000 1.175000  0.7936000      1.786000  
1 1 1 26 28 24 o 13.23000 0.4674000 12.88000 0.7080000 13.57000 0.6104000 -0.6879000     0.9348000 
1 1 1 26 28 26 o 8.292000 0.6800000 8.367000 1.123000  8.216000 0.7678000 0.1505000      1.360000  
1 1 1 26 28 28 f 10.95000 0.5152000 11.29000 0.7259000 10.61000 0.7312000 0.6876000      1.030000  
1 1 1 26 28 30 o 3.738000 0.9810000 3.772000 1.397000  3.704000 1.377000  0.6765000E-01  1.962000  
1 1 1 26 28 32 o 3.657000 0.9630000 3.262000 1.347000  4.051000 1.377000  -0.7886000     1.926000  
1 1 1 26 28 34 o 6.986000 0.6219000 6.577000 0.6988000 7.395000 1.029000  -0.8184000     1.244000  
1 1 1 26 28 36 o 4.479000 0.8950000 4.383000 1.163000  4.576000 1.361000  -0.1922000     1.790000  
1 1 1 26 28 38 o 5.251000 0.9332000 5.792000 0.9933000 4.711000 1.580000  1.081000       1.866000  
1 1 1 26 28 40 o 3.712000 0.9557000 3.458000 1.111000  3.965000 1.555000  -0.5077000     1.911000  
1 1 1 26 28 42 o 3.502000 0.9701000 3.123000 1.283000  3.881000 1.455000  -0.7579000     1.940000  
1 1 1 26 28 44 o 5.654000 1.149000  5.633000 1.894000  5.674000 1.301000  -0.4124000E-01 2.297000  
1 1 1 26 28 46 o 7.660000 1.200000  9.240000 2.061000  6.081000 1.231000  3.159000       2.401000  
1 1 1 26 28 48 o 5.103000 1.263000  6.290000 2.076000  3.916000 1.439000  2.374000       2.526000  
1 1 1 26 29 1  o 12.11000 0.5491000 12.17000 0.9981000 12.04000 0.4583000 0.1243000      1.098000  
1 1 1 26 29 3  o 18.92000 0.4080000 18.40000 0.3976000 19.43000 0.7125000 -1.029000      0.8159000 
1 1 1 26 29 5  o 13.75000 0.5132000 13.54000 0.4536000 13.96000 0.9207000 -0.4206000     1.026000  
1 1 1 26 29 7  o 18.42000 0.4746000 18.79000 0.7635000 18.04000 0.5638000 0.7513000      0.9491000 
1 1 1 26 29 9  o 9.493000 0.6746000 9.686000 1.047000  9.301000 0.8507000 0.3854000      1.349000  
1 1 1 26 29 11 o 26.22000 0.6133000 27.29000 0.6127000 25.15000 1.063000  2.144000       1.227000  
1 1 1 26 29 13 o 10.65000 0.6714000 11.01000 0.9287000 10.30000 0.9699000 0.7081000      1.343000  
1 1 1 26 29 15 o 12.12000 0.4933000 12.46000 0.6602000 11.77000 0.7331000 0.6979000      0.9865000 
1 1 1 26 29 17 o 10.89000 0.5247000 11.10000 0.7126000 10.68000 0.7704000 0.4265000      1.049000  
1 1 1 26 29 19 o 4.456000 1.069000  3.707000 1.520000  5.206000 1.504000  -1.499000      2.139000  
1 1 1 26 29 21 o 6.990000 0.8459000 7.959000 1.194000  6.020000 1.199000  1.940000       1.692000  
1 1 1 26 29 23 o 18.36000 0.4448000 18.27000 0.5785000 18.46000 0.6758000 -0.1916000     0.8896000 
1 1 1 26 29 25 o 25.83000 0.3679000 25.12000 0.5327000 26.54000 0.5075000 -1.424000      0.7358000 
1 1 1 26 29 27 o 4.024000 0.9040000 2.918000 1.268000  5.130000 1.288000  -2.213000      1.808000  
1 1 1 26 29 29 o 5.333000 0.8981000 5.502000 1.261000  5.165000 1.279000  0.3367000      1.796000  
1 1 1 26 29 31 o 11.29000 0.4918000 10.89000 0.7029000 11.68000 0.6881000 -0.7897000     0.9836000 
1 1 1 26 29 33 o 5.401000 0.9081000 4.545000 1.377000  6.256000 1.184000  -1.712000      1.816000  
1 1 1 26 29 35 o 5.252000 1.013000  5.776000 1.245000  4.729000 1.599000  1.047000       2.027000  
1 1 1 26 29 37 o 13.46000 0.4741000 13.12000 0.5392000 13.80000 0.7799000 -0.6853000     0.9482000 
1 1 1 26 29 39 f 5.127000 1.082000  4.224000 1.717000  6.030000 1.318000  -1.807000      2.165000  
1 1 1 26 29 41 o 3.880000 1.052000  4.687000 1.636000  3.072000 1.322000  1.615000       2.103000  
1 1 1 26 29 43 o 4.248000 1.086000  3.334000 1.507000  5.162000 1.564000  -1.828000      2.172000  
1 1 1 26 29 45 o 5.696000 1.283000  6.571000 2.075000  4.822000 1.511000  1.748000       2.567000  
1 1 1 26 29 47 o 8.817000 1.194000  11.27000 2.160000  6.363000 1.017000  4.907000       2.387000  
1 1 1 26 30 0  o 13.69000 0.4548000 13.69000 0.4548000 13.69000 0.4548000 0.000000       0.000000  
1 1 1 26 30 2  o 10.80000 0.4002000 10.46000 0.6343000 11.13000 0.4882000 -0.6696000     0.8004000 
1 1 1 26 30 4  o 12.77000 0.4103000 13.34000 0.7279000 12.20000 0.3788000 1.140000       0.8205000 
1 1 1 26 30 6  o 10.04000 0.6559000 9.852000 0.9288000 10.22000 0.9263000 -0.3708000     1.312000  
1 1 1 26 30 8  o 12.67000 0.5823000 13.08000 0.8293000 12.27000 0.8178000 0.8045000      1.165000  
1 1 1 26 30 10 o 17.42000 0.8250000 18.95000 1.045000  15.90000 1.277000  3.046000       1.650000  
1 1 1 26 30 12 o 13.98000 0.4524000 14.50000 0.5989000 13.46000 0.6781000 1.042000       0.9047000 
1 1 1 26 30 14 o 12.50000 0.5444000 11.97000 0.8692000 13.03000 0.6558000 -1.067000      1.089000  
1 1 1 26 30 16 o 5.866000 0.8953000 7.356000 0.9967000 4.377000 1.488000  2.979000       1.791000  
1 1 1 26 30 18 o 27.45000 0.4271000 27.26000 0.6069000 27.64000 0.6012000 -0.3779000     0.8543000 
1 1 1 26 30 20 o 11.53000 0.5298000 11.99000 0.7386000 11.07000 0.7597000 0.9254000      1.060000  
1 1 1 26 30 22 o 5.770000 0.8932000 5.478000 1.287000  6.062000 1.239000  -0.5840000     1.786000  
1 1 1 26 30 24 o 7.822000 0.7443000 6.703000 1.266000  8.940000 0.7834000 -2.236000      1.489000  
1 1 1 26 30 26 o 5.894000 0.9525000 4.472000 1.618000  7.316000 1.006000  -2.844000      1.905000  
1 1 1 26 30 28 o 14.42000 0.4238000 14.67000 0.6296000 14.18000 0.5677000 0.4875000      0.8477000 
1 1 1 26 30 30 o 8.859000 0.6039000 8.534000 0.9201000 9.183000 0.7825000 -0.6485000     1.208000  
1 1 1 26 30 32 o 14.68000 0.4470000 15.14000 0.6305000 14.23000 0.6338000 0.9189000      0.8940000 
1 1 1 26 30 34 o 4.409000 1.010000  4.624000 1.417000  4.194000 1.441000  0.4302000      2.021000  
1 1 1 26 30 36 o 9.768000 0.7156000 10.94000 0.8878000 8.596000 1.123000  2.345000       1.431000  
1 1 1 26 30 38 o 4.822000 1.170000  4.909000 1.733000  4.736000 1.573000  0.1727000      2.340000  
1 1 1 26 30 40 o 8.682000 0.9429000 10.09000 1.188000  7.275000 1.464000  2.815000       1.886000  
1 1 1 26 30 42 o 3.811000 1.069000  4.072000 1.631000  3.551000 1.383000  0.5216000      2.138000  
1 1 1 26 30 44 o 4.838000 1.160000  4.929000 1.860000  4.748000 1.386000  0.1810000      2.320000  
1 1 1 26 30 46 o 4.568000 1.186000  6.108000 2.034000  3.027000 1.222000  3.082000       2.373000  
1 1 1 26 31 1  o 12.22000 0.3573000 12.28000 0.5253000 12.17000 0.4844000 0.1168000      0.7145000 
1 1 1 26 31 3  o 26.19000 0.3611000 27.14000 0.5898000 25.24000 0.4169000 1.899000       0.7223000 
1 1 1 26 31 5  o 24.37000 0.3857000 24.54000 0.5892000 24.20000 0.4977000 0.3415000      0.7713000 
1 1 1 26 31 7  o 6.642000 0.7946000 7.171000 0.9896000 6.113000 1.244000  1.059000       1.589000  
1 1 1 26 31 9  o 21.90000 0.3560000 21.99000 0.4890000 21.82000 0.5174000 0.1707000      0.7119000 
1 1 1 26 31 11 o 20.74000 0.4407000 20.55000 0.5182000 20.93000 0.7130000 -0.3792000     0.8814000 
1 1 1 26 31 13 o 16.41000 0.5639000 15.94000 0.7669000 16.88000 0.8268000 -0.9474000     1.128000  
1 1 1 26 31 15 o 4.784000 1.100000  4.918000 1.641000  4.650000 1.466000  0.2681000      2.200000  
1 1 1 26 31 17 o 3.936000 1.025000  3.836000 1.398000  4.036000 1.500000  -0.1998000     2.050000  
1 1 1 26 31 19 o 11.65000 0.4964000 12.02000 0.6788000 11.28000 0.7245000 0.7411000      0.9928000 
1 1 1 26 31 21 o 4.162000 0.9938000 3.961000 1.338000  4.362000 1.469000  -0.4008000     1.988000  
1 1 1 26 31 23 o 14.20000 0.4967000 14.58000 0.6340000 13.82000 0.7648000 0.7669000      0.9935000 
1 1 1 26 31 25 o 22.20000 0.4303000 21.34000 0.6874000 23.07000 0.5179000 -1.730000      0.8607000 
1 1 1 26 31 27 o 20.56000 0.3836000 20.55000 0.5776000 20.57000 0.5050000 -0.1562000E-01 0.7672000 
1 1 1 26 31 29 o 13.78000 0.4466000 13.94000 0.6570000 13.61000 0.6050000 0.3304000      0.8931000 
1 1 1 26 31 31 o 13.13000 0.4538000 12.91000 0.6651000 13.35000 0.6175000 -0.4408000     0.9076000 
1 1 1 26 31 33 o 5.820000 0.9169000 5.428000 1.393000  6.212000 1.193000  -0.7842000     1.834000  
1 1 1 26 31 35 o 3.626000 0.8947000 2.326000 1.116000  4.926000 1.399000  -2.600000      1.789000  
1 1 1 26 31 37 o 9.389000 0.9239000 9.032000 1.659000  9.746000 0.8143000 -0.7136000     1.848000  
1 1 1 26 31 39 o 7.038000 0.9632000 7.253000 1.276000  6.823000 1.444000  0.4295000      1.926000  
1 1 1 26 31 41 o 3.293000 1.020000  3.568000 1.566000  3.018000 1.309000  0.5505000      2.041000  
1 1 1 26 31 43 f 6.269000 0.9076000 6.626000 1.295000  5.912000 1.272000  0.7143000      1.815000  
1 1 1 26 31 45 f 3.275000 1.037000  4.247000 1.771000  2.303000 1.079000  1.944000       2.074000  
1 1 1 26 32 0  o 3.248000 1.259000  3.248000 1.259000  3.248000 1.259000  0.000000       0.000000  
1 1 1 26 32 2  o 7.810000 0.7583000 7.522000 1.437000  8.098000 0.4848000 -0.5761000     1.517000  
1 1 1 26 32 4  o 13.99000 0.3961000 13.74000 0.5487000 14.24000 0.5715000 -0.5021000     0.7923000 
1 1 1 26 32 6  o 33.73000 0.3681000 34.11000 0.5167000 33.35000 0.5244000 0.7637000      0.7362000 
1 1 1 26 32 8  o 7.997000 0.6684000 7.947000 0.9126000 8.047000 0.9768000 -0.9965000E-01 1.337000  
1 1 1 26 32 10 o 16.97000 0.5219000 16.85000 0.6114000 17.08000 0.8460000 -0.2329000     1.044000  
1 1 1 26 32 12 o 20.07000 0.4296000 21.01000 0.5965000 19.13000 0.6185000 1.886000       0.8592000 
1 1 1 26 32 14 o 12.31000 0.5963000 11.95000 0.9009000 12.68000 0.7816000 -0.7272000     1.193000  
1 1 1 26 32 16 o 7.165000 0.8703000 7.153000 1.041000  7.178000 1.395000  -0.2499000E-01 1.741000  
1 1 1 26 32 18 o 14.39000 0.4845000 15.18000 0.7216000 13.60000 0.6468000 1.583000       0.9690000 
1 1 1 26 32 20 o 16.80000 0.4075000 16.99000 0.5574000 16.60000 0.5946000 0.3989000      0.8150000 
1 1 1 26 32 22 o 12.67000 0.4569000 12.17000 0.6408000 13.16000 0.6514000 -0.9856000     0.9138000 
1 1 1 26 32 24 o 22.15000 0.4138000 22.04000 0.5341000 22.25000 0.6322000 -0.2114000     0.8276000 
1 1 1 26 32 26 o 11.17000 0.5155000 10.77000 0.7912000 11.57000 0.6610000 -0.7970000     1.031000  
1 1 1 26 32 28 o 11.42000 0.5028000 11.05000 0.7484000 11.79000 0.6716000 -0.7446000     1.006000  
1 1 1 26 32 30 o 5.718000 0.9145000 6.584000 1.149000  4.852000 1.423000  1.731000       1.829000  
1 1 1 26 32 32 o 9.248000 0.8379000 8.392000 0.8823000 10.10000 1.425000  -1.712000      1.676000  
1 1 1 26 32 34 o 4.091000 1.018000  5.010000 1.495000  3.173000 1.383000  1.837000       2.036000  
1 1 1 26 32 36 o 5.802000 0.9734000 5.213000 1.607000  6.390000 1.099000  -1.178000      1.947000  
1 1 1 26 32 38 o 6.804000 0.9019000 6.371000 1.462000  7.238000 1.056000  -0.8668000     1.804000  
1 1 1 26 32 40 f 9.315000 0.6810000 10.18000 0.9921000 8.453000 0.9330000 1.725000       1.362000  
1 1 1 26 32 42 o 8.765000 0.7145000 8.646000 1.079000  8.883000 0.9368000 -0.2372000     1.429000  
1 1 1 26 32 44 o 6.434000 1.184000  6.841000 1.907000  6.027000 1.403000  0.8143000      2.367000  
1 1 1 26 33 1  o 12.06000 0.3232000 12.04000 0.4899000 12.08000 0.4217000 -0.4158000E-01 0.6465000 
1 1 1 26 33 3  o 14.57000 0.3377000 14.54000 0.5402000 14.60000 0.4054000 -0.5795000E-01 0.6754000 
1 1 1 26 33 5  o 4.092000 0.9874000 4.113000 1.431000  4.072000 1.361000  0.4161000E-01  1.975000  
1 1 1 26 33 7  o 16.58000 0.4321000 15.51000 0.6239000 17.64000 0.5980000 -2.124000      0.8642000 
1 1 1 26 33 9  o 26.71000 0.4224000 27.07000 0.5783000 26.36000 0.6159000 0.7126000      0.8448000 
1 1 1 26 33 11 o 20.54000 0.5893000 20.12000 0.5062000 20.96000 1.064000  -0.8406000     1.179000  
1 1 1 26 33 13 o 5.837000 0.9555000 6.300000 1.337000  5.373000 1.366000  0.9268000      1.911000  
1 1 1 26 33 15 o 16.51000 0.3871000 15.78000 0.5543000 17.25000 0.5405000 -1.473000      0.7742000 
1 1 1 26 33 17 o 6.756000 0.7855000 5.869000 1.272000  7.643000 0.9221000 -1.773000      1.571000  
1 1 1 26 33 19 o 7.844000 0.7486000 8.091000 1.043000  7.597000 1.075000  0.4939000      1.497000  
1 1 1 26 33 21 o 9.600000 0.7438000 7.744000 1.166000  11.45000 0.9237000 -3.711000      1.488000  
1 1 1 26 33 23 o 17.06000 0.4300000 16.75000 0.6079000 17.37000 0.6083000 -0.6244000     0.8599000 
1 1 1 26 33 25 o 6.410000 0.9185000 6.718000 1.493000  6.102000 1.070000  0.6156000      1.837000  
1 1 1 26 33 27 o 6.304000 0.9209000 6.713000 1.324000  5.894000 1.280000  0.8195000      1.842000  
1 1 1 26 33 29 o 5.252000 0.9023000 3.955000 1.484000  6.549000 1.027000  -2.594000      1.805000  
1 1 1 26 33 31 o 9.103000 0.7133000 8.461000 0.9709000 9.745000 1.045000  -1.284000      1.427000  
1 1 1 26 33 33 o 10.37000 0.6467000 9.920000 1.003000  10.82000 0.8168000 -0.9038000     1.293000  
1 1 1 26 33 35 f 9.524000 1.141000  8.301000 2.069000  10.75000 0.9643000 -2.444000      2.282000  
1 1 1 26 33 37 o 4.415000 1.019000  4.222000 1.411000  4.609000 1.471000  -0.3870000     2.038000  
1 1 1 26 33 39 o 2.919000 0.9323000 3.112000 1.393000  2.726000 1.239000  0.3861000      1.865000  
1 1 1 26 33 41 o 5.793000 1.019000  5.993000 1.449000  5.594000 1.432000  0.3993000      2.038000  
1 1 1 26 33 43 o 8.136000 0.7864000 8.617000 1.009000  7.654000 1.206000  0.9632000      1.573000  
1 1 1 26 34 0  o 3.482000 1.293000  3.482000 1.293000  3.482000 1.293000  0.000000       0.000000  
1 1 1 26 34 2  o 4.854000 0.6677000 4.251000 1.096000  5.457000 0.7633000 -1.205000      1.335000  
1 1 1 26 34 4  o 20.32000 0.3885000 20.59000 0.5508000 20.05000 0.5479000 0.5332000      0.7769000 
1 1 1 26 34 6  o 18.34000 0.3979000 19.27000 0.5279000 17.41000 0.5955000 1.860000       0.7958000 
1 1 1 26 34 8  o 4.482000 0.9641000 4.888000 1.325000  4.076000 1.401000  0.8124000      1.928000  
1 1 1 26 34 10 o 13.66000 0.5340000 14.14000 0.6193000 13.17000 0.8700000 0.9771000      1.068000  
1 1 1 26 34 12 o 9.751000 0.5608000 10.12000 0.7263000 9.383000 0.8548000 0.7351000      1.122000  
1 1 1 26 34 14 o 6.662000 0.7838000 5.650000 1.147000  7.674000 1.069000  -2.024000      1.568000  
1 1 1 26 34 16 f 15.31000 0.3983000 15.44000 0.5574000 15.18000 0.5692000 0.2586000      0.7967000 
1 1 1 26 34 18 o 13.38000 0.4492000 14.17000 0.6454000 12.59000 0.6251000 1.579000       0.8984000 
1 1 1 26 34 20 o 6.557000 0.8611000 6.240000 1.248000  6.874000 1.187000  -0.6342000     1.722000  
1 1 1 26 34 22 f 8.391000 0.8228000 7.292000 1.120000  9.491000 1.206000  -2.199000      1.646000  
1 1 1 26 34 24 f 13.93000 0.5041000 13.01000 0.7357000 14.85000 0.6894000 -1.844000      1.008000  
1 1 1 26 34 26 o 15.68000 0.5347000 16.59000 0.7729000 14.76000 0.7391000 1.838000       1.069000  
1 1 1 26 34 28 o 18.12000 0.4494000 18.24000 0.6965000 18.01000 0.5679000 0.2294000      0.8987000 
1 1 1 26 34 30 o 4.746000 1.042000  5.526000 1.421000  3.966000 1.524000  1.560000       2.084000  
1 1 1 26 34 32 o 3.699000 1.079000  3.576000 1.519000  3.823000 1.531000  -0.2469000     2.157000  
1 1 1 26 34 34 o 6.605000 1.231000  6.396000 1.968000  6.813000 1.481000  -0.4176000     2.463000  
1 1 1 26 34 36 o 4.384000 1.030000  5.289000 1.497000  3.478000 1.415000  1.811000       2.060000  
1 1 1 26 34 38 o 3.218000 0.9704000 3.284000 1.389000  3.152000 1.356000  0.1319000      1.941000  
1 1 1 26 34 40 o 7.368000 0.9278000 6.120000 1.530000  8.616000 1.050000  -2.496000      1.856000  
1 1 1 26 34 42 o 8.003000 0.8070000 7.724000 1.225000  8.282000 1.050000  -0.5581000     1.614000  
1 1 1 26 35 1  o 14.29000 0.2771000 14.35000 0.3960000 14.23000 0.3877000 0.1249000      0.5542000 
1 1 1 26 35 3  o 3.094000 0.9334000 2.504000 1.107000  3.685000 1.503000  -1.181000      1.867000  
1 1 1 26 35 5  o 4.639000 0.9194000 5.334000 0.9440000 3.944000 1.578000  1.390000       1.839000  
1 1 1 26 35 7  o 6.179000 0.8149000 7.028000 0.9818000 5.330000 1.301000  1.698000       1.630000  
1 1 1 26 35 9  o 4.008000 0.9787000 4.238000 1.348000  3.778000 1.420000  0.4595000      1.957000  
1 1 1 26 35 11 o 11.38000 0.6244000 12.10000 0.6414000 10.66000 1.071000  1.434000       1.249000  
1 1 1 26 35 13 o 21.49000 0.4164000 21.67000 0.6506000 21.32000 0.5200000 0.3526000      0.8329000 
1 1 1 26 35 15 o 7.984000 0.6220000 8.062000 0.9106000 7.905000 0.8477000 0.1571000      1.244000  
1 1 1 26 35 17 o 15.15000 0.4238000 15.34000 0.5874000 14.96000 0.6110000 0.3802000      0.8475000 
1 1 1 26 35 19 o 6.174000 0.8286000 6.215000 1.156000  6.133000 1.187000  0.8170000E-01  1.657000  
1 1 1 26 35 21 o 6.581000 0.8336000 6.149000 1.206000  7.013000 1.151000  -0.8641000     1.667000  
1 1 1 26 35 23 o 6.007000 0.9008000 5.163000 1.433000  6.852000 1.092000  -1.690000      1.802000  
1 1 1 26 35 25 o 4.914000 1.057000  4.078000 1.567000  5.751000 1.419000  -1.673000      2.114000  
1 1 1 26 35 27 o 8.379000 0.6210000 9.160000 0.9264000 7.599000 0.8272000 1.561000       1.242000  
1 1 1 26 35 29 o 10.17000 0.6700000 9.754000 0.8266000 10.59000 1.055000  -0.8361000     1.340000  
1 1 1 26 35 31 o 9.280000 0.9516000 8.400000 1.538000  10.16000 1.121000  -1.760000      1.903000  
1 1 1 26 35 33 o 4.862000 1.091000  4.791000 1.525000  4.934000 1.561000  -0.1433000     2.182000  
1 1 1 26 35 35 o 9.777000 0.5922000 9.349000 0.8641000 10.20000 0.8099000 -0.8555000     1.184000  
1 1 1 26 35 37 o 12.20000 0.5190000 11.83000 0.7528000 12.56000 0.7145000 -0.7352000     1.038000  
1 1 1 26 35 39 o 11.97000 0.5768000 12.28000 0.8440000 11.65000 0.7863000 0.6321000      1.154000  
1 1 1 26 35 41 o 3.189000 0.9801000 3.477000 1.482000  2.902000 1.283000  0.5747000      1.960000  
1 1 1 26 36 0  o 3.980000 1.094000  3.980000 1.094000  3.980000 1.094000  0.000000       0.000000  
1 1 1 26 36 2  o 15.61000 0.2911000 16.04000 0.3914000 15.17000 0.4309000 0.8688000      0.5822000 
1 1 1 26 36 4  o 14.70000 0.4419000 14.76000 0.4269000 14.64000 0.7738000 0.1231000      0.8837000 
1 1 1 26 36 6  o 19.61000 0.3882000 20.03000 0.3960000 19.19000 0.6678000 0.8342000      0.7764000 
1 1 1 26 36 8  o 5.794000 0.8230000 6.464000 1.046000  5.123000 1.271000  1.341000       1.646000  
1 1 1 26 36 10 o 8.182000 0.5992000 8.489000 0.7843000 7.874000 0.9061000 0.6154000      1.198000  
1 1 1 26 36 12 o 18.33000 0.3873000 18.49000 0.5189000 18.17000 0.5751000 0.3200000      0.7746000 
1 1 1 26 36 14 o 10.76000 0.5069000 11.64000 0.6617000 9.879000 0.7681000 1.758000       1.014000  
1 1 1 26 36 16 o 9.030000 0.5624000 8.548000 0.8072000 9.511000 0.7832000 -0.9629000     1.125000  
1 1 1 26 36 18 o 20.59000 0.3730000 20.86000 0.5105000 20.32000 0.5441000 0.5408000      0.7461000 
1 1 1 26 36 20 o 19.65000 0.4200000 19.44000 0.6453000 19.86000 0.5378000 -0.4187000     0.8400000 
1 1 1 26 36 22 o 14.52000 0.5637000 14.52000 0.6293000 14.51000 0.9353000 0.1266000E-01  1.127000  
1 1 1 26 36 24 f 8.505000 0.6932000 8.443000 0.9259000 8.567000 1.032000  -0.1234000     1.386000  
1 1 1 26 36 26 o 16.70000 0.6147000 17.03000 0.5941000 16.38000 1.076000  0.6492000      1.229000  
1 1 1 26 36 28 o 3.618000 1.080000  3.872000 1.604000  3.365000 1.448000  0.5075000      2.161000  
1 1 1 26 36 30 o 6.654000 0.9579000 5.320000 1.592000  7.988000 1.066000  -2.668000      1.916000  
1 1 1 26 36 32 o 3.713000 1.007000  4.358000 1.506000  3.069000 1.337000  1.288000       2.014000  
1 1 1 26 36 34 o 3.933000 1.024000  3.848000 1.420000  4.018000 1.475000  -0.1698000     2.047000  
1 1 1 26 36 36 o 4.592000 1.054000  4.773000 1.478000  4.411000 1.504000  0.3622000      2.109000  
1 1 1 26 36 38 o 3.732000 1.053000  3.979000 1.509000  3.485000 1.470000  0.4932000      2.107000  
1 1 1 26 36 40 o 3.868000 1.118000  3.490000 1.529000  4.247000 1.632000  -0.7564000     2.236000  
1 1 1 26 37 1  o 6.767000 0.4973000 6.708000 0.8317000 6.826000 0.5455000 -0.1179000     0.9946000 
1 1 1 26 37 3  o 11.92000 0.5310000 11.06000 0.5858000 12.79000 0.8858000 -1.729000      1.062000  
1 1 1 26 37 5  o 13.91000 0.4857000 14.22000 0.4398000 13.60000 0.8662000 0.6210000      0.9715000 
1 1 1 26 37 7  o 14.64000 0.4743000 15.26000 0.4270000 14.03000 0.8470000 1.229000       0.9486000 
1 1 1 26 37 9  f 9.185000 0.6415000 8.219000 0.6643000 10.15000 1.098000  -1.931000      1.283000  
1 1 1 26 37 11 o 6.463000 0.8024000 6.070000 1.197000  6.857000 1.069000  -0.7875000     1.605000  
1 1 1 26 37 13 o 4.770000 1.045000  4.698000 1.575000  4.843000 1.373000  -0.1457000     2.089000  
1 1 1 26 37 15 o 13.58000 0.4492000 13.95000 0.5989000 13.21000 0.6697000 0.7463000      0.8985000 
1 1 1 26 37 17 o 15.75000 0.4157000 15.84000 0.6141000 15.65000 0.5605000 0.1907000      0.8315000 
1 1 1 26 37 19 o 9.284000 0.6075000 9.840000 0.8230000 8.728000 0.8937000 1.112000       1.215000  
1 1 1 26 37 21 o 9.829000 0.5821000 9.046000 0.8689000 10.61000 0.7748000 -1.566000      1.164000  
1 1 1 26 37 23 o 18.61000 0.4384000 18.72000 0.5889000 18.50000 0.6496000 0.2160000      0.8768000 
1 1 1 26 37 25 o 18.38000 0.5691000 17.69000 0.5630000 19.07000 0.9891000 -1.380000      1.138000  
1 1 1 26 37 27 o 7.632000 0.8821000 8.158000 1.193000  7.106000 1.300000  1.052000       1.764000  
1 1 1 26 37 29 o 3.617000 1.060000  4.209000 1.675000  3.025000 1.301000  1.184000       2.121000  
1 1 1 26 37 31 o 8.716000 0.7971000 7.619000 1.242000  9.812000 0.9996000 -2.193000      1.594000  
1 1 1 26 37 33 o 8.445000 0.8089000 7.807000 1.143000  9.083000 1.145000  -1.276000      1.618000  
1 1 1 26 37 35 o 4.862000 1.091000  5.390000 1.557000  4.335000 1.528000  1.055000       2.182000  
1 1 1 26 37 37 o 7.616000 0.7948000 6.881000 1.172000  8.351000 1.074000  -1.471000      1.590000  
1 1 1 26 37 39 o 4.851000 1.054000  4.088000 1.542000  5.614000 1.438000  -1.526000      2.108000  
1 1 1 26 38 0  o 2.709000 1.042000  2.709000 1.042000  2.709000 1.042000  0.000000       0.000000  
1 1 1 26 38 2  o 11.23000 0.5309000 11.92000 0.4633000 10.54000 0.9554000 1.379000       1.062000  
1 1 1 26 38 4  o 2.971000 0.9069000 2.084000 0.9438000 3.858000 1.549000  -1.775000      1.814000  
1 1 1 26 38 6  o 8.327000 0.6672000 8.065000 0.6562000 8.588000 1.162000  -0.5228000     1.334000  
1 1 1 26 38 8  o 5.843000 0.8960000 7.131000 0.7488000 4.555000 1.628000  2.576000       1.792000  
1 1 1 26 38 10 o 3.752000 1.018000  4.000000 1.366000  3.504000 1.510000  0.4962000      2.036000  
1 1 1 26 38 12 o 11.39000 0.5554000 11.78000 0.5418000 11.00000 0.9698000 0.7868000      1.111000  
1 1 1 26 38 14 o 6.154000 0.8710000 6.256000 1.240000  6.052000 1.224000  0.2038000      1.742000  
1 1 1 26 38 16 o 8.963000 0.6423000 9.207000 0.9424000 8.720000 0.8729000 0.4875000      1.285000  
1 1 1 26 38 18 o 5.746000 0.9283000 5.975000 1.301000  5.517000 1.325000  0.4587000      1.857000  
1 1 1 26 38 20 o 6.974000 0.8296000 6.144000 1.300000  7.804000 1.031000  -1.660000      1.659000  
1 1 1 26 38 22 o 4.588000 1.178000  4.929000 1.492000  4.247000 1.823000  0.6826000      2.356000  
1 1 1 26 38 24 o 5.822000 1.131000  4.850000 1.909000  6.795000 1.212000  -1.945000      2.261000  
1 1 1 26 38 26 o 10.01000 0.6626000 10.91000 0.8836000 9.115000 0.9876000 1.791000       1.325000  
1 1 1 26 38 28 o 14.66000 0.5042000 15.15000 0.6446000 14.18000 0.7754000 0.9683000      1.008000  
1 1 1 26 38 30 o 13.39000 0.5404000 12.74000 0.7061000 14.03000 0.8182000 -1.293000      1.081000  
1 1 1 26 38 32 o 3.510000 1.010000  3.788000 1.498000  3.232000 1.354000  0.5560000      2.019000  
1 1 1 26 38 34 o 4.291000 1.011000  3.290000 1.422000  5.292000 1.438000  -2.002000      2.022000  
1 1 1 26 38 36 o 5.470000 0.9398000 3.921000 1.417000  7.019000 1.235000  -3.098000      1.880000  
1 1 1 26 38 38 o 3.851000 1.011000  4.179000 1.437000  3.524000 1.423000  0.6549000      2.022000  
1 1 1 26 39 1  o 11.89000 0.4751000 11.82000 0.8869000 11.97000 0.3408000 -0.1543000     0.9501000 
1 1 1 26 39 3  o 13.18000 0.5220000 13.79000 0.5250000 12.57000 0.9023000 1.220000       1.044000  
1 1 1 26 39 5  o 5.031000 0.9318000 5.774000 0.8310000 4.288000 1.668000  1.487000       1.864000  
1 1 1 26 39 7  o 9.566000 0.5826000 9.461000 0.5646000 9.670000 1.019000  -0.2087000     1.165000  
1 1 1 26 39 9  o 8.804000 0.5840000 8.750000 0.6117000 8.858000 0.9950000 -0.1085000     1.168000  
1 1 1 26 39 11 o 9.230000 0.6379000 9.386000 0.6126000 9.074000 1.119000  0.3117000      1.276000  
1 1 1 26 39 13 o 8.914000 0.7363000 8.484000 0.7731000 9.343000 1.253000  -0.8592000     1.473000  
1 1 1 26 39 15 f 5.293000 1.023000  5.168000 1.289000  5.419000 1.589000  -0.2506000     2.046000  
1 1 1 26 39 17 o 10.50000 0.5437000 10.41000 0.7751000 10.60000 0.7625000 -0.1885000     1.087000  
1 1 1 26 39 19 o 5.417000 0.9814000 5.790000 1.419000  5.044000 1.357000  0.7459000      1.963000  
1 1 1 26 39 21 o 12.07000 0.7511000 12.07000 0.7511000 ?        ?         ?              ?         
1 1 1 26 39 23 o 14.37000 0.7386000 13.70000 1.315000  15.05000 0.6730000 -1.350000      1.477000  
1 1 1 26 39 25 o 3.787000 1.122000  3.636000 1.647000  3.938000 1.523000  -0.3024000     2.243000  
1 1 1 26 39 27 o 6.845000 0.8262000 7.524000 1.093000  6.166000 1.239000  1.358000       1.652000  
1 1 1 26 39 29 o 11.86000 0.5682000 11.79000 0.7106000 11.92000 0.8867000 -0.1233000     1.136000  
1 1 1 26 39 31 o 13.37000 0.5344000 14.35000 0.6434000 12.40000 0.8534000 1.952000       1.069000  
1 1 1 26 39 33 o 7.618000 0.8537000 7.900000 1.148000  7.335000 1.263000  0.5647000      1.707000  
1 1 1 26 39 35 o 5.113000 0.9957000 4.762000 1.375000  5.463000 1.440000  -0.7004000     1.991000  
1 1 1 26 39 37 o 2.928000 0.9044000 2.778000 1.231000  3.078000 1.325000  -0.3006000     1.809000  
1 1 1 26 40 0  o 14.78000 0.3614000 14.78000 0.3614000 14.78000 0.3614000 0.000000       0.000000  
1 1 1 26 40 2  o 13.57000 0.4571000 13.37000 0.4054000 13.76000 0.8195000 -0.3882000     0.9143000 
1 1 1 26 40 4  o 9.196000 0.6958000 10.15000 0.5443000 8.247000 1.281000  1.898000       1.392000  
1 1 1 26 40 6  o 4.943000 0.9617000 4.365000 1.064000  5.520000 1.602000  -1.154000      1.923000  
1 1 1 26 40 8  o 5.262000 0.9140000 4.768000 1.043000  5.757000 1.501000  -0.9882000     1.828000  
1 1 1 26 40 10 o 3.137000 0.9416000 2.864000 1.213000  3.410000 1.441000  -0.5459000     1.883000  
1 1 1 26 40 12 o 3.199000 0.9452000 3.012000 1.176000  3.386000 1.480000  -0.3741000     1.890000  
1 1 1 26 40 14 o 4.077000 0.9979000 4.286000 1.175000  3.867000 1.613000  0.4188000      1.996000  
1 1 1 26 40 16 f 9.930000 0.6237000 10.35000 0.6312000 9.507000 1.076000  0.8464000      1.247000  
1 1 1 26 40 18 o 6.725000 1.124000  6.725000 1.124000  ?        ?         ?              ?         
1 1 1 26 40 20 o 6.452000 0.9395000 4.697000 1.589000  8.206000 1.003000  -3.510000      1.879000  
1 1 1 26 40 22 o 5.896000 1.126000  5.814000 1.721000  5.979000 1.452000  -0.1649000     2.252000  
1 1 1 26 40 24 o 9.079000 0.8979000 9.984000 1.427000  8.175000 1.090000  1.809000       1.796000  
1 1 1 26 40 26 o 15.37000 0.5039000 15.37000 0.6846000 15.38000 0.7396000 -0.7008000E-02 1.008000  
1 1 1 26 40 28 o 7.503000 0.8806000 8.620000 0.8897000 6.387000 1.520000  2.233000       1.761000  
1 1 1 26 40 30 o 6.501000 0.9146000 7.237000 0.9998000 5.764000 1.532000  1.473000       1.829000  
1 1 1 26 40 32 o 6.470000 1.122000  6.824000 1.246000  6.116000 1.867000  0.7079000      2.245000  
1 1 1 26 40 34 o 5.424000 1.119000  6.544000 1.622000  4.304000 1.541000  2.240000       2.237000  
1 1 1 26 40 36 o 3.654000 1.036000  3.528000 1.395000  3.780000 1.532000  -0.2511000     2.072000  
1 1 1 26 41 1  o 4.793000 0.8866000 4.589000 0.8168000 4.997000 1.574000  -0.4084000     1.773000  
1 1 1 26 41 3  f 7.232000 0.7969000 6.441000 0.8499000 8.023000 1.348000  -1.581000      1.594000  
1 1 1 26 41 5  o 9.419000 0.6310000 9.254000 0.5909000 9.584000 1.115000  -0.3298000     1.262000  
1 1 1 26 41 7  o 6.020000 0.8346000 6.003000 0.8451000 6.037000 1.439000  -0.3451000E-01 1.669000  
1 1 1 26 41 9  o 7.345000 0.8274000 8.712000 0.6322000 5.978000 1.529000  2.734000       1.655000  
1 1 1 26 41 11 o 14.16000 0.5500000 15.23000 0.4591000 13.09000 0.9996000 2.141000       1.100000  
1 1 1 26 41 13 o 8.359000 0.7616000 8.135000 0.8268000 8.582000 1.279000  -0.4471000     1.523000  
1 1 1 26 41 15 o 19.68000 0.4627000 19.68000 0.4627000 ?        ?         ?              ?         
1 1 1 26 41 17 o 15.27000 0.5514000 15.51000 0.6200000 15.04000 0.9120000 0.4710000      1.103000  
1 1 1 26 41 19 o 11.06000 0.6065000 11.06000 0.6944000 11.06000 0.9947000 -0.6197000E-02 1.213000  
1 1 1 26 41 21 o 4.352000 1.248000  5.335000 2.006000  3.369000 1.487000  1.966000       2.496000  
1 1 1 26 41 23 o 8.714000 0.6596000 7.659000 0.9823000 9.770000 0.8806000 -2.110000      1.319000  
1 1 1 26 41 25 o 5.772000 1.011000  6.112000 1.335000  5.432000 1.518000  0.6806000      2.021000  
1 1 1 26 41 27 o 6.107000 1.057000  5.953000 1.387000  6.260000 1.596000  -0.3068000     2.114000  
1 1 1 26 41 29 o 9.728000 0.6941000 10.76000 0.8060000 8.695000 1.130000  2.067000       1.388000  
1 1 1 26 41 31 o 4.571000 1.044000  5.205000 1.455000  3.937000 1.499000  1.267000       2.089000  
1 1 1 26 41 33 o 3.903000 1.032000  3.633000 1.452000  4.174000 1.468000  -0.5411000     2.065000  
1 1 1 26 41 35 o 3.680000 1.112000  3.154000 1.392000  4.207000 1.735000  -1.053000      2.225000  
1 1 1 26 42 0  o 19.26000 0.6913000 19.26000 0.6913000 19.26000 0.6913000 0.000000       0.000000  
1 1 1 26 42 2  o 12.03000 0.5346000 12.91000 0.4154000 11.15000 0.9852000 1.763000       1.069000  
1 1 1 26 42 4  o 11.45000 0.5481000 11.65000 0.4737000 11.25000 0.9886000 0.3967000      1.096000  
1 1 1 26 42 6  o 9.956000 0.6356000 9.853000 0.5831000 10.06000 1.130000  -0.2059000     1.271000  
1 1 1 26 42 8  o 12.15000 0.5176000 12.64000 0.4984000 11.67000 0.9073000 0.9742000      1.035000  
1 1 1 26 42 10 o 10.01000 0.6925000 10.43000 0.6782000 9.596000 1.208000  0.8349000      1.385000  
1 1 1 26 42 12 o 9.186000 0.9917000 8.428000 0.6876000 9.944000 1.860000  -1.516000      1.983000  
1 1 1 26 42 14 o 6.806000 1.106000  7.738000 0.8907000 5.874000 2.024000  1.865000       2.212000  
1 1 1 26 42 16 o 4.457000 1.099000  4.489000 1.392000  4.425000 1.701000  0.6331000E-01  2.198000  
1 1 1 26 42 18 o 5.100000 1.153000  4.808000 1.609000  5.391000 1.654000  -0.5828000     2.307000  
1 1 1 26 42 20 o 3.896000 0.9939000 3.964000 1.250000  3.828000 1.545000  0.1358000      1.988000  
1 1 1 26 42 22 o 5.759000 1.017000  6.153000 1.090000  5.366000 1.717000  0.7869000      2.034000  
1 1 1 26 42 24 o 11.77000 0.6344000 11.01000 0.6264000 12.52000 1.103000  -1.512000      1.269000  
1 1 1 26 42 26 o 13.71000 0.5816000 14.36000 0.7291000 13.06000 0.9063000 1.300000       1.163000  
1 1 1 26 42 28 f 6.727000 0.9877000 7.735000 1.218000  5.719000 1.556000  2.016000       1.975000  
1 1 1 26 42 30 o 3.496000 1.000000  3.809000 1.464000  3.183000 1.362000  0.6252000      2.000000  
1 1 1 26 42 32 o 5.022000 0.9915000 5.393000 1.357000  4.652000 1.446000  0.7409000      1.983000  
1 1 1 26 42 34 o 4.091000 1.066000  3.105000 1.421000  5.076000 1.590000  -1.971000      2.132000  
1 1 1 26 43 1  o 5.797000 1.151000  6.204000 1.626000  5.390000 1.631000  0.8146000      2.303000  
1 1 1 26 43 3  o 8.860000 0.6627000 8.438000 0.5503000 9.282000 1.206000  -0.8435000     1.325000  
1 1 1 26 43 5  o 13.20000 0.4761000 13.28000 0.4466000 13.12000 0.8410000 0.1551000      0.9522000 
1 1 1 26 43 7  o 10.31000 0.8882000 8.172000 0.6559000 12.46000 1.651000  -4.285000      1.776000  
1 1 1 26 43 9  o 8.052000 1.165000  9.325000 0.6403000 6.779000 2.241000  2.546000       2.331000  
1 1 1 26 43 11 o 11.05000 0.8316000 9.513000 0.7580000 12.58000 1.480000  -3.069000      1.663000  
1 1 1 26 43 13 o 16.76000 0.4965000 16.04000 0.5323000 17.49000 0.8384000 -1.451000      0.9931000 
1 1 1 26 43 15 o 7.313000 1.043000  8.556000 1.049000  6.070000 1.803000  2.486000       2.086000  
1 1 1 26 43 17 o 14.70000 0.4802000 14.61000 0.5781000 14.79000 0.7669000 -0.1882000     0.9604000 
1 1 1 26 43 19 o 9.461000 0.7170000 9.718000 0.6939000 9.204000 1.255000  0.5133000      1.434000  
1 1 1 26 43 21 o 10.40000 0.8299000 9.765000 0.7755000 11.04000 1.467000  -1.278000      1.660000  
1 1 1 26 43 23 o 11.79000 0.7266000 11.71000 0.7692000 11.87000 1.233000  -0.1617000     1.453000  
1 1 1 26 43 25 o 4.977000 1.099000  5.020000 1.326000  4.934000 1.753000  0.8601000E-01  2.198000  
1 1 1 26 43 27 o 6.331000 0.9463000 6.173000 1.127000  6.488000 1.521000  -0.3152000     1.893000  
1 1 1 26 43 29 o 5.788000 0.9932000 6.623000 1.129000  4.953000 1.634000  1.670000       1.986000  
1 1 1 26 43 31 o 9.257000 0.7998000 9.835000 0.8876000 8.678000 1.331000  1.157000       1.600000  
1 1 1 26 43 33 o 4.999000 2.076000  ?        ?         4.999000 2.076000  ?              ?         
1 1 1 26 44 0  o 21.89000 1.011000  21.89000 1.011000  21.89000 1.011000  0.000000       0.000000  
1 1 1 26 44 2  o 11.69000 0.7524000 11.89000 0.5961000 11.48000 1.382000  0.4027000      1.505000  
1 1 1 26 44 4  o 9.478000 1.048000  9.950000 0.8028000 9.005000 1.937000  0.9450000      2.097000  
1 1 1 26 44 6  o 3.926000 1.126000  3.672000 1.235000  4.180000 1.883000  -0.5075000     2.252000  
1 1 1 26 44 8  o 4.267000 1.108000  4.046000 1.249000  4.489000 1.831000  -0.4426000     2.216000  
1 1 1 26 44 10 o 6.742000 1.011000  6.663000 1.360000  6.822000 1.496000  -0.1588000     2.021000  
1 1 1 26 44 12 o 3.404000 1.044000  3.512000 1.481000  3.296000 1.473000  0.2155000      2.089000  
1 1 1 26 44 14 f 4.005000 1.064000  3.542000 1.322000  4.468000 1.668000  -0.9256000     2.129000  
1 1 1 26 44 16 o 5.456000 0.9902000 6.420000 1.070000  4.491000 1.666000  1.929000       1.980000  
1 1 1 26 44 18 o 3.882000 0.9378000 4.460000 1.241000  3.303000 1.407000  1.157000       1.876000  
1 1 1 26 44 20 o 3.992000 1.152000  3.197000 1.353000  4.788000 1.865000  -1.591000      2.304000  
1 1 1 26 44 22 o 3.732000 1.031000  2.673000 1.203000  4.791000 1.675000  -2.117000      2.062000  
1 1 1 26 44 24 o 6.065000 1.030000  4.364000 1.391000  7.765000 1.520000  -3.401000      2.060000  
1 1 1 26 44 26 o 5.693000 1.020000  6.651000 1.063000  4.735000 1.741000  1.916000       2.040000  
1 1 1 26 44 28 o 3.418000 0.9278000 4.015000 1.316000  2.820000 1.308000  1.195000       1.856000  
1 1 1 26 44 30 o 3.591000 0.9634000 3.893000 1.284000  3.290000 1.437000  0.6026000      1.927000  
1 1 1 26 45 1  o 3.416000 1.043000  3.989000 1.611000  2.843000 1.325000  1.147000       2.086000  
1 1 1 26 45 3  o 3.664000 1.029000  3.259000 1.402000  4.070000 1.506000  -0.8114000     2.058000  
1 1 1 26 45 5  o 3.874000 0.9141000 4.173000 1.116000  3.575000 1.448000  0.5974000      1.828000  
1 1 1 26 45 7  o 11.02000 0.6038000 10.67000 0.5667000 11.38000 1.066000  -0.7043000     1.208000  
1 1 1 26 45 9  o 9.145000 0.6962000 8.723000 0.7285000 9.567000 1.187000  -0.8441000     1.392000  
1 1 1 26 45 11 o 9.519000 0.7253000 10.48000 0.7025000 8.554000 1.269000  1.930000       1.451000  
1 1 1 26 45 13 o 7.650000 0.9389000 8.613000 0.7017000 6.686000 1.742000  1.927000       1.878000  
1 1 1 26 45 15 o 6.122000 0.9917000 6.535000 0.9757000 5.709000 1.727000  0.8266000      1.983000  
1 1 1 26 45 17 o 3.827000 1.119000  3.583000 1.320000  4.071000 1.808000  -0.4882000     2.238000  
1 1 1 26 45 19 o 3.584000 0.9754000 2.716000 1.169000  4.452000 1.561000  -1.736000      1.951000  
1 1 1 26 45 21 o 9.260000 0.7562000 9.292000 0.7267000 9.228000 1.326000  0.6377000E-01  1.512000  
1 1 1 26 45 23 o 6.566000 0.9561000 5.648000 1.135000  7.483000 1.539000  -1.835000      1.912000  
1 1 1 26 45 25 o 4.822000 1.058000  5.110000 1.360000  4.534000 1.620000  0.5756000      2.115000  
1 1 1 26 45 27 o 6.366000 0.9240000 4.545000 1.308000  8.186000 1.306000  -3.641000      1.848000  
1 1 1 26 45 29 o 4.832000 1.299000  3.440000 1.300000  6.223000 2.250000  -2.783000      2.598000  
1 1 1 26 46 0  o 4.835000 1.605000  4.835000 1.605000  4.835000 1.605000  0.000000       0.000000  
1 1 1 26 46 2  o 4.868000 1.210000  6.331000 1.969000  3.405000 1.408000  2.926000       2.420000  
1 1 1 26 46 4  o 4.411000 0.9390000 4.739000 1.034000  4.082000 1.568000  0.6573000      1.878000  
1 1 1 26 46 6  o 2.830000 0.8955000 2.439000 1.061000  3.221000 1.443000  -0.7821000     1.791000  
1 1 1 26 46 8  o 3.422000 0.9808000 2.610000 1.078000  4.235000 1.639000  -1.626000      1.962000  
1 1 1 26 46 10 o 9.315000 0.8767000 9.511000 0.6249000 9.119000 1.638000  0.3913000      1.753000  
1 1 1 26 46 12 o 5.722000 1.171000  5.508000 1.276000  5.937000 1.963000  -0.4287000     2.341000  
1 1 1 26 46 14 o 13.24000 0.6557000 14.32000 0.5409000 12.16000 1.195000  2.155000       1.311000  
1 1 1 26 46 16 o 6.182000 0.9421000 7.824000 0.8509000 4.541000 1.681000  3.283000       1.884000  
1 1 1 26 46 18 o 4.461000 1.029000  3.250000 1.291000  5.673000 1.603000  -2.424000      2.058000  
1 1 1 26 46 20 o 3.087000 0.9448000 2.080000 0.9965000 4.093000 1.605000  -2.012000      1.890000  
1 1 1 26 46 22 o 3.865000 1.095000  3.587000 1.365000  4.142000 1.711000  -0.5557000     2.189000  
1 1 1 26 46 24 o 3.790000 1.065000  3.325000 1.379000  4.254000 1.623000  -0.9290000     2.130000  
1 1 1 26 46 26 o 4.287000 1.053000  4.125000 1.366000  4.450000 1.604000  -0.3250000     2.106000  
1 1 1 26 47 1  f 5.182000 1.695000  ?        ?         5.182000 1.695000  ?              ?         
1 1 1 26 47 3  o 3.152000 1.002000  2.486000 1.202000  3.819000 1.604000  -1.333000      2.004000  
1 1 1 26 47 5  o 5.917000 1.306000  6.125000 1.638000  5.709000 2.035000  0.4156000      2.612000  
1 1 1 26 47 7  o 3.847000 1.133000  3.515000 1.332000  4.179000 1.834000  -0.6640000     2.266000  
1 1 1 26 47 9  o 3.076000 0.8705000 3.100000 1.096000  3.052000 1.353000  0.4817000E-01  1.741000  
1 1 1 26 47 11 o 4.710000 1.072000  3.319000 1.184000  6.101000 1.787000  -2.782000      2.143000  
1 1 1 26 47 13 o 7.665000 0.7750000 8.188000 0.8096000 7.142000 1.322000  1.046000       1.550000  
1 1 1 26 47 15 o 4.081000 1.062000  2.796000 1.195000  5.366000 1.755000  -2.570000      2.123000  
1 1 1 26 47 17 o 3.930000 0.9778000 3.826000 1.264000  4.035000 1.492000  -0.2091000     1.956000  
1 1 1 26 47 19 o 7.027000 1.023000  6.674000 1.208000  7.380000 1.651000  -0.7062000     2.045000  
1 1 1 26 47 21 o 5.415000 1.059000  5.261000 1.255000  5.569000 1.706000  -0.3083000     2.118000  
1 1 1 26 47 23 o 4.001000 1.054000  3.146000 1.268000  4.857000 1.684000  -1.712000      2.108000  
1 1 1 26 47 25 o 4.554000 1.213000  4.329000 1.308000  4.780000 2.044000  -0.4513000     2.426000  
1 1 1 26 48 0  o 3.167000 1.364000  3.167000 1.364000  3.167000 1.364000  0.000000       0.000000  
1 1 1 26 48 2  o 5.062000 1.250000  6.197000 2.003000  3.927000 1.495000  2.270000       2.499000  
1 1 1 26 48 4  f 7.864000 1.034000  7.783000 1.477000  7.946000 1.448000  -0.1631000     2.068000  
1 1 1 26 48 6  o 12.02000 0.6039000 12.88000 0.5933000 11.17000 1.052000  1.709000       1.208000  
1 1 1 26 48 8  o 5.193000 1.042000  5.671000 1.236000  4.714000 1.677000  0.9575000      2.083000  
1 1 1 26 48 10 o 5.977000 0.9194000 7.667000 0.7364000 4.287000 1.685000  3.381000       1.839000  
1 1 1 26 48 12 o 6.548000 0.9256000 7.250000 0.9005000 5.846000 1.617000  1.404000       1.851000  
1 1 1 26 48 14 o 3.261000 0.9792000 2.872000 1.171000  3.649000 1.570000  -0.7768000     1.958000  
1 1 1 26 48 16 o 3.490000 0.9851000 2.877000 1.211000  4.104000 1.554000  -1.227000      1.970000  
1 1 1 26 48 18 o 3.444000 0.9852000 3.695000 1.321000  3.193000 1.462000  0.5019000      1.970000  
1 1 1 26 48 20 o 7.686000 0.9194000 7.085000 0.9093000 8.287000 1.598000  -1.202000      1.839000  
1 1 1 26 48 22 o 4.905000 1.054000  4.191000 1.400000  5.618000 1.575000  -1.427000      2.107000  
1 1 1 26 49 1  o 5.863000 1.139000  5.291000 1.599000  6.434000 1.622000  -1.143000      2.278000  
1 1 1 26 49 3  o 11.44000 0.6985000 11.92000 0.9483000 10.97000 1.026000  0.9493000      1.397000  
1 1 1 26 49 5  o 9.021000 1.129000  10.88000 1.549000  7.161000 1.643000  3.721000       2.258000  
1 1 1 26 49 7  o 3.172000 1.012000  2.875000 1.368000  3.469000 1.492000  -0.5934000     2.024000  
1 1 1 26 49 9  o 7.085000 1.002000  7.877000 0.9399000 6.293000 1.771000  1.583000       2.005000  
1 1 1 26 49 11 o 3.767000 0.9984000 3.449000 1.222000  4.085000 1.579000  -0.6361000     1.997000  
1 1 1 26 49 13 o 3.220000 0.9670000 2.949000 1.207000  3.491000 1.511000  -0.5421000     1.934000  
1 1 1 26 49 15 f 4.491000 1.028000  4.117000 1.264000  4.865000 1.620000  -0.7478000     2.055000  
1 1 1 26 49 17 o 3.070000 0.9553000 2.847000 1.207000  3.292000 1.481000  -0.4451000     1.911000  
1 1 1 26 49 19 o 3.599000 1.064000  3.092000 1.358000  4.106000 1.639000  -1.014000      2.128000  
1 1 1 26 49 21 o 5.103000 1.898000  5.103000 1.898000  ?        ?         ?              ?         
1 1 1 26 50 0  o 4.645000 1.587000  4.645000 1.587000  4.645000 1.587000  0.000000       0.000000  
1 1 1 26 50 2  o 3.303000 1.043000  2.886000 1.325000  3.720000 1.611000  -0.8345000     2.086000  
1 1 1 26 50 4  o 4.504000 1.185000  4.949000 1.695000  4.060000 1.658000  0.8898000      2.371000  
1 1 1 26 50 6  o 3.726000 1.047000  4.558000 1.626000  2.893000 1.319000  1.665000       2.094000  
1 1 1 26 50 8  o 6.270000 1.357000  7.735000 2.063000  4.804000 1.765000  2.931000       2.714000  
1 1 1 26 50 10 o 3.831000 1.075000  3.516000 1.491000  4.146000 1.548000  -0.6309000     2.149000  
1 1 1 26 50 12 o 5.614000 1.056000  6.653000 1.082000  4.575000 1.813000  2.078000       2.111000  
1 1 1 26 50 14 o 6.941000 0.8680000 8.144000 0.8540000 5.738000 1.511000  2.406000       1.736000  
1 1 1 26 50 16 o 5.476000 1.063000  5.519000 1.136000  5.433000 1.797000  0.8553000E-01  2.126000  
1 1 1 26 50 18 o 4.003000 1.238000  4.631000 1.965000  3.374000 1.506000  1.258000       2.476000  
1 1 1 26 51 1  o 5.160000 1.194000  5.630000 1.656000  4.689000 1.721000  0.9408000      2.388000  
1 1 1 26 51 3  o 5.262000 1.052000  4.005000 1.483000  6.518000 1.493000  -2.513000      2.104000  
1 1 1 26 51 5  o 5.624000 1.165000  7.027000 1.662000  4.220000 1.634000  2.807000       2.331000  
1 1 1 26 51 7  f 4.268000 1.255000  4.585000 1.953000  3.952000 1.576000  0.6340000      2.510000  
1 1 1 26 51 9  o 5.221000 1.344000  4.320000 1.595000  6.121000 2.162000  -1.801000      2.687000  
1 1 1 26 51 11 o 4.396000 1.216000  4.014000 1.728000  4.778000 1.711000  -0.7635000     2.431000  
1 1 1 26 51 13 o 3.391000 1.026000  3.024000 1.349000  3.758000 1.547000  -0.7338000     2.053000  
1 1 1 26 52 0  o 4.151000 1.601000  4.151000 1.601000  4.151000 1.601000  0.000000       0.000000  
1 1 1 26 52 2  o 4.104000 1.107000  3.203000 1.441000  5.005000 1.681000  -1.802000      2.215000  
1 1 1 26 52 4  o 3.321000 0.9844000 4.077000 1.546000  2.566000 1.219000  1.511000       1.969000  
1 1 1 26 52 6  o 4.314000 1.182000  4.335000 1.641000  4.292000 1.702000  0.4289000E-01  2.364000  
1 1 1 26 52 8  o 7.174000 1.370000  8.416000 2.244000  5.933000 1.571000  2.483000       2.739000  
1 1 1 27 0  1  o 4.187000 1.204000  4.187000 1.204000  4.187000 1.204000  0.000000       0.000000  
1 1 1 27 0  3  o 70.86000 0.7178000 70.86000 0.7178000 70.86000 0.7178000 0.000000       0.000000  
1 1 1 27 0  5  o 69.81000 0.7077000 69.81000 0.7077000 69.81000 0.7077000 0.000000       0.000000  
1 1 1 27 0  7  o 11.19000 0.5017000 11.19000 0.5017000 11.19000 0.5017000 0.000000       0.000000  
1 1 1 27 0  9  o 59.84000 0.7185000 59.84000 0.7185000 59.84000 0.7185000 0.000000       0.000000  
1 1 1 27 0  11 o 45.58000 0.5087000 45.58000 0.5087000 45.58000 0.5087000 0.000000       0.000000  
1 1 1 27 0  13 o 21.77000 0.4032000 21.77000 0.4032000 21.77000 0.4032000 0.000000       0.000000  
1 1 1 27 0  15 o 13.70000 0.4940000 13.70000 0.4940000 13.70000 0.4940000 0.000000       0.000000  
1 1 1 27 0  17 o 8.779000 0.8034000 8.779000 0.8034000 8.779000 0.8034000 0.000000       0.000000  
1 1 1 27 0  19 o 60.07000 0.6313000 60.07000 0.6313000 60.07000 0.6313000 0.000000       0.000000  
1 1 1 27 0  21 o 3.861000 1.331000  3.861000 1.331000  3.861000 1.331000  0.000000       0.000000  
1 1 1 27 0  23 o 30.38000 0.4549000 30.38000 0.4549000 30.38000 0.4549000 0.000000       0.000000  
1 1 1 27 0  25 f 21.39000 0.4615000 21.39000 0.4615000 21.39000 0.4615000 0.000000       0.000000  
1 1 1 27 0  27 o 5.671000 1.313000  5.671000 1.313000  5.671000 1.313000  0.000000       0.000000  
1 1 1 27 0  29 o 2.915000 1.311000  2.915000 1.311000  2.915000 1.311000  0.000000       0.000000  
1 1 1 27 0  31 o 25.89000 0.6326000 25.89000 0.6326000 25.89000 0.6326000 0.000000       0.000000  
1 1 1 27 0  33 f 11.94000 0.6575000 11.94000 0.6575000 11.94000 0.6575000 0.000000       0.000000  
1 1 1 27 0  35 o 24.20000 0.5653000 24.20000 0.5653000 24.20000 0.5653000 0.000000       0.000000  
1 1 1 27 0  37 o 5.413000 1.350000  5.413000 1.350000  5.413000 1.350000  0.000000       0.000000  
1 1 1 27 0  39 o 20.04000 0.5734000 20.04000 0.5734000 20.04000 0.5734000 0.000000       0.000000  
1 1 1 27 0  41 o 2.822000 1.223000  2.822000 1.223000  2.822000 1.223000  0.000000       0.000000  
1 1 1 27 0  43 o 5.189000 1.230000  5.189000 1.230000  5.189000 1.230000  0.000000       0.000000  
1 1 1 27 0  45 o 4.042000 1.311000  4.042000 1.311000  4.042000 1.311000  0.000000       0.000000  
1 1 1 27 0  47 f 2.766000 1.227000  2.766000 1.227000  2.766000 1.227000  0.000000       0.000000  
1 1 1 27 0  49 o 6.405000 2.240000  6.405000 2.240000  6.405000 2.240000  0.000000       0.000000  
1 1 1 27 0  51 o 3.647000 1.369000  3.647000 1.369000  3.647000 1.369000  0.000000       0.000000  
1 1 1 27 0  53 o 3.695000 1.530000  3.695000 1.530000  3.695000 1.530000  0.000000       0.000000  
1 1 1 27 0  55 o 3.031000 1.304000  3.031000 1.304000  3.031000 1.304000  0.000000       0.000000  
1 1 1 27 1  0  o 19.54000 0.4160000 19.54000 0.4160000 19.54000 0.4160000 0.000000       0.000000  
1 1 1 27 1  2  o 37.87000 0.3178000 37.94000 0.4510000 37.81000 0.4481000 0.1339000      0.6357000 
1 1 1 27 1  4  o 31.09000 0.3157000 31.08000 0.4150000 31.11000 0.4759000 -0.2475000E-01 0.6314000 
1 1 1 27 1  6  o 41.07000 0.3622000 40.91000 0.4728000 41.23000 0.5488000 -0.3207000     0.7244000 
1 1 1 27 1  8  o 19.81000 0.3155000 19.83000 0.4070000 19.79000 0.4820000 0.4300000E-01  0.6309000 
1 1 1 27 1  10 o 14.42000 0.3530000 14.70000 0.4408000 14.14000 0.5515000 0.5595000      0.7061000 
1 1 1 27 1  12 f 30.83000 0.3190000 30.94000 0.4234000 30.73000 0.4772000 0.2052000      0.6380000 
1 1 1 27 1  14 o 19.63000 0.3176000 19.53000 0.4151000 19.73000 0.4807000 -0.2017000     0.6352000 
1 1 1 27 1  16 o 5.934000 0.7082000 6.013000 0.9955000 5.856000 1.008000  0.1569000      1.416000  
1 1 1 27 1  18 o 19.81000 0.3435000 18.99000 0.4511000 20.62000 0.5181000 -1.628000      0.6869000 
1 1 1 27 1  20 o 17.64000 0.3299000 17.54000 0.4663000 17.74000 0.4670000 -0.2001000     0.6599000 
1 1 1 27 1  22 o 17.63000 0.3732000 17.96000 0.5325000 17.30000 0.5231000 0.6570000      0.7464000 
1 1 1 27 1  24 o 24.57000 0.3096000 24.70000 0.4345000 24.44000 0.4413000 0.2596000      0.6193000 
1 1 1 27 1  26 o 19.53000 0.3408000 19.84000 0.4805000 19.21000 0.4835000 0.6367000      0.6817000 
1 1 1 27 1  28 o 38.08000 0.3959000 38.54000 0.5687000 37.62000 0.5511000 0.9196000      0.7919000 
1 1 1 27 1  30 o 3.084000 0.9235000 3.359000 1.357000  2.810000 1.253000  0.5487000      1.847000  
1 1 1 27 1  32 o 12.52000 0.4752000 12.62000 0.7040000 12.42000 0.6386000 0.1983000      0.9505000 
1 1 1 27 1  34 o 9.692000 0.6337000 10.15000 0.6608000 9.235000 1.082000  0.9124000      1.267000  
1 1 1 27 1  36 o 14.03000 0.4468000 14.74000 0.6747000 13.33000 0.5859000 1.405000       0.8936000 
1 1 1 27 1  38 o 4.533000 1.020000  4.150000 1.393000  4.917000 1.491000  -0.7673000     2.041000  
1 1 1 27 1  40 o 13.40000 0.4477000 13.25000 0.6964000 13.56000 0.5629000 -0.3182000     0.8954000 
1 1 1 27 1  42 o 7.660000 0.6388000 7.986000 0.8755000 7.333000 0.9303000 0.6528000      1.278000  
1 1 1 27 1  44 o 4.612000 0.9411000 4.058000 1.408000  5.166000 1.250000  -1.108000      1.882000  
1 1 1 27 1  46 o 13.73000 0.4432000 13.71000 0.6536000 13.75000 0.5987000 -0.4137000E-01 0.8864000 
1 1 1 27 1  48 f 9.948000 0.6211000 9.828000 0.9749000 10.07000 0.7699000 -0.2406000     1.242000  
1 1 1 27 1  50 o 4.261000 1.024000  3.847000 1.409000  4.675000 1.487000  -0.8279000     2.049000  
1 1 1 27 1  52 o 4.459000 1.038000  3.593000 1.395000  5.326000 1.536000  -1.733000      2.075000  
1 1 1 27 1  54 o 5.335000 0.9798000 5.310000 1.366000  5.359000 1.405000  -0.4854000E-01 1.960000  
1 1 1 27 2  1  o 31.18000 0.3168000 31.32000 0.4179000 31.04000 0.4763000 0.2892000      0.6336000 
1 1 1 27 2  3  o 12.97000 0.3743000 12.87000 0.4893000 13.07000 0.5666000 -0.2008000     0.7487000 
1 1 1 27 2  5  o 13.19000 0.4339000 13.57000 0.4584000 12.81000 0.7368000 0.7585000      0.8678000 
1 1 1 27 2  7  o 16.90000 0.3094000 16.95000 0.4368000 16.84000 0.4383000 0.1074000      0.6188000 
1 1 1 27 2  9  o 31.32000 0.2948000 31.51000 0.4206000 31.12000 0.4131000 0.3969000      0.5895000 
1 1 1 27 2  11 o 20.82000 0.2822000 21.11000 0.3979000 20.53000 0.4005000 0.5835000      0.5645000 
1 1 1 27 2  13 o 17.94000 0.3031000 18.32000 0.4257000 17.55000 0.4317000 0.7636000      0.6063000 
1 1 1 27 2  15 o 16.79000 0.3418000 16.95000 0.4381000 16.63000 0.5247000 0.3249000      0.6835000 
1 1 1 27 2  17 o 19.04000 0.3481000 19.02000 0.4983000 19.06000 0.4863000 -0.4479000E-01 0.6963000 
1 1 1 27 2  19 o 39.00000 0.3680000 39.37000 0.4894000 38.63000 0.5496000 0.7430000      0.7359000 
1 1 1 27 2  21 o 21.89000 0.3294000 21.71000 0.4350000 22.07000 0.4947000 -0.3580000     0.6588000 
1 1 1 27 2  23 o 23.29000 0.3340000 23.28000 0.5002000 23.31000 0.4427000 -0.2515000E-01 0.6679000 
1 1 1 27 2  25 f 27.28000 0.3570000 27.33000 0.5081000 27.22000 0.5018000 0.1132000      0.7141000 
1 1 1 27 2  27 o 26.77000 0.3237000 26.39000 0.4551000 27.15000 0.4603000 -0.7562000     0.6473000 
1 1 1 27 2  29 o 27.58000 0.3205000 27.35000 0.4545000 27.80000 0.4520000 -0.4415000     0.6410000 
1 1 1 27 2  31 o 20.33000 0.3738000 19.90000 0.4973000 20.75000 0.5582000 -0.8547000     0.7476000 
1 1 1 27 2  33 o 14.17000 0.4504000 14.69000 0.5462000 13.66000 0.7163000 1.031000       0.9008000 
1 1 1 27 2  35 o 4.925000 0.9448000 5.077000 1.389000  4.772000 1.281000  0.3053000      1.890000  
1 1 1 27 2  37 o 5.851000 1.056000  5.187000 1.664000  6.515000 1.300000  -1.328000      2.112000  
1 1 1 27 2  39 o 10.83000 0.5014000 11.91000 0.6571000 9.753000 0.7576000 2.153000       1.003000  
1 1 1 27 2  41 o 10.20000 0.5666000 9.992000 0.8873000 10.41000 0.7048000 -0.4139000     1.133000  
1 1 1 27 2  43 o 7.978000 0.6039000 8.113000 0.8439000 7.843000 0.8640000 0.2695000      1.208000  
1 1 1 27 2  45 o 13.24000 0.4354000 13.36000 0.6256000 13.12000 0.6057000 0.2394000      0.8708000 
1 1 1 27 2  47 o 10.90000 0.5350000 10.04000 0.7631000 11.75000 0.7501000 -1.708000      1.070000  
1 1 1 27 2  49 o 6.443000 0.8696000 7.625000 1.131000  5.261000 1.321000  2.364000       1.739000  
1 1 1 27 2  51 o 13.30000 0.5470000 12.54000 0.8065000 14.06000 0.7392000 -1.513000      1.094000  
1 1 1 27 2  53 o 3.145000 0.8942000 2.467000 1.151000  3.824000 1.369000  -1.357000      1.788000  
1 1 1 27 2  55 o 3.483000 0.9836000 3.724000 1.439000  3.243000 1.341000  0.4807000      1.967000  
1 1 1 27 3  0  o 18.21000 0.4821000 18.21000 0.4821000 18.21000 0.4821000 0.000000       0.000000  
1 1 1 27 3  2  o 46.30000 0.3903000 46.31000 0.5886000 46.28000 0.5126000 0.3441000E-01  0.7806000 
1 1 1 27 3  4  o 10.23000 0.4010000 10.14000 0.5751000 10.32000 0.5589000 -0.1821000     0.8019000 
1 1 1 27 3  6  o 49.33000 0.3778000 49.59000 0.5369000 49.06000 0.5316000 0.5282000      0.7556000 
1 1 1 27 3  8  o 24.65000 0.2818000 24.86000 0.4032000 24.45000 0.3937000 0.4053000      0.5635000 
1 1 1 27 3  10 o 15.56000 0.3192000 15.69000 0.4563000 15.43000 0.4464000 0.2655000      0.6383000 
1 1 1 27 3  12 o 22.00000 0.2850000 21.98000 0.4025000 22.02000 0.4036000 -0.4660000E-01 0.5700000 
1 1 1 27 3  14 o 41.65000 0.3417000 41.60000 0.4815000 41.70000 0.4849000 -0.9834000E-01 0.6834000 
1 1 1 27 3  16 f 39.84000 0.3595000 39.27000 0.5402000 40.41000 0.4744000 -1.138000      0.7190000 
1 1 1 27 3  18 o 51.32000 0.4284000 50.93000 0.5568000 51.71000 0.6510000 -0.7825000     0.8567000 
1 1 1 27 3  20 o 17.02000 0.4024000 17.55000 0.4684000 16.48000 0.6545000 1.062000       0.8048000 
1 1 1 27 3  22 o 39.23000 0.4376000 38.81000 0.5512000 39.65000 0.6799000 -0.8432000     0.8752000 
1 1 1 27 3  24 o 24.15000 0.3168000 23.94000 0.4489000 24.36000 0.4471000 -0.4137000     0.6336000 
1 1 1 27 3  26 o 8.813000 0.5592000 8.543000 0.7739000 9.084000 0.8074000 -0.5408000     1.118000  
1 1 1 27 3  28 o 8.062000 0.6489000 8.465000 0.8660000 7.660000 0.9666000 0.8048000      1.298000  
1 1 1 27 3  30 o 18.74000 0.3897000 18.66000 0.4959000 18.82000 0.6011000 -0.1599000     0.7793000 
1 1 1 27 3  32 o 3.701000 0.9975000 3.273000 1.286000  4.128000 1.526000  -0.8554000     1.995000  
1 1 1 27 3  34 o 25.62000 0.3857000 25.51000 0.4139000 25.74000 0.6510000 -0.2310000     0.7715000 
1 1 1 27 3  36 o 5.289000 0.9365000 5.175000 1.356000  5.402000 1.293000  -0.2270000     1.873000  
1 1 1 27 3  38 o 15.57000 0.4758000 15.39000 0.7690000 15.76000 0.5606000 -0.3750000     0.9516000 
1 1 1 27 3  40 o 20.01000 0.3751000 19.96000 0.5306000 20.05000 0.5305000 -0.9361000E-01 0.7503000 
1 1 1 27 3  42 o 10.74000 0.5295000 10.29000 0.8477000 11.19000 0.6349000 -0.8991000     1.059000  
1 1 1 27 3  44 o 3.470000 0.9538000 3.375000 1.349000  3.566000 1.349000  -0.1902000     1.908000  
1 1 1 27 3  46 o 7.369000 0.7637000 6.807000 1.239000  7.931000 0.8932000 -1.124000      1.527000  
1 1 1 27 3  48 o 10.04000 0.5690000 10.61000 0.7764000 9.476000 0.8320000 1.135000       1.138000  
1 1 1 27 3  50 o 6.017000 0.9331000 5.713000 1.319000  6.321000 1.320000  -0.6081000     1.866000  
1 1 1 27 3  52 o 6.630000 0.9217000 6.509000 1.443000  6.752000 1.148000  -0.2426000     1.843000  
1 1 1 27 3  54 o 9.134000 0.6021000 9.430000 0.8686000 8.838000 0.8339000 0.5915000      1.204000  
1 1 1 27 4  1  o 26.44000 0.3034000 26.03000 0.4550000 26.85000 0.4015000 -0.8167000     0.6068000 
1 1 1 27 4  3  o 69.80000 0.5413000 69.92000 0.8189000 69.68000 0.7082000 0.2459000      1.083000  
1 1 1 27 4  5  o 54.70000 0.4087000 55.30000 0.5835000 54.10000 0.5724000 1.194000       0.8174000 
1 1 1 27 4  7  o 34.23000 0.3048000 34.53000 0.4346000 33.92000 0.4275000 0.6019000      0.6096000 
1 1 1 27 4  9  o 31.60000 0.2949000 31.67000 0.4165000 31.53000 0.4176000 0.1352000      0.5898000 
1 1 1 27 4  11 o 18.33000 0.2980000 18.64000 0.4225000 18.03000 0.4205000 0.6121000      0.5961000 
1 1 1 27 4  13 o 11.00000 0.4046000 11.14000 0.5630000 10.86000 0.5813000 0.2840000      0.8093000 
1 1 1 27 4  15 o 24.65000 0.3123000 24.90000 0.4736000 24.40000 0.4074000 0.4990000      0.6247000 
1 1 1 27 4  17 o 31.45000 0.3053000 31.22000 0.4296000 31.69000 0.4340000 -0.4799000     0.6107000 
1 1 1 27 4  19 o 8.312000 0.6737000 8.438000 0.8563000 8.187000 1.040000  0.2507000      1.347000  
1 1 1 27 4  21 o 19.88000 0.3457000 20.17000 0.4358000 19.58000 0.5367000 0.5854000      0.6914000 
1 1 1 27 4  23 o 22.81000 0.4018000 22.47000 0.6070000 23.15000 0.5265000 -0.6785000     0.8036000 
1 1 1 27 4  25 o 19.26000 0.3367000 19.28000 0.4700000 19.25000 0.4822000 0.2729000E-01  0.6734000 
1 1 1 27 4  27 o 20.47000 0.3218000 20.36000 0.4573000 20.59000 0.4530000 -0.2329000     0.6436000 
1 1 1 27 4  29 f 20.47000 0.3666000 20.61000 0.4675000 20.34000 0.5650000 0.2675000      0.7333000 
1 1 1 27 4  31 o 24.84000 0.3262000 24.34000 0.4649000 25.33000 0.4577000 -0.9828000     0.6524000 
1 1 1 27 4  33 o 15.82000 0.4242000 15.96000 0.5310000 15.68000 0.6616000 0.2763000      0.8483000 
1 1 1 27 4  35 o 11.18000 0.5550000 11.38000 0.5809000 10.98000 0.9459000 0.4037000      1.110000  
1 1 1 27 4  37 o 5.927000 0.8379000 5.073000 1.289000  6.781000 1.071000  -1.707000      1.676000  
1 1 1 27 4  39 o 10.25000 0.5612000 10.17000 0.8823000 10.32000 0.6938000 -0.1506000     1.122000  
1 1 1 27 4  41 o 12.80000 0.4547000 12.71000 0.6808000 12.89000 0.6029000 -0.1785000     0.9094000 
1 1 1 27 4  43 f 3.820000 1.023000  3.489000 1.467000  4.151000 1.425000  -0.6626000     2.045000  
1 1 1 27 4  45 o 11.40000 0.4805000 11.25000 0.6962000 11.55000 0.6624000 -0.3033000     0.9610000 
1 1 1 27 4  47 o 8.516000 0.8087000 7.935000 1.003000  9.098000 1.269000  -1.163000      1.617000  
1 1 1 27 4  49 o 3.122000 0.9687000 3.145000 1.372000  3.100000 1.368000  0.4471000E-01  1.937000  
1 1 1 27 4  51 o 6.140000 0.8554000 6.621000 1.067000  5.659000 1.337000  0.9620000      1.711000  
1 1 1 27 4  53 f 5.216000 1.079000  5.349000 1.655000  5.083000 1.385000  0.2657000      2.158000  
1 1 1 27 4  55 o 5.373000 0.9213000 5.150000 1.374000  5.595000 1.228000  -0.4453000     1.843000  
1 1 1 27 5  0  o 26.55000 0.4013000 26.55000 0.4013000 26.55000 0.4013000 0.000000       0.000000  
1 1 1 27 5  2  o 8.606000 0.4701000 8.675000 0.6668000 8.537000 0.6628000 0.1383000      0.9401000 
1 1 1 27 5  4  o 22.40000 0.3072000 22.68000 0.4646000 22.11000 0.4021000 0.5619000      0.6145000 
1 1 1 27 5  6  f 35.39000 0.3362000 34.91000 0.5100000 35.87000 0.4381000 -0.9596000     0.6723000 
1 1 1 27 5  8  o 51.74000 0.4260000 52.06000 0.6501000 51.42000 0.5506000 0.6429000      0.8519000 
1 1 1 27 5  10 o 11.47000 0.4097000 11.89000 0.6097000 11.04000 0.5475000 0.8486000      0.8194000 
1 1 1 27 5  12 o 37.35000 0.3478000 37.16000 0.5295000 37.54000 0.4511000 -0.3761000     0.6956000 
1 1 1 27 5  14 o 28.49000 0.3640000 28.88000 0.6012000 28.11000 0.4104000 0.7748000      0.7279000 
1 1 1 27 5  16 o 35.70000 0.4068000 35.87000 0.5186000 35.54000 0.6270000 0.3321000      0.8137000 
1 1 1 27 5  18 f 16.68000 0.3631000 16.65000 0.4551000 16.71000 0.5659000 -0.6700000E-01 0.7262000 
1 1 1 27 5  20 o 16.14000 0.3695000 16.53000 0.4853000 15.76000 0.5574000 0.7693000      0.7390000 
1 1 1 27 5  22 o 36.85000 0.3338000 36.16000 0.4667000 37.53000 0.4773000 -1.370000      0.6676000 
1 1 1 27 5  24 o 36.09000 0.3809000 35.89000 0.5279000 36.29000 0.5494000 -0.4097000     0.7619000 
1 1 1 27 5  26 o 29.50000 0.3144000 29.04000 0.4415000 29.96000 0.4477000 -0.9237000     0.6288000 
1 1 1 27 5  28 o 19.42000 0.3654000 19.38000 0.4732000 19.46000 0.5569000 -0.7502000E-01 0.7308000 
1 1 1 27 5  30 o 24.22000 0.3177000 24.17000 0.4507000 24.27000 0.4478000 -0.1030000     0.6353000 
1 1 1 27 5  32 o 34.26000 0.3853000 34.18000 0.5411000 34.34000 0.5487000 -0.1523000     0.7707000 
1 1 1 27 5  34 o 7.098000 0.7557000 7.143000 0.8703000 7.053000 1.236000  0.9086000E-01  1.511000  
1 1 1 27 5  36 o 20.15000 0.3678000 20.49000 0.4043000 19.81000 0.6146000 0.6718000      0.7357000 
1 1 1 27 5  38 o 16.35000 0.3889000 16.67000 0.5731000 16.02000 0.5257000 0.6484000      0.7777000 
1 1 1 27 5  40 o 18.88000 0.3899000 18.85000 0.6087000 18.91000 0.4874000 -0.6226000E-01 0.7797000 
1 1 1 27 5  42 o 11.68000 0.6429000 10.60000 1.152000  12.77000 0.5721000 -2.175000      1.286000  
1 1 1 27 5  44 o 6.742000 0.7025000 6.425000 1.039000  7.060000 0.9458000 -0.6357000     1.405000  
1 1 1 27 5  46 o 9.963000 0.7123000 9.792000 0.9761000 10.13000 1.038000  -0.3434000     1.425000  
1 1 1 27 5  48 o 4.949000 0.9745000 5.433000 1.344000  4.465000 1.411000  0.9684000      1.949000  
1 1 1 27 5  50 o 11.07000 0.5010000 11.06000 0.7134000 11.08000 0.7037000 -0.2026000E-01 1.002000  
1 1 1 27 5  52 o 5.020000 0.9940000 5.186000 1.418000  4.854000 1.393000  0.3323000      1.988000  
1 1 1 27 5  54 o 4.015000 1.019000  3.507000 1.472000  4.523000 1.409000  -1.017000      2.038000  
1 1 1 27 6  1  o 48.03000 0.3722000 47.76000 0.5235000 48.31000 0.5292000 -0.5517000     0.7444000 
1 1 1 27 6  3  o 11.61000 0.4072000 11.26000 0.6287000 11.96000 0.5176000 -0.7018000     0.8143000 
1 1 1 27 6  5  o 45.00000 0.4392000 45.13000 0.7215000 44.86000 0.5010000 0.2657000      0.8784000 
1 1 1 27 6  7  o 34.38000 0.3356000 34.13000 0.5130000 34.63000 0.4328000 -0.4935000     0.6712000 
1 1 1 27 6  9  o 44.33000 0.3531000 44.10000 0.4979000 44.55000 0.5009000 -0.4452000     0.7063000 
1 1 1 27 6  11 o 25.73000 0.2886000 25.96000 0.4162000 25.49000 0.3998000 0.4651000      0.5771000 
1 1 1 27 6  13 o 29.39000 0.3315000 29.54000 0.4667000 29.23000 0.4711000 0.3089000      0.6631000 
1 1 1 27 6  15 o 17.03000 0.4004000 17.16000 0.6643000 16.90000 0.4472000 0.2592000      0.8008000 
1 1 1 27 6  17 f 61.78000 0.4940000 61.51000 0.7462000 62.04000 0.6476000 -0.5342000     0.9880000 
1 1 1 27 6  19 o 6.251000 0.8258000 6.065000 1.262000  6.437000 1.066000  -0.3726000     1.652000  
1 1 1 27 6  21 o 11.22000 0.4453000 11.80000 0.6230000 10.64000 0.6365000 1.152000       0.8906000 
1 1 1 27 6  23 o 22.84000 0.3160000 22.21000 0.4486000 23.47000 0.4451000 -1.254000      0.6319000 
1 1 1 27 6  25 o 4.302000 0.8963000 3.218000 1.317000  5.386000 1.216000  -2.168000      1.793000  
1 1 1 27 6  27 o 13.89000 0.4129000 13.57000 0.5472000 14.20000 0.6184000 -0.6345000     0.8258000 
1 1 1 27 6  29 o 16.20000 0.3689000 16.10000 0.5232000 16.29000 0.5203000 -0.1868000     0.7379000 
1 1 1 27 6  31 o 12.55000 0.4739000 12.07000 0.6167000 13.04000 0.7197000 -0.9654000     0.9478000 
1 1 1 27 6  33 o 20.31000 0.3508000 20.04000 0.4206000 20.57000 0.5616000 -0.5381000     0.7016000 
1 1 1 27 6  35 o 7.981000 0.8783000 8.827000 0.7004000 7.135000 1.611000  1.692000       1.757000  
1 1 1 27 6  37 o 7.692000 0.6218000 7.397000 0.9255000 7.988000 0.8306000 -0.5907000     1.244000  
1 1 1 27 6  39 o 9.494000 0.5232000 9.923000 0.7595000 9.066000 0.7197000 0.8576000      1.046000  
1 1 1 27 6  41 o 3.361000 0.9628000 3.537000 1.457000  3.185000 1.259000  0.3522000      1.926000  
1 1 1 27 6  43 o 3.730000 0.9282000 4.442000 1.361000  3.018000 1.262000  1.424000       1.856000  
1 1 1 27 6  45 o 10.19000 0.5853000 9.653000 0.8142000 10.73000 0.8411000 -1.081000      1.171000  
1 1 1 27 6  47 o 4.613000 0.9974000 4.695000 1.365000  4.531000 1.454000  0.1641000      1.995000  
1 1 1 27 6  49 o 4.657000 1.038000  5.524000 1.490000  3.791000 1.444000  1.734000       2.075000  
1 1 1 27 6  51 o 5.406000 0.9525000 4.573000 1.442000  6.240000 1.244000  -1.667000      1.905000  
1 1 1 27 6  53 o 8.367000 0.6392000 8.496000 0.9166000 8.238000 0.8910000 0.2574000      1.278000  
1 1 1 27 6  55 o 3.415000 0.9570000 3.344000 1.336000  3.486000 1.371000  -0.1427000     1.914000  
1 1 1 27 7  0  o 19.66000 0.4079000 19.66000 0.4079000 19.66000 0.4079000 0.000000       0.000000  
1 1 1 27 7  2  o 36.50000 0.3401000 36.64000 0.5183000 36.36000 0.4406000 0.2755000      0.6803000 
1 1 1 27 7  4  o 32.90000 0.3255000 32.90000 0.4948000 32.90000 0.4230000 -0.8587000E-02 0.6510000 
1 1 1 27 7  6  o 20.75000 0.3092000 20.89000 0.4701000 20.62000 0.4019000 0.2696000      0.6184000 
1 1 1 27 7  8  o 40.55000 0.3355000 40.80000 0.4788000 40.30000 0.4702000 0.5032000      0.6711000 
1 1 1 27 7  10 o 31.92000 0.2966000 32.08000 0.4211000 31.75000 0.4179000 0.3358000      0.5933000 
1 1 1 27 7  12 o 14.29000 0.3562000 14.95000 0.5187000 13.63000 0.4882000 1.324000       0.7123000 
1 1 1 27 7  14 o 24.54000 0.2880000 24.44000 0.4107000 24.64000 0.4039000 -0.1919000     0.5761000 
1 1 1 27 7  16 o 40.24000 0.3376000 40.36000 0.4781000 40.11000 0.4769000 0.2494000      0.6753000 
1 1 1 27 7  18 o 34.15000 0.3363000 33.58000 0.4376000 34.72000 0.5107000 -1.143000      0.6726000 
1 1 1 27 7  20 o 6.985000 0.8085000 7.723000 1.094000  6.247000 1.191000  1.475000       1.617000  
1 1 1 27 7  22 o 10.71000 0.4744000 10.36000 0.6759000 11.06000 0.6659000 -0.6981000     0.9488000 
1 1 1 27 7  24 o 8.338000 0.7391000 6.444000 1.212000  10.23000 0.8461000 -3.788000      1.478000  
1 1 1 27 7  26 o 3.889000 0.8857000 5.036000 1.282000  2.741000 1.223000  2.295000       1.771000  
1 1 1 27 7  28 o 18.36000 0.3698000 18.83000 0.4818000 17.89000 0.5611000 0.9408000      0.7396000 
1 1 1 27 7  30 o 12.04000 0.4938000 12.55000 0.6114000 11.54000 0.7755000 1.014000       0.9876000 
1 1 1 27 7  32 o 10.33000 0.5364000 10.45000 0.6561000 10.22000 0.8487000 0.2233000      1.073000  
1 1 1 27 7  34 o 8.494000 0.5987000 8.344000 0.7461000 8.644000 0.9366000 -0.2995000     1.197000  
1 1 1 27 7  36 o 5.766000 0.8234000 6.873000 0.8445000 4.658000 1.414000  2.214000       1.647000  
1 1 1 27 7  38 o 5.758000 0.8814000 5.024000 1.461000  6.492000 0.9864000 -1.468000      1.763000  
1 1 1 27 7  40 o 5.531000 0.8854000 5.643000 1.247000  5.420000 1.257000  0.2230000      1.771000  
1 1 1 27 7  42 f 4.843000 0.9626000 4.227000 1.497000  5.458000 1.211000  -1.231000      1.925000  
1 1 1 27 7  44 o 4.257000 0.9951000 3.689000 1.379000  4.826000 1.435000  -1.136000      1.990000  
1 1 1 27 7  46 o 6.235000 0.8024000 6.520000 1.083000  5.950000 1.184000  0.5697000      1.605000  
1 1 1 27 7  48 o 16.89000 0.3814000 16.49000 0.5433000 17.29000 0.5355000 -0.7948000     0.7628000 
1 1 1 27 7  50 o 6.699000 0.8013000 6.271000 1.153000  7.127000 1.113000  -0.8559000     1.603000  
1 1 1 27 7  52 o 3.603000 0.9871000 3.077000 1.311000  4.128000 1.476000  -1.051000      1.974000  
1 1 1 27 7  54 o 4.744000 0.9737000 5.846000 1.371000  3.643000 1.383000  2.203000       1.947000  
1 1 1 27 8  1  o 23.89000 0.3365000 23.73000 0.4773000 24.05000 0.4744000 -0.3265000     0.6729000 
1 1 1 27 8  3  o 46.02000 0.3613000 46.11000 0.5103000 45.93000 0.5117000 0.1808000      0.7226000 
1 1 1 27 8  5  o 38.30000 0.3220000 37.99000 0.4535000 38.61000 0.4572000 -0.6238000     0.6440000 
1 1 1 27 8  7  o 12.18000 0.3890000 12.42000 0.5852000 11.95000 0.5127000 0.4623000      0.7780000 
1 1 1 27 8  9  o 20.92000 0.3261000 20.77000 0.4522000 21.06000 0.4701000 -0.2928000     0.6522000 
1 1 1 27 8  11 o 33.48000 0.3259000 33.50000 0.4914000 33.47000 0.4281000 0.2631000E-01  0.6517000 
1 1 1 27 8  13 o 47.96000 0.3727000 48.12000 0.5284000 47.79000 0.5257000 0.3267000      0.7454000 
1 1 1 27 8  15 o 34.87000 0.3142000 34.87000 0.4413000 34.87000 0.4474000 0.5074000E-03  0.6284000 
1 1 1 27 8  17 o 39.74000 0.3620000 39.49000 0.4733000 39.99000 0.5478000 -0.5064000     0.7239000 
1 1 1 27 8  19 o 31.23000 0.3394000 31.11000 0.4342000 31.35000 0.5217000 -0.2377000     0.6787000 
1 1 1 27 8  21 o 14.42000 0.4388000 14.48000 0.6360000 14.36000 0.6047000 0.1178000      0.8776000 
1 1 1 27 8  23 o 27.56000 0.3686000 27.65000 0.5318000 27.48000 0.5105000 0.1675000      0.7372000 
1 1 1 27 8  25 o 42.32000 0.4311000 42.12000 0.6992000 42.52000 0.5046000 -0.4040000     0.8623000 
1 1 1 27 8  27 o 26.39000 0.3151000 26.69000 0.4481000 26.09000 0.4433000 0.6086000      0.6303000 
1 1 1 27 8  29 o 10.00000 0.5901000 10.88000 0.7946000 9.119000 0.8727000 1.763000       1.180000  
1 1 1 27 8  31 o 16.62000 0.3940000 16.43000 0.5139000 16.81000 0.5973000 -0.3776000     0.7880000 
1 1 1 27 8  33 o 11.91000 0.4650000 11.90000 0.5667000 11.92000 0.7374000 -0.2719000E-01 0.9300000 
1 1 1 27 8  35 o 5.070000 1.007000  5.241000 1.114000  4.899000 1.677000  0.3418000      2.013000  
1 1 1 27 8  37 o 7.984000 0.6353000 7.697000 0.8140000 8.271000 0.9757000 -0.5739000     1.271000  
1 1 1 27 8  39 o 25.08000 0.3259000 26.05000 0.4639000 24.12000 0.4579000 1.923000       0.6518000 
1 1 1 27 8  41 o 10.61000 0.4611000 10.87000 0.6632000 10.36000 0.6409000 0.5076000      0.9223000 
1 1 1 27 8  43 o 4.020000 1.035000  3.767000 1.459000  4.273000 1.469000  -0.5065000     2.070000  
1 1 1 27 8  45 o 8.999000 0.6198000 8.693000 0.9693000 9.305000 0.7727000 -0.6123000     1.240000  
1 1 1 27 8  47 o 11.75000 0.5686000 11.96000 0.6726000 11.54000 0.9170000 0.4213000      1.137000  
1 1 1 27 8  49 o 5.149000 0.9980000 5.252000 1.426000  5.046000 1.396000  0.2057000      1.996000  
1 1 1 27 8  51 o 6.283000 0.8819000 7.056000 1.114000  5.510000 1.367000  1.546000       1.764000  
1 1 1 27 8  53 o 3.021000 0.9141000 3.010000 1.304000  3.032000 1.282000  -0.2223000E-01 1.828000  
1 1 1 27 8  55 f 7.337000 1.119000  7.568000 1.588000  7.105000 1.578000  0.4627000      2.239000  
1 1 1 27 9  0  f 47.99000 0.6154000 47.99000 0.6154000 47.99000 0.6154000 0.000000       0.000000  
1 1 1 27 9  2  o 15.63000 0.3546000 15.74000 0.4475000 15.52000 0.5501000 0.2176000      0.7091000 
1 1 1 27 9  4  o 16.97000 0.3040000 17.06000 0.4208000 16.88000 0.4389000 0.1777000      0.6081000 
1 1 1 27 9  6  o 48.06000 0.4243000 47.99000 0.6013000 48.13000 0.5988000 -0.1364000     0.8486000 
1 1 1 27 9  8  o 31.92000 0.3587000 31.69000 0.5822000 32.15000 0.4191000 -0.4641000     0.7174000 
1 1 1 27 9  10 o 9.909000 0.4573000 10.93000 0.6262000 8.887000 0.6666000 2.045000       0.9146000 
1 1 1 27 9  12 o 23.72000 0.2840000 23.77000 0.4005000 23.67000 0.4028000 0.9967000E-01  0.5680000 
1 1 1 27 9  14 o 25.55000 0.2913000 25.95000 0.4117000 25.16000 0.4121000 0.7971000      0.5825000 
1 1 1 27 9  16 o 43.15000 0.3777000 42.13000 0.4861000 44.17000 0.5782000 -2.046000      0.7554000 
1 1 1 27 9  18 o 33.15000 0.3128000 33.17000 0.4417000 33.12000 0.4429000 0.5160000E-01  0.6255000 
1 1 1 27 9  20 o 35.14000 0.4071000 35.12000 0.4570000 35.17000 0.6738000 -0.4835000E-01 0.8141000 
1 1 1 27 9  22 o 23.68000 0.3028000 23.92000 0.4286000 23.44000 0.4277000 0.4780000      0.6055000 
1 1 1 27 9  24 o 16.26000 0.4009000 16.25000 0.6186000 16.27000 0.5102000 -0.2073000E-01 0.8018000 
1 1 1 27 9  26 o 38.45000 0.3439000 38.51000 0.4922000 38.40000 0.4804000 0.1076000      0.6878000 
1 1 1 27 9  28 o 11.79000 0.4621000 11.26000 0.5981000 12.32000 0.7045000 -1.054000      0.9242000 
1 1 1 27 9  30 o 12.59000 0.4546000 12.35000 0.6034000 12.83000 0.6800000 -0.4825000     0.9091000 
1 1 1 27 9  32 o 20.29000 0.3417000 20.13000 0.4114000 20.45000 0.5456000 -0.3153000     0.6833000 
1 1 1 27 9  34 o 8.050000 0.6872000 7.903000 0.7849000 8.196000 1.128000  -0.2932000     1.374000  
1 1 1 27 9  36 o 13.20000 0.4595000 13.47000 0.6510000 12.93000 0.6486000 0.5407000      0.9190000 
1 1 1 27 9  38 o 5.624000 0.8732000 5.618000 1.253000  5.630000 1.217000  -0.1196000E-01 1.746000  
1 1 1 27 9  40 o 15.98000 0.3635000 15.79000 0.5225000 16.17000 0.5056000 -0.3862000     0.7271000 
1 1 1 27 9  42 o 11.27000 0.5184000 12.11000 0.6223000 10.43000 0.8293000 1.677000       1.037000  
1 1 1 27 9  44 o 8.871000 0.6064000 9.348000 0.8741000 8.394000 0.8406000 0.9539000      1.213000  
1 1 1 27 9  46 o 12.78000 0.4563000 12.39000 0.6784000 13.16000 0.6103000 -0.7722000     0.9126000 
1 1 1 27 9  48 o 8.999000 0.5763000 9.088000 0.8087000 8.911000 0.8213000 0.1773000      1.153000  
1 1 1 27 9  50 f 5.701000 0.8660000 4.725000 1.309000  6.678000 1.134000  -1.952000      1.732000  
1 1 1 27 9  52 o 11.62000 0.4917000 10.45000 0.7245000 12.80000 0.6649000 -2.348000      0.9834000 
1 1 1 27 9  54 o 4.699000 1.018000  4.993000 1.452000  4.404000 1.426000  0.5890000      2.035000  
1 1 1 27 10 1  o 29.21000 0.2930000 29.58000 0.4161000 28.84000 0.4127000 0.7379000      0.5860000 
1 1 1 27 10 3  o 38.26000 0.3928000 38.10000 0.4529000 38.42000 0.6418000 -0.3261000     0.7855000 
1 1 1 27 10 5  o 24.46000 0.3059000 24.71000 0.4583000 24.21000 0.4054000 0.4947000      0.6119000 
1 1 1 27 10 7  o 36.95000 0.3871000 37.46000 0.6323000 36.44000 0.4466000 1.012000       0.7741000 
1 1 1 27 10 9  o 5.676000 0.6873000 6.221000 0.8963000 5.132000 1.042000  1.089000       1.375000  
1 1 1 27 10 11 o 22.79000 0.2854000 23.14000 0.4040000 22.45000 0.4031000 0.6891000      0.5707000 
1 1 1 27 10 13 o 11.03000 0.4014000 11.30000 0.5390000 10.77000 0.5949000 0.5343000      0.8028000 
1 1 1 27 10 15 o 17.45000 0.3280000 17.49000 0.4384000 17.41000 0.4879000 0.8179000E-01  0.6559000 
1 1 1 27 10 17 o 7.233000 0.6835000 7.770000 0.7676000 6.695000 1.131000  1.075000       1.367000  
1 1 1 27 10 19 o 22.10000 0.3323000 21.91000 0.4184000 22.30000 0.5163000 -0.3946000     0.6646000 
1 1 1 27 10 21 o 7.302000 0.6935000 6.645000 1.003000  7.960000 0.9584000 -1.315000      1.387000  
1 1 1 27 10 23 o 19.43000 0.3328000 19.57000 0.4776000 19.28000 0.4635000 0.2902000      0.6655000 
1 1 1 27 10 25 o 42.52000 0.4290000 41.55000 0.6898000 43.49000 0.5101000 -1.947000      0.8579000 
1 1 1 27 10 27 o 10.81000 0.5376000 11.61000 0.6556000 10.02000 0.8522000 1.597000       1.075000  
1 1 1 27 10 29 o 17.33000 0.3535000 17.32000 0.4254000 17.34000 0.5648000 -0.2020000E-01 0.7070000 
1 1 1 27 10 31 o 10.87000 0.4967000 10.44000 0.6243000 11.30000 0.7727000 -0.8598000     0.9934000 
1 1 1 27 10 33 o 16.20000 0.3647000 15.86000 0.4482000 16.54000 0.5754000 -0.6778000     0.7294000 
1 1 1 27 10 35 o 15.58000 0.4417000 15.19000 0.4788000 15.96000 0.7425000 -0.7634000     0.8835000 
1 1 1 27 10 37 o 7.481000 0.6097000 6.790000 0.8407000 8.172000 0.8831000 -1.382000      1.219000  
1 1 1 27 10 39 o 3.074000 0.8824000 3.349000 1.300000  2.800000 1.193000  0.5489000      1.765000  
1 1 1 27 10 41 o 8.325000 0.6035000 8.414000 0.7546000 8.236000 0.9420000 0.1775000      1.207000  
1 1 1 27 10 43 o 4.398000 0.9072000 3.486000 1.334000  5.310000 1.230000  -1.824000      1.814000  
1 1 1 27 10 45 o 8.002000 0.7556000 7.934000 1.212000  8.071000 0.9022000 -0.1369000     1.511000  
1 1 1 27 10 47 o 4.352000 1.047000  3.294000 1.317000  5.410000 1.629000  -2.116000      2.095000  
1 1 1 27 10 49 o 9.042000 0.6291000 9.069000 0.9347000 9.014000 0.8423000 0.5577000E-01  1.258000  
1 1 1 27 10 51 o 4.504000 0.9673000 5.643000 1.400000  3.366000 1.335000  2.277000       1.935000  
1 1 1 27 10 53 o 3.688000 0.9736000 3.659000 1.372000  3.717000 1.382000  -0.5796000E-01 1.947000  
1 1 1 27 11 0  o 11.84000 0.5385000 11.84000 0.5385000 11.84000 0.5385000 0.000000       0.000000  
1 1 1 27 11 2  o 59.03000 0.4993000 59.36000 0.7111000 58.71000 0.7012000 0.6545000      0.9986000 
1 1 1 27 11 4  o 24.68000 0.3886000 25.26000 0.6021000 24.10000 0.4915000 1.158000       0.7772000 
1 1 1 27 11 6  o 23.62000 0.3208000 24.21000 0.4585000 23.03000 0.4488000 1.180000       0.6416000 
1 1 1 27 11 8  o 30.52000 0.3189000 30.37000 0.4829000 30.67000 0.4166000 -0.3055000     0.6378000 
1 1 1 27 11 10 o 31.46000 0.3185000 31.51000 0.4223000 31.41000 0.4769000 0.1036000      0.6370000 
1 1 1 27 11 12 o 24.90000 0.2881000 25.08000 0.4077000 24.73000 0.4071000 0.3423000      0.5762000 
1 1 1 27 11 14 o 15.35000 0.3754000 15.17000 0.4508000 15.53000 0.6004000 -0.3516000     0.7508000 
1 1 1 27 11 16 o 10.27000 0.4616000 9.653000 0.6296000 10.89000 0.6750000 -1.240000      0.9231000 
1 1 1 27 11 18 o 5.911000 0.7640000 5.865000 1.086000  5.958000 1.075000  -0.9368000E-01 1.528000  
1 1 1 27 11 20 o 16.55000 0.3423000 16.40000 0.4851000 16.69000 0.4832000 -0.2979000     0.6847000 
1 1 1 27 11 22 o 21.02000 0.3355000 21.23000 0.4388000 20.80000 0.5077000 0.4244000      0.6710000 
1 1 1 27 11 24 o 38.44000 0.4134000 39.38000 0.6797000 37.50000 0.4708000 1.885000       0.8269000 
1 1 1 27 11 26 o 25.70000 0.3461000 25.83000 0.4497000 25.57000 0.5261000 0.2611000      0.6921000 
1 1 1 27 11 28 o 3.636000 0.9839000 3.122000 1.319000  4.150000 1.460000  -1.028000      1.968000  
1 1 1 27 11 30 o 11.39000 0.4576000 10.51000 0.6220000 12.27000 0.6714000 -1.767000      0.9153000 
1 1 1 27 11 32 o 6.785000 0.8511000 6.954000 1.196000  6.617000 1.211000  0.3370000      1.702000  
1 1 1 27 11 34 o 23.38000 0.3207000 23.29000 0.3856000 23.48000 0.5125000 -0.1813000     0.6414000 
1 1 1 27 11 36 o 6.391000 0.8575000 6.409000 0.8888000 6.373000 1.467000  0.3532000E-01  1.715000  
1 1 1 27 11 38 o 12.73000 0.4106000 12.46000 0.5390000 12.99000 0.6194000 -0.5315000     0.8211000 
1 1 1 27 11 40 o 9.227000 0.5774000 9.431000 0.7023000 9.022000 0.9167000 0.4090000      1.155000  
1 1 1 27 11 42 o 6.826000 0.6807000 7.139000 0.9412000 6.513000 0.9837000 0.6254000      1.361000  
1 1 1 27 11 44 o 10.21000 0.5376000 10.45000 0.7974000 9.960000 0.7211000 0.4940000      1.075000  
1 1 1 27 11 46 o 7.232000 0.6933000 6.554000 1.132000  7.910000 0.8005000 -1.357000      1.387000  
1 1 1 27 11 48 o 8.441000 0.5875000 8.052000 0.8274000 8.829000 0.8342000 -0.7768000     1.175000  
1 1 1 27 11 50 o 5.703000 0.9030000 5.302000 1.268000  6.105000 1.286000  -0.8033000     1.806000  
1 1 1 27 11 52 o 10.13000 0.5749000 10.13000 0.7906000 10.12000 0.8347000 0.5912000E-02  1.150000  
1 1 1 27 11 54 o 4.584000 1.077000  4.389000 1.494000  4.780000 1.551000  -0.3910000     2.153000  
1 1 1 27 12 1  o 35.88000 0.3901000 36.35000 0.5980000 35.41000 0.5012000 0.9395000      0.7802000 
1 1 1 27 12 3  o 23.22000 0.3241000 23.53000 0.4495000 22.91000 0.4670000 0.6231000      0.6482000 
1 1 1 27 12 5  o 34.10000 0.3787000 34.46000 0.4392000 33.74000 0.6171000 0.7195000      0.7574000 
1 1 1 27 12 7  o 41.13000 0.3643000 41.54000 0.4803000 40.73000 0.5479000 0.8105000      0.7286000 
1 1 1 27 12 9  o 38.19000 0.3728000 38.75000 0.5326000 37.64000 0.5219000 1.116000       0.7457000 
1 1 1 27 12 11 o 14.24000 0.4010000 13.90000 0.4787000 14.58000 0.6434000 -0.6796000     0.8020000 
1 1 1 27 12 13 o 25.31000 0.3322000 25.90000 0.4053000 24.73000 0.5265000 1.172000       0.6644000 
1 1 1 27 12 15 o 4.960000 0.8116000 6.148000 0.9701000 3.772000 1.301000  2.376000       1.623000  
1 1 1 27 12 17 o 8.657000 0.5269000 8.678000 0.7173000 8.636000 0.7719000 0.4277000E-01  1.054000  
1 1 1 27 12 19 o 11.29000 0.4186000 10.86000 0.5974000 11.73000 0.5865000 -0.8714000     0.8371000 
1 1 1 27 12 21 o 39.82000 0.3648000 38.99000 0.5425000 40.65000 0.4878000 -1.658000      0.7295000 
1 1 1 27 12 23 f 25.04000 0.3271000 25.09000 0.4893000 25.00000 0.4344000 0.8676000E-01  0.6543000 
1 1 1 27 12 25 o 13.64000 0.3940000 13.39000 0.5893000 13.89000 0.5232000 -0.5035000     0.7880000 
1 1 1 27 12 27 o 19.23000 0.3430000 19.15000 0.4156000 19.32000 0.5457000 -0.1704000     0.6859000 
1 1 1 27 12 29 o 9.820000 0.6039000 9.975000 0.8587000 9.664000 0.8493000 0.3119000      1.208000  
1 1 1 27 12 31 o 6.241000 0.8011000 5.196000 1.199000  7.286000 1.063000  -2.089000      1.602000  
1 1 1 27 12 33 o 14.32000 0.4110000 14.11000 0.4667000 14.53000 0.6766000 -0.4201000     0.8220000 
1 1 1 27 12 35 o 10.09000 0.5211000 9.907000 0.7019000 10.28000 0.7703000 -0.3704000     1.042000  
1 1 1 27 12 37 o 15.79000 0.3658000 16.04000 0.4385000 15.53000 0.5856000 0.5124000      0.7316000 
1 1 1 27 12 39 o 6.373000 0.8193000 6.010000 0.8862000 6.736000 1.378000  -0.7256000     1.639000  
1 1 1 27 12 41 o 8.324000 0.5640000 8.135000 0.8062000 8.512000 0.7888000 -0.3769000     1.128000  
1 1 1 27 12 43 o 5.950000 0.7937000 5.826000 1.152000  6.073000 1.092000  -0.2475000     1.587000  
1 1 1 27 12 45 o 13.05000 0.4136000 13.33000 0.5800000 12.77000 0.5899000 0.5582000      0.8273000 
1 1 1 27 12 47 o 3.960000 0.9924000 4.576000 1.429000  3.344000 1.377000  1.232000       1.985000  
1 1 1 27 12 49 o 6.738000 0.9837000 5.973000 1.694000  7.503000 1.001000  -1.530000      1.967000  
1 1 1 27 12 51 o 6.207000 0.8337000 5.149000 1.323000  7.265000 1.014000  -2.116000      1.667000  
1 1 1 27 12 53 o 3.957000 1.042000  4.045000 1.420000  3.868000 1.526000  0.1775000      2.084000  
1 1 1 27 13 0  o 22.92000 0.4539000 22.92000 0.4539000 22.92000 0.4539000 0.000000       0.000000  
1 1 1 27 13 2  o 3.778000 0.9101000 3.357000 1.221000  4.199000 1.350000  -0.8424000     1.820000  
1 1 1 27 13 4  o 29.36000 0.3730000 30.01000 0.4651000 28.71000 0.5832000 1.304000       0.7460000 
1 1 1 27 13 6  o 12.49000 0.3865000 13.17000 0.4887000 11.80000 0.5989000 1.372000       0.7730000 
1 1 1 27 13 8  o 37.35000 0.4878000 36.83000 0.4512000 37.87000 0.8649000 -1.040000      0.9755000 
1 1 1 27 13 10 o 33.26000 0.3782000 33.71000 0.4913000 32.80000 0.5752000 0.9088000      0.7565000 
1 1 1 27 13 12 o 33.65000 0.3300000 34.03000 0.4378000 33.27000 0.4939000 0.7584000      0.6600000 
1 1 1 27 13 14 o 20.17000 0.2970000 19.85000 0.4152000 20.48000 0.4248000 -0.6236000     0.5940000 
1 1 1 27 13 16 o 14.27000 0.3466000 14.49000 0.4791000 14.06000 0.5010000 0.4300000      0.6932000 
1 1 1 27 13 18 o 38.89000 0.3356000 38.89000 0.4724000 38.90000 0.4769000 -0.1390000E-01 0.6713000 
1 1 1 27 13 20 o 27.66000 0.3223000 27.51000 0.4812000 27.82000 0.4290000 -0.3072000     0.6447000 
1 1 1 27 13 22 o 26.35000 0.3386000 26.71000 0.4728000 25.98000 0.4849000 0.7315000      0.6773000 
1 1 1 27 13 24 o 7.305000 0.6335000 7.252000 0.8795000 7.359000 0.9120000 -0.1070000     1.267000  
1 1 1 27 13 26 o 17.43000 0.3573000 16.90000 0.4218000 17.96000 0.5769000 -1.059000      0.7147000 
1 1 1 27 13 28 o 18.25000 0.3846000 19.17000 0.5340000 17.32000 0.5537000 1.855000       0.7692000 
1 1 1 27 13 30 o 10.83000 0.4573000 9.851000 0.5777000 11.81000 0.7090000 -1.954000      0.9146000 
1 1 1 27 13 32 o 3.427000 0.9465000 2.830000 1.155000  4.023000 1.499000  -1.193000      1.893000  
1 1 1 27 13 34 o 3.388000 0.8964000 3.345000 1.182000  3.431000 1.348000  -0.8587000E-01 1.793000  
1 1 1 27 13 36 o 9.970000 0.5906000 9.148000 0.7434000 10.79000 0.9179000 -1.643000      1.181000  
1 1 1 27 13 38 f 9.998000 0.5802000 10.17000 0.6215000 9.824000 0.9799000 0.3486000      1.160000  
1 1 1 27 13 40 o 3.282000 0.8951000 3.151000 1.265000  3.413000 1.267000  -0.2627000     1.790000  
1 1 1 27 13 42 o 6.792000 0.6796000 6.069000 1.023000  7.515000 0.8948000 -1.446000      1.359000  
1 1 1 27 13 44 o 10.02000 0.5382000 9.308000 0.8363000 10.74000 0.6777000 -1.432000      1.076000  
1 1 1 27 13 46 o 14.07000 0.4385000 14.06000 0.5871000 14.09000 0.6516000 -0.2992000E-01 0.8770000 
1 1 1 27 13 48 o 8.582000 0.6046000 7.897000 0.9107000 9.268000 0.7956000 -1.371000      1.209000  
1 1 1 27 13 50 o 10.11000 0.6232000 10.08000 0.9476000 10.14000 0.8097000 -0.6326000E-01 1.246000  
1 1 1 27 13 52 o 8.972000 0.7061000 8.979000 0.8505000 8.964000 1.127000  0.1570000E-01  1.412000  
1 1 1 27 13 54 o 4.476000 1.286000  4.433000 1.690000  4.519000 1.939000  -0.8554000E-01 2.572000  
1 1 1 27 14 1  o 9.290000 0.4599000 8.921000 0.6489000 9.659000 0.6518000 -0.7384000     0.9197000 
1 1 1 27 14 3  o 38.61000 0.3246000 38.43000 0.4574000 38.79000 0.4607000 -0.3644000     0.6492000 
1 1 1 27 14 5  o 36.94000 0.4117000 36.62000 0.5045000 37.27000 0.6506000 -0.6448000     0.8233000 
1 1 1 27 14 7  f 10.87000 0.4054000 11.24000 0.5439000 10.50000 0.6014000 0.7369000      0.8109000 
1 1 1 27 14 9  o 20.82000 0.3077000 20.90000 0.4069000 20.73000 0.4617000 0.1712000      0.6155000 
1 1 1 27 14 11 o 9.516000 0.4730000 9.968000 0.6217000 9.065000 0.7131000 0.9027000      0.9461000 
1 1 1 27 14 13 o 31.59000 0.3017000 31.37000 0.4233000 31.81000 0.4300000 -0.4457000     0.6033000 
1 1 1 27 14 15 f 36.07000 0.3199000 35.75000 0.4480000 36.40000 0.4567000 -0.6500000     0.6398000 
1 1 1 27 14 17 o 20.66000 0.3221000 21.03000 0.4641000 20.30000 0.4468000 0.7250000      0.6442000 
1 1 1 27 14 19 f 18.47000 0.3309000 18.63000 0.4892000 18.31000 0.4457000 0.3262000      0.6618000 
1 1 1 27 14 21 o 13.46000 0.3715000 13.87000 0.5087000 13.06000 0.5415000 0.8052000      0.7429000 
1 1 1 27 14 23 o 14.20000 0.3697000 13.74000 0.5476000 14.65000 0.4967000 -0.9067000     0.7393000 
1 1 1 27 14 25 o 12.37000 0.4644000 12.37000 0.5874000 12.38000 0.7194000 -0.1148000E-01 0.9287000 
1 1 1 27 14 27 o 6.661000 0.8822000 6.670000 1.296000  6.652000 1.197000  0.1801000E-01  1.764000  
1 1 1 27 14 29 o 3.478000 0.9106000 2.883000 1.150000  4.072000 1.412000  -1.189000      1.821000  
1 1 1 27 14 31 o 3.145000 0.8810000 3.414000 1.220000  2.877000 1.271000  0.5363000      1.762000  
1 1 1 27 14 33 o 8.083000 0.6195000 7.718000 0.8343000 8.448000 0.9159000 -0.7299000     1.239000  
1 1 1 27 14 35 o 10.62000 0.4678000 10.98000 0.5194000 10.27000 0.7781000 0.7065000      0.9355000 
1 1 1 27 14 37 o 13.50000 0.4727000 12.61000 0.5665000 14.38000 0.7568000 -1.765000      0.9454000 
1 1 1 27 14 39 o 5.980000 0.7413000 4.791000 1.096000  7.169000 0.9981000 -2.378000      1.483000  
1 1 1 27 14 41 o 6.673000 0.7055000 7.118000 0.9097000 6.228000 1.079000  0.8909000      1.411000  
1 1 1 27 14 43 o 2.935000 0.8694000 2.735000 1.194000  3.134000 1.264000  -0.3985000     1.739000  
1 1 1 27 14 45 f 4.347000 0.8336000 2.937000 1.252000  5.757000 1.101000  -2.821000      1.667000  
1 1 1 27 14 47 o 4.246000 0.9825000 3.293000 1.327000  5.198000 1.449000  -1.905000      1.965000  
1 1 1 27 14 49 o 5.932000 0.9468000 6.037000 1.324000  5.827000 1.353000  0.2101000      1.894000  
1 1 1 27 14 51 o 4.036000 1.042000  3.477000 1.456000  4.595000 1.490000  -1.118000      2.083000  
1 1 1 27 14 53 o 3.701000 1.002000  4.063000 1.415000  3.339000 1.418000  0.7234000      2.003000  
1 1 1 27 15 0  o 4.851000 1.138000  4.851000 1.138000  4.851000 1.138000  0.000000       0.000000  
1 1 1 27 15 2  o 20.13000 0.2917000 20.38000 0.4088000 19.87000 0.4162000 0.5006000      0.5834000 
1 1 1 27 15 4  o 21.87000 0.2846000 21.98000 0.4007000 21.75000 0.4043000 0.2316000      0.5693000 
1 1 1 27 15 6  o 11.61000 0.4549000 11.45000 0.5304000 11.77000 0.7392000 -0.3153000     0.9098000 
1 1 1 27 15 8  o 11.58000 0.4612000 10.92000 0.6069000 12.24000 0.6948000 -1.315000      0.9225000 
1 1 1 27 15 10 f 47.06000 0.4271000 46.79000 0.6005000 47.32000 0.6075000 -0.5292000     0.8542000 
1 1 1 27 15 12 o 44.19000 0.3541000 43.85000 0.4990000 44.53000 0.5026000 -0.6804000     0.7083000 
1 1 1 27 15 14 o 13.34000 0.3655000 13.38000 0.5365000 13.29000 0.4966000 0.9072000E-01  0.7311000 
1 1 1 27 15 16 o 22.79000 0.3110000 23.27000 0.4583000 22.31000 0.4205000 0.9537000      0.6220000 
1 1 1 27 15 18 o 9.163000 0.4708000 9.372000 0.6223000 8.955000 0.7065000 0.4171000      0.9415000 
1 1 1 27 15 20 o 10.83000 0.4339000 10.68000 0.6007000 10.98000 0.6263000 -0.2926000     0.8678000 
1 1 1 27 15 22 o 29.60000 0.3321000 29.73000 0.4392000 29.48000 0.4984000 0.2411000      0.6643000 
1 1 1 27 15 24 o 3.589000 0.9516000 3.295000 1.233000  3.882000 1.450000  -0.5871000     1.903000  
1 1 1 27 15 26 o 14.02000 0.4220000 13.68000 0.5386000 14.36000 0.6498000 -0.6810000     0.8440000 
1 1 1 27 15 28 o 10.97000 0.4549000 10.52000 0.6061000 11.41000 0.6785000 -0.8829000     0.9098000 
1 1 1 27 15 30 o 3.810000 0.9288000 3.345000 1.185000  4.275000 1.430000  -0.9295000     1.858000  
1 1 1 27 15 32 o 18.94000 0.3333000 18.51000 0.4050000 19.37000 0.5293000 -0.8569000     0.6665000 
1 1 1 27 15 34 o 23.06000 0.3361000 22.91000 0.4271000 23.22000 0.5190000 -0.3072000     0.6721000 
1 1 1 27 15 36 o 14.79000 0.6327000 15.57000 0.4220000 14.02000 1.193000  1.553000       1.265000  
1 1 1 27 15 38 o 8.000000 0.6073000 7.786000 0.8923000 8.215000 0.8241000 -0.4295000     1.215000  
1 1 1 27 15 40 o 11.39000 0.4274000 11.18000 0.5218000 11.60000 0.6771000 -0.4185000     0.8548000 
1 1 1 27 15 42 o 7.495000 0.6256000 7.378000 0.9059000 7.613000 0.8629000 -0.2348000     1.251000  
1 1 1 27 15 44 o 5.948000 0.7845000 5.687000 1.146000  6.210000 1.072000  -0.5228000     1.569000  
1 1 1 27 15 46 o 6.019000 0.8227000 6.741000 1.065000  5.296000 1.255000  1.445000       1.645000  
1 1 1 27 15 48 o 4.156000 0.9783000 3.890000 1.378000  4.421000 1.390000  -0.5310000     1.957000  
1 1 1 27 15 50 o 8.409000 0.7118000 8.568000 0.9106000 8.249000 1.094000  0.3188000      1.424000  
1 1 1 27 15 52 o 3.609000 0.9959000 4.796000 1.636000  2.422000 1.136000  2.374000       1.992000  
1 1 1 27 16 1  f 20.79000 0.3083000 21.04000 0.4318000 20.55000 0.4401000 0.4833000      0.6166000 
1 1 1 27 16 3  o 70.33000 0.5807000 70.22000 0.8198000 70.45000 0.8226000 -0.2350000     1.161000  
1 1 1 27 16 5  o 14.64000 0.3407000 14.72000 0.4483000 14.56000 0.5133000 0.1556000      0.6815000 
1 1 1 27 16 7  o 22.69000 0.3259000 22.87000 0.4413000 22.51000 0.4798000 0.3621000      0.6519000 
1 1 1 27 16 9  o 30.43000 0.3319000 30.96000 0.4593000 29.90000 0.4792000 1.056000       0.6637000 
1 1 1 27 16 11 f 3.932000 0.8989000 3.573000 1.307000  4.290000 1.235000  -0.7166000     1.798000  
1 1 1 27 16 13 o 15.86000 0.3335000 15.93000 0.4869000 15.78000 0.4560000 0.1514000      0.6671000 
1 1 1 27 16 15 o 11.61000 0.4071000 10.61000 0.5810000 12.60000 0.5703000 -1.990000      0.8141000 
1 1 1 27 16 17 o 17.16000 0.3223000 17.18000 0.4545000 17.15000 0.4571000 0.3446000E-01  0.6446000 
1 1 1 27 16 19 f 8.542000 0.5142000 8.619000 0.6893000 8.465000 0.7632000 0.1546000      1.028000  
1 1 1 27 16 21 o 31.63000 0.3095000 31.83000 0.4405000 31.43000 0.4349000 0.3979000      0.6191000 
1 1 1 27 16 23 o 27.57000 0.4178000 27.42000 0.5191000 27.72000 0.6547000 -0.2943000     0.8356000 
1 1 1 27 16 25 o 34.09000 0.3338000 33.82000 0.4037000 34.35000 0.5318000 -0.5320000     0.6677000 
1 1 1 27 16 27 o 10.65000 0.4861000 10.65000 0.6131000 10.65000 0.7546000 -0.2682000E-02 0.9723000 
1 1 1 27 16 29 o 11.70000 0.4274000 11.67000 0.4891000 11.73000 0.7009000 -0.6029000E-01 0.8547000 
1 1 1 27 16 31 o 15.17000 0.4047000 15.41000 0.4147000 14.93000 0.6952000 0.4857000      0.8094000 
1 1 1 27 16 33 o 5.743000 0.8028000 4.626000 1.085000  6.861000 1.183000  -2.236000      1.606000  
1 1 1 27 16 35 o 12.57000 0.5114000 12.72000 0.5515000 12.42000 0.8613000 0.2988000      1.023000  
1 1 1 27 16 37 o 2.955000 0.8426000 3.312000 1.208000  2.598000 1.175000  0.7137000      1.685000  
1 1 1 27 16 39 o 10.81000 0.4851000 10.92000 0.6524000 10.71000 0.7181000 0.2078000      0.9702000 
1 1 1 27 16 41 o 8.677000 0.5358000 9.398000 0.7484000 7.956000 0.7670000 1.442000       1.072000  
1 1 1 27 16 43 o 9.261000 0.5209000 8.917000 0.7422000 9.604000 0.7310000 -0.6873000     1.042000  
1 1 1 27 16 45 o 4.405000 1.004000  4.276000 1.369000  4.535000 1.468000  -0.2589000     2.008000  
1 1 1 27 16 47 o 5.131000 1.002000  4.764000 1.362000  5.498000 1.469000  -0.7340000     2.003000  
1 1 1 27 16 49 o 8.130000 0.7565000 8.361000 0.9926000 7.899000 1.142000  0.4616000      1.513000  
1 1 1 27 16 51 o 7.154000 0.7638000 7.702000 0.9306000 6.606000 1.211000  1.096000       1.528000  
1 1 1 27 16 53 o 4.118000 1.075000  3.932000 1.458000  4.304000 1.580000  -0.3716000     2.150000  
1 1 1 27 17 0  o 12.56000 0.6221000 12.56000 0.6221000 12.56000 0.6221000 0.000000       0.000000  
1 1 1 27 17 2  o 35.60000 0.3939000 35.64000 0.4926000 35.56000 0.6148000 0.7852000E-01  0.7877000 
1 1 1 27 17 4  o 56.90000 0.4543000 57.12000 0.6839000 56.68000 0.5980000 0.4373000      0.9085000 
1 1 1 27 17 6  o 24.40000 0.3017000 24.45000 0.4443000 24.35000 0.4084000 0.9670000E-01  0.6034000 
1 1 1 27 17 8  o 10.61000 0.4251000 10.90000 0.5809000 10.32000 0.6208000 0.5862000      0.8502000 
1 1 1 27 17 10 o 9.380000 0.5377000 9.269000 0.6077000 9.491000 0.8872000 -0.2218000     1.075000  
1 1 1 27 17 12 o 35.73000 0.4094000 35.22000 0.4970000 36.24000 0.6506000 -1.021000      0.8187000 
1 1 1 27 17 14 o 29.06000 0.3317000 29.30000 0.4213000 28.81000 0.5124000 0.4852000      0.6633000 
1 1 1 27 17 16 o 25.09000 0.3380000 24.86000 0.4165000 25.31000 0.5324000 -0.4464000     0.6760000 
1 1 1 27 17 18 o 13.34000 0.4485000 13.54000 0.5141000 13.14000 0.7350000 0.4014000      0.8970000 
1 1 1 27 17 20 o 33.55000 0.3456000 33.92000 0.4461000 33.17000 0.5281000 0.7562000      0.6913000 
1 1 1 27 17 22 o 36.03000 0.3947000 35.35000 0.4016000 36.72000 0.6796000 -1.373000      0.7894000 
1 1 1 27 17 24 o 6.424000 0.7445000 6.511000 0.8423000 6.337000 1.228000  0.1739000      1.489000  
1 1 1 27 17 26 o 19.14000 0.3589000 18.39000 0.4825000 19.88000 0.5313000 -1.490000      0.7177000 
1 1 1 27 17 28 o 4.880000 0.8394000 5.568000 0.8969000 4.191000 1.419000  1.377000       1.679000  
1 1 1 27 17 30 o 16.69000 0.3737000 16.58000 0.3918000 16.81000 0.6365000 -0.2328000     0.7474000 
1 1 1 27 17 32 o 16.06000 0.4180000 15.08000 0.4113000 17.05000 0.7278000 -1.961000      0.8360000 
1 1 1 27 17 34 o 10.95000 0.4440000 10.75000 0.5046000 11.16000 0.7306000 -0.4079000     0.8879000 
1 1 1 27 17 36 o 7.091000 0.8303000 7.788000 0.7824000 6.394000 1.465000  1.394000       1.661000  
1 1 1 27 17 38 o 6.742000 0.7273000 5.964000 1.038000  7.521000 1.019000  -1.557000      1.455000  
1 1 1 27 17 40 o 14.58000 0.3934000 14.44000 0.5333000 14.72000 0.5784000 -0.2852000     0.7867000 
1 1 1 27 17 42 o 15.40000 0.3869000 15.78000 0.5556000 15.01000 0.5387000 0.7637000      0.7739000 
1 1 1 27 17 44 o 4.586000 0.9607000 4.993000 1.283000  4.178000 1.430000  0.8155000      1.921000  
1 1 1 27 17 46 o 4.990000 0.9360000 5.030000 1.234000  4.949000 1.407000  0.8110000E-01  1.872000  
1 1 1 27 17 48 o 8.005000 0.7953000 8.885000 0.8183000 7.125000 1.364000  1.759000       1.591000  
1 1 1 27 17 50 o 6.688000 0.8888000 6.470000 1.415000  6.905000 1.076000  -0.4356000     1.778000  
1 1 1 27 17 52 o 5.648000 0.8899000 4.983000 1.355000  6.312000 1.154000  -1.329000      1.780000  
1 1 1 27 18 1  o 53.70000 0.4036000 53.34000 0.5660000 54.05000 0.5756000 -0.7147000     0.8073000 
1 1 1 27 18 3  o 34.92000 0.3117000 34.11000 0.4283000 35.73000 0.4531000 -1.624000      0.6235000 
1 1 1 27 18 5  o 29.76000 0.3067000 29.57000 0.4510000 29.96000 0.4156000 -0.3895000     0.6133000 
1 1 1 27 18 7  o 29.24000 0.3143000 29.24000 0.4081000 29.23000 0.4783000 0.1149000E-01  0.6287000 
1 1 1 27 18 9  o 26.30000 0.3232000 26.24000 0.3951000 26.37000 0.5115000 -0.1275000     0.6463000 
1 1 1 27 18 11 o 24.41000 0.3046000 24.28000 0.4525000 24.54000 0.4079000 -0.2683000     0.6092000 
1 1 1 27 18 13 o 37.13000 0.3226000 37.15000 0.4544000 37.11000 0.4579000 0.4004000E-01  0.6451000 
1 1 1 27 18 15 o 30.29000 0.3215000 30.08000 0.4734000 30.50000 0.4350000 -0.4213000     0.6429000 
1 1 1 27 18 17 o 77.70000 0.5546000 77.43000 0.7822000 77.96000 0.7863000 -0.5248000     1.109000  
1 1 1 27 18 19 o 43.26000 0.4205000 44.37000 0.6056000 42.14000 0.5835000 2.229000       0.8410000 
1 1 1 27 18 21 o 3.761000 0.9585000 3.875000 1.259000  3.647000 1.446000  0.2282000      1.917000  
1 1 1 27 18 23 o 18.36000 0.4277000 18.68000 0.4728000 18.05000 0.7129000 0.6318000      0.8554000 
1 1 1 27 18 25 o 18.05000 0.3432000 17.54000 0.4274000 18.57000 0.5372000 -1.033000      0.6865000 
1 1 1 27 18 27 o 20.78000 0.3202000 20.55000 0.3990000 21.01000 0.5008000 -0.4675000     0.6404000 
1 1 1 27 18 29 o 29.40000 0.3501000 29.34000 0.3665000 29.45000 0.5967000 -0.1166000     0.7002000 
1 1 1 27 18 31 o 13.76000 0.4427000 13.72000 0.4209000 13.81000 0.7790000 -0.8947000E-01 0.8854000 
1 1 1 27 18 33 o 5.460000 0.7622000 3.825000 1.108000  7.095000 1.047000  -3.270000      1.524000  
1 1 1 27 18 35 o 9.401000 0.4858000 10.04000 0.5946000 8.765000 0.7683000 1.272000       0.9715000 
1 1 1 27 18 37 o 22.17000 0.3365000 22.36000 0.4395000 21.98000 0.5098000 0.3709000      0.6731000 
1 1 1 27 18 39 o 11.08000 0.4343000 10.84000 0.5610000 11.33000 0.6633000 -0.4892000     0.8687000 
1 1 1 27 18 41 o 7.330000 0.6802000 7.770000 0.8586000 6.890000 1.055000  0.8808000      1.360000  
1 1 1 27 18 43 o 6.919000 0.6879000 7.061000 0.8988000 6.777000 1.042000  0.2838000      1.376000  
1 1 1 27 18 45 o 3.818000 0.9368000 3.448000 1.282000  4.187000 1.367000  -0.7390000     1.874000  
1 1 1 27 18 47 o 3.167000 0.9696000 2.672000 1.200000  3.662000 1.523000  -0.9906000     1.939000  
1 1 1 27 18 49 o 12.83000 0.4701000 13.40000 0.6313000 12.27000 0.6968000 1.127000       0.9403000 
1 1 1 27 18 51 o 7.973000 0.7780000 7.523000 1.238000  8.424000 0.9424000 -0.9011000     1.556000  
1 1 1 27 19 0  o 68.59000 0.6978000 68.59000 0.6978000 68.59000 0.6978000 0.000000       0.000000  
1 1 1 27 19 2  o 31.64000 0.2985000 31.48000 0.4124000 31.80000 0.4315000 -0.3169000     0.5969000 
1 1 1 27 19 4  o 13.93000 0.3338000 14.23000 0.4474000 13.64000 0.4954000 0.5870000      0.6675000 
1 1 1 27 19 6  o 16.03000 0.3534000 15.93000 0.4375000 16.14000 0.5551000 -0.2108000     0.7068000 
1 1 1 27 19 8  o 11.24000 0.4519000 12.18000 0.4907000 10.30000 0.7590000 1.888000       0.9038000 
1 1 1 27 19 10 o 8.195000 0.5073000 8.622000 0.6927000 7.767000 0.7412000 0.8547000      1.015000  
1 1 1 27 19 12 o 22.66000 0.3079000 22.73000 0.4567000 22.59000 0.4129000 0.1416000      0.6157000 
1 1 1 27 19 14 o 20.05000 0.2950000 20.57000 0.4026000 19.54000 0.4312000 1.030000       0.5900000 
1 1 1 27 19 16 o 50.57000 0.5078000 50.75000 0.8008000 50.39000 0.6247000 0.3525000      1.016000  
1 1 1 27 19 18 o 14.93000 0.3354000 15.02000 0.4694000 14.83000 0.4793000 0.1962000      0.6709000 
1 1 1 27 19 20 o 21.84000 0.3194000 21.83000 0.3583000 21.85000 0.5289000 -0.2783000E-01 0.6388000 
1 1 1 27 19 22 o 41.78000 0.4273000 41.50000 0.4348000 42.07000 0.7357000 -0.5680000     0.8546000 
1 1 1 27 19 24 o 12.43000 0.4337000 11.94000 0.5772000 12.91000 0.6474000 -0.9640000     0.8674000 
1 1 1 27 19 26 o 4.470000 0.8541000 4.725000 0.9885000 4.215000 1.393000  0.5095000      1.708000  
1 1 1 27 19 28 o 8.731000 0.5486000 8.272000 0.5874000 9.190000 0.9268000 -0.9182000     1.097000  
1 1 1 27 19 30 o 3.935000 0.9569000 3.619000 1.128000  4.251000 1.546000  -0.6317000     1.914000  
1 1 1 27 19 32 o 6.086000 0.7492000 6.098000 0.8010000 6.075000 1.266000  0.2322000E-01  1.498000  
1 1 1 27 19 34 o 18.05000 0.3502000 18.38000 0.4268000 17.72000 0.5553000 0.6612000      0.7004000 
1 1 1 27 19 36 o 9.313000 0.4775000 9.176000 0.5753000 9.450000 0.7623000 -0.2748000     0.9550000 
1 1 1 27 19 38 o 2.457000 0.8061000 2.484000 1.140000  2.429000 1.140000  0.5522000E-01  1.612000  
1 1 1 27 19 40 o 3.545000 0.9006000 3.100000 1.176000  3.989000 1.364000  -0.8898000     1.801000  
1 1 1 27 19 42 o 2.768000 0.8589000 2.985000 1.297000  2.551000 1.126000  0.4338000      1.718000  
1 1 1 27 19 44 o 4.042000 0.9720000 3.661000 1.287000  4.423000 1.457000  -0.7614000     1.944000  
1 1 1 27 19 46 o 4.267000 0.9120000 3.185000 1.287000  5.349000 1.292000  -2.164000      1.824000  
1 1 1 27 19 48 o 11.99000 0.4914000 12.65000 0.6723000 11.33000 0.7167000 1.322000       0.9827000 
1 1 1 27 19 50 o 10.95000 0.5309000 10.67000 0.7497000 11.22000 0.7521000 -0.5517000     1.062000  
1 1 1 27 19 52 o 6.147000 2.080000  ?        ?         6.147000 2.080000  ?              ?         
1 1 1 27 20 1  o 53.28000 0.4003000 53.23000 0.5650000 53.34000 0.5673000 -0.1117000     0.8007000 
1 1 1 27 20 3  o 26.41000 0.2837000 26.79000 0.3914000 26.03000 0.4106000 0.7583000      0.5673000 
1 1 1 27 20 5  o 32.44000 0.3296000 32.55000 0.4231000 32.33000 0.5055000 0.2140000      0.6592000 
1 1 1 27 20 7  o 29.09000 0.2905000 29.38000 0.4082000 28.79000 0.4136000 0.5877000      0.5811000 
1 1 1 27 20 9  o 23.16000 0.3175000 22.61000 0.4012000 23.71000 0.4924000 -1.099000      0.6351000 
1 1 1 27 20 11 o 29.15000 0.3481000 29.34000 0.5293000 28.97000 0.4525000 0.3712000      0.6963000 
1 1 1 27 20 13 o 24.39000 0.3387000 24.60000 0.5300000 24.18000 0.4219000 0.4227000      0.6774000 
1 1 1 27 20 15 o 28.00000 0.4263000 27.66000 0.5290000 28.33000 0.6686000 -0.6667000     0.8525000 
1 1 1 27 20 17 o 42.31000 0.3829000 41.87000 0.5876000 42.76000 0.4911000 -0.8919000     0.7658000 
1 1 1 27 20 19 o 24.59000 0.3452000 24.94000 0.4747000 24.23000 0.5012000 0.7053000      0.6903000 
1 1 1 27 20 21 o 22.21000 0.3447000 22.68000 0.4349000 21.75000 0.5349000 0.9301000      0.6894000 
1 1 1 27 20 23 o 22.51000 0.3834000 21.63000 0.3732000 23.39000 0.6700000 -1.759000      0.7669000 
1 1 1 27 20 25 o 13.64000 0.3728000 13.47000 0.4013000 13.81000 0.6284000 -0.3432000     0.7456000 
1 1 1 27 20 27 o 5.534000 0.8655000 5.093000 1.008000  5.975000 1.407000  -0.8821000     1.731000  
1 1 1 27 20 29 o 15.94000 0.4060000 15.89000 0.3772000 16.00000 0.7191000 -0.1146000     0.8120000 
1 1 1 27 20 31 o 4.591000 0.8440000 4.739000 1.003000  4.444000 1.357000  0.2946000      1.688000  
1 1 1 27 20 33 o 11.71000 0.4170000 11.73000 0.4885000 11.68000 0.6760000 0.4860000E-01  0.8340000 
1 1 1 27 20 35 o 6.873000 0.7445000 6.537000 0.8015000 7.209000 1.255000  -0.6725000     1.489000  
1 1 1 27 20 37 o 5.009000 0.8255000 5.853000 0.8749000 4.164000 1.400000  1.690000       1.651000  
1 1 1 27 20 39 o 5.774000 0.7831000 5.119000 1.062000  6.429000 1.151000  -1.310000      1.566000  
1 1 1 27 20 41 o 10.89000 0.4599000 10.82000 0.5860000 10.95000 0.7090000 -0.1229000     0.9199000 
1 1 1 27 20 43 o 3.388000 0.9597000 2.870000 1.285000  3.906000 1.425000  -1.036000      1.919000  
1 1 1 27 20 45 o 8.859000 0.6524000 9.647000 0.6994000 8.070000 1.102000  1.577000       1.305000  
1 1 1 27 20 47 o 3.450000 0.9569000 3.239000 1.288000  3.661000 1.415000  -0.4228000     1.914000  
1 1 1 27 20 49 o 2.909000 0.8913000 2.630000 1.192000  3.188000 1.326000  -0.5576000     1.783000  
1 1 1 27 20 51 o 4.575000 0.8440000 2.961000 1.274000  6.189000 1.108000  -3.228000      1.688000  
1 1 1 27 21 0  o 16.46000 0.5306000 16.46000 0.5306000 16.46000 0.5306000 0.000000       0.000000  
1 1 1 27 21 2  o 22.41000 0.2845000 22.40000 0.3946000 22.41000 0.4098000 -0.1258000E-01 0.5689000 
1 1 1 27 21 4  f 12.69000 0.4019000 12.67000 0.4948000 12.71000 0.6335000 -0.4502000E-01 0.8038000 
1 1 1 27 21 6  o 38.25000 0.3225000 38.07000 0.4542000 38.43000 0.4580000 -0.3520000     0.6451000 
1 1 1 27 21 8  o 19.91000 0.3667000 19.54000 0.5373000 20.28000 0.4991000 -0.7345000     0.7333000 
1 1 1 27 21 10 o 4.005000 0.9573000 3.835000 1.473000  4.176000 1.223000  -0.3409000     1.915000  
1 1 1 27 21 12 o 5.211000 0.9172000 7.028000 1.523000  3.394000 1.022000  3.635000       1.834000  
1 1 1 27 21 14 o 17.60000 0.3033000 17.19000 0.4250000 18.01000 0.4328000 -0.8177000     0.6066000 
1 1 1 27 21 16 o 8.195000 0.4900000 8.524000 0.6655000 7.866000 0.7194000 0.6586000      0.9800000 
1 1 1 27 21 18 o 8.318000 0.5931000 8.854000 0.5223000 7.783000 1.065000  1.071000       1.186000  
1 1 1 27 21 20 o 16.39000 0.3993000 16.56000 0.3712000 16.22000 0.7071000 0.3374000      0.7986000 
1 1 1 27 21 22 o 33.61000 0.3393000 33.18000 0.4127000 34.05000 0.5387000 -0.8760000     0.6786000 
1 1 1 27 21 24 f 19.64000 0.3335000 19.75000 0.4188000 19.52000 0.5191000 0.2262000      0.6669000 
1 1 1 27 21 26 o 10.92000 0.6429000 11.44000 0.4488000 10.40000 1.205000  1.041000       1.286000  
1 1 1 27 21 28 o 3.808000 0.8948000 3.391000 1.105000  4.226000 1.408000  -0.8353000     1.790000  
1 1 1 27 21 30 o 7.872000 0.5472000 7.458000 0.6470000 8.287000 0.8827000 -0.8295000     1.094000  
1 1 1 27 21 32 o 10.95000 0.4250000 10.46000 0.5167000 11.44000 0.6749000 -0.9714000     0.8500000 
1 1 1 27 21 34 o 14.49000 0.3566000 14.04000 0.4101000 14.95000 0.5835000 -0.9119000     0.7132000 
1 1 1 27 21 36 o 5.337000 0.8064000 5.459000 0.9046000 5.214000 1.335000  0.2451000      1.613000  
1 1 1 27 21 38 o 3.781000 0.8872000 2.871000 1.171000  4.691000 1.333000  -1.820000      1.774000  
1 1 1 27 21 40 o 5.529000 0.8368000 6.421000 0.9438000 4.638000 1.382000  1.783000       1.674000  
1 1 1 27 21 42 o 8.853000 0.5532000 8.684000 0.7566000 9.023000 0.8072000 -0.3384000     1.106000  
1 1 1 27 21 44 o 5.212000 0.8964000 5.433000 1.447000  4.992000 1.058000  0.4415000      1.793000  
1 1 1 27 21 46 o 4.957000 0.9601000 5.370000 1.215000  4.544000 1.487000  0.8259000      1.920000  
1 1 1 27 21 48 o 3.119000 0.9110000 2.846000 1.254000  3.392000 1.321000  -0.5465000     1.822000  
1 1 1 27 21 50 o 8.346000 0.6365000 8.956000 0.8408000 7.735000 0.9558000 1.222000       1.273000  
1 1 1 27 22 1  o 30.04000 0.2878000 30.22000 0.4068000 29.86000 0.4071000 0.3582000      0.5755000 
1 1 1 27 22 3  o 13.73000 0.3641000 13.64000 0.4594000 13.81000 0.5651000 -0.1670000     0.7283000 
1 1 1 27 22 5  o 16.63000 0.3002000 16.49000 0.4336000 16.77000 0.4153000 -0.2779000     0.6004000 
1 1 1 27 22 7  o 28.67000 0.3328000 28.53000 0.5163000 28.81000 0.4199000 -0.2784000     0.6655000 
1 1 1 27 22 9  o 48.54000 0.4081000 49.08000 0.5357000 47.99000 0.6158000 1.089000       0.8162000 
1 1 1 27 22 11 o 40.34000 0.3387000 40.48000 0.4748000 40.19000 0.4833000 0.2850000      0.6775000 
1 1 1 27 22 13 o 7.808000 0.4884000 8.064000 0.6595000 7.552000 0.7205000 0.5119000      0.9768000 
1 1 1 27 22 15 o 12.34000 0.4942000 12.35000 0.7153000 12.32000 0.6823000 0.2423000E-01  0.9885000 
1 1 1 27 22 17 o 8.857000 0.5300000 8.493000 0.5259000 9.222000 0.9203000 -0.7288000     1.060000  
1 1 1 27 22 19 o 32.48000 0.3229000 32.46000 0.3646000 32.49000 0.5330000 -0.3096000E-01 0.6458000 
1 1 1 27 22 21 o 16.68000 0.3717000 16.55000 0.4535000 16.80000 0.5890000 -0.2423000     0.7434000 
1 1 1 27 22 23 o 17.44000 0.3837000 18.10000 0.3379000 16.79000 0.6890000 1.315000       0.7674000 
1 1 1 27 22 25 o 13.92000 0.5195000 13.98000 0.3575000 13.85000 0.9755000 0.1283000      1.039000  
1 1 1 27 22 27 o 9.174000 0.5242000 9.223000 0.5928000 9.125000 0.8648000 0.9783000E-01  1.048000  
1 1 1 27 22 29 o 18.53000 0.3087000 18.84000 0.3408000 18.22000 0.5148000 0.6156000      0.6174000 
1 1 1 27 22 31 o 16.28000 0.3500000 16.26000 0.4439000 16.30000 0.5412000 -0.4693000E-01 0.7000000 
1 1 1 27 22 33 o 4.315000 0.8500000 3.607000 1.053000  5.023000 1.335000  -1.417000      1.700000  
1 1 1 27 22 35 o 5.949000 0.8582000 6.099000 0.7907000 5.799000 1.523000  0.2998000      1.716000  
1 1 1 27 22 37 o 10.84000 0.4371000 10.61000 0.5145000 11.06000 0.7068000 -0.4445000     0.8742000 
1 1 1 27 22 39 o 6.845000 0.6856000 7.262000 0.7846000 6.428000 1.125000  0.8336000      1.371000  
1 1 1 27 22 41 o 7.601000 0.6289000 7.865000 0.7371000 7.337000 1.019000  0.5279000      1.258000  
1 1 1 27 22 43 o 9.889000 0.5670000 9.836000 0.6693000 9.942000 0.9153000 -0.1064000     1.134000  
1 1 1 27 22 45 o 3.938000 0.9962000 3.464000 1.423000  4.413000 1.394000  -0.9497000     1.992000  
1 1 1 27 22 47 o 3.506000 0.8872000 2.590000 1.154000  4.422000 1.348000  -1.832000      1.774000  
1 1 1 27 22 49 o 6.272000 0.8216000 6.673000 1.084000  5.870000 1.234000  0.8031000      1.643000  
1 1 1 27 23 0  f 16.25000 0.4175000 16.25000 0.4175000 16.25000 0.4175000 0.000000       0.000000  
1 1 1 27 23 2  o 7.519000 0.5732000 7.431000 0.7235000 7.608000 0.8893000 -0.1767000     1.146000  
1 1 1 27 23 4  o 9.326000 0.4375000 9.169000 0.6276000 9.484000 0.6097000 -0.3150000     0.8750000 
1 1 1 27 23 6  o 14.55000 0.4037000 14.51000 0.6004000 14.60000 0.5397000 -0.9424000E-01 0.8073000 
1 1 1 27 23 8  o 18.70000 0.3783000 18.86000 0.5395000 18.53000 0.5305000 0.3324000      0.7566000 
1 1 1 27 23 10 o 13.15000 0.3242000 13.88000 0.4426000 12.43000 0.4738000 1.454000       0.6483000 
1 1 1 27 23 12 o 17.81000 0.3009000 17.89000 0.4281000 17.73000 0.4228000 0.1617000      0.6017000 
1 1 1 27 23 14 o 2.444000 0.7467000 2.159000 0.9942000 2.730000 1.114000  -0.5714000     1.493000  
1 1 1 27 23 16 o 25.04000 0.3203000 25.72000 0.3942000 24.36000 0.5050000 1.365000       0.6406000 
1 1 1 27 23 18 o 14.82000 0.3605000 14.92000 0.3845000 14.72000 0.6099000 0.2020000      0.7210000 
1 1 1 27 23 20 o 16.40000 0.3393000 16.77000 0.3231000 16.02000 0.5967000 0.7491000      0.6786000 
1 1 1 27 23 22 o 12.77000 0.3567000 12.57000 0.3433000 12.98000 0.6254000 -0.4145000     0.7134000 
1 1 1 27 23 24 o 35.18000 0.4909000 35.50000 0.4921000 34.86000 0.8496000 0.6375000      0.9818000 
1 1 1 27 23 26 o 23.08000 0.3103000 22.79000 0.3460000 23.37000 0.5151000 -0.5753000     0.6206000 
1 1 1 27 23 28 o 4.162000 0.9111000 3.857000 1.215000  4.466000 1.359000  -0.6093000     1.822000  
1 1 1 27 23 30 o 8.228000 0.4805000 7.912000 0.5344000 8.544000 0.7988000 -0.6321000     0.9611000 
1 1 1 27 23 32 o 24.67000 0.3521000 24.38000 0.5031000 24.95000 0.4926000 -0.5674000     0.7041000 
1 1 1 27 23 34 o 17.67000 0.3260000 17.39000 0.3585000 17.96000 0.5446000 -0.5689000     0.6520000 
1 1 1 27 23 36 o 5.212000 0.7977000 5.562000 0.8169000 4.862000 1.370000  0.6997000      1.595000  
1 1 1 27 23 38 o 3.468000 0.8845000 3.341000 1.137000  3.596000 1.355000  -0.2548000     1.769000  
1 1 1 27 23 40 o 3.240000 0.9021000 3.201000 1.192000  3.279000 1.354000  -0.7824000E-01 1.804000  
1 1 1 27 23 42 o 6.989000 1.011000  8.528000 0.6310000 5.449000 1.921000  3.079000       2.022000  
1 1 1 27 23 44 o 3.423000 0.9319000 3.138000 1.268000  3.709000 1.366000  -0.5704000     1.864000  
1 1 1 27 23 46 o 8.757000 0.7098000 8.424000 1.009000  9.089000 0.9984000 -0.6655000     1.420000  
1 1 1 27 23 48 o 5.394000 0.9384000 5.425000 1.315000  5.363000 1.339000  0.6192000E-01  1.877000  
1 1 1 27 23 50 o 5.485000 1.124000  6.884000 1.599000  4.086000 1.581000  2.798000       2.249000  
1 1 1 27 24 1  o 8.097000 0.4576000 8.147000 0.6643000 8.048000 0.6294000 0.9911000E-01  0.9151000 
1 1 1 27 24 3  o 25.75000 0.2876000 25.98000 0.4056000 25.52000 0.4078000 0.4603000      0.5751000 
1 1 1 27 24 5  o 6.782000 0.7937000 6.529000 1.184000  7.036000 1.058000  -0.5069000     1.587000  
1 1 1 27 24 7  o 6.660000 0.6179000 7.272000 0.6888000 6.048000 1.026000  1.223000       1.236000  
1 1 1 27 24 9  o 8.593000 0.4718000 8.887000 0.5922000 8.300000 0.7346000 0.5862000      0.9436000 
1 1 1 27 24 11 o 30.31000 0.3469000 30.67000 0.4711000 29.95000 0.5094000 0.7168000      0.6939000 
1 1 1 27 24 13 o 4.628000 1.136000  5.096000 1.693000  4.160000 1.514000  0.9364000      2.271000  
1 1 1 27 24 15 o 7.929000 0.7478000 8.624000 0.9903000 7.233000 1.121000  1.392000       1.496000  
1 1 1 27 24 17 o 17.75000 0.4567000 18.20000 0.6613000 17.31000 0.6301000 0.8944000      0.9134000 
1 1 1 27 24 19 o 26.73000 0.3582000 25.85000 0.5074000 27.60000 0.5057000 -1.747000      0.7164000 
1 1 1 27 24 21 o 3.618000 1.036000  3.745000 1.432000  3.492000 1.496000  0.2523000      2.071000  
1 1 1 27 24 23 o 7.720000 1.040000  7.908000 0.9566000 7.533000 1.847000  0.3755000      2.080000  
1 1 1 27 24 25 o 5.499000 0.6630000 4.707000 0.5822000 6.292000 1.191000  -1.585000      1.326000  
1 1 1 27 24 27 o 9.925000 0.3967000 9.720000 0.4144000 10.13000 0.6766000 -0.4098000     0.7935000 
1 1 1 27 24 29 o 17.49000 0.3123000 17.72000 0.3237000 17.25000 0.5342000 0.4709000      0.6247000 
1 1 1 27 24 31 o 16.54000 0.3368000 16.87000 0.4137000 16.21000 0.5315000 0.6636000      0.6735000 
1 1 1 27 24 33 o 6.662000 0.6400000 6.016000 0.8889000 7.308000 0.9209000 -1.292000      1.280000  
1 1 1 27 24 35 o 9.785000 0.5324000 8.970000 0.5302000 10.60000 0.9235000 -1.628000      1.065000  
1 1 1 27 24 37 o 2.722000 0.8198000 2.617000 1.077000  2.827000 1.236000  -0.2098000     1.640000  
1 1 1 27 24 39 o 10.98000 0.4614000 10.86000 0.5045000 11.10000 0.7727000 -0.2362000     0.9229000 
1 1 1 27 24 41 o 5.676000 1.053000  5.743000 0.9466000 5.609000 1.881000  0.1342000      2.106000  
1 1 1 27 24 43 o 5.142000 0.8359000 5.788000 0.9968000 4.496000 1.342000  1.292000       1.672000  
1 1 1 27 24 45 o 4.074000 0.9614000 4.214000 1.329000  3.934000 1.390000  0.2797000      1.923000  
1 1 1 27 24 47 o 3.992000 0.9754000 3.053000 1.315000  4.931000 1.441000  -1.878000      1.951000  
1 1 1 27 24 49 o 4.089000 0.9854000 5.355000 1.561000  2.822000 1.203000  2.533000       1.971000  
1 1 1 27 25 0  o 3.335000 1.205000  3.335000 1.205000  3.335000 1.205000  0.000000       0.000000  
1 1 1 27 25 2  o 25.75000 0.3454000 26.24000 0.5009000 25.26000 0.4758000 0.9852000      0.6909000 
1 1 1 27 25 4  o 14.25000 0.3897000 14.00000 0.6317000 14.50000 0.4565000 -0.5081000     0.7794000 
1 1 1 27 25 6  o 3.214000 0.8467000 3.281000 1.196000  3.147000 1.199000  0.1340000      1.693000  
1 1 1 27 25 8  o 8.971000 0.4161000 9.036000 0.5629000 8.906000 0.6130000 0.1293000      0.8322000 
1 1 1 27 25 10 o 29.86000 0.3812000 30.52000 0.4457000 29.20000 0.6186000 1.313000       0.7624000 
1 1 1 27 25 12 o 35.23000 0.3912000 34.65000 0.5413000 35.81000 0.5650000 -1.158000      0.7825000 
1 1 1 27 25 14 o 25.37000 0.3738000 25.26000 0.5239000 25.47000 0.5334000 -0.2191000     0.7476000 
1 1 1 27 25 16 o 9.680000 0.6710000 10.05000 0.9978000 9.309000 0.8973000 0.7417000      1.342000  
1 1 1 27 25 18 o 12.59000 0.5452000 12.18000 0.7374000 12.99000 0.8032000 -0.8101000     1.090000  
1 1 1 27 25 20 o 10.04000 0.6081000 9.310000 0.8743000 10.76000 0.8454000 -1.455000      1.216000  
1 1 1 27 25 22 o 13.25000 0.4773000 12.60000 0.6390000 13.89000 0.7091000 -1.289000      0.9545000 
1 1 1 27 25 24 o 31.56000 0.3732000 30.88000 0.5379000 32.23000 0.5174000 -1.351000      0.7463000 
1 1 1 27 25 26 o 14.75000 0.5981000 14.76000 1.049000  14.73000 0.5754000 0.3207000E-01  1.196000  
1 1 1 27 25 28 o 7.994000 0.5650000 7.723000 0.5223000 8.265000 1.002000  -0.5421000     1.130000  
1 1 1 27 25 30 o 6.637000 0.5976000 6.807000 0.5561000 6.467000 1.058000  0.3401000      1.195000  
1 1 1 27 25 32 o 4.769000 0.8828000 4.647000 1.137000  4.892000 1.351000  -0.2453000     1.766000  
1 1 1 27 25 34 o 16.42000 0.3670000 16.83000 0.4494000 16.01000 0.5804000 0.8265000      0.7341000 
1 1 1 27 25 36 o 5.553000 0.7960000 5.101000 1.033000  6.005000 1.211000  -0.9038000     1.592000  
1 1 1 27 25 38 o 15.22000 0.3645000 14.97000 0.4325000 15.47000 0.5868000 -0.5051000     0.7290000 
1 1 1 27 25 40 o 8.664000 0.8824000 9.461000 0.5730000 7.867000 1.669000  1.594000       1.765000  
1 1 1 27 25 42 o 6.918000 0.7606000 7.943000 0.7635000 5.893000 1.316000  2.050000       1.521000  
1 1 1 27 25 44 o 3.059000 0.8861000 2.367000 1.084000  3.750000 1.402000  -1.383000      1.772000  
1 1 1 27 25 46 o 5.135000 0.9237000 5.686000 1.200000  4.584000 1.404000  1.102000       1.847000  
1 1 1 27 25 48 o 3.429000 1.057000  3.755000 1.703000  3.102000 1.253000  0.6530000      2.114000  
1 1 1 27 26 1  o 19.80000 0.4351000 20.09000 0.4803000 19.51000 0.7255000 0.5781000      0.8701000 
1 1 1 27 26 3  o 10.59000 0.4806000 11.58000 0.6878000 9.596000 0.6714000 1.981000       0.9612000 
1 1 1 27 26 5  o 7.002000 0.5388000 7.178000 0.7420000 6.826000 0.7815000 0.3512000      1.078000  
1 1 1 27 26 7  o 23.67000 0.3125000 22.92000 0.3839000 24.42000 0.4932000 -1.503000      0.6250000 
1 1 1 27 26 9  f 7.367000 0.7254000 8.357000 0.9553000 6.378000 1.092000  1.979000       1.451000  
1 1 1 27 26 11 o 23.05000 0.3672000 23.35000 0.5219000 22.75000 0.5168000 0.6013000      0.7345000 
1 1 1 27 26 13 o 31.10000 0.6007000 30.65000 0.9450000 31.55000 0.7418000 -0.9004000     1.201000  
1 1 1 27 26 15 o 20.37000 0.4536000 20.50000 0.6396000 20.25000 0.6434000 0.2437000      0.9072000 
1 1 1 27 26 17 o 18.77000 0.4272000 19.07000 0.5451000 18.48000 0.6581000 0.5946000      0.8545000 
1 1 1 27 26 19 o 35.74000 0.4251000 36.01000 0.5439000 35.47000 0.6535000 0.5462000      0.8503000 
1 1 1 27 26 21 o 5.475000 0.9258000 5.647000 1.183000  5.302000 1.424000  0.3448000      1.852000  
1 1 1 27 26 23 o 9.886000 0.6800000 8.623000 1.059000  11.15000 0.8529000 -2.527000      1.360000  
1 1 1 27 26 25 o 11.29000 0.5335000 10.53000 0.8691000 12.04000 0.6189000 -1.505000      1.067000  
1 1 1 27 26 27 o 13.53000 0.4480000 13.29000 0.6818000 13.77000 0.5812000 -0.4732000     0.8960000 
1 1 1 27 26 29 o 18.05000 0.4620000 18.34000 0.7517000 17.76000 0.5374000 0.5763000      0.9241000 
1 1 1 27 26 31 o 13.17000 0.3763000 13.12000 0.4460000 13.23000 0.6063000 -0.1111000     0.7526000 
1 1 1 27 26 33 o 10.45000 0.4515000 10.66000 0.5337000 10.24000 0.7283000 0.4178000      0.9029000 
1 1 1 27 26 35 o 4.875000 0.9136000 5.465000 1.027000  4.285000 1.512000  1.180000       1.827000  
1 1 1 27 26 37 o 4.650000 1.128000  5.072000 1.761000  4.227000 1.409000  0.8452000      2.255000  
1 1 1 27 26 39 f 6.920000 0.7582000 7.988000 0.6422000 5.852000 1.374000  2.136000       1.516000  
1 1 1 27 26 41 o 3.472000 0.9333000 3.461000 1.236000  3.483000 1.399000  -0.2189000E-01 1.867000  
1 1 1 27 26 43 o 5.204000 1.006000  5.320000 1.398000  5.089000 1.445000  0.2314000      2.011000  
1 1 1 27 26 45 o 4.857000 0.9374000 3.894000 1.286000  5.820000 1.364000  -1.926000      1.875000  
1 1 1 27 26 47 o 3.225000 0.9830000 3.729000 1.583000  2.720000 1.166000  1.009000       1.966000  
1 1 1 27 27 0  o 28.93000 0.4854000 28.93000 0.4854000 28.93000 0.4854000 0.000000       0.000000  
1 1 1 27 27 2  o 18.80000 0.2863000 18.98000 0.4168000 18.62000 0.3924000 0.3589000      0.5725000 
1 1 1 27 27 4  o 15.17000 0.3600000 15.21000 0.5014000 15.12000 0.5167000 0.9474000E-01  0.7200000 
1 1 1 27 27 6  o 8.366000 0.4772000 8.731000 0.6042000 8.002000 0.7388000 0.7283000      0.9545000 
1 1 1 27 27 8  o 4.040000 1.003000  3.472000 1.421000  4.607000 1.417000  -1.135000      2.007000  
1 1 1 27 27 10 o 21.25000 0.4906000 21.91000 0.6404000 20.59000 0.7435000 1.325000       0.9813000 
1 1 1 27 27 12 o 12.36000 0.5857000 12.69000 0.8407000 12.04000 0.8156000 0.6527000      1.171000  
1 1 1 27 27 14 o 6.234000 0.9588000 5.329000 1.358000  7.139000 1.354000  -1.810000      1.918000  
1 1 1 27 27 16 o 22.94000 0.3660000 23.40000 0.5136000 22.48000 0.5217000 0.9212000      0.7321000 
1 1 1 27 27 18 o 13.59000 0.4462000 13.38000 0.6213000 13.80000 0.6405000 -0.4176000     0.8923000 
1 1 1 27 27 20 o 24.60000 0.3897000 24.80000 0.5039000 24.40000 0.5946000 0.3982000      0.7794000 
1 1 1 27 27 22 o 15.80000 0.4427000 16.03000 0.6921000 15.57000 0.5521000 0.4603000      0.8853000 
1 1 1 27 27 24 o 3.480000 0.9709000 3.540000 1.404000  3.420000 1.341000  0.1199000      1.942000  
1 1 1 27 27 26 o 3.310000 0.8783000 4.221000 1.376000  2.400000 1.092000  1.821000       1.757000  
1 1 1 27 27 28 o 15.19000 0.4258000 15.26000 0.6231000 15.11000 0.5804000 0.1484000      0.8515000 
1 1 1 27 27 30 o 10.77000 0.5269000 10.32000 0.7834000 11.22000 0.7049000 -0.9022000     1.054000  
1 1 1 27 27 32 f 3.984000 0.9417000 3.239000 1.165000  4.729000 1.480000  -1.489000      1.883000  
1 1 1 27 27 34 f 3.572000 0.8839000 2.777000 1.133000  4.367000 1.357000  -1.589000      1.768000  
1 1 1 27 27 36 o 11.04000 0.4996000 10.86000 0.6844000 11.23000 0.7279000 -0.3705000     0.9991000 
1 1 1 27 27 38 o 17.21000 0.4149000 16.93000 0.4620000 17.50000 0.6893000 -0.5713000     0.8298000 
1 1 1 27 27 40 o 10.73000 0.5294000 10.86000 0.6619000 10.60000 0.8264000 0.2539000      1.059000  
1 1 1 27 27 42 o 5.192000 1.086000  5.359000 1.593000  5.026000 1.476000  0.3327000      2.172000  
1 1 1 27 27 44 o 3.566000 0.9826000 2.895000 1.404000  4.237000 1.375000  -1.342000      1.965000  
1 1 1 27 27 46 o 4.445000 1.175000  4.983000 1.967000  3.907000 1.285000  1.077000       2.349000  
1 1 1 27 28 1  o 3.235000 0.8121000 3.852000 1.198000  2.617000 1.097000  1.234000       1.624000  
1 1 1 27 28 3  o 31.41000 0.4021000 30.91000 0.4263000 31.92000 0.6820000 -1.009000      0.8043000 
1 1 1 27 28 5  o 26.25000 0.3182000 26.04000 0.4963000 26.46000 0.3983000 -0.4225000     0.6364000 
1 1 1 27 28 7  o 25.03000 0.7340000 25.72000 1.056000  24.34000 1.020000  1.379000       1.468000  
1 1 1 27 28 9  o 20.53000 0.4567000 20.21000 0.6404000 20.85000 0.6514000 -0.6372000     0.9135000 
1 1 1 27 28 11 o 21.30000 0.4381000 21.17000 0.6091000 21.44000 0.6297000 -0.2668000     0.8761000 
1 1 1 27 28 13 o 8.369000 0.7677000 9.162000 1.080000  7.575000 1.091000  1.586000       1.535000  
1 1 1 27 28 15 o 14.73000 0.4271000 14.62000 0.5790000 14.83000 0.6280000 -0.2172000     0.8542000 
1 1 1 27 28 17 o 6.352000 0.8467000 6.217000 1.061000  6.487000 1.319000  -0.2699000     1.693000  
1 1 1 27 28 19 o 10.49000 0.6139000 10.55000 0.8981000 10.42000 0.8370000 0.1312000      1.228000  
1 1 1 27 28 21 o 10.50000 0.5239000 10.85000 0.7415000 10.15000 0.7402000 0.6948000      1.048000  
1 1 1 27 28 23 f 8.216000 0.7150000 7.200000 1.057000  9.232000 0.9635000 -2.032000      1.430000  
1 1 1 27 28 25 o 4.877000 1.029000  5.191000 1.604000  4.562000 1.288000  0.6283000      2.057000  
1 1 1 27 28 27 o 7.726000 0.6977000 7.728000 1.082000  7.723000 0.8813000 0.5212000E-02  1.395000  
1 1 1 27 28 29 o 11.29000 0.5043000 11.12000 0.7771000 11.46000 0.6428000 -0.3340000     1.009000  
1 1 1 27 28 31 o 12.51000 0.4830000 11.81000 0.7261000 13.21000 0.6371000 -1.399000      0.9660000 
1 1 1 27 28 33 f 3.555000 0.9455000 2.900000 1.283000  4.211000 1.389000  -1.311000      1.891000  
1 1 1 27 28 35 o 6.462000 0.7620000 7.303000 0.8342000 5.622000 1.276000  1.681000       1.524000  
1 1 1 27 28 37 o 18.81000 0.4102000 18.89000 0.4985000 18.73000 0.6516000 0.1525000      0.8205000 
1 1 1 27 28 39 o 10.45000 0.5936000 10.34000 0.8707000 10.56000 0.8069000 -0.2231000     1.187000  
1 1 1 27 28 41 o 9.100000 0.7275000 9.768000 1.081000  8.431000 0.9742000 1.337000       1.455000  
1 1 1 27 28 43 o 14.53000 0.4763000 14.68000 0.6649000 14.37000 0.6822000 0.3037000      0.9527000 
1 1 1 27 28 45 o 6.176000 1.136000  6.208000 1.919000  6.144000 1.218000  0.6413000E-01  2.273000  
1 1 1 27 28 47 o 7.076000 2.523000  7.076000 2.523000  ?        ?         ?              ?         
1 1 1 27 29 0  o 7.096000 0.7596000 7.096000 0.7596000 7.096000 0.7596000 0.000000       0.000000  
1 1 1 27 29 2  o 4.502000 0.9084000 3.801000 1.504000  5.202000 1.019000  -1.400000      1.817000  
1 1 1 27 29 4  o 11.43000 0.4910000 11.40000 0.8316000 11.46000 0.5223000 -0.6302000E-01 0.9820000 
1 1 1 27 29 6  o 15.17000 0.4812000 15.87000 0.6443000 14.48000 0.7149000 1.388000       0.9624000 
1 1 1 27 29 8  o 30.29000 0.5544000 30.10000 0.5124000 30.49000 0.9834000 -0.3881000     1.109000  
1 1 1 27 29 10 o 8.788000 0.8620000 9.594000 1.010000  7.983000 1.398000  1.611000       1.724000  
1 1 1 27 29 12 o 11.65000 0.4838000 11.70000 0.6985000 11.60000 0.6696000 0.1029000      0.9676000 
1 1 1 27 29 14 o 13.36000 0.4653000 13.69000 0.6550000 13.04000 0.6610000 0.6578000      0.9305000 
1 1 1 27 29 16 o 20.42000 0.4308000 20.36000 0.6201000 20.48000 0.5982000 -0.1199000     0.8616000 
1 1 1 27 29 18 o 16.08000 0.4619000 16.45000 0.6896000 15.70000 0.6147000 0.7502000      0.9238000 
1 1 1 27 29 20 o 11.12000 0.4957000 11.35000 0.6944000 10.89000 0.7075000 0.4620000      0.9914000 
1 1 1 27 29 22 o 7.290000 0.6825000 9.070000 0.7955000 5.510000 1.109000  3.560000       1.365000  
1 1 1 27 29 24 o 7.740000 0.6674000 7.376000 1.047000  8.105000 0.8280000 -0.7291000     1.335000  
1 1 1 27 29 26 o 4.470000 0.9122000 3.196000 1.333000  5.743000 1.246000  -2.547000      1.824000  
1 1 1 27 29 28 o 9.930000 0.5050000 9.338000 0.7866000 10.52000 0.6336000 -1.184000      1.010000  
1 1 1 27 29 30 o 10.53000 0.5251000 9.957000 0.7839000 11.11000 0.6989000 -1.155000      1.050000  
1 1 1 27 29 32 o 5.775000 0.9180000 6.231000 1.207000  5.320000 1.383000  0.9106000      1.836000  
1 1 1 27 29 34 o 5.590000 1.103000  6.687000 1.523000  4.494000 1.596000  2.193000       2.206000  
1 1 1 27 29 36 o 6.412000 1.054000  5.277000 1.732000  7.547000 1.200000  -2.270000      2.107000  
1 1 1 27 29 38 o 7.440000 1.115000  7.242000 1.733000  7.637000 1.403000  -0.3947000     2.230000  
1 1 1 27 29 40 o 3.646000 1.032000  3.451000 1.479000  3.840000 1.440000  -0.3890000     2.064000  
1 1 1 27 29 42 f 5.696000 0.9567000 5.685000 1.375000  5.708000 1.330000  -0.2338000E-01 1.913000  
1 1 1 27 29 44 o 4.692000 1.160000  5.927000 1.899000  3.458000 1.332000  2.470000       2.320000  
1 1 1 27 29 46 o 3.844000 1.193000  4.552000 2.019000  3.137000 1.272000  1.415000       2.386000  
1 1 1 27 30 1  o 6.723000 0.8964000 6.874000 1.646000  6.573000 0.7118000 0.3016000      1.793000  
1 1 1 27 30 3  o 8.791000 0.4571000 9.547000 0.5347000 8.035000 0.7414000 1.512000       0.9141000 
1 1 1 27 30 5  o 12.55000 0.3409000 12.78000 0.5785000 12.33000 0.3607000 0.4485000      0.6818000 
1 1 1 27 30 7  o 26.90000 0.3599000 27.48000 0.5045000 26.33000 0.5135000 1.157000       0.7198000 
1 1 1 27 30 9  o 29.54000 0.3646000 29.63000 0.5072000 29.44000 0.5239000 0.1914000      0.7292000 
1 1 1 27 30 11 o 15.88000 0.4032000 16.32000 0.5480000 15.44000 0.5916000 0.8757000      0.8064000 
1 1 1 27 30 13 o 12.40000 0.8526000 12.34000 1.082000  12.45000 1.318000  -0.1062000     1.705000  
1 1 1 27 30 15 o 17.47000 0.5727000 17.72000 0.9300000 17.23000 0.6686000 0.4911000      1.145000  
1 1 1 27 30 17 o 16.37000 0.4182000 16.73000 0.5734000 16.00000 0.6088000 0.7232000      0.8364000 
1 1 1 27 30 19 o 10.70000 0.5337000 10.89000 0.7333000 10.51000 0.7758000 0.3766000      1.067000  
1 1 1 27 30 21 o 9.550000 0.5972000 9.559000 0.8386000 9.541000 0.8506000 0.1810000E-01  1.194000  
1 1 1 27 30 23 o 30.09000 0.4136000 30.34000 0.6394000 29.85000 0.5250000 0.4985000      0.8273000 
1 1 1 27 30 25 o 19.88000 0.4361000 19.22000 0.7108000 20.54000 0.5053000 -1.318000      0.8721000 
1 1 1 27 30 27 o 13.74000 0.4638000 13.81000 0.6970000 13.68000 0.6123000 0.1321000      0.9277000 
1 1 1 27 30 29 o 9.698000 0.5671000 9.372000 0.8375000 10.02000 0.7650000 -0.6520000     1.134000  
1 1 1 27 30 31 o 4.537000 1.003000  4.055000 1.477000  5.018000 1.357000  -0.9630000     2.006000  
1 1 1 27 30 33 o 3.563000 1.014000  3.721000 1.549000  3.406000 1.309000  0.3154000      2.028000  
1 1 1 27 30 35 o 3.459000 0.9948000 4.016000 1.531000  2.901000 1.271000  1.115000       1.990000  
1 1 1 27 30 37 o 8.014000 0.9462000 7.896000 1.425000  8.132000 1.246000  -0.2363000     1.892000  
1 1 1 27 30 39 o 4.247000 1.069000  4.436000 1.561000  4.059000 1.461000  0.3774000      2.138000  
1 1 1 27 30 41 o 7.660000 0.8053000 6.507000 1.319000  8.812000 0.9244000 -2.305000      1.611000  
1 1 1 27 30 43 o 13.85000 0.5574000 14.50000 0.6905000 13.20000 0.8753000 1.297000       1.115000  
1 1 1 27 30 45 o 5.777000 1.314000  6.983000 2.271000  4.571000 1.321000  2.413000       2.627000  
1 1 1 27 31 0  o 18.07000 0.3949000 18.07000 0.3949000 18.07000 0.3949000 0.000000       0.000000  
1 1 1 27 31 2  o 2.847000 0.7506000 2.458000 1.030000  3.236000 1.092000  -0.7788000     1.501000  
1 1 1 27 31 4  o 25.33000 0.3144000 25.89000 0.5453000 24.77000 0.3132000 1.116000       0.6289000 
1 1 1 27 31 6  o 12.63000 0.4445000 12.69000 0.6122000 12.57000 0.6446000 0.1177000      0.8890000 
1 1 1 27 31 8  o 25.03000 0.4112000 24.73000 0.5844000 25.32000 0.5788000 -0.5942000     0.8225000 
1 1 1 27 31 10 o 17.42000 0.5911000 17.21000 0.6435000 17.64000 0.9916000 -0.4272000     1.182000  
1 1 1 27 31 12 o 17.72000 0.4404000 17.44000 0.6218000 18.01000 0.6238000 -0.5758000     0.8808000 
1 1 1 27 31 14 o 11.16000 0.5237000 11.19000 0.7014000 11.13000 0.7779000 0.6161000E-01  1.047000  
1 1 1 27 31 16 o 4.232000 0.9837000 3.705000 1.371000  4.759000 1.411000  -1.053000      1.967000  
1 1 1 27 31 18 o 17.91000 0.4987000 18.02000 0.6845000 17.80000 0.7255000 0.2161000      0.9975000 
1 1 1 27 31 20 o 7.629000 0.7681000 7.486000 1.073000  7.771000 1.099000  -0.2852000     1.536000  
1 1 1 27 31 22 o 4.091000 1.080000  3.332000 1.361000  4.851000 1.679000  -1.519000      2.161000  
1 1 1 27 31 24 f 11.14000 0.5452000 10.60000 0.8395000 11.68000 0.6959000 -1.074000      1.090000  
1 1 1 27 31 26 o 10.21000 0.5663000 9.887000 0.8868000 10.54000 0.7045000 -0.6511000     1.133000  
1 1 1 27 31 28 o 14.65000 0.4407000 14.39000 0.6171000 14.91000 0.6294000 -0.5254000     0.8814000 
1 1 1 27 31 30 o 4.966000 0.9332000 4.237000 1.457000  5.694000 1.167000  -1.457000      1.866000  
1 1 1 27 31 32 f 10.16000 0.6946000 9.682000 1.116000  10.64000 0.8274000 -0.9589000     1.389000  
1 1 1 27 31 34 o 2.639000 0.8624000 2.443000 1.152000  2.835000 1.284000  -0.3925000     1.725000  
1 1 1 27 31 36 o 7.391000 1.139000  6.511000 1.965000  8.271000 1.153000  -1.761000      2.278000  
1 1 1 27 31 38 o 7.164000 0.8715000 7.380000 1.258000  6.947000 1.206000  0.4337000      1.743000  
1 1 1 27 31 40 o 5.029000 1.168000  4.695000 1.747000  5.363000 1.550000  -0.6682000     2.335000  
1 1 1 27 31 42 o 9.555000 0.6891000 9.635000 1.054000  9.475000 0.8883000 0.1595000      1.378000  
1 1 1 27 31 44 o 5.691000 1.156000  5.481000 1.942000  5.900000 1.255000  -0.4194000     2.312000  
1 1 1 27 32 1  o 13.35000 0.2932000 13.26000 0.4163000 13.45000 0.4131000 -0.1893000     0.5864000 
1 1 1 27 32 3  o 17.23000 0.3186000 17.45000 0.5450000 17.02000 0.3302000 0.4253000      0.6372000 
1 1 1 27 32 5  o 8.235000 0.6664000 9.212000 0.8379000 7.258000 1.036000  1.953000       1.333000  
1 1 1 27 32 7  o 28.04000 0.4155000 28.63000 0.5778000 27.46000 0.5973000 1.177000       0.8310000 
1 1 1 27 32 9  f 17.84000 0.4167000 18.57000 0.5373000 17.11000 0.6372000 1.452000       0.8335000 
1 1 1 27 32 11 o 5.084000 0.9652000 4.788000 1.372000  5.381000 1.358000  -0.5936000     1.930000  
1 1 1 27 32 13 o 10.74000 0.6139000 10.97000 0.9671000 10.52000 0.7564000 0.4525000      1.228000  
1 1 1 27 32 15 o 11.89000 0.4789000 11.91000 0.6627000 11.86000 0.6917000 0.4947000E-01  0.9579000 
1 1 1 27 32 17 o 8.547000 0.5907000 8.960000 0.7839000 8.134000 0.8838000 0.8258000      1.181000  
1 1 1 27 32 19 f 5.785000 0.9099000 5.850000 1.243000  5.719000 1.329000  0.1305000      1.820000  
1 1 1 27 32 21 o 12.39000 0.5823000 12.06000 0.6534000 12.72000 0.9640000 -0.6624000     1.165000  
1 1 1 27 32 23 o 26.10000 0.5550000 25.81000 0.8419000 26.39000 0.7234000 -0.5748000     1.110000  
1 1 1 27 32 25 o 13.02000 0.5220000 12.65000 0.8031000 13.39000 0.6671000 -0.7389000     1.044000  
1 1 1 27 32 27 o 10.05000 0.5481000 9.827000 0.8280000 10.27000 0.7183000 -0.4417000     1.096000  
1 1 1 27 32 29 o 18.85000 0.3837000 19.02000 0.5385000 18.68000 0.5467000 0.3451000      0.7673000 
1 1 1 27 32 31 o 11.36000 0.6593000 11.21000 0.9649000 11.51000 0.8988000 -0.3030000     1.319000  
1 1 1 27 32 33 o 7.048000 0.7654000 7.216000 1.073000  6.880000 1.092000  0.3361000      1.531000  
1 1 1 27 32 35 o 3.754000 1.088000  4.146000 1.630000  3.362000 1.443000  0.7843000      2.177000  
1 1 1 27 32 37 o 8.328000 0.7336000 8.654000 1.065000  8.002000 1.009000  0.6520000      1.467000  
1 1 1 27 32 39 o 8.980000 0.7860000 8.923000 1.074000  9.036000 1.148000  -0.1131000     1.572000  
1 1 1 27 32 41 o 6.052000 1.233000  6.368000 1.868000  5.737000 1.609000  0.6314000      2.466000  
1 1 1 27 32 43 o 6.340000 1.007000  7.075000 1.384000  5.604000 1.464000  1.472000       2.014000  
1 1 1 27 33 0  o 3.582000 1.226000  3.582000 1.226000  3.582000 1.226000  0.000000       0.000000  
1 1 1 27 33 2  o 2.740000 0.8150000 2.940000 1.316000  2.540000 0.9612000 0.4001000      1.630000  
1 1 1 27 33 4  o 4.653000 0.8757000 4.984000 1.173000  4.322000 1.301000  0.6612000      1.751000  
1 1 1 27 33 6  o 4.491000 0.9638000 4.393000 1.358000  4.589000 1.368000  -0.1956000     1.928000  
1 1 1 27 33 8  o 9.482000 0.5493000 10.19000 0.7123000 8.778000 0.8364000 1.408000       1.099000  
1 1 1 27 33 10 o 17.94000 0.4824000 18.07000 0.5252000 17.82000 0.8092000 0.2526000      0.9647000 
1 1 1 27 33 12 o 7.726000 0.6810000 7.311000 0.9998000 8.141000 0.9250000 -0.8301000     1.362000  
1 1 1 27 33 14 o 4.546000 0.9579000 3.779000 1.400000  5.312000 1.307000  -1.533000      1.916000  
1 1 1 27 33 16 o 13.31000 0.4312000 12.86000 0.6252000 13.75000 0.5939000 -0.8917000     0.8623000 
1 1 1 27 33 18 o 2.492000 0.8104000 2.570000 1.162000  2.414000 1.130000  0.1562000      1.621000  
1 1 1 27 33 20 o 3.862000 0.9778000 4.176000 1.379000  3.547000 1.386000  0.6289000      1.956000  
1 1 1 27 33 22 o 10.74000 0.6362000 10.89000 0.7145000 10.59000 1.053000  0.3023000      1.272000  
1 1 1 27 33 24 f 5.793000 0.9688000 5.283000 1.404000  6.303000 1.335000  -1.020000      1.938000  
1 1 1 27 33 26 o 7.464000 0.8659000 7.821000 1.081000  7.107000 1.353000  0.7144000      1.732000  
1 1 1 27 33 28 o 14.15000 0.5241000 14.45000 0.7350000 13.85000 0.7473000 0.6008000      1.048000  
1 1 1 27 33 30 o 5.476000 1.079000  5.173000 1.544000  5.780000 1.507000  -0.6068000     2.158000  
1 1 1 27 33 32 o 6.527000 0.9000000 6.017000 1.345000  7.037000 1.196000  -1.020000      1.800000  
1 1 1 27 33 34 o 10.84000 0.6671000 10.37000 0.8770000 11.32000 1.006000  -0.9449000     1.334000  
1 1 1 27 33 36 o 8.311000 0.9247000 7.425000 1.483000  9.197000 1.105000  -1.772000      1.849000  
1 1 1 27 33 38 o 4.508000 1.137000  5.369000 1.753000  3.647000 1.449000  1.722000       2.274000  
1 1 1 27 33 40 o 4.712000 1.044000  4.945000 1.403000  4.480000 1.546000  0.4656000      2.087000  
1 1 1 27 33 42 o 3.319000 1.003000  3.130000 1.386000  3.509000 1.449000  -0.3790000     2.005000  
1 1 1 27 34 1  o 11.00000 0.3613000 10.77000 0.4847000 11.22000 0.5360000 -0.4562000     0.7226000 
1 1 1 27 34 3  o 18.93000 0.3496000 19.26000 0.4794000 18.60000 0.5090000 0.6581000      0.6992000 
1 1 1 27 34 5  f 7.306000 0.6449000 8.229000 0.7446000 6.383000 1.053000  1.846000       1.290000  
1 1 1 27 34 7  o 7.897000 0.6169000 8.700000 0.7379000 7.094000 0.9888000 1.606000       1.234000  
1 1 1 27 34 9  o 14.49000 0.4047000 14.98000 0.5255000 14.01000 0.6155000 0.9661000      0.8093000 
1 1 1 27 34 11 f 9.913000 0.5446000 10.32000 0.6439000 9.501000 0.8785000 0.8225000      1.089000  
1 1 1 27 34 13 o 3.028000 0.9212000 3.635000 1.450000  2.420000 1.137000  1.216000       1.842000  
1 1 1 27 34 15 o 10.68000 0.5182000 11.47000 0.6626000 9.895000 0.7970000 1.575000       1.036000  
1 1 1 27 34 17 o 17.62000 0.3712000 17.12000 0.5216000 18.12000 0.5282000 -0.9906000     0.7423000 
1 1 1 27 34 19 o 10.77000 0.5113000 11.11000 0.7135000 10.44000 0.7325000 0.6630000      1.023000  
1 1 1 27 34 21 o 7.233000 0.7443000 7.188000 1.042000  7.279000 1.063000  -0.9113000E-01 1.489000  
1 1 1 27 34 23 o 7.407000 0.8043000 7.829000 1.072000  6.985000 1.199000  0.8434000      1.609000  
1 1 1 27 34 25 o 3.934000 1.033000  4.989000 1.646000  2.878000 1.250000  2.111000       2.067000  
1 1 1 27 34 27 o 12.97000 0.5767000 13.65000 0.7063000 12.29000 0.9119000 1.365000       1.153000  
1 1 1 27 34 29 o 15.08000 0.4901000 15.27000 0.7359000 14.89000 0.6476000 0.3798000      0.9802000 
1 1 1 27 34 31 o 3.757000 1.089000  3.857000 1.628000  3.656000 1.448000  0.2015000      2.179000  
1 1 1 27 34 33 o 5.629000 1.204000  4.607000 1.609000  6.650000 1.793000  -2.043000      2.409000  
1 1 1 27 34 35 o 3.087000 1.011000  3.727000 1.668000  2.446000 1.141000  1.281000       2.021000  
1 1 1 27 34 37 o 9.703000 0.6394000 9.635000 0.9324000 9.770000 0.8752000 -0.1351000     1.279000  
1 1 1 27 34 39 o 13.45000 0.5273000 12.93000 0.7622000 13.97000 0.7290000 -1.033000      1.055000  
1 1 1 27 34 41 o 8.162000 0.7690000 7.704000 1.143000  8.621000 1.029000  -0.9171000     1.538000  
1 1 1 27 35 0  o 18.80000 0.4437000 18.80000 0.4437000 18.80000 0.4437000 0.000000       0.000000  
1 1 1 27 35 2  o 3.178000 0.7526000 2.730000 1.076000  3.627000 1.053000  -0.8970000     1.505000  
1 1 1 27 35 4  o 11.30000 0.5602000 11.68000 0.5937000 10.91000 0.9502000 0.7769000      1.120000  
1 1 1 27 35 6  o 3.436000 0.8489000 4.372000 1.256000  2.500000 1.142000  1.872000       1.698000  
1 1 1 27 35 8  o 11.73000 0.4500000 11.67000 0.6125000 11.80000 0.6595000 -0.1257000     0.9000000 
1 1 1 27 35 10 o 10.50000 0.6214000 10.15000 0.6767000 10.84000 1.042000  -0.6889000     1.243000  
1 1 1 27 35 12 o 19.61000 0.3725000 19.77000 0.5074000 19.44000 0.5456000 0.3365000      0.7450000 
1 1 1 27 35 14 o 16.48000 0.4078000 16.84000 0.5534000 16.12000 0.5991000 0.7214000      0.8155000 
1 1 1 27 35 16 o 16.19000 0.3944000 15.90000 0.5555000 16.48000 0.5601000 -0.5855000     0.7889000 
1 1 1 27 35 18 o 5.901000 0.8733000 5.671000 1.328000  6.130000 1.134000  -0.4598000     1.747000  
1 1 1 27 35 20 o 4.585000 0.9747000 5.148000 1.375000  4.021000 1.382000  1.127000       1.949000  
1 1 1 27 35 22 o 11.12000 0.7045000 10.89000 0.9466000 11.35000 1.044000  -0.4551000     1.409000  
1 1 1 27 35 24 o 6.670000 0.9557000 5.601000 1.634000  7.739000 0.9926000 -2.138000      1.911000  
1 1 1 27 35 26 o 9.118000 0.8139000 8.685000 1.039000  9.550000 1.253000  -0.8654000     1.628000  
1 1 1 27 35 28 o 8.760000 0.7439000 9.617000 1.026000  7.904000 1.077000  1.713000       1.488000  
1 1 1 27 35 30 o 8.540000 0.7848000 8.503000 1.247000  8.576000 0.9536000 -0.7242000E-01 1.570000  
1 1 1 27 35 32 o 3.654000 1.008000  3.499000 1.357000  3.809000 1.492000  -0.3092000     2.016000  
1 1 1 27 35 34 o 6.843000 0.9835000 6.297000 1.651000  7.388000 1.069000  -1.091000      1.967000  
1 1 1 27 35 36 o 13.02000 0.5227000 13.15000 0.7565000 12.89000 0.7214000 0.2691000      1.045000  
1 1 1 27 35 38 o 7.959000 0.9126000 7.755000 1.292000  8.163000 1.290000  -0.4072000     1.825000  
1 1 1 27 35 40 o 6.714000 1.003000  5.307000 1.516000  8.122000 1.314000  -2.814000      2.006000  
1 1 1 27 36 1  o 8.789000 0.3685000 8.655000 0.5796000 8.922000 0.4554000 -0.2670000     0.7371000 
1 1 1 27 36 3  o 10.82000 0.5387000 10.25000 0.4685000 11.40000 0.9702000 -1.157000      1.077000  
1 1 1 27 36 5  o 6.114000 0.8455000 6.409000 0.7660000 5.818000 1.508000  0.5906000      1.691000  
1 1 1 27 36 7  o 6.770000 0.6941000 6.383000 1.033000  7.157000 0.9269000 -0.7747000     1.388000  
1 1 1 27 36 9  o 9.712000 0.6594000 9.906000 1.037000  9.518000 0.8142000 0.3880000      1.319000  
1 1 1 27 36 11 o 6.067000 0.8586000 5.948000 1.156000  6.187000 1.270000  -0.2390000     1.717000  
1 1 1 27 36 13 o 12.96000 0.5020000 13.57000 0.7292000 12.35000 0.6902000 1.221000       1.004000  
1 1 1 27 36 15 o 4.299000 0.9397000 4.202000 1.313000  4.397000 1.345000  -0.1954000     1.879000  
1 1 1 27 36 17 o 4.355000 0.9596000 4.320000 1.321000  4.390000 1.392000  -0.7073000E-01 1.919000  
1 1 1 27 36 19 o 7.098000 0.7271000 7.204000 1.032000  6.992000 1.025000  0.2116000      1.454000  
1 1 1 27 36 21 o 5.384000 0.9553000 4.883000 1.347000  5.885000 1.355000  -1.001000      1.911000  
1 1 1 27 36 23 f 3.790000 0.9566000 3.802000 1.435000  3.778000 1.266000  0.2421000E-01  1.913000  
1 1 1 27 36 25 o 4.706000 1.078000  4.011000 1.318000  5.401000 1.706000  -1.390000      2.156000  
1 1 1 27 36 27 o 6.700000 1.080000  6.292000 1.806000  7.108000 1.184000  -0.8161000     2.159000  
1 1 1 27 36 29 o 22.78000 0.4629000 23.09000 0.6500000 22.48000 0.6593000 0.6098000      0.9258000 
1 1 1 27 36 31 o 20.34000 0.4962000 19.62000 0.7140000 21.06000 0.6893000 -1.446000      0.9924000 
1 1 1 27 36 33 o 17.44000 0.6130000 16.63000 0.6261000 18.25000 1.054000  -1.614000      1.226000  
1 1 1 27 36 35 o 6.507000 1.058000  6.800000 1.649000  6.213000 1.325000  0.5864000      2.115000  
1 1 1 27 36 37 o 3.493000 0.9808000 2.781000 1.291000  4.206000 1.477000  -1.425000      1.962000  
1 1 1 27 36 39 o 5.181000 1.006000  5.494000 1.400000  4.868000 1.446000  0.6266000      2.013000  
1 1 1 27 37 0  o 13.39000 0.4008000 13.39000 0.4008000 13.39000 0.4008000 0.000000       0.000000  
1 1 1 27 37 2  o 7.644000 0.6453000 7.189000 0.6338000 8.099000 1.124000  -0.9101000     1.291000  
1 1 1 27 37 4  o 4.208000 0.9685000 4.134000 1.102000  4.282000 1.593000  -0.1478000     1.937000  
1 1 1 27 37 6  o 8.905000 0.6802000 9.397000 0.5684000 8.414000 1.236000  0.9829000      1.360000  
1 1 1 27 37 8  o 5.927000 0.8732000 4.850000 1.010000  7.004000 1.425000  -2.155000      1.746000  
1 1 1 27 37 10 o 9.160000 0.6464000 8.914000 0.7475000 9.406000 1.055000  -0.4922000     1.293000  
1 1 1 27 37 12 o 9.127000 0.5801000 9.257000 0.7573000 8.997000 0.8790000 0.2596000      1.160000  
1 1 1 27 37 14 o 10.62000 0.5153000 11.39000 0.6347000 9.858000 0.8119000 1.532000       1.031000  
1 1 1 27 37 16 o 6.350000 0.8057000 8.015000 0.8239000 4.686000 1.385000  3.329000       1.611000  
1 1 1 27 37 18 o 3.154000 0.9051000 2.891000 1.224000  3.417000 1.334000  -0.5257000     1.810000  
1 1 1 27 37 20 o 9.333000 0.6067000 8.789000 0.8801000 9.876000 0.8353000 -1.087000      1.213000  
1 1 1 27 37 22 o 7.812000 0.9196000 7.379000 1.054000  8.246000 1.508000  -0.8668000     1.839000  
1 1 1 27 37 24 o 9.980000 1.062000  8.176000 1.959000  11.78000 0.8226000 -3.608000      2.124000  
1 1 1 27 37 26 o 8.401000 0.8603000 8.072000 1.422000  8.729000 0.9683000 -0.6574000     1.721000  
1 1 1 27 37 28 o 11.17000 0.6916000 10.76000 1.071000  11.57000 0.8758000 -0.8061000     1.383000  
1 1 1 27 37 30 o 5.229000 1.112000  4.288000 1.502000  6.170000 1.640000  -1.882000      2.224000  
1 1 1 27 37 32 o 10.33000 0.7289000 9.840000 0.8729000 10.82000 1.168000  -0.9786000     1.458000  
1 1 1 27 37 34 o 4.799000 1.071000  4.644000 1.497000  4.955000 1.532000  -0.3114000     2.142000  
1 1 1 27 37 36 o 10.10000 0.6539000 10.03000 0.8995000 10.17000 0.9494000 -0.1394000     1.308000  
1 1 1 27 37 38 o 6.336000 1.048000  6.903000 1.300000  5.770000 1.645000  1.133000       2.097000  
1 1 1 27 38 1  o 4.725000 0.7111000 4.791000 1.242000  4.659000 0.6923000 0.1321000      1.422000  
1 1 1 27 38 3  o 15.00000 0.4455000 14.28000 0.5185000 15.73000 0.7247000 -1.448000      0.8911000 
1 1 1 27 38 5  o 9.894000 0.5548000 9.557000 0.5490000 10.23000 0.9642000 -0.6750000     1.110000  
1 1 1 27 38 7  o 7.940000 0.7467000 8.325000 0.6288000 7.556000 1.355000  0.7687000      1.493000  
1 1 1 27 38 9  o 8.611000 0.6812000 8.900000 0.6080000 8.323000 1.219000  0.5771000      1.362000  
1 1 1 27 38 11 o 4.344000 1.032000  4.921000 1.343000  3.768000 1.568000  1.153000       2.064000  
1 1 1 27 38 13 o 12.99000 0.5243000 12.64000 0.8357000 13.33000 0.6334000 -0.6878000     1.049000  
1 1 1 27 38 15 o 3.000000 0.9042000 3.465000 1.362000  2.536000 1.189000  0.9285000      1.808000  
1 1 1 27 38 17 o 10.86000 0.5258000 11.30000 0.7677000 10.42000 0.7187000 0.8763000      1.052000  
1 1 1 27 38 19 o 4.535000 1.055000  4.736000 1.424000  4.333000 1.559000  0.4030000      2.111000  
1 1 1 27 38 21 o 4.436000 1.228000  3.306000 1.330000  5.566000 2.064000  -2.260000      2.456000  
1 1 1 27 38 23 o 11.09000 0.6955000 10.48000 1.098000  11.70000 0.8539000 -1.211000      1.391000  
1 1 1 27 38 25 o 2.875000 0.9143000 2.797000 1.329000  2.954000 1.256000  -0.1577000     1.829000  
1 1 1 27 38 27 o 7.247000 0.9247000 7.871000 1.407000  6.623000 1.201000  1.249000       1.849000  
1 1 1 27 38 29 o 15.83000 0.5309000 15.51000 0.6817000 16.15000 0.8140000 -0.6427000     1.062000  
1 1 1 27 38 31 f 8.898000 0.7132000 10.52000 0.8433000 7.274000 1.150000  3.249000       1.426000  
1 1 1 27 38 33 o 3.957000 0.9963000 4.641000 1.479000  3.273000 1.336000  1.368000       1.993000  
1 1 1 27 38 35 o 7.964000 0.7378000 7.550000 1.062000  8.378000 1.025000  -0.8280000     1.476000  
1 1 1 27 38 37 o 3.859000 0.9698000 2.803000 1.285000  4.914000 1.453000  -2.111000      1.940000  
1 1 1 27 39 0  o 29.53000 0.3937000 29.53000 0.3937000 29.53000 0.3937000 0.000000       0.000000  
1 1 1 27 39 2  o 11.10000 0.5227000 11.85000 0.4523000 10.35000 0.9424000 1.498000       1.045000  
1 1 1 27 39 4  o 4.944000 0.9150000 3.861000 1.129000  6.028000 1.440000  -2.167000      1.830000  
1 1 1 27 39 6  o 10.84000 0.5577000 11.11000 0.5108000 10.57000 0.9916000 0.5393000      1.115000  
1 1 1 27 39 8  o 9.236000 0.5887000 9.230000 0.5972000 9.242000 1.015000  -0.1201000E-01 1.177000  
1 1 1 27 39 10 o 5.249000 0.9897000 5.752000 1.178000  4.746000 1.591000  1.006000       1.979000  
1 1 1 27 39 12 o 5.074000 0.8691000 6.511000 0.8365000 3.638000 1.524000  2.873000       1.738000  
1 1 1 27 39 14 o 9.843000 0.5698000 10.02000 0.8029000 9.666000 0.8087000 0.3535000      1.140000  
1 1 1 27 39 16 o 8.243000 0.7176000 8.455000 1.068000  8.030000 0.9593000 0.4253000      1.435000  
1 1 1 27 39 18 f 4.218000 1.079000  4.136000 1.465000  4.300000 1.584000  -0.1635000     2.157000  
1 1 1 27 39 20 o 4.650000 1.089000  4.360000 1.615000  4.940000 1.462000  -0.5794000     2.178000  
1 1 1 27 39 22 o 8.771000 1.079000  8.443000 1.920000  9.098000 0.9862000 -0.6548000     2.159000  
1 1 1 27 39 24 o 8.454000 0.9960000 6.797000 1.804000  10.11000 0.8457000 -3.314000      1.992000  
1 1 1 27 39 26 o 10.87000 0.6470000 10.61000 0.8903000 11.14000 0.9390000 -0.5263000     1.294000  
1 1 1 27 39 28 o 11.40000 0.6416000 12.13000 0.7510000 10.67000 1.040000  1.460000       1.283000  
1 1 1 27 39 30 o 11.66000 0.6247000 11.77000 0.8021000 11.56000 0.9581000 0.2092000      1.249000  
1 1 1 27 39 32 o 9.184000 0.7711000 11.18000 0.7440000 7.186000 1.351000  3.995000       1.542000  
1 1 1 27 39 34 f 4.549000 1.005000  4.778000 1.444000  4.320000 1.399000  0.4588000      2.011000  
1 1 1 27 39 36 o 4.132000 0.9986000 5.052000 1.518000  3.211000 1.298000  1.841000       1.997000  
1 1 1 27 40 1  o 9.897000 0.4783000 8.953000 0.4356000 10.84000 0.8518000 -1.887000      0.9567000 
1 1 1 27 40 3  o 19.64000 0.4176000 20.40000 0.4857000 18.89000 0.6795000 1.510000       0.8352000 
1 1 1 27 40 5  o 15.52000 0.4747000 14.96000 0.4425000 16.09000 0.8399000 -1.131000      0.9494000 
1 1 1 27 40 7  o 7.625000 0.8514000 8.712000 0.6427000 6.538000 1.577000  2.174000       1.703000  
1 1 1 27 40 9  f 4.350000 0.9898000 4.513000 1.203000  4.186000 1.572000  0.3267000      1.980000  
1 1 1 27 40 11 o 2.904000 0.8640000 3.035000 1.168000  2.774000 1.273000  0.2610000      1.728000  
1 1 1 27 40 13 o 5.548000 0.9723000 5.995000 1.091000  5.101000 1.610000  0.8946000      1.945000  
1 1 1 27 40 15 o 12.86000 0.7623000 13.20000 0.5094000 12.52000 1.437000  0.6724000      1.525000  
1 1 1 27 40 17 o 12.67000 0.6032000 11.86000 0.9918000 13.48000 0.6868000 -1.617000      1.206000  
1 1 1 27 40 19 o 4.854000 1.073000  6.406000 1.638000  3.302000 1.385000  3.104000       2.146000  
1 1 1 27 40 21 o 4.389000 1.245000  3.759000 1.587000  5.019000 1.918000  -1.260000      2.489000  
1 1 1 27 40 23 o 5.938000 0.9414000 5.189000 1.490000  6.687000 1.150000  -1.497000      1.883000  
1 1 1 27 40 25 o 5.784000 1.091000  5.407000 1.440000  6.161000 1.641000  -0.7543000     2.183000  
1 1 1 27 40 27 o 5.778000 0.9483000 5.931000 1.247000  5.625000 1.429000  0.3055000      1.897000  
1 1 1 27 40 29 o 4.266000 1.005000  5.151000 1.455000  3.381000 1.386000  1.770000       2.010000  
1 1 1 27 40 31 o 4.006000 1.047000  3.699000 1.462000  4.313000 1.498000  -0.6144000     2.093000  
1 1 1 27 40 33 o 3.924000 0.9984000 3.494000 1.365000  4.353000 1.457000  -0.8587000     1.997000  
1 1 1 27 40 35 o 3.862000 1.029000  2.730000 1.235000  4.994000 1.647000  -2.263000      2.058000  
1 1 1 27 41 0  o 4.017000 0.8813000 4.017000 0.8813000 4.017000 0.8813000 0.000000       0.000000  
1 1 1 27 41 2  o 3.632000 0.9044000 3.202000 1.030000  4.062000 1.487000  -0.8594000     1.809000  
1 1 1 27 41 4  o 4.920000 0.9831000 4.507000 1.066000  5.333000 1.652000  -0.8255000     1.966000  
1 1 1 27 41 6  o 3.798000 1.004000  3.368000 1.206000  4.228000 1.605000  -0.8601000     2.008000  
1 1 1 27 41 8  o 3.075000 0.9158000 3.120000 1.193000  3.030000 1.389000  0.8963000E-01  1.832000  
1 1 1 27 41 10 o 6.782000 1.180000  7.629000 1.036000  5.935000 2.122000  1.693000       2.361000  
1 1 1 27 41 12 o 5.058000 1.134000  4.504000 1.245000  5.613000 1.896000  -1.108000      2.268000  
1 1 1 27 41 14 o 8.861000 0.7840000 8.326000 0.8412000 9.396000 1.323000  -1.070000      1.568000  
1 1 1 27 41 16 o 7.455000 0.9164000 7.376000 0.9541000 7.535000 1.565000  -0.1586000     1.833000  
1 1 1 27 41 18 o 12.13000 0.6995000 11.64000 0.6938000 12.63000 1.215000  -0.9835000     1.399000  
1 1 1 27 41 20 o 4.555000 1.101000  3.223000 1.411000  5.886000 1.690000  -2.663000      2.201000  
1 1 1 27 41 22 o 5.869000 1.011000  5.259000 1.486000  6.479000 1.372000  -1.220000      2.022000  
1 1 1 27 41 24 o 3.930000 1.040000  3.784000 1.443000  4.076000 1.499000  -0.2924000     2.080000  
1 1 1 27 41 26 o 3.870000 1.012000  3.280000 1.342000  4.460000 1.516000  -1.180000      2.024000  
1 1 1 27 41 28 o 4.442000 0.9330000 5.763000 1.298000  3.121000 1.341000  2.642000       1.866000  
1 1 1 27 41 30 o 3.455000 0.9904000 3.070000 1.364000  3.839000 1.436000  -0.7694000     1.981000  
1 1 1 27 41 32 o 4.055000 1.088000  4.339000 1.607000  3.772000 1.467000  0.5667000      2.176000  
1 1 1 27 41 34 o 4.778000 1.333000  4.935000 1.746000  4.620000 2.013000  0.3152000      2.665000  
1 1 1 27 42 1  o 3.242000 0.9579000 3.142000 1.357000  3.342000 1.352000  -0.1998000     1.916000  
1 1 1 27 42 3  o 7.816000 0.6325000 8.573000 0.5825000 7.059000 1.123000  1.515000       1.265000  
1 1 1 27 42 5  o 5.084000 1.195000  3.440000 1.191000  6.727000 2.073000  -3.287000      2.391000  
1 1 1 27 42 7  o 8.580000 1.124000  7.431000 0.7099000 9.729000 2.133000  -2.298000      2.248000  
1 1 1 27 42 9  o 3.583000 1.058000  2.546000 1.118000  4.620000 1.796000  -2.074000      2.116000  
1 1 1 27 42 11 o 12.01000 0.6342000 11.84000 0.6144000 12.17000 1.110000  -0.3261000     1.268000  
1 1 1 27 42 13 o 5.073000 1.118000  4.727000 1.291000  5.419000 1.826000  -0.6921000     2.237000  
1 1 1 27 42 15 o 3.933000 0.9899000 4.241000 1.375000  3.624000 1.425000  0.6165000      1.980000  
1 1 1 27 42 17 o 8.651000 0.9504000 9.682000 0.7935000 7.619000 1.727000  2.064000       1.901000  
1 1 1 27 42 19 o 4.344000 0.9539000 4.117000 1.216000  4.572000 1.470000  -0.4548000     1.908000  
1 1 1 27 42 21 o 5.609000 1.099000  5.100000 1.187000  6.118000 1.849000  -1.018000      2.198000  
1 1 1 27 42 23 o 4.042000 1.107000  3.928000 1.488000  4.156000 1.641000  -0.2284000     2.215000  
1 1 1 27 42 25 o 7.011000 0.8362000 5.780000 1.354000  8.243000 0.9817000 -2.462000      1.672000  
1 1 1 27 42 27 o 7.600000 0.8151000 8.769000 0.9909000 6.431000 1.294000  2.338000       1.630000  
1 1 1 27 42 29 o 5.732000 1.007000  5.345000 1.400000  6.118000 1.448000  -0.7738000     2.014000  
1 1 1 27 42 31 o 4.650000 1.109000  3.402000 1.447000  5.897000 1.682000  -2.494000      2.219000  
1 1 1 27 43 0  o 5.222000 0.7038000 5.222000 0.7038000 5.222000 0.7038000 0.000000       0.000000  
1 1 1 27 43 2  o 4.502000 0.9912000 5.214000 1.042000  3.791000 1.686000  1.423000       1.982000  
1 1 1 27 43 4  o 14.28000 0.7355000 14.39000 0.5907000 14.18000 1.347000  0.2060000      1.471000  
1 1 1 27 43 6  o 9.872000 0.6374000 10.33000 0.6142000 9.410000 1.117000  0.9244000      1.275000  
1 1 1 27 43 8  o 9.003000 0.6536000 9.128000 0.7114000 8.878000 1.097000  0.2501000      1.307000  
1 1 1 27 43 10 o 6.935000 0.9928000 6.657000 1.191000  7.213000 1.589000  -0.5568000     1.986000  
1 1 1 27 43 12 o 5.640000 1.019000  7.050000 1.195000  4.230000 1.652000  2.821000       2.039000  
1 1 1 27 43 14 o 4.703000 1.096000  5.229000 1.471000  4.178000 1.624000  1.051000       2.191000  
1 1 1 27 43 16 o 3.074000 0.9183000 3.161000 1.268000  2.986000 1.329000  0.1747000      1.837000  
1 1 1 27 43 18 o 4.674000 1.131000  4.004000 1.294000  5.344000 1.856000  -1.340000      2.263000  
1 1 1 27 43 20 o 4.352000 1.011000  3.127000 1.285000  5.577000 1.563000  -2.449000      2.023000  
1 1 1 27 43 22 o 6.972000 0.9660000 7.840000 0.8293000 6.104000 1.745000  1.736000       1.932000  
1 1 1 27 43 24 o 7.842000 0.7679000 7.400000 0.9012000 8.284000 1.244000  -0.8838000     1.536000  
1 1 1 27 43 26 o 6.340000 0.9272000 6.225000 1.130000  6.455000 1.470000  -0.2303000     1.854000  
1 1 1 27 43 28 o 5.018000 1.140000  3.815000 1.461000  6.220000 1.749000  -2.405000      2.279000  
1 1 1 27 43 30 o 5.437000 1.007000  5.257000 1.401000  5.618000 1.446000  -0.3610000     2.014000  
1 1 1 27 44 1  o 7.920000 0.8017000 8.106000 1.103000  7.733000 1.164000  0.3730000      1.603000  
1 1 1 27 44 3  o 4.878000 1.134000  4.942000 1.564000  4.814000 1.643000  0.1285000      2.268000  
1 1 1 27 44 5  o 6.557000 0.8843000 6.561000 0.7554000 6.553000 1.599000  0.8111000E-02  1.769000  
1 1 1 27 44 7  o 5.877000 0.8970000 5.769000 0.9843000 5.986000 1.500000  -0.2178000     1.794000  
1 1 1 27 44 9  o 5.166000 1.025000  5.557000 1.123000  4.775000 1.715000  0.7823000      2.050000  
1 1 1 27 44 11 o 9.163000 0.9018000 9.717000 0.6778000 8.609000 1.671000  1.108000       1.804000  
1 1 1 27 44 13 o 7.393000 1.027000  9.176000 0.7305000 5.609000 1.920000  3.567000       2.054000  
1 1 1 27 44 15 o 10.57000 0.8912000 11.74000 0.5749000 9.397000 1.687000  2.339000       1.782000  
1 1 1 27 44 17 o 13.29000 0.5109000 14.04000 0.5156000 12.54000 0.8821000 1.498000       1.022000  
1 1 1 27 44 19 o 6.260000 0.9775000 5.469000 1.083000  7.052000 1.628000  -1.583000      1.955000  
1 1 1 27 44 21 o 3.814000 1.040000  3.004000 1.229000  4.625000 1.679000  -1.622000      2.080000  
1 1 1 27 44 23 o 3.878000 1.004000  3.568000 1.255000  4.189000 1.568000  -0.6208000     2.009000  
1 1 1 27 44 25 o 4.997000 1.085000  5.015000 1.262000  4.980000 1.766000  0.3530000E-01  2.170000  
1 1 1 27 44 27 o 4.942000 1.085000  5.339000 1.330000  4.544000 1.715000  0.7943000      2.170000  
1 1 1 27 44 29 o 6.201000 1.124000  7.322000 0.9425000 5.081000 2.040000  2.240000       2.247000  
1 1 1 27 45 0  o 7.110000 1.708000  7.110000 1.708000  7.110000 1.708000  0.000000       0.000000  
1 1 1 27 45 2  o 7.256000 1.226000  7.049000 1.541000  7.464000 1.908000  -0.4150000     2.452000  
1 1 1 27 45 4  o 5.990000 1.361000  6.346000 1.842000  5.634000 2.004000  0.7124000      2.721000  
1 1 1 27 45 6  o 9.385000 0.6695000 8.322000 0.5982000 10.45000 1.198000  -2.126000      1.339000  
1 1 1 27 45 8  o 4.613000 1.120000  4.257000 1.149000  4.970000 1.924000  -0.7131000     2.241000  
1 1 1 27 45 10 o 5.354000 1.137000  5.992000 1.326000  4.717000 1.847000  1.276000       2.273000  
1 1 1 27 45 12 f 8.102000 0.9053000 8.536000 0.8537000 7.668000 1.597000  0.8683000      1.811000  
1 1 1 27 45 14 o 2.859000 0.9048000 2.721000 1.185000  2.997000 1.368000  -0.2755000     1.810000  
1 1 1 27 45 16 o 2.959000 0.9172000 2.595000 1.149000  3.323000 1.430000  -0.7282000     1.834000  
1 1 1 27 45 18 o 4.227000 1.060000  3.104000 1.211000  5.350000 1.740000  -2.246000      2.120000  
1 1 1 27 45 20 o 4.584000 1.130000  3.339000 1.371000  5.829000 1.796000  -2.490000      2.259000  
1 1 1 27 45 22 o 5.655000 1.011000  5.676000 1.309000  5.634000 1.542000  0.4192000E-01  2.022000  
1 1 1 27 45 24 o 5.029000 1.086000  5.065000 1.190000  4.994000 1.817000  0.7036000E-01  2.172000  
1 1 1 27 45 26 o 3.601000 1.012000  3.854000 1.319000  3.348000 1.536000  0.5058000      2.025000  
1 1 1 27 46 1  o 3.588000 1.063000  3.883000 1.553000  3.293000 1.452000  0.5903000      2.126000  
1 1 1 27 46 3  o 6.056000 1.105000  6.483000 1.428000  5.630000 1.686000  0.8527000      2.209000  
1 1 1 27 46 5  o 3.715000 1.009000  3.294000 1.428000  4.136000 1.427000  -0.8416000     2.018000  
1 1 1 27 46 7  o 7.265000 0.9425000 6.668000 1.228000  7.862000 1.430000  -1.194000      1.885000  
1 1 1 27 46 9  o 6.502000 1.070000  6.565000 1.213000  6.439000 1.762000  0.1259000      2.139000  
1 1 1 27 46 11 o 12.91000 0.5321000 14.25000 0.5115000 11.57000 0.9331000 2.678000       1.064000  
1 1 1 27 46 13 o 7.757000 0.9338000 8.944000 0.8098000 6.569000 1.683000  2.375000       1.868000  
1 1 1 27 46 15 o 2.974000 0.8949000 3.164000 1.244000  2.785000 1.287000  0.3792000      1.790000  
1 1 1 27 46 17 o 4.209000 0.9827000 4.966000 1.245000  3.452000 1.521000  1.514000       1.965000  
1 1 1 27 46 19 o 5.083000 1.046000  5.574000 1.328000  4.592000 1.616000  0.9819000      2.092000  
1 1 1 27 46 21 o 4.338000 1.074000  3.224000 1.274000  5.451000 1.729000  -2.227000      2.148000  
1 1 1 27 46 23 o 5.604000 1.047000  6.025000 1.127000  5.182000 1.765000  0.8433000      2.094000  
1 1 1 27 46 25 o 4.828000 1.175000  5.007000 1.271000  4.649000 1.977000  0.3576000      2.350000  
1 1 1 27 47 0  o 3.600000 1.553000  3.600000 1.553000  3.600000 1.553000  0.000000       0.000000  
1 1 1 27 47 2  o 5.305000 1.077000  5.868000 1.430000  4.742000 1.611000  1.125000       2.154000  
1 1 1 27 47 4  o 9.321000 1.069000  9.895000 1.812000  8.747000 1.136000  1.148000       2.139000  
1 1 1 27 47 6  o 6.320000 0.9920000 6.328000 0.9861000 6.311000 1.722000  0.1768000E-01  1.984000  
1 1 1 27 47 8  o 5.366000 1.099000  4.615000 1.347000  6.117000 1.736000  -1.502000      2.198000  
1 1 1 27 47 10 o 4.240000 0.9936000 3.513000 1.211000  4.966000 1.575000  -1.453000      1.987000  
1 1 1 27 47 12 o 2.891000 0.9341000 2.582000 1.156000  3.200000 1.467000  -0.6181000     1.868000  
1 1 1 27 47 14 o 8.213000 0.6869000 8.379000 0.7262000 8.047000 1.166000  0.3326000      1.374000  
1 1 1 27 47 16 o 5.526000 1.026000  5.548000 1.060000  5.505000 1.756000  0.4310000E-01  2.051000  
1 1 1 27 47 18 o 4.485000 1.017000  4.655000 1.272000  4.316000 1.587000  0.3392000      2.034000  
1 1 1 27 47 20 o 8.006000 0.8098000 6.418000 1.061000  9.593000 1.224000  -3.176000      1.620000  
1 1 1 27 47 22 o 6.484000 1.067000  5.065000 1.313000  7.903000 1.681000  -2.838000      2.133000  
1 1 1 27 48 1  o 4.613000 1.271000  5.037000 1.958000  4.190000 1.620000  0.8463000      2.542000  
1 1 1 27 48 3  o 5.077000 1.127000  5.592000 1.565000  4.561000 1.623000  1.031000       2.254000  
1 1 1 27 48 5  o 4.012000 1.089000  4.148000 1.484000  3.876000 1.593000  0.2713000      2.177000  
1 1 1 27 48 7  o 4.296000 1.133000  3.384000 1.502000  5.208000 1.697000  -1.824000      2.266000  
1 1 1 27 48 9  o 7.548000 0.8422000 6.878000 1.183000  8.218000 1.200000  -1.340000      1.684000  
1 1 1 27 48 11 f 3.067000 0.9535000 2.284000 1.045000  3.850000 1.595000  -1.566000      1.907000  
1 1 1 27 48 13 o 3.545000 0.9835000 2.964000 1.183000  4.126000 1.571000  -1.162000      1.967000  
1 1 1 27 48 15 o 5.559000 0.9522000 6.510000 0.9051000 4.607000 1.676000  1.902000       1.904000  
1 1 1 27 48 17 o 3.302000 0.9575000 2.854000 1.168000  3.750000 1.517000  -0.8961000     1.915000  
1 1 1 27 48 19 o 4.878000 1.159000  4.999000 1.530000  4.756000 1.742000  0.2426000      2.318000  
1 1 1 27 48 21 o 4.233000 1.915000  4.233000 1.915000  ?        ?         ?              ?         
1 1 1 27 49 0  o 6.984000 1.657000  6.984000 1.657000  6.984000 1.657000  0.000000       0.000000  
1 1 1 27 49 2  o 8.438000 1.191000  6.891000 1.345000  9.985000 1.965000  -3.094000      2.381000  
1 1 1 27 49 4  o 4.882000 1.141000  4.364000 1.593000  5.400000 1.634000  -1.036000      2.282000  
1 1 1 27 49 6  o 3.505000 1.068000  3.350000 1.448000  3.660000 1.571000  -0.3105000     2.137000  
1 1 1 27 49 8  o 5.531000 1.123000  6.069000 1.612000  4.993000 1.563000  1.076000       2.245000  
1 1 1 27 49 10 o 4.040000 1.157000  3.505000 1.546000  4.575000 1.722000  -1.070000      2.314000  
1 1 1 27 49 12 o 5.041000 1.152000  5.974000 1.676000  4.108000 1.580000  1.866000       2.303000  
1 1 1 27 49 14 o 6.111000 1.001000  6.428000 0.9236000 5.793000 1.777000  0.6350000      2.003000  
1 1 1 27 49 16 o 2.966000 0.9047000 2.891000 1.207000  3.041000 1.348000  -0.1501000     1.809000  
1 1 1 27 49 18 o 3.890000 1.783000  3.890000 1.783000  ?        ?         ?              ?         
1 1 1 27 50 1  o 3.040000 0.9928000 3.543000 1.578000  2.536000 1.205000  1.007000       1.986000  
1 1 1 27 50 3  o 4.390000 1.191000  4.100000 1.656000  4.681000 1.713000  -0.5813000     2.383000  
1 1 1 27 50 5  f 3.755000 1.104000  3.473000 1.545000  4.037000 1.576000  -0.5648000     2.207000  
1 1 1 27 50 7  o 3.525000 1.066000  3.237000 1.459000  3.813000 1.553000  -0.5762000     2.131000  
1 1 1 27 50 9  o 7.721000 1.086000  8.415000 1.388000  7.026000 1.670000  1.389000       2.172000  
1 1 1 27 50 11 o 5.024000 1.120000  3.906000 1.582000  6.143000 1.586000  -2.237000      2.240000  
1 1 1 27 50 13 o 3.328000 1.058000  3.182000 1.456000  3.473000 1.536000  -0.2904000     2.117000  
1 1 1 27 51 0  f 2.945000 1.355000  2.945000 1.355000  2.945000 1.355000  0.000000       0.000000  
1 1 1 27 51 2  o 5.782000 1.158000  5.249000 1.654000  6.314000 1.622000  -1.065000      2.316000  
1 1 1 27 51 4  o 4.578000 1.184000  5.308000 1.743000  3.847000 1.604000  1.461000       2.369000  
1 1 1 27 51 6  o 3.012000 0.9604000 2.807000 1.304000  3.216000 1.410000  -0.4097000     1.921000  
1 1 1 27 51 8  o 3.421000 1.111000  3.525000 1.653000  3.317000 1.485000  0.2086000      2.222000  
1 1 1 28 0  0  o 40.97000 0.6711000 40.97000 0.6711000 40.97000 0.6711000 0.000000       0.000000  
1 1 1 28 0  2  o 18.21000 0.4037000 18.21000 0.4037000 18.21000 0.4037000 0.000000       0.000000  
1 1 1 28 0  4  o 19.74000 0.4111000 19.74000 0.4111000 19.74000 0.4111000 0.000000       0.000000  
1 1 1 28 0  6  o 20.43000 0.4204000 20.43000 0.4204000 20.43000 0.4204000 0.000000       0.000000  
1 1 1 28 0  8  f 19.59000 0.4305000 19.59000 0.4305000 19.59000 0.4305000 0.000000       0.000000  
1 1 1 28 0  10 o 13.71000 0.4776000 13.71000 0.4776000 13.71000 0.4776000 0.000000       0.000000  
1 1 1 28 0  12 o 19.13000 0.4346000 19.13000 0.4346000 19.13000 0.4346000 0.000000       0.000000  
1 1 1 28 0  14 o 11.97000 0.5445000 11.97000 0.5445000 11.97000 0.5445000 0.000000       0.000000  
1 1 1 28 0  16 o 11.16000 0.7076000 11.16000 0.7076000 11.16000 0.7076000 0.000000       0.000000  
1 1 1 28 0  18 o 34.76000 0.4562000 34.76000 0.4562000 34.76000 0.4562000 0.000000       0.000000  
1 1 1 28 0  20 o 24.41000 0.5042000 24.41000 0.5042000 24.41000 0.5042000 0.000000       0.000000  
1 1 1 28 0  22 o 23.36000 0.4475000 23.36000 0.4475000 23.36000 0.4475000 0.000000       0.000000  
1 1 1 28 0  24 o 41.27000 0.5053000 41.27000 0.5053000 41.27000 0.5053000 0.000000       0.000000  
1 1 1 28 0  26 o 27.13000 0.4489000 27.13000 0.4489000 27.13000 0.4489000 0.000000       0.000000  
1 1 1 28 0  28 o 3.948000 1.395000  3.948000 1.395000  3.948000 1.395000  0.000000       0.000000  
1 1 1 28 0  30 o 16.99000 0.5063000 16.99000 0.5063000 16.99000 0.5063000 0.000000       0.000000  
1 1 1 28 0  32 o 10.35000 0.7086000 10.35000 0.7086000 10.35000 0.7086000 0.000000       0.000000  
1 1 1 28 0  34 o 3.545000 1.407000  3.545000 1.407000  3.545000 1.407000  0.000000       0.000000  
1 1 1 28 0  36 o 13.50000 0.6417000 13.50000 0.6417000 13.50000 0.6417000 0.000000       0.000000  
1 1 1 28 0  38 o 5.932000 1.433000  5.932000 1.433000  5.932000 1.433000  0.000000       0.000000  
1 1 1 28 0  40 o 14.35000 0.5641000 14.35000 0.5641000 14.35000 0.5641000 0.000000       0.000000  
1 1 1 28 0  42 o 10.09000 0.7184000 10.09000 0.7184000 10.09000 0.7184000 0.000000       0.000000  
1 1 1 28 0  44 o 2.657000 1.191000  2.657000 1.191000  2.657000 1.191000  0.000000       0.000000  
1 1 1 28 0  46 o 3.428000 1.405000  3.428000 1.405000  3.428000 1.405000  0.000000       0.000000  
1 1 1 28 0  48 o 4.686000 1.522000  4.686000 1.522000  4.686000 1.522000  0.000000       0.000000  
1 1 1 28 0  50 o 2.940000 1.261000  2.940000 1.261000  2.940000 1.261000  0.000000       0.000000  
1 1 1 28 0  52 o 3.232000 1.429000  3.232000 1.429000  3.232000 1.429000  0.000000       0.000000  
1 1 1 28 0  54 o 8.435000 0.9199000 8.435000 0.9199000 8.435000 0.9199000 0.000000       0.000000  
1 1 1 28 1  1  o 23.46000 0.2892000 23.69000 0.4134000 23.22000 0.4045000 0.4617000      0.5783000 
1 1 1 28 1  3  o 38.54000 0.3248000 38.32000 0.4573000 38.76000 0.4614000 -0.4364000     0.6496000 
1 1 1 28 1  5  o 14.13000 0.3327000 13.83000 0.4831000 14.44000 0.4575000 -0.6127000     0.6654000 
1 1 1 28 1  7  o 20.83000 0.2838000 20.99000 0.4030000 20.68000 0.3999000 0.3116000      0.5677000 
1 1 1 28 1  9  o 34.10000 0.3076000 34.06000 0.4389000 34.14000 0.4313000 -0.7774000E-01 0.6153000 
1 1 1 28 1  11 o 10.05000 0.4107000 10.28000 0.5784000 9.812000 0.5832000 0.4658000      0.8214000 
1 1 1 28 1  13 o 8.240000 0.5138000 8.290000 0.7577000 8.190000 0.6942000 0.1004000      1.028000  
1 1 1 28 1  15 o 25.16000 0.3209000 25.28000 0.4873000 25.05000 0.4177000 0.2319000      0.6418000 
1 1 1 28 1  17 o 25.02000 0.3305000 25.13000 0.4330000 24.91000 0.4993000 0.2181000      0.6609000 
1 1 1 28 1  19 o 27.12000 0.3411000 27.21000 0.4417000 27.03000 0.5199000 0.1836000      0.6822000 
1 1 1 28 1  21 o 45.26000 0.4497000 45.23000 0.7313000 45.30000 0.5236000 -0.7515000E-01 0.8994000 
1 1 1 28 1  23 o 15.37000 0.3862000 15.49000 0.5336000 15.26000 0.5584000 0.2321000      0.7723000 
1 1 1 28 1  25 o 29.78000 0.3205000 29.89000 0.4511000 29.67000 0.4554000 0.2265000      0.6410000 
1 1 1 28 1  27 o 20.13000 0.3362000 19.75000 0.4792000 20.51000 0.4718000 -0.7578000     0.6725000 
1 1 1 28 1  29 o 14.13000 0.4098000 13.85000 0.5944000 14.40000 0.5643000 -0.5474000     0.8196000 
1 1 1 28 1  31 f 11.33000 0.5761000 11.46000 0.7050000 11.21000 0.9113000 0.2552000      1.152000  
1 1 1 28 1  33 o 17.38000 0.3791000 17.21000 0.4932000 17.55000 0.5758000 -0.3373000     0.7582000 
1 1 1 28 1  35 o 29.24000 0.3817000 28.60000 0.5545000 29.88000 0.5248000 -1.279000      0.7635000 
1 1 1 28 1  37 o 17.90000 0.4547000 17.03000 0.5809000 18.76000 0.6997000 -1.733000      0.9094000 
1 1 1 28 1  39 o 24.98000 0.3549000 25.45000 0.5406000 24.51000 0.4601000 0.9422000      0.7099000 
1 1 1 28 1  41 o 2.879000 0.8610000 2.412000 1.126000  3.346000 1.303000  -0.9340000     1.722000  
1 1 1 28 1  43 o 3.183000 0.9007000 3.372000 1.326000  2.994000 1.219000  0.3776000      1.801000  
1 1 1 28 1  45 o 11.55000 0.5991000 12.41000 0.9892000 10.70000 0.6762000 1.715000       1.198000  
1 1 1 28 1  47 o 5.903000 0.8730000 6.204000 1.203000  5.602000 1.266000  0.6025000      1.746000  
1 1 1 28 1  49 o 7.024000 0.7735000 8.217000 0.9432000 5.831000 1.226000  2.387000       1.547000  
1 1 1 28 1  51 o 6.133000 0.9489000 6.712000 1.117000  5.555000 1.535000  1.157000       1.898000  
1 1 1 28 1  53 o 8.507000 0.6760000 8.758000 1.063000  8.256000 0.8353000 0.5017000      1.352000  
1 1 1 28 2  0  o 39.38000 0.4664000 39.38000 0.4664000 39.38000 0.4664000 0.000000       0.000000  
1 1 1 28 2  2  f 17.80000 0.2937000 17.93000 0.4120000 17.68000 0.4188000 0.2488000      0.5875000 
1 1 1 28 2  4  o 28.94000 0.2877000 28.99000 0.4046000 28.88000 0.4092000 0.1114000      0.5755000 
1 1 1 28 2  6  o 10.41000 0.4273000 10.49000 0.5759000 10.34000 0.6313000 0.1539000      0.8545000 
1 1 1 28 2  8  o 21.46000 0.3085000 21.87000 0.4151000 21.04000 0.4566000 0.8247000      0.6171000 
1 1 1 28 2  10 o 24.81000 0.3109000 25.28000 0.4101000 24.34000 0.4673000 0.9408000      0.6217000 
1 1 1 28 2  12 o 16.77000 0.3288000 16.48000 0.4340000 17.06000 0.4941000 -0.5838000     0.6576000 
1 1 1 28 2  14 o 26.34000 0.3428000 26.55000 0.4808000 26.13000 0.4888000 0.4173000      0.6857000 
1 1 1 28 2  16 o 18.66000 0.3182000 19.05000 0.4425000 18.26000 0.4573000 0.7985000      0.6364000 
1 1 1 28 2  18 o 45.07000 0.3666000 44.98000 0.5175000 45.15000 0.5194000 -0.1686000     0.7332000 
1 1 1 28 2  20 o 11.58000 0.4572000 12.00000 0.6410000 11.16000 0.6521000 0.8427000      0.9144000 
1 1 1 28 2  22 o 14.36000 0.3935000 14.38000 0.5563000 14.33000 0.5567000 0.4985000E-01  0.7870000 
1 1 1 28 2  24 o 16.81000 0.3684000 16.80000 0.5204000 16.82000 0.5215000 -0.1328000E-01 0.7368000 
1 1 1 28 2  26 o 14.68000 0.3935000 14.15000 0.5534000 15.21000 0.5594000 -1.056000      0.7869000 
1 1 1 28 2  28 o 16.78000 0.3984000 16.43000 0.5632000 17.14000 0.5637000 -0.7132000     0.7968000 
1 1 1 28 2  30 o 22.31000 0.3485000 22.14000 0.4483000 22.48000 0.5338000 -0.3418000     0.6971000 
1 1 1 28 2  32 o 17.49000 0.3690000 17.32000 0.5498000 17.65000 0.4925000 -0.3208000     0.7381000 
1 1 1 28 2  34 o 5.619000 0.9070000 4.832000 1.253000  6.406000 1.312000  -1.573000      1.814000  
1 1 1 28 2  36 o 7.621000 0.8328000 7.225000 1.417000  8.017000 0.8751000 -0.7918000     1.666000  
1 1 1 28 2  38 o 9.386000 0.5456000 9.691000 0.7545000 9.081000 0.7884000 0.6103000      1.091000  
1 1 1 28 2  40 o 4.889000 0.9841000 4.019000 1.543000  5.760000 1.222000  -1.741000      1.968000  
1 1 1 28 2  42 o 7.205000 0.6934000 7.553000 0.9424000 6.857000 1.018000  0.6966000      1.387000  
1 1 1 28 2  44 o 9.358000 0.7541000 9.343000 1.299000  9.372000 0.7662000 -0.2871000E-01 1.508000  
1 1 1 28 2  46 o 11.19000 0.5388000 11.41000 0.7184000 10.96000 0.8030000 0.4526000      1.078000  
1 1 1 28 2  48 o 3.733000 1.041000  3.825000 1.461000  3.642000 1.483000  0.1830000      2.082000  
1 1 1 28 2  50 o 6.715000 1.065000  6.773000 1.158000  6.656000 1.787000  0.1163000      2.129000  
1 1 1 28 2  52 o 5.731000 0.9419000 5.233000 1.401000  6.228000 1.260000  -0.9949000     1.884000  
1 1 1 28 2  54 o 9.241000 0.6551000 9.312000 1.044000  9.170000 0.7923000 0.1422000      1.310000  
1 1 1 28 3  1  o 20.50000 0.2900000 20.93000 0.4138000 20.08000 0.4065000 0.8505000      0.5800000 
1 1 1 28 3  3  o 42.13000 0.3684000 42.31000 0.4833000 41.94000 0.5563000 0.3708000      0.7369000 
1 1 1 28 3  5  o 14.06000 0.3553000 14.54000 0.4673000 13.58000 0.5352000 0.9513000      0.7105000 
1 1 1 28 3  7  o 44.93000 0.3864000 44.83000 0.5052000 45.03000 0.5849000 -0.2030000     0.7729000 
1 1 1 28 3  9  o 38.72000 0.3540000 38.77000 0.4681000 38.66000 0.5312000 0.1077000      0.7080000 
1 1 1 28 3  11 o 15.61000 0.3413000 15.31000 0.4575000 15.92000 0.5066000 -0.6185000     0.6826000 
1 1 1 28 3  13 o 45.87000 0.4201000 45.81000 0.5923000 45.92000 0.5958000 -0.1146000     0.8402000 
1 1 1 28 3  15 o 73.52000 0.5701000 74.44000 0.7546000 72.60000 0.8547000 1.836000       1.140000  
1 1 1 28 3  17 o 52.39000 0.4982000 51.93000 0.5663000 52.85000 0.8198000 -0.9286000     0.9963000 
1 1 1 28 3  19 o 44.23000 0.3906000 44.25000 0.5155000 44.22000 0.5870000 0.2642000E-01  0.7812000 
1 1 1 28 3  21 o 20.56000 0.3491000 21.12000 0.5320000 20.00000 0.4521000 1.125000       0.6981000 
1 1 1 28 3  23 o 29.48000 0.3203000 29.15000 0.4453000 29.81000 0.4604000 -0.6639000     0.6405000 
1 1 1 28 3  25 o 11.88000 0.5025000 11.54000 0.7414000 12.22000 0.6785000 -0.6839000     1.005000  
1 1 1 28 3  27 o 18.66000 0.3439000 18.61000 0.4862000 18.70000 0.4864000 -0.8838000E-01 0.6877000 
1 1 1 28 3  29 o 21.81000 0.3540000 22.03000 0.4658000 21.59000 0.5331000 0.4340000      0.7079000 
1 1 1 28 3  31 o 8.209000 0.5893000 8.668000 0.8029000 7.750000 0.8629000 0.9181000      1.179000  
1 1 1 28 3  33 o 15.81000 0.4464000 15.71000 0.4522000 15.92000 0.7697000 -0.2146000     0.8927000 
1 1 1 28 3  35 o 3.951000 0.9995000 4.025000 1.294000  3.877000 1.524000  0.1476000      1.999000  
1 1 1 28 3  37 o 4.324000 0.9480000 3.379000 1.427000  5.270000 1.248000  -1.891000      1.896000  
1 1 1 28 3  39 o 11.14000 0.4611000 11.27000 0.6562000 11.02000 0.6478000 0.2567000      0.9221000 
1 1 1 28 3  41 o 4.615000 0.9622000 3.737000 1.475000  5.492000 1.236000  -1.755000      1.924000  
1 1 1 28 3  43 o 4.549000 1.084000  4.885000 1.675000  4.213000 1.375000  0.6715000      2.167000  
1 1 1 28 3  45 o 10.68000 0.5205000 11.06000 0.7883000 10.31000 0.6800000 0.7539000      1.041000  
1 1 1 28 3  47 o 5.340000 1.063000  5.924000 1.308000  4.757000 1.676000  1.167000       2.126000  
1 1 1 28 3  49 o 8.829000 0.5978000 8.831000 0.8870000 8.827000 0.8017000 0.3646000E-02  1.196000  
1 1 1 28 3  51 o 7.027000 1.067000  6.390000 1.262000  7.665000 1.720000  -1.276000      2.133000  
1 1 1 28 3  53 o 7.159000 0.7887000 6.790000 1.132000  7.527000 1.099000  -0.7368000     1.577000  
1 1 1 28 4  0  o 72.58000 0.8466000 72.58000 0.8466000 72.58000 0.8466000 0.000000       0.000000  
1 1 1 28 4  2  o 44.00000 0.3786000 44.04000 0.4983000 43.97000 0.5702000 0.6561000E-01  0.7573000 
1 1 1 28 4  4  o 26.99000 0.3049000 27.05000 0.4002000 26.94000 0.4602000 0.1084000      0.6099000 
1 1 1 28 4  6  o 44.96000 0.3565000 45.12000 0.5065000 44.80000 0.5018000 0.3223000      0.7130000 
1 1 1 28 4  8  o 38.92000 0.3286000 38.99000 0.4668000 38.85000 0.4626000 0.1334000      0.6572000 
1 1 1 28 4  10 o 16.42000 0.3107000 16.99000 0.4321000 15.85000 0.4467000 1.143000       0.6215000 
1 1 1 28 4  12 o 26.84000 0.3100000 26.92000 0.4624000 26.75000 0.4131000 0.1732000      0.6200000 
1 1 1 28 4  14 o 21.56000 0.3008000 21.73000 0.4201000 21.39000 0.4308000 0.3405000      0.6017000 
1 1 1 28 4  16 o 12.62000 0.3909000 12.38000 0.5615000 12.86000 0.5439000 -0.4740000     0.7817000 
1 1 1 28 4  18 o 37.18000 0.5351000 36.63000 0.4633000 37.72000 0.9646000 -1.094000      1.070000  
1 1 1 28 4  20 o 35.13000 0.3540000 35.58000 0.4680000 34.67000 0.5312000 0.9098000      0.7079000 
1 1 1 28 4  22 o 26.43000 0.3880000 25.52000 0.5857000 27.33000 0.5090000 -1.819000      0.7760000 
1 1 1 28 4  24 o 19.77000 0.3532000 19.49000 0.5318000 20.06000 0.4649000 -0.5732000     0.7064000 
1 1 1 28 4  26 f 15.87000 0.3731000 16.22000 0.5216000 15.52000 0.5337000 0.6996000      0.7462000 
1 1 1 28 4  28 f 6.376000 0.8434000 6.327000 1.074000  6.425000 1.300000  -0.9796000E-01 1.687000  
1 1 1 28 4  30 f 7.047000 0.6922000 7.762000 0.8937000 6.331000 1.057000  1.432000       1.384000  
1 1 1 28 4  32 o 5.441000 0.9395000 5.337000 1.294000  5.545000 1.362000  -0.2081000     1.879000  
1 1 1 28 4  34 o 3.081000 0.9174000 3.092000 1.227000  3.070000 1.364000  0.2186000E-01  1.835000  
1 1 1 28 4  36 o 8.846000 0.5947000 7.699000 0.8466000 9.993000 0.8353000 -2.294000      1.189000  
1 1 1 28 4  38 o 5.758000 0.9642000 4.630000 1.653000  6.886000 0.9924000 -2.256000      1.928000  
1 1 1 28 4  40 o 3.007000 0.8767000 2.891000 1.238000  3.123000 1.242000  -0.2324000     1.753000  
1 1 1 28 4  42 o 4.015000 0.9719000 3.435000 1.426000  4.595000 1.321000  -1.160000      1.944000  
1 1 1 28 4  44 o 5.262000 0.9019000 5.246000 1.334000  5.279000 1.215000  -0.3298000E-01 1.804000  
1 1 1 28 4  46 o 9.439000 0.7643000 9.708000 0.8745000 9.170000 1.254000  0.5386000      1.529000  
1 1 1 28 4  48 f 5.341000 0.9666000 4.659000 1.482000  6.023000 1.242000  -1.364000      1.933000  
1 1 1 28 4  50 o 7.217000 0.7458000 7.112000 1.065000  7.322000 1.044000  -0.2101000     1.492000  
1 1 1 28 4  52 o 7.540000 1.065000  8.373000 1.174000  6.707000 1.777000  1.667000       2.129000  
1 1 1 28 4  54 o 3.205000 0.9480000 3.037000 1.316000  3.374000 1.364000  -0.3376000     1.896000  
1 1 1 28 5  1  o 10.00000 0.5155000 10.30000 0.7459000 9.712000 0.7119000 0.5837000      1.031000  
1 1 1 28 5  3  o 33.12000 0.3042000 33.30000 0.4320000 32.94000 0.4282000 0.3578000      0.6083000 
1 1 1 28 5  5  o 24.60000 0.2844000 24.44000 0.3988000 24.76000 0.4055000 -0.3157000     0.5688000 
1 1 1 28 5  7  o 17.30000 0.3107000 17.19000 0.4423000 17.40000 0.4366000 -0.2113000     0.6215000 
1 1 1 28 5  9  f 60.17000 0.4443000 60.26000 0.6293000 60.08000 0.6274000 0.1868000      0.8886000 
1 1 1 28 5  11 o 6.987000 0.6281000 7.389000 0.8688000 6.586000 0.9074000 0.8034000      1.256000  
1 1 1 28 5  13 o 2.727000 0.8220000 2.781000 1.175000  2.673000 1.149000  0.1084000      1.644000  
1 1 1 28 5  15 o 8.134000 0.5344000 7.782000 0.7740000 8.486000 0.7370000 -0.7037000     1.069000  
1 1 1 28 5  17 o 44.94000 0.3899000 44.75000 0.5130000 45.12000 0.5873000 -0.3702000     0.7798000 
1 1 1 28 5  19 o 13.44000 0.4541000 14.04000 0.5383000 12.85000 0.7314000 1.186000       0.9081000 
1 1 1 28 5  21 o 28.77000 0.3653000 28.64000 0.5056000 28.90000 0.5275000 -0.2571000     0.7306000 
1 1 1 28 5  23 o 17.51000 0.3983000 17.29000 0.5482000 17.73000 0.5779000 -0.4456000     0.7965000 
1 1 1 28 5  25 o 13.90000 0.4379000 13.75000 0.5577000 14.05000 0.6753000 -0.2988000     0.8758000 
1 1 1 28 5  27 o 21.26000 0.3221000 21.42000 0.4565000 21.10000 0.4546000 0.3208000      0.6443000 
1 1 1 28 5  29 o 14.65000 0.3718000 14.41000 0.5269000 14.88000 0.5247000 -0.4778000     0.7435000 
1 1 1 28 5  31 o 15.32000 0.4267000 15.13000 0.6923000 15.52000 0.4991000 -0.3915000     0.8534000 
1 1 1 28 5  33 o 16.93000 0.3729000 16.70000 0.4462000 17.16000 0.5976000 -0.4585000     0.7458000 
1 1 1 28 5  35 o 4.507000 0.9469000 4.804000 1.185000  4.210000 1.477000  0.5939000      1.894000  
1 1 1 28 5  37 o 15.39000 0.3978000 15.20000 0.6023000 15.57000 0.5197000 -0.3635000     0.7955000 
1 1 1 28 5  39 o 26.88000 0.4054000 26.78000 0.6709000 26.98000 0.4554000 -0.2003000     0.8109000 
1 1 1 28 5  41 o 9.138000 0.5584000 9.005000 0.8441000 9.270000 0.7311000 -0.2649000     1.117000  
1 1 1 28 5  43 o 4.097000 0.9904000 4.622000 1.486000  3.571000 1.309000  1.051000       1.981000  
1 1 1 28 5  45 o 10.71000 0.5995000 10.96000 0.7904000 10.46000 0.9016000 0.5079000      1.199000  
1 1 1 28 5  47 o 3.660000 0.9790000 4.148000 1.430000  3.172000 1.337000  0.9763000      1.958000  
1 1 1 28 5  49 o 3.848000 1.051000  3.699000 1.482000  3.998000 1.492000  -0.2984000     2.103000  
1 1 1 28 5  51 o 4.096000 1.025000  3.774000 1.427000  4.418000 1.471000  -0.6441000     2.050000  
1 1 1 28 5  53 o 3.733000 1.050000  3.272000 1.419000  4.195000 1.549000  -0.9224000     2.100000  
1 1 1 28 6  0  o 7.479000 0.8367000 7.479000 0.8367000 7.479000 0.8367000 0.000000       0.000000  
1 1 1 28 6  2  o 50.32000 0.4170000 50.57000 0.6323000 50.06000 0.5440000 0.5093000      0.8341000 
1 1 1 28 6  4  o 14.99000 0.3241000 14.40000 0.4507000 15.57000 0.4658000 -1.176000      0.6482000 
1 1 1 28 6  6  o 54.26000 0.4084000 54.43000 0.5790000 54.10000 0.5762000 0.3268000      0.8169000 
1 1 1 28 6  8  o 5.275000 0.8801000 4.570000 1.487000  5.980000 0.9424000 -1.410000      1.760000  
1 1 1 28 6  10 o 30.99000 0.3733000 30.39000 0.6160000 31.58000 0.4218000 -1.187000      0.7466000 
1 1 1 28 6  12 o 9.309000 0.5530000 9.378000 0.8777000 9.239000 0.6729000 0.1384000      1.106000  
1 1 1 28 6  14 o 15.91000 0.3820000 15.93000 0.5880000 15.89000 0.4877000 0.4120000E-01  0.7640000 
1 1 1 28 6  16 o 46.32000 0.3983000 45.92000 0.5204000 46.72000 0.6031000 -0.7983000     0.7966000 
1 1 1 28 6  18 o 4.450000 0.9546000 4.788000 1.358000  4.112000 1.342000  0.6762000      1.909000  
1 1 1 28 6  20 o 32.87000 0.3201000 33.02000 0.4483000 32.73000 0.4572000 0.2823000      0.6403000 
1 1 1 28 6  22 o 23.23000 0.3415000 22.95000 0.5100000 23.51000 0.4543000 -0.5606000     0.6830000 
1 1 1 28 6  24 o 18.31000 0.4373000 18.04000 0.4816000 18.58000 0.7300000 -0.5395000     0.8745000 
1 1 1 28 6  26 o 15.10000 0.3741000 14.97000 0.5236000 15.23000 0.5343000 -0.2552000     0.7481000 
1 1 1 28 6  28 o 13.90000 0.3908000 13.94000 0.5430000 13.86000 0.5622000 0.7958000E-01  0.7816000 
1 1 1 28 6  30 o 10.40000 0.5420000 10.69000 0.8675000 10.12000 0.6500000 0.5727000      1.084000  
1 1 1 28 6  32 o 20.85000 0.3354000 20.89000 0.4113000 20.80000 0.5300000 0.8365000E-01  0.6709000 
1 1 1 28 6  34 o 20.78000 0.5000000 21.27000 0.4194000 20.28000 0.9078000 0.9902000      0.9999000 
1 1 1 28 6  36 o 5.532000 0.8718000 5.424000 1.108000  5.639000 1.346000  -0.2155000     1.744000  
1 1 1 28 6  38 o 14.92000 0.4956000 15.14000 0.8191000 14.70000 0.5582000 0.4313000      0.9912000 
1 1 1 28 6  40 o 3.113000 0.9314000 3.303000 1.416000  2.922000 1.210000  0.3803000      1.863000  
1 1 1 28 6  42 f 4.761000 0.9165000 4.517000 1.347000  5.005000 1.243000  -0.4886000     1.833000  
1 1 1 28 6  44 o 6.721000 0.9844000 7.398000 1.419000  6.045000 1.364000  1.353000       1.969000  
1 1 1 28 6  46 o 10.73000 0.5252000 10.73000 0.7078000 10.72000 0.7760000 0.1304000E-01  1.050000  
1 1 1 28 6  48 o 5.660000 0.9244000 4.951000 1.472000  6.369000 1.118000  -1.418000      1.849000  
1 1 1 28 6  50 o 13.97000 0.4263000 14.16000 0.5928000 13.78000 0.6127000 0.3776000      0.8525000 
1 1 1 28 6  52 o 9.791000 0.6033000 9.504000 0.9261000 10.08000 0.7735000 -0.5749000     1.207000  
1 1 1 28 6  54 o 4.782000 1.245000  5.384000 1.960000  4.180000 1.536000  1.204000       2.491000  
1 1 1 28 7  1  o 41.62000 0.3420000 41.58000 0.4818000 41.67000 0.4856000 -0.8493000E-01 0.6841000 
1 1 1 28 7  3  o 9.426000 0.5139000 9.153000 0.7723000 9.700000 0.6783000 -0.5466000     1.028000  
1 1 1 28 7  5  o 12.14000 0.4218000 11.95000 0.6555000 12.33000 0.5310000 -0.3792000     0.8436000 
1 1 1 28 7  7  o 30.96000 0.3695000 31.48000 0.6117000 30.43000 0.4148000 1.048000       0.7391000 
1 1 1 28 7  9  o 4.484000 0.9492000 4.189000 1.482000  4.778000 1.186000  -0.5886000     1.898000  
1 1 1 28 7  11 o 12.21000 0.4478000 12.38000 0.6994000 12.05000 0.5595000 0.3286000      0.8957000 
1 1 1 28 7  13 o 14.64000 0.4007000 14.53000 0.6186000 14.75000 0.5095000 -0.2172000     0.8014000 
1 1 1 28 7  15 o 11.54000 0.5508000 11.99000 0.8725000 11.09000 0.6726000 0.8935000      1.102000  
1 1 1 28 7  17 o 15.67000 0.3867000 16.55000 0.5762000 14.80000 0.5159000 1.752000       0.7734000 
1 1 1 28 7  19 o 16.71000 0.3627000 17.24000 0.4722000 16.18000 0.5508000 1.063000       0.7255000 
1 1 1 28 7  21 o 12.62000 0.4633000 12.91000 0.5717000 12.32000 0.7293000 0.5971000      0.9267000 
1 1 1 28 7  23 o 12.08000 0.5192000 11.55000 0.7322000 12.61000 0.7362000 -1.056000      1.038000  
1 1 1 28 7  25 o 28.77000 0.3423000 28.85000 0.4466000 28.68000 0.5190000 0.1685000      0.6847000 
1 1 1 28 7  27 o 8.107000 0.5692000 8.448000 0.8208000 7.765000 0.7888000 0.6830000      1.138000  
1 1 1 28 7  29 o 8.240000 0.6279000 7.858000 0.9614000 8.621000 0.8081000 -0.7634000     1.256000  
1 1 1 28 7  31 o 18.32000 0.3457000 18.33000 0.4210000 18.32000 0.5485000 0.8081000E-02  0.6915000 
1 1 1 28 7  33 o 18.49000 0.3902000 18.33000 0.4164000 18.65000 0.6600000 -0.3180000     0.7803000 
1 1 1 28 7  35 o 7.724000 0.6497000 7.308000 0.8278000 8.140000 1.002000  -0.8322000     1.299000  
1 1 1 28 7  37 o 11.79000 0.4987000 11.78000 0.7200000 11.80000 0.6902000 -0.1702000E-01 0.9974000 
1 1 1 28 7  39 o 20.10000 0.3358000 20.20000 0.4804000 20.00000 0.4693000 0.2060000      0.6715000 
1 1 1 28 7  41 o 7.880000 0.7115000 7.160000 1.179000  8.601000 0.7971000 -1.441000      1.423000  
1 1 1 28 7  43 o 4.788000 0.9742000 4.798000 1.292000  4.778000 1.459000  0.2071000E-01  1.948000  
1 1 1 28 7  45 o 7.975000 0.7562000 7.318000 1.262000  8.631000 0.8340000 -1.313000      1.512000  
1 1 1 28 7  47 o 9.504000 0.5770000 9.966000 0.7380000 9.042000 0.8873000 0.9244000      1.154000  
1 1 1 28 7  49 o 8.170000 0.6810000 8.451000 0.9349000 7.889000 0.9906000 0.5620000      1.362000  
1 1 1 28 7  51 o 4.269000 0.9995000 3.701000 1.421000  4.837000 1.405000  -1.136000      1.999000  
1 1 1 28 7  53 o 5.078000 0.9630000 5.594000 1.343000  4.562000 1.381000  1.032000       1.926000  
1 1 1 28 8  0  o 27.88000 0.4082000 27.88000 0.4082000 27.88000 0.4082000 0.000000       0.000000  
1 1 1 28 8  2  o 41.46000 0.3678000 41.52000 0.5605000 41.41000 0.4765000 0.1125000      0.7356000 
1 1 1 28 8  4  o 17.45000 0.4101000 17.92000 0.6857000 16.97000 0.4500000 0.9525000      0.8202000 
1 1 1 28 8  6  o 9.941000 0.4541000 9.696000 0.6713000 10.19000 0.6118000 -0.4906000     0.9083000 
1 1 1 28 8  8  o 37.43000 0.3461000 37.27000 0.5203000 37.60000 0.4564000 -0.3248000     0.6921000 
1 1 1 28 8  10 o 55.70000 0.4181000 55.67000 0.5920000 55.73000 0.5906000 -0.6145000E-01 0.8362000 
1 1 1 28 8  12 o 24.88000 0.3631000 24.88000 0.4793000 24.88000 0.5456000 0.5341000E-03  0.7262000 
1 1 1 28 8  14 f 16.76000 0.3444000 17.27000 0.4605000 16.26000 0.5123000 1.005000       0.6889000 
1 1 1 28 8  16 o 10.20000 0.4700000 10.14000 0.6710000 10.26000 0.6582000 -0.1245000     0.9399000 
1 1 1 28 8  18 o 8.357000 0.6020000 9.064000 0.8929000 7.649000 0.8078000 1.415000       1.204000  
1 1 1 28 8  20 o 21.26000 0.4172000 21.34000 0.5461000 21.17000 0.6310000 0.1752000      0.8345000 
1 1 1 28 8  22 f 30.89000 0.3166000 30.10000 0.4449000 31.67000 0.4506000 -1.575000      0.6332000 
1 1 1 28 8  24 o 13.54000 0.4028000 13.39000 0.5621000 13.70000 0.5772000 -0.3078000     0.8057000 
1 1 1 28 8  26 o 22.52000 0.3416000 22.61000 0.5213000 22.42000 0.4416000 0.1846000      0.6832000 
1 1 1 28 8  28 o 13.89000 0.4242000 13.87000 0.5406000 13.92000 0.6538000 -0.5680000E-01 0.8484000 
1 1 1 28 8  30 o 15.95000 0.3799000 16.33000 0.4929000 15.58000 0.5781000 0.7539000      0.7597000 
1 1 1 28 8  32 o 12.05000 0.4200000 12.22000 0.5072000 11.89000 0.6695000 0.3281000      0.8399000 
1 1 1 28 8  34 o 11.69000 0.5362000 10.77000 0.5972000 12.61000 0.8908000 -1.835000      1.072000  
1 1 1 28 8  36 o 5.914000 0.7993000 5.565000 1.049000  6.262000 1.206000  -0.6971000     1.599000  
1 1 1 28 8  38 o 12.88000 0.4264000 12.86000 0.5052000 12.91000 0.6871000 -0.5389000E-01 0.8528000 
1 1 1 28 8  40 o 4.881000 0.8631000 5.461000 1.184000  4.301000 1.256000  1.160000       1.726000  
1 1 1 28 8  42 o 4.051000 1.050000  3.873000 1.510000  4.228000 1.460000  -0.3552000     2.100000  
1 1 1 28 8  44 o 11.48000 0.4873000 11.20000 0.7584000 11.77000 0.6120000 -0.5745000     0.9745000 
1 1 1 28 8  46 o 3.128000 0.9720000 3.540000 1.468000  2.717000 1.275000  0.8233000      1.944000  
1 1 1 28 8  48 o 4.514000 0.9822000 3.871000 1.434000  5.158000 1.343000  -1.287000      1.964000  
1 1 1 28 8  50 f 8.641000 0.6272000 8.761000 0.8609000 8.522000 0.9124000 0.2393000      1.254000  
1 1 1 28 8  52 o 3.585000 0.9712000 3.190000 1.308000  3.980000 1.436000  -0.7907000     1.942000  
1 1 1 28 8  54 o 4.737000 1.247000  5.707000 1.964000  3.767000 1.537000  1.941000       2.494000  
1 1 1 28 9  1  o 14.29000 0.3896000 14.03000 0.6128000 14.55000 0.4814000 -0.5182000     0.7793000 
1 1 1 28 9  3  o 15.83000 0.3977000 16.33000 0.6536000 15.33000 0.4534000 1.005000       0.7955000 
1 1 1 28 9  5  o 28.53000 0.3558000 28.98000 0.5816000 28.09000 0.4100000 0.8980000      0.7116000 
1 1 1 28 9  7  o 32.09000 0.3280000 32.49000 0.4984000 31.68000 0.4265000 0.8136000      0.6560000 
1 1 1 28 9  9  o 3.839000 0.9360000 3.870000 1.351000  3.808000 1.296000  0.6182000E-01  1.872000  
1 1 1 28 9  11 f 24.94000 0.2923000 24.78000 0.4095000 25.10000 0.4172000 -0.3187000     0.5846000 
1 1 1 28 9  13 o 16.66000 0.3394000 16.97000 0.4402000 16.35000 0.5166000 0.6228000      0.6787000 
1 1 1 28 9  15 o 22.11000 0.3233000 22.24000 0.4203000 21.99000 0.4912000 0.2401000      0.6465000 
1 1 1 28 9  17 o 19.41000 0.3429000 19.29000 0.4391000 19.53000 0.5269000 -0.2346000     0.6858000 
1 1 1 28 9  19 o 32.28000 0.3420000 31.98000 0.4428000 32.58000 0.5214000 -0.5960000     0.6841000 
1 1 1 28 9  21 o 19.46000 0.3676000 19.38000 0.5615000 19.54000 0.4745000 -0.1657000     0.7352000 
1 1 1 28 9  23 o 13.94000 0.4871000 13.90000 0.7964000 13.98000 0.5612000 -0.8033000E-01 0.9742000 
1 1 1 28 9  25 o 12.98000 0.4462000 13.04000 0.6933000 12.92000 0.5617000 0.1219000      0.8923000 
1 1 1 28 9  27 o 8.821000 0.5490000 8.411000 0.8306000 9.231000 0.7181000 -0.8203000     1.098000  
1 1 1 28 9  29 o 3.785000 0.9915000 3.493000 1.342000  4.077000 1.460000  -0.5842000     1.983000  
1 1 1 28 9  31 o 26.67000 0.3146000 27.01000 0.3941000 26.33000 0.4905000 0.6758000      0.6292000 
1 1 1 28 9  33 o 14.82000 0.4875000 14.80000 0.6266000 14.83000 0.7471000 -0.2601000E-01 0.9750000 
1 1 1 28 9  35 o 13.53000 0.4026000 13.28000 0.5010000 13.77000 0.6303000 -0.4864000     0.8051000 
1 1 1 28 9  37 o 14.79000 0.3908000 14.96000 0.4926000 14.62000 0.6068000 0.3395000      0.7816000 
1 1 1 28 9  39 o 6.441000 0.6827000 6.440000 1.029000  6.441000 0.8978000 -0.1546000E-02 1.365000  
1 1 1 28 9  41 o 3.820000 0.9822000 3.636000 1.325000  4.005000 1.450000  -0.3693000     1.964000  
1 1 1 28 9  43 o 3.268000 0.9807000 3.634000 1.532000  2.903000 1.225000  0.7306000      1.961000  
1 1 1 28 9  45 o 7.968000 0.6292000 7.794000 0.8991000 8.143000 0.8806000 -0.3488000     1.258000  
1 1 1 28 9  47 o 3.826000 0.9316000 4.318000 1.299000  3.334000 1.336000  0.9841000      1.863000  
1 1 1 28 9  49 o 3.635000 0.9510000 2.993000 1.322000  4.276000 1.367000  -1.284000      1.902000  
1 1 1 28 9  51 o 8.280000 0.6475000 8.655000 0.8569000 7.905000 0.9709000 0.7502000      1.295000  
1 1 1 28 9  53 o 7.661000 0.7048000 7.575000 0.9998000 7.747000 0.9937000 -0.1726000     1.410000  
1 1 1 28 10 0  o 79.14000 1.132000  79.14000 1.132000  79.14000 1.132000  0.000000       0.000000  
1 1 1 28 10 2  o 44.43000 0.3831000 44.86000 0.5794000 43.99000 0.5014000 0.8775000      0.7663000 
1 1 1 28 10 4  o 25.66000 0.3071000 26.05000 0.4602000 25.28000 0.4067000 0.7698000      0.6142000 
1 1 1 28 10 6  o 39.37000 0.3777000 39.83000 0.5461000 38.91000 0.5219000 0.9276000      0.7554000 
1 1 1 28 10 8  o 37.18000 0.3485000 37.43000 0.5260000 36.93000 0.4572000 0.4987000      0.6969000 
1 1 1 28 10 10 o 32.98000 0.3079000 33.83000 0.4408000 32.14000 0.4300000 1.693000       0.6158000 
1 1 1 28 10 12 o 9.773000 0.5369000 9.871000 0.6497000 9.674000 0.8549000 0.1964000      1.074000  
1 1 1 28 10 14 o 37.88000 0.3519000 38.04000 0.4641000 37.71000 0.5292000 0.3250000      0.7038000 
1 1 1 28 10 16 o 25.25000 0.3178000 25.05000 0.4157000 25.44000 0.4807000 -0.3855000     0.6355000 
1 1 1 28 10 18 o 12.82000 0.4027000 12.96000 0.5506000 12.68000 0.5877000 0.2770000      0.8053000 
1 1 1 28 10 20 o 20.18000 0.3460000 20.13000 0.4424000 20.23000 0.5321000 -0.1015000     0.6920000 
1 1 1 28 10 22 o 8.790000 0.5473000 8.855000 0.7682000 8.724000 0.7799000 0.1312000      1.095000  
1 1 1 28 10 24 o 15.32000 0.5944000 15.28000 1.084000  15.36000 0.4878000 -0.7642000E-01 1.189000  
1 1 1 28 10 26 f 11.40000 0.4487000 11.61000 0.6398000 11.19000 0.6292000 0.4167000      0.8973000 
1 1 1 28 10 28 o 12.46000 0.4338000 12.01000 0.5642000 12.91000 0.6592000 -0.9013000     0.8677000 
1 1 1 28 10 30 o 10.08000 0.5085000 10.15000 0.6461000 10.00000 0.7855000 0.1521000      1.017000  
1 1 1 28 10 32 o 17.75000 0.3983000 18.01000 0.4862000 17.49000 0.6309000 0.5245000      0.7965000 
1 1 1 28 10 34 o 14.58000 0.4680000 14.12000 0.4690000 15.04000 0.8099000 -0.9175000     0.9359000 
1 1 1 28 10 36 o 10.49000 0.4741000 10.60000 0.5709000 10.38000 0.7571000 0.2254000      0.9483000 
1 1 1 28 10 38 o 13.56000 0.3912000 12.89000 0.4923000 14.24000 0.6082000 -1.344000      0.7825000 
1 1 1 28 10 40 o 9.967000 0.5507000 9.595000 0.7332000 10.34000 0.8218000 -0.7441000     1.101000  
1 1 1 28 10 42 o 4.413000 0.9128000 5.303000 1.274000  3.524000 1.308000  1.779000       1.826000  
1 1 1 28 10 44 o 12.85000 0.4747000 12.58000 0.7448000 13.12000 0.5889000 -0.5424000     0.9495000 
1 1 1 28 10 46 o 11.59000 0.5714000 10.70000 0.7036000 12.49000 0.9005000 -1.783000      1.143000  
1 1 1 28 10 48 o 7.599000 0.7427000 7.124000 1.110000  8.073000 0.9869000 -0.9492000     1.485000  
1 1 1 28 10 50 o 4.708000 0.9940000 4.505000 1.385000  4.910000 1.426000  -0.4040000     1.988000  
1 1 1 28 10 52 o 3.278000 0.9079000 2.389000 1.132000  4.167000 1.420000  -1.777000      1.816000  
1 1 1 28 11 1  o 29.72000 0.3936000 29.84000 0.4875000 29.61000 0.6181000 0.2313000      0.7872000 
1 1 1 28 11 3  o 28.75000 0.3187000 28.83000 0.4149000 28.67000 0.4838000 0.1639000      0.6373000 
1 1 1 28 11 5  o 20.43000 0.3600000 20.14000 0.4605000 20.72000 0.5534000 -0.5763000     0.7199000 
1 1 1 28 11 7  o 27.73000 0.3396000 28.13000 0.4846000 27.33000 0.4758000 0.7965000      0.6792000 
1 1 1 28 11 9  o 30.22000 0.3538000 30.36000 0.4255000 30.08000 0.5654000 0.2847000      0.7077000 
1 1 1 28 11 11 o 30.02000 0.3555000 30.11000 0.4278000 29.93000 0.5679000 0.1719000      0.7110000 
1 1 1 28 11 13 o 6.652000 0.6561000 6.750000 0.9045000 6.553000 0.9506000 0.1969000      1.312000  
1 1 1 28 11 15 o 23.22000 0.2955000 22.86000 0.4137000 23.57000 0.4220000 -0.7102000     0.5909000 
1 1 1 28 11 17 o 15.34000 0.3483000 15.65000 0.4752000 15.02000 0.5094000 0.6358000      0.6966000 
1 1 1 28 11 19 o 47.34000 0.3780000 46.38000 0.5251000 48.31000 0.5439000 -1.935000      0.7560000 
1 1 1 28 11 21 o 39.12000 0.3890000 39.09000 0.5462000 39.14000 0.5540000 -0.5193000E-01 0.7779000 
1 1 1 28 11 23 o 19.62000 0.3250000 19.39000 0.4655000 19.84000 0.4536000 -0.4507000     0.6500000 
1 1 1 28 11 25 o 28.87000 0.3129000 28.41000 0.4555000 29.33000 0.4291000 -0.9271000     0.6258000 
1 1 1 28 11 27 o 9.881000 0.5502000 10.06000 0.7193000 9.701000 0.8328000 0.3610000      1.100000  
1 1 1 28 11 29 o 6.095000 0.7639000 4.999000 1.103000  7.192000 1.057000  -2.192000      1.528000  
1 1 1 28 11 31 o 32.22000 0.3307000 32.70000 0.4062000 31.74000 0.5220000 0.9523000      0.6614000 
1 1 1 28 11 33 o 22.12000 0.3449000 21.71000 0.4340000 22.53000 0.5362000 -0.8288000     0.6898000 
1 1 1 28 11 35 f 11.82000 0.4862000 11.26000 0.5312000 12.39000 0.8145000 -1.130000      0.9724000 
1 1 1 28 11 37 o 8.817000 0.5736000 8.158000 0.7776000 9.475000 0.8436000 -1.316000      1.147000  
1 1 1 28 11 39 o 8.690000 0.6246000 7.484000 0.7670000 9.897000 0.9860000 -2.414000      1.249000  
1 1 1 28 11 41 o 8.881000 0.5228000 8.995000 0.7658000 8.768000 0.7118000 0.2263000      1.046000  
1 1 1 28 11 43 o 9.531000 0.5504000 10.00000 0.7843000 9.059000 0.7724000 0.9427000      1.101000  
1 1 1 28 11 45 o 3.772000 0.9852000 2.947000 1.332000  4.598000 1.452000  -1.652000      1.970000  
1 1 1 28 11 47 o 4.396000 0.9640000 3.771000 1.390000  5.021000 1.336000  -1.251000      1.928000  
1 1 1 28 11 49 o 3.730000 0.9698000 3.496000 1.341000  3.963000 1.401000  -0.4666000     1.940000  
1 1 1 28 11 51 o 4.275000 0.9672000 3.361000 1.351000  5.188000 1.384000  -1.827000      1.934000  
1 1 1 28 11 53 o 3.823000 1.044000  3.465000 1.394000  4.181000 1.556000  -0.7158000     2.089000  
1 1 1 28 12 0  o 12.33000 0.5273000 12.33000 0.5273000 12.33000 0.5273000 0.000000       0.000000  
1 1 1 28 12 2  o 12.30000 0.4893000 13.40000 0.5405000 11.20000 0.8158000 2.200000       0.9786000 
1 1 1 28 12 4  o 39.88000 0.3332000 39.94000 0.4718000 39.81000 0.4706000 0.1269000      0.6664000 
1 1 1 28 12 6  o 25.25000 0.2905000 25.38000 0.4072000 25.12000 0.4144000 0.2595000      0.5810000 
1 1 1 28 12 8  o 8.273000 0.5817000 8.842000 0.7786000 7.704000 0.8644000 1.138000       1.163000  
1 1 1 28 12 10 o 34.73000 0.3338000 34.69000 0.4450000 34.78000 0.4975000 -0.9883000E-01 0.6675000 
1 1 1 28 12 12 o 14.83000 0.3411000 15.00000 0.4709000 14.66000 0.4937000 0.3458000      0.6823000 
1 1 1 28 12 14 o 32.31000 0.3121000 31.95000 0.4398000 32.68000 0.4428000 -0.7337000     0.6242000 
1 1 1 28 12 16 o 27.29000 0.2987000 26.70000 0.4147000 27.88000 0.4300000 -1.181000      0.5974000 
1 1 1 28 12 18 f 23.90000 0.3512000 23.98000 0.4706000 23.82000 0.5214000 0.1638000      0.7024000 
1 1 1 28 12 20 o 32.88000 0.3656000 32.93000 0.5159000 32.82000 0.5181000 0.1109000      0.7312000 
1 1 1 28 12 22 o 6.936000 0.6696000 7.231000 0.9321000 6.640000 0.9616000 0.5919000      1.339000  
1 1 1 28 12 24 o 9.257000 0.5508000 9.280000 0.8226000 9.234000 0.7327000 0.4632000E-01  1.102000  
1 1 1 28 12 26 o 23.89000 0.3368000 24.03000 0.4504000 23.75000 0.5010000 0.2762000      0.6736000 
1 1 1 28 12 28 o 15.20000 0.4924000 15.87000 0.7655000 14.53000 0.6196000 1.343000       0.9849000 
1 1 1 28 12 30 o 3.921000 0.9309000 3.591000 1.234000  4.251000 1.394000  -0.6601000     1.862000  
1 1 1 28 12 32 o 6.584000 0.7024000 6.687000 0.8135000 6.482000 1.145000  0.2053000      1.405000  
1 1 1 28 12 34 o 15.99000 0.4285000 15.44000 0.4644000 16.54000 0.7203000 -1.098000      0.8570000 
1 1 1 28 12 36 o 12.82000 0.4066000 12.62000 0.4822000 13.01000 0.6548000 -0.3852000     0.8132000 
1 1 1 28 12 38 o 8.878000 0.6426000 9.100000 0.6542000 8.655000 1.106000  0.4453000      1.285000  
1 1 1 28 12 40 o 3.781000 0.9134000 3.918000 1.317000  3.643000 1.266000  0.2748000      1.827000  
1 1 1 28 12 42 o 5.110000 0.8898000 4.596000 1.351000  5.624000 1.158000  -1.028000      1.780000  
1 1 1 28 12 44 o 7.367000 0.6825000 7.535000 0.9555000 7.199000 0.9748000 0.3366000      1.365000  
1 1 1 28 12 46 o 5.730000 0.9644000 5.205000 1.464000  6.255000 1.256000  -1.049000      1.929000  
1 1 1 28 12 48 o 6.239000 0.9100000 6.028000 1.391000  6.450000 1.174000  -0.4213000     1.820000  
1 1 1 28 12 50 o 7.893000 0.6924000 7.830000 1.006000  7.956000 0.9513000 -0.1264000     1.385000  
1 1 1 28 12 52 o 9.606000 0.6491000 9.152000 0.8974000 10.06000 0.9380000 -0.9080000     1.298000  
1 1 1 28 13 1  o 20.72000 0.3109000 20.51000 0.4532000 20.94000 0.4257000 -0.4263000     0.6218000 
1 1 1 28 13 3  o 35.76000 0.3489000 35.52000 0.4494000 36.00000 0.5340000 -0.4822000     0.6979000 
1 1 1 28 13 5  o 38.86000 0.3492000 38.95000 0.4666000 38.77000 0.5197000 0.1775000      0.6984000 
1 1 1 28 13 7  o 36.10000 0.3386000 36.39000 0.4549000 35.81000 0.5016000 0.5797000      0.6772000 
1 1 1 28 13 9  f 20.58000 0.3042000 20.38000 0.4251000 20.79000 0.4352000 -0.4064000     0.6084000 
1 1 1 28 13 11 o 45.39000 0.3953000 45.77000 0.5180000 45.01000 0.5971000 0.7608000      0.7905000 
1 1 1 28 13 13 o 28.36000 0.2981000 28.37000 0.4188000 28.35000 0.4244000 0.1495000E-01  0.5963000 
1 1 1 28 13 15 o 15.41000 0.3591000 15.63000 0.5206000 15.19000 0.4949000 0.4431000      0.7183000 
1 1 1 28 13 17 o 13.91000 0.3917000 14.71000 0.5531000 13.10000 0.5547000 1.611000       0.7833000 
1 1 1 28 13 19 o 55.85000 0.4237000 55.75000 0.5993000 55.96000 0.5990000 -0.2152000     0.8473000 
1 1 1 28 13 21 o 23.50000 0.3287000 23.62000 0.4320000 23.37000 0.4954000 0.2514000      0.6573000 
1 1 1 28 13 23 o 19.80000 0.3279000 19.42000 0.4919000 20.19000 0.4338000 -0.7671000     0.6559000 
1 1 1 28 13 25 o 7.194000 0.6567000 7.241000 0.9344000 7.146000 0.9229000 0.9476000E-01  1.313000  
1 1 1 28 13 27 o 10.90000 0.4777000 10.92000 0.6609000 10.88000 0.6900000 0.3997000E-01  0.9554000 
1 1 1 28 13 29 o 6.858000 0.6454000 6.366000 0.8037000 7.350000 1.010000  -0.9837000     1.291000  
1 1 1 28 13 31 o 20.04000 0.3551000 20.34000 0.3849000 19.74000 0.5969000 0.5923000      0.7102000 
1 1 1 28 13 33 o 18.66000 0.3417000 18.48000 0.4058000 18.84000 0.5499000 -0.3633000     0.6834000 
1 1 1 28 13 35 o 13.93000 0.4680000 13.29000 0.5382000 14.56000 0.7659000 -1.275000      0.9360000 
1 1 1 28 13 37 o 10.56000 0.5435000 10.41000 0.6343000 10.71000 0.8827000 -0.3028000     1.087000  
1 1 1 28 13 39 o 12.39000 0.4179000 12.17000 0.5040000 12.61000 0.6666000 -0.4324000     0.8357000 
1 1 1 28 13 41 o 7.324000 0.6828000 6.249000 1.093000  8.399000 0.8186000 -2.150000      1.366000  
1 1 1 28 13 43 o 4.450000 0.9161000 4.874000 1.230000  4.026000 1.358000  0.8473000      1.832000  
1 1 1 28 13 45 o 7.561000 0.7458000 6.220000 1.170000  8.902000 0.9258000 -2.683000      1.492000  
1 1 1 28 13 47 o 7.823000 0.7875000 7.490000 1.268000  8.155000 0.9337000 -0.6645000     1.575000  
1 1 1 28 13 49 o 3.170000 0.9133000 3.411000 1.316000  2.930000 1.267000  0.4813000      1.827000  
1 1 1 28 13 51 o 7.302000 0.8037000 7.772000 0.9474000 6.832000 1.298000  0.9396000      1.607000  
1 1 1 28 13 53 o 3.762000 1.016000  3.004000 1.366000  4.521000 1.503000  -1.517000      2.031000  
1 1 1 28 14 0  o 30.46000 0.4785000 30.46000 0.4785000 30.46000 0.4785000 0.000000       0.000000  
1 1 1 28 14 2  o 10.84000 0.5124000 11.44000 0.6304000 10.24000 0.8078000 1.195000       1.025000  
1 1 1 28 14 4  o 11.35000 0.5068000 11.30000 0.5575000 11.39000 0.8465000 -0.8619000E-01 1.014000  
1 1 1 28 14 6  f 19.44000 0.3152000 19.50000 0.4288000 19.39000 0.4620000 0.1081000      0.6303000 
1 1 1 28 14 8  f 8.149000 0.5891000 8.181000 0.8325000 8.117000 0.8336000 0.6469000E-01  1.178000  
1 1 1 28 14 10 o 20.64000 0.2931000 20.53000 0.4020000 20.74000 0.4266000 -0.2107000     0.5862000 
1 1 1 28 14 12 o 19.43000 0.3224000 19.40000 0.4734000 19.47000 0.4378000 -0.6929000E-01 0.6448000 
1 1 1 28 14 14 o 12.66000 0.3855000 12.15000 0.5806000 13.17000 0.5073000 -1.017000      0.7710000 
1 1 1 28 14 16 o 37.45000 0.3532000 37.86000 0.4711000 37.04000 0.5263000 0.8188000      0.7064000 
1 1 1 28 14 18 o 28.17000 0.3073000 28.06000 0.4329000 28.28000 0.4361000 -0.2206000     0.6145000 
1 1 1 28 14 20 o 11.24000 0.4277000 10.77000 0.6183000 11.71000 0.5910000 -0.9399000     0.8553000 
1 1 1 28 14 22 o 2.916000 0.8574000 2.915000 1.202000  2.917000 1.223000  -0.2024000E-02 1.715000  
1 1 1 28 14 24 f 33.21000 0.4323000 32.98000 0.6854000 33.43000 0.5269000 -0.4555000     0.8645000 
1 1 1 28 14 26 o 13.24000 0.4274000 12.72000 0.5710000 13.76000 0.6360000 -1.043000      0.8547000 
1 1 1 28 14 28 o 17.06000 0.3454000 17.14000 0.4147000 16.97000 0.5524000 0.1628000      0.6908000 
1 1 1 28 14 30 o 10.62000 0.4811000 10.73000 0.5379000 10.51000 0.7979000 0.2268000      0.9623000 
1 1 1 28 14 32 o 11.83000 0.4442000 11.19000 0.5822000 12.47000 0.6710000 -1.281000      0.8884000 
1 1 1 28 14 34 o 15.64000 0.3631000 15.69000 0.4137000 15.60000 0.5967000 0.8858000E-01  0.7261000 
1 1 1 28 14 36 o 12.25000 0.4384000 12.14000 0.5757000 12.37000 0.6612000 -0.2297000     0.8767000 
1 1 1 28 14 38 o 5.382000 0.8480000 5.757000 1.000000  5.008000 1.370000  0.7489000      1.696000  
1 1 1 28 14 40 o 4.766000 0.8749000 3.581000 1.219000  5.950000 1.256000  -2.368000      1.750000  
1 1 1 28 14 42 f 4.743000 0.9041000 4.873000 1.289000  4.612000 1.268000  0.2606000      1.808000  
1 1 1 28 14 44 o 12.08000 0.4885000 12.70000 0.6116000 11.46000 0.7619000 1.240000       0.9770000 
1 1 1 28 14 46 o 9.351000 0.5772000 8.980000 0.8066000 9.722000 0.8258000 -0.7426000     1.154000  
1 1 1 28 14 48 o 8.162000 0.8924000 7.176000 1.566000  9.148000 0.8568000 -1.972000      1.785000  
1 1 1 28 14 50 o 6.738000 0.8876000 4.974000 1.374000  8.503000 1.124000  -3.529000      1.775000  
1 1 1 28 14 52 o 3.112000 0.9272000 2.826000 1.255000  3.397000 1.365000  -0.5717000     1.854000  
1 1 1 28 15 1  o 35.16000 0.3531000 35.54000 0.5007000 34.77000 0.4979000 0.7752000      0.7061000 
1 1 1 28 15 3  o 21.64000 0.3252000 21.01000 0.4606000 22.26000 0.4592000 -1.252000      0.6504000 
1 1 1 28 15 5  o 20.99000 0.3752000 21.09000 0.4568000 20.89000 0.5952000 0.2085000      0.7503000 
1 1 1 28 15 7  o 12.46000 0.3845000 12.35000 0.5490000 12.57000 0.5387000 -0.2221000     0.7691000 
1 1 1 28 15 9  o 25.55000 0.3449000 25.46000 0.5372000 25.64000 0.4327000 -0.1829000     0.6898000 
1 1 1 28 15 11 o 21.26000 0.3118000 21.53000 0.4554000 20.99000 0.4258000 0.5397000      0.6235000 
1 1 1 28 15 13 o 58.68000 0.4368000 57.85000 0.6117000 59.50000 0.6237000 -1.654000      0.8736000 
1 1 1 28 15 15 o 39.62000 0.3352000 39.43000 0.4704000 39.81000 0.4777000 -0.3858000     0.6705000 
1 1 1 28 15 17 o 54.60000 0.4504000 55.23000 0.5933000 53.97000 0.6779000 1.253000       0.9009000 
1 1 1 28 15 19 o 36.80000 0.3250000 36.34000 0.4571000 37.27000 0.4621000 -0.9266000     0.6500000 
1 1 1 28 15 21 o 18.80000 0.3376000 19.06000 0.4481000 18.55000 0.5050000 0.5096000      0.6751000 
1 1 1 28 15 23 o 19.65000 0.4389000 20.13000 0.6970000 19.17000 0.5336000 0.9664000      0.8778000 
1 1 1 28 15 25 f 23.53000 0.3523000 22.99000 0.4916000 24.06000 0.5047000 -1.071000      0.7046000 
1 1 1 28 15 27 o 8.570000 0.5546000 7.896000 0.7597000 9.243000 0.8081000 -1.348000      1.109000  
1 1 1 28 15 29 o 22.72000 0.3448000 22.98000 0.3725000 22.47000 0.5805000 0.5162000      0.6897000 
1 1 1 28 15 31 o 3.885000 0.9250000 3.820000 1.221000  3.950000 1.390000  -0.1294000     1.850000  
1 1 1 28 15 33 o 9.800000 0.4897000 9.534000 0.6621000 10.07000 0.7218000 -0.5313000     0.9795000 
1 1 1 28 15 35 o 7.289000 0.8306000 7.896000 0.6264000 6.681000 1.539000  1.215000       1.661000  
1 1 1 28 15 37 o 12.00000 0.4513000 10.99000 0.6587000 13.02000 0.6172000 -2.033000      0.9027000 
1 1 1 28 15 39 o 4.934000 0.9014000 4.386000 1.248000  5.483000 1.301000  -1.097000      1.803000  
1 1 1 28 15 41 o 2.636000 0.8191000 3.157000 1.281000  2.114000 1.021000  1.043000       1.638000  
1 1 1 28 15 43 o 2.989000 0.8686000 3.455000 1.311000  2.522000 1.140000  0.9329000      1.737000  
1 1 1 28 15 45 o 5.987000 0.8494000 6.586000 1.086000  5.388000 1.306000  1.198000       1.699000  
1 1 1 28 15 47 o 2.512000 0.8220000 2.488000 1.145000  2.537000 1.180000  -0.4907000E-01 1.644000  
1 1 1 28 15 49 o 4.080000 1.065000  3.759000 1.440000  4.400000 1.570000  -0.6407000     2.130000  
1 1 1 28 15 51 o 2.879000 0.8698000 2.588000 1.155000  3.170000 1.301000  -0.5820000     1.740000  
1 1 1 28 16 0  o 30.45000 0.4212000 30.45000 0.4212000 30.45000 0.4212000 0.000000       0.000000  
1 1 1 28 16 2  o 32.61000 0.3088000 32.03000 0.4312000 33.19000 0.4422000 -1.168000      0.6176000 
1 1 1 28 16 4  o 23.80000 0.2958000 23.48000 0.4133000 24.12000 0.4234000 -0.6446000     0.5917000 
1 1 1 28 16 6  o 17.18000 0.3883000 17.39000 0.4470000 16.96000 0.6350000 0.4356000      0.7766000 
1 1 1 28 16 8  o 23.44000 0.3001000 22.83000 0.4043000 24.04000 0.4435000 -1.208000      0.6002000 
1 1 1 28 16 10 o 37.13000 0.3518000 36.43000 0.5219000 37.84000 0.4719000 -1.409000      0.7036000 
1 1 1 28 16 12 o 17.84000 0.3108000 18.02000 0.4314000 17.66000 0.4476000 0.3638000      0.6217000 
1 1 1 28 16 14 o 11.80000 0.3951000 12.05000 0.5253000 11.55000 0.5903000 0.4916000      0.7902000 
1 1 1 28 16 16 o 16.73000 0.3329000 17.07000 0.4401000 16.40000 0.4996000 0.6667000      0.6658000 
1 1 1 28 16 18 f 17.45000 0.3249000 17.67000 0.4579000 17.23000 0.4609000 0.4470000      0.6497000 
1 1 1 28 16 20 o 4.963000 1.056000  4.584000 1.511000  5.341000 1.477000  -0.7566000     2.113000  
1 1 1 28 16 22 o 13.94000 0.3783000 13.95000 0.4957000 13.93000 0.5714000 0.1194000E-01  0.7565000 
1 1 1 28 16 24 o 34.18000 0.3479000 34.17000 0.4500000 34.18000 0.5308000 -0.1898000E-01 0.6959000 
1 1 1 28 16 26 o 8.070000 0.5668000 7.297000 0.7647000 8.844000 0.8369000 -1.547000      1.134000  
1 1 1 28 16 28 o 13.85000 0.4213000 13.87000 0.4492000 13.82000 0.7129000 0.4620000E-01  0.8426000 
1 1 1 28 16 30 o 13.44000 0.3810000 13.52000 0.4473000 13.35000 0.6169000 0.1745000      0.7620000 
1 1 1 28 16 32 o 9.264000 0.5845000 8.558000 0.6353000 9.971000 0.9813000 -1.413000      1.169000  
1 1 1 28 16 34 o 11.44000 0.4573000 11.07000 0.5928000 11.81000 0.6964000 -0.7339000     0.9145000 
1 1 1 28 16 36 o 6.919000 0.6608000 6.968000 0.8100000 6.869000 1.044000  0.9916000E-01  1.322000  
1 1 1 28 16 38 o 14.05000 0.4174000 13.58000 0.5657000 14.52000 0.6140000 -0.9430000     0.8349000 
1 1 1 28 16 40 o 6.123000 0.7790000 4.649000 1.168000  7.596000 1.031000  -2.948000      1.558000  
1 1 1 28 16 42 o 9.435000 0.5089000 9.360000 0.7244000 9.510000 0.7149000 -0.1497000     1.018000  
1 1 1 28 16 44 f 5.287000 0.9334000 5.151000 1.232000  5.423000 1.403000  -0.2723000     1.867000  
1 1 1 28 16 46 o 6.798000 0.8357000 7.645000 0.8877000 5.952000 1.416000  1.693000       1.671000  
1 1 1 28 16 48 o 9.770000 0.6394000 10.29000 0.8100000 9.246000 0.9895000 1.049000       1.279000  
1 1 1 28 16 50 o 3.755000 0.9553000 3.297000 1.288000  4.214000 1.412000  -0.9177000     1.911000  
1 1 1 28 16 52 o 5.290000 1.369000  5.136000 2.149000  5.444000 1.698000  -0.3080000     2.739000  
1 1 1 28 17 1  o 26.34000 0.2945000 26.02000 0.4047000 26.66000 0.4279000 -0.6380000     0.5889000 
1 1 1 28 17 3  o 31.67000 0.3015000 31.69000 0.4247000 31.65000 0.4281000 0.3984000E-01  0.6030000 
1 1 1 28 17 5  o 48.45000 0.4111000 48.41000 0.5328000 48.49000 0.6263000 -0.7721000E-01 0.8223000 
1 1 1 28 17 7  o 16.84000 0.3118000 16.71000 0.4326000 16.98000 0.4492000 -0.2645000     0.6237000 
1 1 1 28 17 9  o 23.86000 0.3283000 24.46000 0.4457000 23.26000 0.4821000 1.204000       0.6566000 
1 1 1 28 17 11 o 30.18000 0.3016000 30.42000 0.4216000 29.94000 0.4314000 0.4831000      0.6032000 
1 1 1 28 17 13 o 19.22000 0.3007000 19.18000 0.4229000 19.27000 0.4276000 -0.9455000E-01 0.6014000 
1 1 1 28 17 15 o 10.79000 0.4321000 11.41000 0.5510000 10.17000 0.6657000 1.241000       0.8642000 
1 1 1 28 17 17 o 45.44000 0.3654000 45.31000 0.5149000 45.56000 0.5186000 -0.2540000     0.7308000 
1 1 1 28 17 19 o 21.59000 0.3041000 21.88000 0.4332000 21.29000 0.4269000 0.5841000      0.6082000 
1 1 1 28 17 21 o 20.11000 0.3282000 20.42000 0.4276000 19.81000 0.4980000 0.6037000      0.6564000 
1 1 1 28 17 23 o 13.60000 0.3899000 12.97000 0.4783000 14.24000 0.6159000 -1.272000      0.7798000 
1 1 1 28 17 25 o 8.237000 0.5677000 7.720000 0.7601000 8.754000 0.8434000 -1.034000      1.135000  
1 1 1 28 17 27 o 13.06000 0.3923000 12.95000 0.4774000 13.16000 0.6227000 -0.2074000     0.7847000 
1 1 1 28 17 29 o 20.63000 0.3203000 20.62000 0.3793000 20.64000 0.5162000 -0.2881000E-01 0.6406000 
1 1 1 28 17 31 o 14.46000 0.4207000 13.95000 0.4328000 14.98000 0.7215000 -1.036000      0.8414000 
1 1 1 28 17 33 o 12.71000 0.4024000 12.99000 0.4529000 12.43000 0.6652000 0.5635000      0.8048000 
1 1 1 28 17 35 o 3.462000 0.9654000 2.646000 1.107000  4.278000 1.582000  -1.632000      1.931000  
1 1 1 28 17 37 o 18.18000 0.3590000 18.35000 0.4410000 18.00000 0.5667000 0.3419000      0.7180000 
1 1 1 28 17 39 o 3.270000 0.9081000 3.529000 1.289000  3.012000 1.279000  0.5174000      1.816000  
1 1 1 28 17 41 o 4.071000 0.9212000 3.742000 1.244000  4.401000 1.359000  -0.6583000     1.842000  
1 1 1 28 17 43 o 10.80000 0.4796000 10.85000 0.6284000 10.75000 0.7248000 0.9754000E-01  0.9593000 
1 1 1 28 17 45 o 4.879000 0.9302000 4.908000 1.278000  4.851000 1.352000  0.5668000E-01  1.860000  
1 1 1 28 17 47 o 8.216000 0.6973000 8.172000 0.8542000 8.260000 1.102000  -0.8859000E-01 1.395000  
1 1 1 28 17 49 o 3.120000 0.9241000 3.123000 1.292000  3.118000 1.321000  0.4745000E-02  1.848000  
1 1 1 28 17 51 o 3.552000 0.9453000 4.163000 1.402000  2.941000 1.268000  1.222000       1.891000  
1 1 1 28 18 0  o 3.517000 1.243000  3.517000 1.243000  3.517000 1.243000  0.000000       0.000000  
1 1 1 28 18 2  o 9.870000 0.4545000 10.42000 0.5591000 9.318000 0.7166000 1.104000       0.9089000 
1 1 1 28 18 4  o 28.90000 0.2934000 28.31000 0.4096000 29.49000 0.4201000 -1.179000      0.5867000 
1 1 1 28 18 6  o 29.22000 0.3264000 28.97000 0.4173000 29.47000 0.5020000 -0.4975000     0.6528000 
1 1 1 28 18 8  o 19.10000 0.3118000 18.97000 0.4163000 19.23000 0.4642000 -0.2686000     0.6235000 
1 1 1 28 18 10 o 25.17000 0.3319000 25.39000 0.4657000 24.95000 0.4729000 0.4435000      0.6637000 
1 1 1 28 18 12 o 11.46000 0.4771000 11.59000 0.5869000 11.32000 0.7523000 0.2773000      0.9542000 
1 1 1 28 18 14 o 40.90000 0.3740000 41.04000 0.4823000 40.76000 0.5718000 0.2785000      0.7480000 
1 1 1 28 18 16 o 23.62000 0.3791000 23.19000 0.5497000 24.05000 0.5221000 -0.8527000     0.7582000 
1 1 1 28 18 18 o 10.51000 0.4943000 10.52000 0.6006000 10.51000 0.7851000 0.8252000E-02  0.9885000 
1 1 1 28 18 20 o 13.18000 0.4260000 12.96000 0.5135000 13.41000 0.6799000 -0.4505000     0.8520000 
1 1 1 28 18 22 o 20.36000 0.4196000 20.53000 0.4597000 20.20000 0.7021000 0.3314000      0.8393000 
1 1 1 28 18 24 f 27.18000 0.3110000 26.90000 0.3684000 27.45000 0.5011000 -0.5552000     0.6220000 
1 1 1 28 18 26 o 23.41000 0.3099000 23.89000 0.3646000 22.94000 0.5012000 0.9554000      0.6198000 
1 1 1 28 18 28 o 6.033000 0.7260000 6.124000 0.8436000 5.943000 1.182000  0.1807000      1.452000  
1 1 1 28 18 30 o 4.005000 0.8955000 4.191000 1.035000  3.819000 1.462000  0.3719000      1.791000  
1 1 1 28 18 32 o 6.338000 0.6627000 5.845000 0.8335000 6.832000 1.031000  -0.9875000     1.325000  
1 1 1 28 18 34 o 10.75000 0.4772000 10.58000 0.5640000 10.93000 0.7700000 -0.3573000     0.9545000 
1 1 1 28 18 36 o 3.301000 0.9048000 3.101000 1.184000  3.500000 1.369000  -0.3993000     1.810000  
1 1 1 28 18 38 o 6.533000 0.7080000 5.968000 0.9598000 7.099000 1.041000  -1.130000      1.416000  
1 1 1 28 18 40 o 4.030000 0.9415000 3.515000 1.272000  4.545000 1.389000  -1.030000      1.883000  
1 1 1 28 18 42 o 8.852000 0.5259000 9.120000 0.7225000 8.583000 0.7642000 0.5368000      1.052000  
1 1 1 28 18 44 o 6.422000 0.7545000 7.238000 0.8372000 5.607000 1.255000  1.631000       1.509000  
1 1 1 28 18 46 o 4.717000 1.068000  4.602000 1.308000  4.832000 1.689000  -0.2297000     2.136000  
1 1 1 28 18 48 o 4.771000 0.9966000 4.931000 1.424000  4.610000 1.395000  0.3215000      1.993000  
1 1 1 28 18 50 o 3.143000 0.9128000 3.653000 1.386000  2.633000 1.188000  1.020000       1.826000  
1 1 1 28 19 1  o 20.41000 0.2872000 20.54000 0.4003000 20.28000 0.4119000 0.2587000      0.5744000 
1 1 1 28 19 3  o 23.98000 0.2829000 24.10000 0.3920000 23.86000 0.4080000 0.2434000      0.5658000 
1 1 1 28 19 5  o 32.36000 0.3026000 32.48000 0.4278000 32.24000 0.4282000 0.2429000      0.6052000 
1 1 1 28 19 7  o 13.79000 0.3820000 12.96000 0.5126000 14.62000 0.5665000 -1.668000      0.7639000 
1 1 1 28 19 9  o 40.96000 0.3782000 39.61000 0.4708000 42.31000 0.5920000 -2.702000      0.7564000 
1 1 1 28 19 11 o 35.69000 0.3449000 35.72000 0.5138000 35.67000 0.4602000 0.5196000E-01  0.6898000 
1 1 1 28 19 13 f 39.13000 0.3828000 39.22000 0.5338000 39.04000 0.5489000 0.1788000      0.7656000 
1 1 1 28 19 15 o 17.55000 0.4031000 17.58000 0.4525000 17.52000 0.6672000 0.6749000E-01  0.8061000 
1 1 1 28 19 17 o 6.782000 0.6260000 6.986000 0.8373000 6.579000 0.9307000 0.4063000      1.252000  
1 1 1 28 19 19 o 15.43000 0.3230000 15.37000 0.4508000 15.50000 0.4627000 -0.1375000     0.6460000 
1 1 1 28 19 21 f 28.65000 0.3271000 29.23000 0.4010000 28.06000 0.5170000 1.171000       0.6543000 
1 1 1 28 19 23 o 31.38000 0.3562000 31.46000 0.4901000 31.30000 0.5169000 0.1641000      0.7123000 
1 1 1 28 19 25 o 25.98000 0.3167000 25.22000 0.3953000 26.75000 0.4949000 -1.526000      0.6334000 
1 1 1 28 19 27 o 31.09000 0.4501000 30.95000 0.3843000 31.23000 0.8142000 -0.2804000     0.9003000 
1 1 1 28 19 29 o 4.714000 0.9382000 4.816000 1.031000  4.612000 1.568000  0.2038000      1.876000  
1 1 1 28 19 31 f 3.933000 0.8714000 4.030000 1.073000  3.835000 1.373000  0.1948000      1.743000  
1 1 1 28 19 33 o 9.153000 0.4991000 8.768000 0.6345000 9.538000 0.7706000 -0.7703000     0.9982000 
1 1 1 28 19 35 o 15.60000 0.4317000 15.50000 0.4205000 15.69000 0.7540000 -0.1966000     0.8633000 
1 1 1 28 19 37 o 13.72000 0.4053000 13.81000 0.4928000 13.64000 0.6436000 0.1668000      0.8106000 
1 1 1 28 19 39 o 4.469000 0.9774000 5.093000 1.368000  3.845000 1.397000  1.248000       1.955000  
1 1 1 28 19 41 o 4.997000 0.9057000 4.115000 1.259000  5.880000 1.302000  -1.765000      1.811000  
1 1 1 28 19 43 o 3.878000 0.9000000 2.969000 1.204000  4.787000 1.338000  -1.818000      1.800000  
1 1 1 28 19 45 o 5.315000 0.8303000 6.365000 1.042000  4.265000 1.293000  2.100000       1.661000  
1 1 1 28 19 47 o 4.159000 0.9476000 4.466000 1.311000  3.852000 1.368000  0.6144000      1.895000  
1 1 1 28 19 49 o 10.28000 0.4964000 10.44000 0.6927000 10.12000 0.7112000 0.3282000      0.9928000 
1 1 1 28 20 0  o 62.72000 0.6479000 62.72000 0.6479000 62.72000 0.6479000 0.000000       0.000000  
1 1 1 28 20 2  o 31.58000 0.2989000 31.69000 0.4140000 31.47000 0.4313000 0.2142000      0.5978000 
1 1 1 28 20 4  o 10.49000 0.4215000 9.946000 0.6107000 11.03000 0.5810000 -1.083000      0.8429000 
1 1 1 28 20 6  o 7.883000 0.5329000 7.763000 0.7735000 8.003000 0.7333000 -0.2396000     1.066000  
1 1 1 28 20 8  o 36.99000 0.4165000 36.08000 0.4429000 37.90000 0.7054000 -1.820000      0.8329000 
1 1 1 28 20 10 o 3.214000 0.8701000 2.661000 1.166000  3.767000 1.292000  -1.106000      1.740000  
1 1 1 28 20 12 o 10.57000 0.6026000 10.91000 0.8137000 10.24000 0.8891000 0.6682000      1.205000  
1 1 1 28 20 14 f 14.69000 0.4333000 14.56000 0.6616000 14.81000 0.5599000 -0.2537000     0.8667000 
1 1 1 28 20 16 o 30.07000 0.3947000 29.55000 0.6277000 30.58000 0.4785000 -1.028000      0.7893000 
1 1 1 28 20 18 o 3.838000 0.9722000 3.977000 1.498000  3.700000 1.240000  0.2768000      1.944000  
1 1 1 28 20 20 o 6.487000 0.7697000 7.154000 0.6834000 5.819000 1.379000  1.335000       1.539000  
1 1 1 28 20 22 o 27.09000 0.3754000 27.19000 0.3616000 27.00000 0.6580000 0.1813000      0.7508000 
1 1 1 28 20 24 o 13.66000 0.3725000 13.64000 0.4015000 13.68000 0.6277000 -0.4667000E-01 0.7451000 
1 1 1 28 20 26 o 12.00000 0.6069000 11.91000 0.5001000 12.09000 1.106000  -0.1801000     1.214000  
1 1 1 28 20 28 o 14.09000 0.3628000 13.69000 0.4174000 14.49000 0.5935000 -0.7926000     0.7256000 
1 1 1 28 20 30 o 19.53000 0.3139000 18.98000 0.3643000 20.08000 0.5112000 -1.100000      0.6277000 
1 1 1 28 20 32 o 19.40000 0.3454000 19.53000 0.4702000 19.28000 0.5060000 0.2444000      0.6907000 
1 1 1 28 20 34 f 9.442000 0.4656000 8.638000 0.5637000 10.25000 0.7412000 -1.609000      0.9312000 
1 1 1 28 20 36 o 3.765000 0.9020000 3.178000 1.148000  4.352000 1.391000  -1.174000      1.804000  
1 1 1 28 20 38 o 9.121000 0.5128000 8.853000 0.6473000 9.389000 0.7955000 -0.5359000     1.026000  
1 1 1 28 20 40 o 10.44000 0.4926000 10.58000 0.6255000 10.30000 0.7613000 0.2807000      0.9853000 
1 1 1 28 20 42 o 10.20000 0.5936000 10.72000 0.5496000 9.687000 1.052000  1.035000       1.187000  
1 1 1 28 20 44 o 2.907000 0.8849000 2.244000 1.053000  3.571000 1.422000  -1.328000      1.770000  
1 1 1 28 20 46 o 6.019000 0.8663000 6.334000 1.074000  5.704000 1.360000  0.6291000      1.733000  
1 1 1 28 20 48 o 7.311000 0.7049000 6.730000 1.019000  7.892000 0.9737000 -1.162000      1.410000  
1 1 1 28 20 50 o 6.979000 0.7594000 7.142000 1.071000  6.817000 1.077000  0.3252000      1.519000  
1 1 1 28 21 1  o 28.04000 0.2849000 27.86000 0.4005000 28.23000 0.4054000 -0.3712000     0.5698000 
1 1 1 28 21 3  o 30.21000 0.3172000 30.29000 0.4062000 30.13000 0.4873000 0.1646000      0.6344000 
1 1 1 28 21 5  o 26.44000 0.3211000 26.84000 0.4161000 26.04000 0.4891000 0.8000000      0.6422000 
1 1 1 28 21 7  o 20.00000 0.3368000 19.14000 0.4151000 20.86000 0.5304000 -1.724000      0.6735000 
1 1 1 28 21 9  o 7.306000 0.7863000 7.492000 1.101000  7.120000 1.123000  0.3729000      1.573000  
1 1 1 28 21 11 o 13.23000 0.5322000 13.07000 0.9404000 13.39000 0.4985000 -0.3209000     1.064000  
1 1 1 28 21 13 o 28.16000 0.3343000 28.12000 0.5160000 28.21000 0.4251000 -0.8535000E-01 0.6686000 
1 1 1 28 21 15 o 11.18000 0.3787000 11.69000 0.5347000 10.67000 0.5364000 1.023000       0.7574000 
1 1 1 28 21 17 o 19.37000 0.2968000 19.02000 0.4049000 19.71000 0.4341000 -0.6914000     0.5936000 
1 1 1 28 21 19 o 22.78000 0.3179000 22.74000 0.3659000 22.83000 0.5200000 -0.9475000E-01 0.6358000 
1 1 1 28 21 21 o 19.58000 0.3447000 19.71000 0.4313000 19.46000 0.5378000 0.2502000      0.6894000 
1 1 1 28 21 23 f 10.69000 0.4774000 10.93000 0.5563000 10.44000 0.7759000 0.4874000      0.9547000 
1 1 1 28 21 25 o 13.32000 0.5329000 13.21000 0.4233000 13.44000 0.9781000 -0.2391000     1.066000  
1 1 1 28 21 27 o 9.355000 0.4645000 9.067000 0.5095000 9.642000 0.7767000 -0.5749000     0.9289000 
1 1 1 28 21 29 f 9.277000 0.4567000 8.554000 0.5910000 9.999000 0.6964000 -1.445000      0.9133000 
1 1 1 28 21 31 o 7.343000 0.5806000 7.575000 0.6512000 7.111000 0.9615000 0.4639000      1.161000  
1 1 1 28 21 33 o 9.409000 0.4577000 9.189000 0.5243000 9.629000 0.7504000 -0.4399000     0.9154000 
1 1 1 28 21 35 o 18.21000 0.3963000 18.20000 0.3693000 18.21000 0.7014000 -0.1172000E-01 0.7927000 
1 1 1 28 21 37 o 23.79000 0.3285000 24.46000 0.4011000 23.13000 0.5203000 1.320000       0.6569000 
1 1 1 28 21 39 o 2.973000 0.8596000 2.874000 1.143000  3.071000 1.284000  -0.1963000     1.719000  
1 1 1 28 21 41 o 9.710000 0.6378000 10.63000 0.6437000 8.792000 1.101000  1.837000       1.276000  
1 1 1 28 21 43 o 9.005000 0.5934000 9.611000 0.6921000 8.399000 0.9641000 1.211000       1.187000  
1 1 1 28 21 45 o 4.598000 0.9132000 4.568000 1.295000  4.628000 1.288000  -0.6002000E-01 1.826000  
1 1 1 28 21 47 o 4.902000 0.9564000 5.591000 1.302000  4.213000 1.402000  1.378000       1.913000  
1 1 1 28 21 49 o 4.075000 0.9615000 3.970000 1.325000  4.180000 1.393000  -0.2099000     1.923000  
1 1 1 28 22 0  o 14.20000 0.4618000 14.20000 0.4618000 14.20000 0.4618000 0.000000       0.000000  
1 1 1 28 22 2  o 17.09000 0.3121000 17.78000 0.4149000 16.39000 0.4664000 1.393000       0.6243000 
1 1 1 28 22 4  f 12.87000 0.4009000 13.34000 0.4860000 12.40000 0.6377000 0.9395000      0.8018000 
1 1 1 28 22 6  o 21.81000 0.3212000 21.84000 0.4116000 21.77000 0.4932000 0.7284000E-01  0.6424000 
1 1 1 28 22 8  o 33.68000 0.4216000 33.59000 0.4798000 33.77000 0.6934000 -0.1814000     0.8432000 
1 1 1 28 22 10 o 31.09000 0.3361000 31.39000 0.5274000 30.79000 0.4169000 0.6014000      0.6723000 
1 1 1 28 22 12 o 14.71000 0.3197000 15.41000 0.4226000 14.02000 0.4798000 1.396000       0.6394000 
1 1 1 28 22 14 o 14.51000 0.3146000 14.88000 0.4287000 14.15000 0.4605000 0.7355000      0.6292000 
1 1 1 28 22 16 o 10.63000 0.3711000 11.20000 0.5186000 10.05000 0.5310000 1.155000       0.7422000 
1 1 1 28 22 18 o 20.28000 0.3198000 20.23000 0.3525000 20.33000 0.5337000 -0.9996000E-01 0.6396000 
1 1 1 28 22 20 o 9.896000 0.5609000 9.901000 0.4502000 9.891000 1.028000  0.9588000E-02  1.122000  
1 1 1 28 22 22 o 22.85000 0.5349000 23.42000 0.3301000 22.29000 1.018000  1.130000       1.070000  
1 1 1 28 22 24 o 12.19000 0.3864000 11.38000 0.3882000 12.99000 0.6682000 -1.614000      0.7728000 
1 1 1 28 22 26 f 11.31000 0.4456000 11.66000 0.4988000 10.96000 0.7385000 0.7028000      0.8912000 
1 1 1 28 22 28 f 7.916000 0.4985000 7.329000 0.5952000 8.502000 0.7997000 -1.173000      0.9969000 
1 1 1 28 22 30 o 19.24000 0.3172000 19.26000 0.3946000 19.23000 0.4967000 0.2110000E-01  0.6343000 
1 1 1 28 22 32 o 9.064000 0.4599000 8.833000 0.5370000 9.294000 0.7468000 -0.4607000     0.9199000 
1 1 1 28 22 34 o 5.252000 0.7268000 4.467000 1.008000  6.038000 1.047000  -1.571000      1.454000  
1 1 1 28 22 36 o 7.691000 0.6084000 8.060000 0.6151000 7.321000 1.050000  0.7388000      1.217000  
1 1 1 28 22 38 o 9.136000 0.5071000 9.100000 0.5835000 9.172000 0.8296000 -0.7194000E-01 1.014000  
1 1 1 28 22 40 o 6.416000 0.8327000 6.623000 0.8100000 6.208000 1.455000  0.4146000      1.665000  
1 1 1 28 22 42 o 6.367000 0.9651000 7.593000 0.9271000 5.140000 1.693000  2.452000       1.930000  
1 1 1 28 22 44 o 2.873000 0.8661000 3.049000 1.241000  2.697000 1.209000  0.3523000      1.732000  
1 1 1 28 22 46 o 5.765000 0.8290000 6.148000 1.001000  5.382000 1.322000  0.7652000      1.658000  
1 1 1 28 22 48 o 3.785000 0.9689000 3.923000 1.369000  3.648000 1.371000  0.2751000      1.938000  
1 1 1 28 23 1  o 33.74000 0.3001000 33.85000 0.4257000 33.62000 0.4233000 0.2326000      0.6003000 
1 1 1 28 23 3  o 9.616000 0.4957000 9.459000 0.6228000 9.773000 0.7714000 -0.3139000     0.9915000 
1 1 1 28 23 5  o 13.90000 0.3964000 14.23000 0.6309000 13.57000 0.4801000 0.6581000      0.7928000 
1 1 1 28 23 7  o 26.51000 0.3235000 26.84000 0.4964000 26.18000 0.4149000 0.6551000      0.6470000 
1 1 1 28 23 9  o 35.98000 0.3159000 36.60000 0.4510000 35.36000 0.4424000 1.242000       0.6317000 
1 1 1 28 23 11 o 27.85000 0.3122000 27.83000 0.4624000 27.87000 0.4196000 -0.4244000E-01 0.6245000 
1 1 1 28 23 13 o 4.819000 0.7231000 6.044000 0.8613000 3.593000 1.162000  2.451000       1.446000  
1 1 1 28 23 15 o 7.694000 0.4950000 8.135000 0.6480000 7.252000 0.7485000 0.8832000      0.9901000 
1 1 1 28 23 17 o 14.82000 0.4081000 15.53000 0.3596000 14.12000 0.7326000 1.411000       0.8161000 
1 1 1 28 23 19 o 12.06000 0.3778000 11.89000 0.3687000 12.23000 0.6596000 -0.3448000     0.7556000 
1 1 1 28 23 21 o 3.606000 0.8763000 3.398000 0.9535000 3.815000 1.471000  -0.4172000     1.753000  
1 1 1 28 23 23 f 19.68000 0.3351000 19.23000 0.3135000 20.14000 0.5924000 -0.9007000     0.6703000 
1 1 1 28 23 25 o 15.30000 0.3388000 15.17000 0.3608000 15.44000 0.5736000 -0.2624000     0.6777000 
1 1 1 28 23 27 o 4.700000 0.7970000 3.395000 1.058000  6.005000 1.192000  -2.610000      1.594000  
1 1 1 28 23 29 o 5.489000 0.7660000 4.548000 1.068000  6.430000 1.098000  -1.882000      1.532000  
1 1 1 28 23 31 o 3.653000 0.8526000 3.395000 1.056000  3.910000 1.339000  -0.5156000     1.705000  
1 1 1 28 23 33 o 5.271000 0.7389000 4.371000 1.006000  6.171000 1.082000  -1.800000      1.478000  
1 1 1 28 23 35 o 7.265000 0.6547000 7.932000 0.6007000 6.598000 1.163000  1.334000       1.309000  
1 1 1 28 23 37 o 3.604000 0.8878000 4.064000 1.197000  3.145000 1.311000  0.9186000      1.776000  
1 1 1 28 23 39 o 8.311000 0.5733000 8.147000 0.6729000 8.475000 0.9283000 -0.3282000     1.147000  
1 1 1 28 23 41 o 4.530000 1.005000  3.884000 1.210000  5.177000 1.606000  -1.293000      2.010000  
1 1 1 28 23 43 o 7.149000 0.7702000 7.421000 1.034000  6.877000 1.142000  0.5444000      1.540000  
1 1 1 28 23 45 o 4.451000 1.045000  4.096000 1.292000  4.806000 1.642000  -0.7104000     2.089000  
1 1 1 28 23 47 o 7.134000 0.7077000 7.385000 1.013000  6.883000 0.9889000 0.5020000      1.415000  
1 1 1 28 24 0  o 2.603000 1.126000  2.603000 1.126000  2.603000 1.126000  0.000000       0.000000  
1 1 1 28 24 2  o 4.867000 0.9455000 5.176000 1.285000  4.557000 1.388000  0.6190000      1.891000  
1 1 1 28 24 4  o 17.81000 0.2993000 17.65000 0.4264000 17.97000 0.4202000 -0.3190000     0.5986000 
1 1 1 28 24 6  o 10.20000 0.5301000 8.719000 0.9313000 11.69000 0.5067000 -2.968000      1.060000  
1 1 1 28 24 8  o 6.146000 0.7087000 5.545000 0.9736000 6.748000 1.030000  -1.204000      1.417000  
1 1 1 28 24 10 o 17.72000 0.2807000 18.79000 0.3869000 16.65000 0.4069000 2.142000       0.5615000 
1 1 1 28 24 12 o 19.54000 0.2901000 19.78000 0.4225000 19.30000 0.3976000 0.4768000      0.5802000 
1 1 1 28 24 14 o 12.01000 0.4017000 12.38000 0.3530000 11.64000 0.7217000 0.7396000      0.8034000 
1 1 1 28 24 16 o 31.07000 0.3791000 30.82000 0.5301000 31.32000 0.5420000 -0.4955000     0.7582000 
1 1 1 28 24 18 o 25.07000 0.3955000 25.75000 0.4981000 24.39000 0.6145000 1.364000       0.7910000 
1 1 1 28 24 20 o 13.18000 0.4935000 13.40000 0.6297000 12.96000 0.7601000 0.4378000      0.9871000 
1 1 1 28 24 22 o 9.956000 0.7582000 9.836000 0.7875000 10.08000 1.296000  -0.2401000     1.516000  
1 1 1 28 24 24 o 14.97000 0.3921000 14.67000 0.3215000 15.26000 0.7154000 -0.5953000     0.7843000 
1 1 1 28 24 26 o 7.967000 0.5177000 8.497000 0.4204000 7.438000 0.9462000 1.059000       1.035000  
1 1 1 28 24 28 o 5.006000 0.7289000 5.118000 0.6906000 4.893000 1.284000  0.2258000      1.458000  
1 1 1 28 24 30 o 10.60000 0.4339000 10.70000 0.5110000 10.50000 0.7014000 0.1969000      0.8678000 
1 1 1 28 24 32 o 13.60000 0.3848000 14.08000 0.4668000 13.11000 0.6120000 0.9695000      0.7697000 
1 1 1 28 24 34 o 8.780000 0.6166000 7.985000 0.8012000 9.575000 0.9375000 -1.590000      1.233000  
1 1 1 28 24 36 o 14.01000 0.3798000 13.73000 0.4456000 14.28000 0.6151000 -0.5516000     0.7596000 
1 1 1 28 24 38 o 9.544000 0.4871000 9.121000 0.5909000 9.967000 0.7744000 -0.8454000     0.9741000 
1 1 1 28 24 40 o 4.204000 0.9827000 4.053000 1.167000  4.356000 1.582000  -0.3024000     1.965000  
1 1 1 28 24 42 o 4.238000 0.8344000 5.457000 1.036000  3.019000 1.308000  2.439000       1.669000  
1 1 1 28 24 44 o 3.141000 0.9343000 2.949000 1.293000  3.333000 1.349000  -0.3838000     1.869000  
1 1 1 28 24 46 o 12.01000 0.4582000 12.75000 0.5811000 11.28000 0.7085000 1.475000       0.9163000 
1 1 1 28 24 48 o 6.952000 0.8145000 8.365000 1.035000  5.538000 1.258000  2.827000       1.629000  
1 1 1 28 25 1  o 20.69000 0.3475000 20.32000 0.4881000 21.06000 0.4949000 -0.7392000     0.6950000 
1 1 1 28 25 3  o 23.16000 0.3196000 22.67000 0.4004000 23.66000 0.4983000 -0.9953000     0.6393000 
1 1 1 28 25 5  o 6.349000 0.7239000 6.133000 1.197000  6.564000 0.8141000 -0.4315000     1.448000  
1 1 1 28 25 7  o 38.22000 0.3772000 38.44000 0.5147000 38.00000 0.5516000 0.4438000      0.7545000 
1 1 1 28 25 9  o 25.31000 0.3005000 25.88000 0.3929000 24.74000 0.4548000 1.134000       0.6010000 
1 1 1 28 25 11 o 12.06000 0.3139000 12.33000 0.4377000 11.80000 0.4500000 0.5305000      0.6278000 
1 1 1 28 25 13 o 21.85000 0.4221000 22.23000 0.6475000 21.47000 0.5416000 0.7583000      0.8442000 
1 1 1 28 25 15 o 10.63000 0.6141000 10.75000 0.7922000 10.52000 0.9385000 0.2270000      1.228000  
1 1 1 28 25 17 o 4.885000 1.072000  4.665000 1.425000  5.105000 1.603000  -0.4398000     2.145000  
1 1 1 28 25 19 o 9.398000 0.6313000 8.022000 0.9289000 10.77000 0.8550000 -2.751000      1.263000  
1 1 1 28 25 21 o 2.765000 0.8781000 2.505000 1.176000  3.025000 1.304000  -0.5197000     1.756000  
1 1 1 28 25 23 o 12.11000 0.5356000 11.69000 0.8793000 12.53000 0.6119000 -0.8399000     1.071000  
1 1 1 28 25 25 o 7.123000 0.8251000 7.098000 1.366000  7.147000 0.9253000 -0.4952000E-01 1.650000  
1 1 1 28 25 27 o 7.271000 0.6916000 7.901000 1.007000  6.642000 0.9482000 1.259000       1.383000  
1 1 1 28 25 29 o 15.22000 0.3242000 14.89000 0.3459000 15.54000 0.5484000 -0.6519000     0.6483000 
1 1 1 28 25 31 o 14.32000 0.3730000 15.08000 0.4394000 13.55000 0.6028000 1.524000       0.7460000 
1 1 1 28 25 33 o 5.651000 0.7997000 6.132000 0.9606000 5.170000 1.279000  0.9620000      1.599000  
1 1 1 28 25 35 o 6.909000 0.6814000 6.567000 0.9354000 7.251000 0.9910000 -0.6840000     1.363000  
1 1 1 28 25 37 o 4.050000 0.8752000 3.144000 1.083000  4.956000 1.375000  -1.812000      1.750000  
1 1 1 28 25 39 o 8.587000 0.8927000 9.035000 0.5895000 8.139000 1.685000  0.8960000      1.785000  
1 1 1 28 25 41 o 7.534000 0.6958000 8.185000 0.6877000 6.883000 1.210000  1.302000       1.392000  
1 1 1 28 25 43 o 6.071000 0.8244000 6.632000 0.8149000 5.511000 1.433000  1.121000       1.649000  
1 1 1 28 25 45 f 7.668000 0.7542000 6.016000 1.200000  9.321000 0.9137000 -3.305000      1.508000  
1 1 1 28 25 47 o 5.951000 0.8987000 5.405000 1.462000  6.497000 1.046000  -1.091000      1.797000  
1 1 1 28 26 0  o 7.047000 0.7726000 7.047000 0.7726000 7.047000 0.7726000 0.000000       0.000000  
1 1 1 28 26 2  o 13.86000 0.3415000 14.22000 0.4418000 13.50000 0.5207000 0.7204000      0.6829000 
1 1 1 28 26 4  o 10.66000 0.6299000 11.07000 1.066000  10.26000 0.6710000 0.8172000      1.260000  
1 1 1 28 26 6  o 9.082000 0.4447000 8.592000 0.6057000 9.572000 0.6514000 -0.9800000     0.8895000 
1 1 1 28 26 8  o 11.93000 0.3428000 12.17000 0.4868000 11.69000 0.4827000 0.4799000      0.6856000 
1 1 1 28 26 10 o 30.59000 0.4454000 31.37000 0.6435000 29.81000 0.6160000 1.560000       0.8909000 
1 1 1 28 26 12 o 18.55000 0.5003000 18.53000 0.7489000 18.58000 0.6636000 -0.4479000E-01 1.001000  
1 1 1 28 26 14 o 14.23000 0.5009000 13.61000 0.6266000 14.86000 0.7817000 -1.254000      1.002000  
1 1 1 28 26 16 o 15.41000 0.4232000 15.05000 0.5747000 15.77000 0.6214000 -0.7230000     0.8464000 
1 1 1 28 26 18 o 10.95000 0.5231000 10.86000 0.6645000 11.05000 0.8080000 -0.1818000     1.046000  
1 1 1 28 26 20 o 13.28000 0.4785000 13.44000 0.7178000 13.12000 0.6329000 0.3118000      0.9570000 
1 1 1 28 26 22 o 21.97000 0.4478000 22.20000 0.6237000 21.74000 0.6427000 0.4527000      0.8956000 
1 1 1 28 26 24 o 7.780000 0.6589000 7.902000 0.9812000 7.658000 0.8798000 0.2438000      1.318000  
1 1 1 28 26 26 o 7.659000 0.6582000 7.726000 0.9792000 7.592000 0.8798000 0.1348000      1.316000  
1 1 1 28 26 28 o 13.82000 0.5176000 13.79000 0.7804000 13.86000 0.6803000 -0.6996000E-01 1.035000  
1 1 1 28 26 30 o 11.66000 0.4777000 11.83000 0.7123000 11.50000 0.6366000 0.3248000      0.9553000 
1 1 1 28 26 32 o 2.700000 0.8137000 2.553000 1.081000  2.846000 1.217000  -0.2928000     1.627000  
1 1 1 28 26 34 o 6.815000 0.7670000 7.148000 0.7655000 6.481000 1.329000  0.6676000      1.534000  
1 1 1 28 26 36 o 2.152000 0.7315000 2.084000 0.9983000 2.220000 1.069000  -0.1360000     1.463000  
1 1 1 28 26 38 o 5.920000 1.050000  4.253000 1.053000  7.586000 1.818000  -3.333000      2.101000  
1 1 1 28 26 40 o 11.41000 0.4804000 11.11000 0.6064000 11.72000 0.7453000 -0.6038000     0.9609000 
1 1 1 28 26 42 o 12.87000 0.5237000 13.56000 0.7185000 12.19000 0.7622000 1.371000       1.047000  
1 1 1 28 26 44 o 5.189000 1.175000  6.182000 1.934000  4.195000 1.336000  1.987000       2.350000  
1 1 1 28 26 46 f 6.251000 1.095000  7.933000 1.733000  4.569000 1.340000  3.363000       2.191000  
1 1 1 28 27 1  o 8.000000 0.6316000 8.590000 0.6784000 7.411000 1.066000  1.179000       1.263000  
1 1 1 28 27 3  o 34.32000 0.3956000 34.37000 0.4943000 34.26000 0.6178000 0.1081000      0.7912000 
1 1 1 28 27 5  o 20.35000 0.3044000 20.70000 0.4245000 20.01000 0.4365000 0.6899000      0.6089000 
1 1 1 28 27 7  o 10.48000 0.8837000 8.910000 1.656000  12.05000 0.6168000 -3.141000      1.767000  
1 1 1 28 27 9  o 13.44000 0.7159000 13.43000 0.6435000 13.46000 1.279000  -0.2411000E-01 1.432000  
1 1 1 28 27 11 o 26.50000 0.3922000 26.18000 0.5057000 26.82000 0.5997000 -0.6425000     0.7845000 
1 1 1 28 27 13 o 21.65000 0.3668000 21.47000 0.5288000 21.82000 0.5083000 -0.3547000     0.7335000 
1 1 1 28 27 15 o 6.147000 0.8896000 7.687000 0.9543000 4.606000 1.502000  3.080000       1.779000  
1 1 1 28 27 17 o 13.69000 0.4506000 13.64000 0.5802000 13.74000 0.6895000 -0.1058000     0.9011000 
1 1 1 28 27 19 o 8.672000 0.7197000 8.503000 1.126000  8.841000 0.8968000 -0.3381000     1.439000  
1 1 1 28 27 21 o 7.514000 0.6936000 7.774000 1.010000  7.255000 0.9511000 0.5191000      1.387000  
1 1 1 28 27 23 o 8.876000 0.5914000 8.492000 0.8556000 9.260000 0.8167000 -0.7679000     1.183000  
1 1 1 28 27 25 o 5.667000 0.9344000 5.301000 1.539000  6.033000 1.061000  -0.7324000     1.869000  
1 1 1 28 27 27 o 6.884000 0.7742000 6.949000 1.134000  6.819000 1.054000  0.1292000      1.548000  
1 1 1 28 27 29 o 9.003000 0.6638000 8.672000 0.8373000 9.334000 1.030000  -0.6615000     1.328000  
1 1 1 28 27 31 o 8.383000 0.6435000 8.928000 0.8807000 7.837000 0.9385000 1.091000       1.287000  
1 1 1 28 27 33 o 4.189000 0.8536000 4.734000 1.053000  3.645000 1.344000  1.089000       1.707000  
1 1 1 28 27 35 o 3.753000 0.9400000 3.680000 1.274000  3.825000 1.382000  -0.1455000     1.880000  
1 1 1 28 27 37 o 4.511000 1.166000  3.433000 1.266000  5.589000 1.959000  -2.156000      2.332000  
1 1 1 28 27 39 f 7.605000 0.9510000 8.002000 1.489000  7.207000 1.184000  0.7949000      1.902000  
1 1 1 28 27 41 o 10.99000 0.5851000 10.36000 0.9037000 11.62000 0.7436000 -1.263000      1.170000  
1 1 1 28 27 43 o 4.520000 1.066000  5.077000 1.576000  3.964000 1.435000  1.113000       2.131000  
1 1 1 28 27 45 o 5.449000 1.179000  7.037000 1.906000  3.861000 1.388000  3.176000       2.358000  
1 1 1 28 28 0  o 10.87000 0.7539000 10.87000 0.7539000 10.87000 0.7539000 0.000000       0.000000  
1 1 1 28 28 2  o 11.60000 0.4062000 11.93000 0.5313000 11.26000 0.6146000 0.6700000      0.8124000 
1 1 1 28 28 4  o 14.68000 0.3214000 15.72000 0.4282000 13.65000 0.4793000 2.073000       0.6427000 
1 1 1 28 28 6  o 12.38000 0.3472000 13.09000 0.4387000 11.67000 0.5384000 1.422000       0.6944000 
1 1 1 28 28 8  o 9.924000 0.5804000 10.42000 0.7743000 9.425000 0.8649000 0.9968000      1.161000  
1 1 1 28 28 10 o 29.68000 0.4186000 29.49000 0.5026000 29.87000 0.6696000 -0.3795000     0.8373000 
1 1 1 28 28 12 o 8.357000 0.6592000 8.395000 0.9904000 8.319000 0.8703000 0.7618000E-01  1.318000  
1 1 1 28 28 14 o 20.63000 0.3967000 19.93000 0.5090000 21.33000 0.6087000 -1.406000      0.7935000 
1 1 1 28 28 16 o 9.903000 0.6337000 10.79000 0.8684000 9.012000 0.9232000 1.783000       1.267000  
1 1 1 28 28 18 o 21.30000 0.3830000 21.29000 0.5252000 21.31000 0.5575000 -0.2198000E-01 0.7659000 
1 1 1 28 28 20 o 5.856000 0.9122000 5.585000 1.354000  6.126000 1.223000  -0.5406000     1.824000  
1 1 1 28 28 22 o 9.708000 0.6182000 9.142000 0.7880000 10.28000 0.9528000 -1.134000      1.236000  
1 1 1 28 28 24 o 7.851000 0.6848000 7.322000 1.024000  8.381000 0.9096000 -1.059000      1.370000  
1 1 1 28 28 26 o 17.67000 0.3929000 16.83000 0.5835000 18.50000 0.5264000 -1.663000      0.7859000 
1 1 1 28 28 28 o 22.27000 0.3789000 22.18000 0.5602000 22.36000 0.5104000 -0.1767000     0.7579000 
1 1 1 28 28 30 o 13.18000 0.4779000 13.23000 0.6935000 13.13000 0.6577000 0.1019000      0.9558000 
1 1 1 28 28 32 o 6.247000 1.008000  4.647000 1.631000  7.846000 1.185000  -3.199000      2.016000  
1 1 1 28 28 34 o 15.46000 0.4860000 15.35000 0.6483000 15.58000 0.7242000 -0.2307000     0.9720000 
1 1 1 28 28 36 o 5.913000 0.8862000 5.571000 1.043000  6.255000 1.433000  -0.6838000     1.772000  
1 1 1 28 28 38 o 5.052000 1.117000  4.605000 1.791000  5.499000 1.334000  -0.8947000     2.234000  
1 1 1 28 28 40 o 7.746000 0.8024000 7.275000 1.282000  8.217000 0.9649000 -0.9427000     1.605000  
1 1 1 28 28 42 o 9.328000 0.6803000 9.382000 1.002000  9.275000 0.9201000 0.1067000      1.361000  
1 1 1 28 28 44 o 4.260000 1.216000  4.329000 1.809000  4.192000 1.625000  0.1366000      2.431000  
1 1 1 28 29 1  o 23.67000 0.3034000 23.10000 0.3890000 24.25000 0.4656000 -1.145000      0.6067000 
1 1 1 28 29 3  f 6.196000 0.5681000 6.158000 0.8173000 6.233000 0.7893000 -0.7492000E-01 1.136000  
1 1 1 28 29 5  o 15.77000 0.2780000 15.61000 0.3952000 15.94000 0.3910000 -0.3305000     0.5560000 
1 1 1 28 29 7  o 18.94000 0.3674000 19.67000 0.5087000 18.21000 0.5302000 1.460000       0.7347000 
1 1 1 28 29 9  o 17.96000 0.5564000 18.52000 0.5200000 17.40000 0.9838000 1.128000       1.113000  
1 1 1 28 29 11 o 17.51000 0.4433000 17.86000 0.6236000 17.17000 0.6303000 0.6896000      0.8866000 
1 1 1 28 29 13 o 17.57000 0.4412000 16.32000 0.6328000 18.82000 0.6150000 -2.500000      0.8824000 
1 1 1 28 29 15 o 20.68000 0.5029000 20.60000 0.6658000 20.76000 0.7540000 -0.1636000     1.006000  
1 1 1 28 29 17 f 18.99000 0.3859000 19.04000 0.5289000 18.93000 0.5622000 0.1081000      0.7718000 
1 1 1 28 29 19 o 7.283000 0.7139000 7.976000 0.8484000 6.590000 1.148000  1.386000       1.428000  
1 1 1 28 29 21 o 7.281000 0.7656000 8.656000 0.7978000 5.906000 1.307000  2.751000       1.531000  
1 1 1 28 29 23 o 13.94000 0.4111000 13.13000 0.5867000 14.76000 0.5761000 -1.629000      0.8223000 
1 1 1 28 29 25 o 5.766000 0.9684000 5.737000 1.519000  5.795000 1.202000  -0.5886000E-01 1.937000  
1 1 1 28 29 27 o 13.91000 0.4510000 13.64000 0.6809000 14.18000 0.5916000 -0.5432000     0.9020000 
1 1 1 28 29 29 o 19.57000 0.3865000 19.00000 0.5636000 20.13000 0.5291000 -1.138000      0.7731000 
1 1 1 28 29 31 o 6.945000 0.7466000 6.509000 1.158000  7.381000 0.9430000 -0.8717000     1.493000  
1 1 1 28 29 33 o 6.315000 0.9843000 6.553000 1.327000  6.076000 1.454000  0.4771000      1.969000  
1 1 1 28 29 35 o 4.280000 1.049000  4.644000 1.423000  3.916000 1.541000  0.7276000      2.098000  
1 1 1 28 29 37 o 5.630000 1.082000  4.703000 1.769000  6.558000 1.248000  -1.854000      2.165000  
1 1 1 28 29 39 o 5.227000 1.029000  5.388000 1.442000  5.067000 1.468000  0.3211000      2.058000  
1 1 1 28 29 41 o 11.51000 0.5783000 11.42000 0.8349000 11.59000 0.8003000 -0.1679000     1.157000  
1 1 1 28 29 43 o 6.880000 0.9371000 7.714000 1.286000  6.046000 1.363000  1.668000       1.874000  
1 1 1 28 29 45 f 4.452000 2.074000  4.452000 2.074000  ?        ?         ?              ?         
1 1 1 28 30 0  o 19.93000 0.3997000 19.93000 0.3997000 19.93000 0.3997000 0.000000       0.000000  
1 1 1 28 30 2  o 15.93000 0.3759000 16.44000 0.6010000 15.41000 0.4516000 1.031000       0.7517000 
1 1 1 28 30 4  f 16.33000 0.2760000 16.08000 0.3740000 16.57000 0.4060000 -0.4866000     0.5520000 
1 1 1 28 30 6  o 10.70000 0.5466000 10.63000 0.7025000 10.78000 0.8375000 -0.1479000     1.093000  
1 1 1 28 30 8  o 15.80000 0.4528000 16.02000 0.6166000 15.58000 0.6632000 0.4445000      0.9055000 
1 1 1 28 30 10 f 22.20000 0.5285000 22.75000 0.5862000 21.65000 0.8795000 1.098000       1.057000  
1 1 1 28 30 12 o 14.73000 0.5057000 14.50000 0.8352000 14.96000 0.5704000 -0.4636000     1.011000  
1 1 1 28 30 14 o 26.49000 0.3680000 26.32000 0.5124000 26.67000 0.5283000 -0.3535000     0.7359000 
1 1 1 28 30 16 o 29.47000 0.3758000 29.57000 0.5093000 29.37000 0.5528000 0.2003000      0.7516000 
1 1 1 28 30 18 o 10.14000 0.6608000 10.91000 0.6588000 9.356000 1.146000  1.559000       1.322000  
1 1 1 28 30 20 o 14.99000 0.4766000 15.85000 0.7034000 14.12000 0.6431000 1.735000       0.9531000 
1 1 1 28 30 22 o 4.638000 1.089000  4.189000 1.362000  5.087000 1.700000  -0.8975000     2.178000  
1 1 1 28 30 24 o 6.032000 0.9096000 4.971000 1.375000  7.093000 1.191000  -2.122000      1.819000  
1 1 1 28 30 26 o 12.45000 0.4947000 12.37000 0.7154000 12.53000 0.6834000 -0.1602000     0.9893000 
1 1 1 28 30 28 o 16.76000 0.4474000 17.07000 0.6543000 16.46000 0.6102000 0.6117000      0.8947000 
1 1 1 28 30 30 o 9.857000 0.5895000 9.350000 0.9634000 10.36000 0.6796000 -1.015000      1.179000  
1 1 1 28 30 32 f 3.694000 1.010000  4.178000 1.466000  3.211000 1.391000  0.9672000      2.020000  
1 1 1 28 30 34 o 8.069000 0.6687000 8.809000 0.9555000 7.329000 0.9357000 1.479000       1.337000  
1 1 1 28 30 36 o 5.534000 1.310000  6.442000 2.189000  4.625000 1.440000  1.817000       2.620000  
1 1 1 28 30 38 o 5.950000 0.9416000 5.819000 1.309000  6.081000 1.354000  -0.2620000     1.883000  
1 1 1 28 30 40 o 6.140000 0.9540000 5.595000 1.462000  6.685000 1.226000  -1.091000      1.908000  
1 1 1 28 30 42 o 5.163000 1.063000  4.265000 1.614000  6.062000 1.383000  -1.798000      2.126000  
1 1 1 28 30 44 o 5.276000 1.242000  5.064000 1.496000  5.488000 1.984000  -0.4240000     2.485000  
1 1 1 28 31 1  o 9.815000 0.8529000 8.626000 1.631000  11.00000 0.5008000 -2.379000      1.706000  
1 1 1 28 31 3  o 7.147000 0.5071000 6.578000 0.7627000 7.717000 0.6685000 -1.139000      1.014000  
1 1 1 28 31 5  o 8.730000 0.5944000 8.929000 0.7780000 8.531000 0.8990000 0.3980000      1.189000  
1 1 1 28 31 7  o 11.10000 0.4844000 11.14000 0.6523000 11.05000 0.7163000 0.8808000E-01  0.9688000 
1 1 1 28 31 9  o 8.365000 0.6638000 9.797000 0.7466000 6.933000 1.098000  2.864000       1.328000  
1 1 1 28 31 11 o 9.574000 0.5594000 10.00000 0.7566000 9.146000 0.8242000 0.8555000      1.119000  
1 1 1 28 31 13 o 11.55000 0.5558000 12.41000 0.8057000 10.69000 0.7658000 1.718000       1.112000  
1 1 1 28 31 15 o 8.532000 0.6077000 8.192000 0.8591000 8.873000 0.8599000 -0.6811000     1.215000  
1 1 1 28 31 17 o 24.75000 0.3714000 24.74000 0.4978000 24.76000 0.5512000 -0.1843000E-01 0.7427000 
1 1 1 28 31 19 o 13.05000 0.4820000 12.75000 0.6807000 13.34000 0.6827000 -0.5903000     0.9641000 
1 1 1 28 31 21 o 6.393000 0.8602000 5.703000 1.265000  7.084000 1.166000  -1.380000      1.720000  
1 1 1 28 31 23 o 10.41000 0.7084000 9.965000 0.9908000 10.85000 1.013000  -0.8873000     1.417000  
1 1 1 28 31 25 o 7.956000 0.8649000 6.431000 1.521000  9.481000 0.8244000 -3.049000      1.730000  
1 1 1 28 31 27 o 13.08000 0.5141000 12.22000 0.8224000 13.94000 0.6172000 -1.721000      1.028000  
1 1 1 28 31 29 o 14.83000 0.4537000 13.96000 0.6897000 15.70000 0.5895000 -1.734000      0.9073000 
1 1 1 28 31 31 o 4.438000 1.036000  3.743000 1.457000  5.132000 1.472000  -1.389000      2.071000  
1 1 1 28 31 33 o 5.735000 0.8649000 7.060000 1.078000  4.411000 1.352000  2.648000       1.730000  
1 1 1 28 31 35 o 4.167000 1.089000  4.358000 1.651000  3.975000 1.419000  0.3835000      2.177000  
1 1 1 28 31 37 o 5.094000 1.195000  4.895000 1.795000  5.294000 1.578000  -0.3984000     2.390000  
1 1 1 28 31 39 o 3.179000 0.9491000 3.101000 1.327000  3.258000 1.357000  -0.1576000     1.898000  
1 1 1 28 31 41 f 6.506000 0.9837000 7.250000 1.373000  5.762000 1.410000  1.488000       1.967000  
1 1 1 28 31 43 o 3.938000 1.070000  4.526000 1.590000  3.349000 1.434000  1.176000       2.141000  
1 1 1 28 32 0  o 9.345000 0.5694000 9.345000 0.5694000 9.345000 0.5694000 0.000000       0.000000  
1 1 1 28 32 2  o 25.88000 0.3158000 25.90000 0.3954000 25.87000 0.4925000 0.3186000E-01  0.6315000 
1 1 1 28 32 4  o 11.90000 0.3438000 12.32000 0.6121000 11.48000 0.3131000 0.8376000      0.6876000 
1 1 1 28 32 6  o 11.46000 0.4592000 11.60000 0.6225000 11.31000 0.6753000 0.2964000      0.9185000 
1 1 1 28 32 8  o 20.24000 0.3832000 20.61000 0.5654000 19.87000 0.5173000 0.7426000      0.7664000 
1 1 1 28 32 10 o 13.99000 0.4697000 14.70000 0.5517000 13.29000 0.7604000 1.414000       0.9394000 
1 1 1 28 32 12 o 9.086000 0.6175000 8.715000 0.9511000 9.456000 0.7879000 -0.7417000     1.235000  
1 1 1 28 32 14 o 20.86000 0.3650000 21.44000 0.4940000 20.29000 0.5375000 1.155000       0.7300000 
1 1 1 28 32 16 o 9.818000 0.5710000 10.20000 0.7424000 9.440000 0.8677000 0.7556000      1.142000  
1 1 1 28 32 18 o 7.637000 0.6790000 8.497000 0.8314000 6.777000 1.074000  1.720000       1.358000  
1 1 1 28 32 20 o 6.468000 0.8428000 7.050000 1.070000  5.886000 1.302000  1.164000       1.686000  
1 1 1 28 32 22 o 8.707000 0.7013000 8.620000 0.8527000 8.794000 1.114000  -0.1734000     1.403000  
1 1 1 28 32 24 o 7.210000 0.8935000 8.084000 1.196000  6.336000 1.328000  1.749000       1.787000  
1 1 1 28 32 26 o 13.82000 0.4614000 13.17000 0.7123000 14.46000 0.5868000 -1.293000      0.9229000 
1 1 1 28 32 28 o 15.44000 0.6759000 15.14000 1.141000  15.75000 0.7253000 -0.6141000     1.352000  
1 1 1 28 32 30 o 6.161000 1.045000  6.169000 1.410000  6.153000 1.543000  0.1620000E-01  2.090000  
1 1 1 28 32 32 o 9.588000 0.5648000 9.015000 0.8703000 10.16000 0.7201000 -1.146000      1.130000  
1 1 1 28 32 34 o 7.722000 0.6865000 8.018000 0.9771000 7.425000 0.9645000 0.5925000      1.373000  
1 1 1 28 32 36 o 5.386000 0.9355000 5.270000 1.369000  5.503000 1.275000  -0.2330000     1.871000  
1 1 1 28 32 38 o 2.652000 0.8525000 2.507000 1.183000  2.796000 1.228000  -0.2887000     1.705000  
1 1 1 28 32 40 o 3.583000 1.035000  3.977000 1.569000  3.189000 1.350000  0.7874000      2.069000  
1 1 1 28 32 42 o 6.280000 1.083000  6.808000 1.628000  5.752000 1.430000  1.056000       2.167000  
1 1 1 28 33 1  o 30.59000 0.3405000 31.26000 0.5166000 29.91000 0.4437000 1.350000       0.6810000 
1 1 1 28 33 3  o 7.879000 0.5214000 7.313000 0.9367000 8.446000 0.4581000 -1.132000      1.043000  
1 1 1 28 33 5  o 8.951000 0.5527000 10.24000 0.6678000 7.661000 0.8809000 2.579000       1.105000  
1 1 1 28 33 7  o 12.53000 0.4469000 13.49000 0.6024000 11.57000 0.6603000 1.920000       0.8938000 
1 1 1 28 33 9  o 16.03000 0.3968000 15.87000 0.5560000 16.18000 0.5664000 -0.3088000     0.7936000 
1 1 1 28 33 11 o 7.255000 0.7086000 7.325000 0.9827000 7.185000 1.021000  0.1395000      1.417000  
1 1 1 28 33 13 o 15.55000 0.4754000 14.95000 0.7586000 16.16000 0.5732000 -1.206000      0.9508000 
1 1 1 28 33 15 o 11.27000 0.5082000 10.87000 0.7086000 11.68000 0.7287000 -0.8045000     1.016000  
1 1 1 28 33 17 o 15.30000 0.3879000 14.89000 0.5469000 15.71000 0.5502000 -0.8203000     0.7757000 
1 1 1 28 33 19 o 6.491000 0.7981000 6.204000 1.155000  6.778000 1.102000  -0.5741000     1.596000  
1 1 1 28 33 21 o 9.755000 0.5348000 10.25000 0.7324000 9.259000 0.7795000 0.9916000      1.070000  
1 1 1 28 33 23 o 7.083000 0.7925000 6.175000 1.218000  7.991000 1.014000  -1.816000      1.585000  
1 1 1 28 33 25 o 5.085000 0.9325000 3.970000 1.431000  6.201000 1.196000  -2.231000      1.865000  
1 1 1 28 33 27 o 11.11000 0.7034000 11.97000 1.016000  10.26000 0.9728000 1.710000       1.407000  
1 1 1 28 33 29 o 4.108000 1.016000  4.774000 1.533000  3.441000 1.335000  1.333000       2.033000  
1 1 1 28 33 31 o 7.683000 0.9666000 7.396000 1.558000  7.970000 1.145000  -0.5741000     1.933000  
1 1 1 28 33 33 o 11.16000 0.6323000 10.51000 0.8663000 11.81000 0.9212000 -1.298000      1.265000  
1 1 1 28 33 35 o 6.414000 1.096000  4.933000 1.465000  7.894000 1.631000  -2.961000      2.192000  
1 1 1 28 33 37 o 4.169000 1.074000  4.077000 1.541000  4.262000 1.495000  -0.1853000     2.148000  
1 1 1 28 33 39 o 5.633000 1.114000  4.945000 1.509000  6.321000 1.640000  -1.376000      2.228000  
1 1 1 28 33 41 o 3.446000 1.105000  3.742000 1.685000  3.149000 1.430000  0.5930000      2.210000  
1 1 1 28 34 0  o 2.505000 1.091000  2.505000 1.091000  2.505000 1.091000  0.000000       0.000000  
1 1 1 28 34 2  o 11.58000 0.5128000 11.51000 0.9447000 11.65000 0.3995000 -0.1371000     1.026000  
1 1 1 28 34 4  o 10.50000 0.4738000 10.60000 0.6545000 10.40000 0.6852000 0.1982000      0.9475000 
1 1 1 28 34 6  o 4.973000 0.8706000 4.857000 1.250000  5.088000 1.212000  -0.2303000     1.741000  
1 1 1 28 34 8  o 19.53000 0.3562000 19.39000 0.4923000 19.67000 0.5149000 -0.2805000     0.7124000 
1 1 1 28 34 10 o 23.96000 0.4715000 24.73000 0.6494000 23.19000 0.6838000 1.532000       0.9430000 
1 1 1 28 34 12 o 12.01000 0.4864000 12.07000 0.6558000 11.96000 0.7184000 0.1073000      0.9728000 
1 1 1 28 34 14 o 24.03000 0.3735000 24.42000 0.5193000 23.64000 0.5371000 0.7828000      0.7471000 
1 1 1 28 34 16 o 13.49000 0.4423000 13.98000 0.5930000 13.00000 0.6564000 0.9770000      0.8845000 
1 1 1 28 34 18 o 4.116000 0.9695000 4.441000 1.361000  3.790000 1.381000  0.6515000      1.939000  
1 1 1 28 34 20 o 17.52000 0.4014000 17.42000 0.5382000 17.61000 0.5957000 -0.1892000     0.8028000 
1 1 1 28 34 22 o 23.16000 0.4350000 24.06000 0.6336000 22.27000 0.5963000 1.788000       0.8700000 
1 1 1 28 34 24 o 5.323000 1.002000  4.192000 1.609000  6.455000 1.193000  -2.263000      2.003000  
1 1 1 28 34 26 f 19.33000 0.6426000 19.91000 0.9931000 18.76000 0.8157000 1.154000       1.285000  
1 1 1 28 34 28 o 15.26000 0.4634000 15.04000 0.6868000 15.48000 0.6223000 -0.4409000     0.9268000 
1 1 1 28 34 30 o 6.549000 1.086000  5.771000 1.789000  7.328000 1.233000  -1.556000      2.173000  
1 1 1 28 34 32 f 3.757000 1.041000  3.627000 1.480000  3.888000 1.465000  -0.2609000     2.082000  
1 1 1 28 34 34 o 5.268000 1.001000  5.584000 1.347000  4.952000 1.481000  0.6320000      2.002000  
1 1 1 28 34 36 o 8.825000 0.7639000 8.914000 0.8847000 8.736000 1.246000  0.1781000      1.528000  
1 1 1 28 34 38 o 8.509000 0.8448000 10.12000 1.023000  6.896000 1.344000  3.227000       1.690000  
1 1 1 28 34 40 o 4.375000 1.179000  4.069000 1.594000  4.680000 1.737000  -0.6106000     2.358000  
1 1 1 28 35 1  o 16.85000 0.2756000 16.81000 0.3944000 16.89000 0.3851000 -0.8395000E-01 0.5512000 
1 1 1 28 35 3  o 5.516000 0.9638000 4.195000 1.287000  6.837000 1.435000  -2.643000      1.928000  
1 1 1 28 35 5  o 14.88000 0.3865000 14.96000 0.5398000 14.80000 0.5534000 0.1662000      0.7731000 
1 1 1 28 35 7  o 19.08000 0.3590000 19.18000 0.4954000 18.98000 0.5198000 0.1967000      0.7181000 
1 1 1 28 35 9  o 12.85000 0.4318000 13.14000 0.5989000 12.56000 0.6221000 0.5815000      0.8636000 
1 1 1 28 35 11 o 8.353000 0.5992000 8.388000 0.8288000 8.319000 0.8656000 0.6862000E-01  1.198000  
1 1 1 28 35 13 o 11.64000 0.5654000 11.90000 0.8451000 11.38000 0.7514000 0.5200000      1.131000  
1 1 1 28 35 15 f 6.299000 0.8046000 6.761000 1.033000  5.837000 1.233000  0.9238000      1.609000  
1 1 1 28 35 17 o 2.969000 0.8638000 2.655000 1.153000  3.282000 1.286000  -0.6267000     1.728000  
1 1 1 28 35 19 o 7.750000 0.6921000 8.169000 0.8935000 7.331000 1.057000  0.8379000      1.384000  
1 1 1 28 35 21 o 18.28000 0.5267000 17.67000 0.6715000 18.88000 0.8116000 -1.211000      1.053000  
1 1 1 28 35 23 o 10.67000 0.6829000 10.72000 0.7696000 10.62000 1.128000  0.1033000      1.366000  
1 1 1 28 35 25 o 3.986000 1.059000  3.957000 1.513000  4.016000 1.482000  -0.5928000E-01 2.118000  
1 1 1 28 35 27 f 5.224000 1.031000  5.615000 1.491000  4.833000 1.425000  0.7816000      2.063000  
1 1 1 28 35 29 o 14.16000 0.5192000 13.25000 0.7222000 15.07000 0.7462000 -1.818000      1.038000  
1 1 1 28 35 31 o 11.50000 0.5594000 11.20000 0.8051000 11.80000 0.7769000 -0.6016000     1.119000  
1 1 1 28 35 33 o 10.47000 0.6211000 9.840000 0.9198000 11.10000 0.8348000 -1.258000      1.242000  
1 1 1 28 35 35 f 4.186000 1.092000  4.320000 1.642000  4.051000 1.440000  0.2686000      2.184000  
1 1 1 28 35 37 o 4.281000 1.068000  4.604000 1.512000  3.958000 1.510000  0.6456000      2.137000  
1 1 1 28 35 39 o 4.046000 1.043000  4.793000 1.562000  3.300000 1.381000  1.493000       2.085000  
1 1 1 28 36 0  o 5.677000 0.6475000 5.677000 0.6475000 5.677000 0.6475000 0.000000       0.000000  
1 1 1 28 36 2  o 2.950000 0.7378000 3.631000 1.130000  2.269000 0.9488000 1.362000       1.476000  
1 1 1 28 36 4  o 6.249000 0.8198000 6.704000 0.7254000 5.794000 1.470000  0.9102000      1.640000  
1 1 1 28 36 6  f 6.489000 0.7551000 7.416000 0.9491000 5.562000 1.175000  1.855000       1.510000  
1 1 1 28 36 8  o 8.657000 0.5947000 9.092000 0.7796000 8.221000 0.8982000 0.8711000      1.189000  
1 1 1 28 36 10 o 8.779000 0.7474000 9.032000 0.8080000 8.527000 1.258000  0.5053000      1.495000  
1 1 1 28 36 12 o 11.75000 0.4860000 11.83000 0.6508000 11.67000 0.7219000 0.1520000      0.9719000 
1 1 1 28 36 14 o 3.981000 0.9799000 3.546000 1.369000  4.416000 1.402000  -0.8700000     1.960000  
1 1 1 28 36 16 o 6.486000 0.8278000 6.073000 1.157000  6.898000 1.184000  -0.8254000     1.656000  
1 1 1 28 36 18 o 4.306000 1.006000  4.086000 1.434000  4.525000 1.411000  -0.4383000     2.012000  
1 1 1 28 36 20 o 8.882000 0.6279000 8.368000 0.9459000 9.395000 0.8261000 -1.027000      1.256000  
1 1 1 28 36 22 o 10.53000 0.7170000 10.47000 0.9620000 10.60000 1.064000  -0.1314000     1.434000  
1 1 1 28 36 24 o 5.922000 1.134000  5.185000 1.880000  6.659000 1.270000  -1.474000      2.269000  
1 1 1 28 36 26 o 4.469000 1.032000  5.660000 1.584000  3.277000 1.323000  2.383000       2.064000  
1 1 1 28 36 28 o 10.64000 0.6267000 10.59000 0.7855000 10.68000 0.9766000 -0.9490000E-01 1.253000  
1 1 1 28 36 30 o 5.874000 0.9824000 5.608000 1.364000  6.140000 1.415000  -0.5325000     1.965000  
1 1 1 28 36 32 o 15.10000 0.6527000 13.64000 0.7463000 16.57000 1.071000  -2.926000      1.305000  
1 1 1 28 36 34 o 4.739000 1.088000  4.781000 1.645000  4.697000 1.423000  0.8449000E-01  2.175000  
1 1 1 28 36 36 o 9.683000 0.6129000 9.715000 0.8845000 9.650000 0.8487000 0.6470000E-01  1.226000  
1 1 1 28 36 38 o 4.610000 0.9668000 3.679000 1.412000  5.540000 1.321000  -1.861000      1.934000  
1 1 1 28 37 1  o 4.330000 0.7102000 4.894000 0.8637000 3.765000 1.128000  1.129000       1.420000  
1 1 1 28 37 3  o 7.693000 0.7851000 7.681000 0.7577000 7.705000 1.375000  -0.2407000E-01 1.570000  
1 1 1 28 37 5  o 18.57000 0.4127000 18.69000 0.4000000 18.44000 0.7221000 0.2474000      0.8254000 
1 1 1 28 37 7  o 17.22000 0.4346000 17.48000 0.4927000 16.95000 0.7159000 0.5281000      0.8691000 
1 1 1 28 37 9  o 11.67000 0.4596000 12.29000 0.6068000 11.06000 0.6904000 1.232000       0.9192000 
1 1 1 28 37 11 f 9.192000 0.6062000 10.59000 0.6757000 7.796000 1.007000  2.790000       1.212000  
1 1 1 28 37 13 o 9.537000 0.6518000 10.10000 0.9261000 8.979000 0.9173000 1.117000       1.304000  
1 1 1 28 37 15 o 4.143000 0.9738000 4.094000 1.395000  4.192000 1.360000  -0.9833000E-01 1.948000  
1 1 1 28 37 17 o 6.076000 0.8963000 6.421000 1.154000  5.731000 1.371000  0.6897000      1.793000  
1 1 1 28 37 19 o 5.514000 0.9921000 6.276000 1.170000  4.751000 1.602000  1.525000       1.984000  
1 1 1 28 37 21 o 13.40000 0.7507000 13.54000 1.169000  13.27000 0.9424000 0.2732000      1.501000  
1 1 1 28 37 23 o 17.02000 0.4764000 17.23000 0.7091000 16.81000 0.6365000 0.4139000      0.9528000 
1 1 1 28 37 25 o 8.281000 0.7755000 7.859000 1.208000  8.704000 0.9723000 -0.8444000     1.551000  
1 1 1 28 37 27 o 8.601000 0.7883000 8.763000 1.018000  8.439000 1.204000  0.3245000      1.577000  
1 1 1 28 37 29 o 5.761000 0.9741000 6.707000 1.222000  4.815000 1.517000  1.892000       1.948000  
1 1 1 28 37 31 o 3.683000 1.073000  3.538000 1.518000  3.828000 1.516000  -0.2906000     2.146000  
1 1 1 28 37 33 o 9.591000 0.6880000 8.838000 1.103000  10.34000 0.8228000 -1.505000      1.376000  
1 1 1 28 37 35 o 4.797000 1.017000  4.819000 1.430000  4.775000 1.448000  0.4476000E-01  2.035000  
1 1 1 28 37 37 o 8.428000 0.7409000 9.024000 0.8984000 7.833000 1.178000  1.190000       1.482000  
1 1 1 28 38 0  o 13.49000 0.3847000 13.49000 0.3847000 13.49000 0.3847000 0.000000       0.000000  
1 1 1 28 38 2  o 8.727000 0.6564000 8.852000 0.5435000 8.602000 1.195000  0.2495000      1.313000  
1 1 1 28 38 4  o 6.990000 0.7677000 5.211000 0.9782000 8.770000 1.183000  -3.559000      1.535000  
1 1 1 28 38 6  o 3.251000 0.9304000 3.170000 1.170000  3.333000 1.447000  -0.1635000     1.861000  
1 1 1 28 38 8  o 10.79000 0.5929000 11.86000 0.4907000 9.720000 1.079000  2.143000       1.186000  
1 1 1 28 38 10 o 10.47000 0.6203000 11.33000 0.6270000 9.600000 1.070000  1.735000       1.241000  
1 1 1 28 38 12 o 9.764000 0.5400000 9.927000 0.7118000 9.601000 0.8122000 0.3257000      1.080000  
1 1 1 28 38 14 o 4.024000 0.9811000 3.929000 1.309000  4.119000 1.462000  -0.1905000     1.962000  
1 1 1 28 38 16 o 10.20000 0.5798000 10.09000 0.6919000 10.32000 0.9306000 -0.2304000     1.160000  
1 1 1 28 38 18 o 6.636000 0.9988000 8.149000 1.174000  5.123000 1.616000  3.027000       1.998000  
1 1 1 28 38 20 o 12.01000 0.8676000 9.950000 1.597000  14.07000 0.6781000 -4.117000      1.735000  
1 1 1 28 38 22 o 10.89000 0.6382000 10.61000 1.021000  11.18000 0.7658000 -0.5686000     1.276000  
1 1 1 28 38 24 o 4.937000 0.9280000 6.639000 1.184000  3.234000 1.429000  3.405000       1.856000  
1 1 1 28 38 26 o 6.813000 1.014000  5.644000 1.558000  7.982000 1.298000  -2.339000      2.027000  
1 1 1 28 38 28 o 5.390000 1.017000  3.875000 1.525000  6.904000 1.346000  -3.029000      2.034000  
1 1 1 28 38 30 o 3.579000 0.9689000 3.041000 1.318000  4.116000 1.421000  -1.075000      1.938000  
1 1 1 28 38 32 o 3.021000 0.9575000 3.185000 1.409000  2.857000 1.297000  0.3278000      1.915000  
1 1 1 28 38 34 o 3.151000 0.9558000 2.761000 1.291000  3.540000 1.409000  -0.7790000     1.912000  
1 1 1 28 38 36 o 4.227000 1.007000  3.305000 1.333000  5.149000 1.511000  -1.844000      2.015000  
1 1 1 28 39 1  o 9.833000 0.6942000 10.96000 0.5607000 8.702000 1.270000  2.261000       1.388000  
1 1 1 28 39 3  o 4.959000 0.9490000 5.816000 0.9742000 4.101000 1.629000  1.715000       1.898000  
1 1 1 28 39 5  f 6.056000 0.9369000 6.849000 0.7382000 5.263000 1.722000  1.586000       1.874000  
1 1 1 28 39 7  o 9.423000 0.6357000 10.53000 0.5394000 8.318000 1.151000  2.210000       1.271000  
1 1 1 28 39 9  o 4.995000 0.9801000 4.789000 1.102000  5.202000 1.621000  -0.4124000     1.960000  
1 1 1 28 39 11 o 3.020000 0.9290000 2.311000 1.033000  3.729000 1.545000  -1.418000      1.858000  
1 1 1 28 39 13 o 12.06000 0.5798000 12.00000 0.8489000 12.12000 0.7899000 -0.1194000     1.160000  
1 1 1 28 39 15 o 10.03000 0.6928000 10.00000 0.9762000 10.07000 0.9834000 -0.6657000E-01 1.386000  
1 1 1 28 39 17 o 4.198000 1.022000  3.463000 1.450000  4.934000 1.442000  -1.471000      2.045000  
1 1 1 28 39 19 o 5.359000 1.097000  6.053000 1.597000  4.665000 1.504000  1.388000       2.193000  
1 1 1 28 39 21 o 13.98000 0.5985000 13.48000 0.8977000 14.48000 0.7919000 -0.9932000     1.197000  
1 1 1 28 39 23 o 9.934000 0.8287000 8.340000 1.367000  11.53000 0.9372000 -3.188000      1.657000  
1 1 1 28 39 25 o 10.38000 0.7077000 10.47000 0.9446000 10.30000 1.054000  0.1613000      1.415000  
1 1 1 28 39 27 o 9.603000 0.7792000 10.60000 1.209000  8.605000 0.9830000 1.995000       1.558000  
1 1 1 28 39 29 o 6.259000 0.9257000 6.141000 1.245000  6.377000 1.371000  -0.2369000     1.851000  
1 1 1 28 39 31 o 6.481000 0.8970000 8.130000 0.9887000 4.832000 1.497000  3.298000       1.794000  
1 1 1 28 39 33 o 3.633000 1.011000  3.710000 1.462000  3.555000 1.397000  0.1554000      2.022000  
1 1 1 28 39 35 o 5.512000 1.297000  6.250000 1.810000  4.775000 1.857000  1.475000       2.593000  
1 1 1 28 40 0  o 11.97000 0.5334000 11.97000 0.5334000 11.97000 0.5334000 0.000000       0.000000  
1 1 1 28 40 2  o 14.46000 0.4565000 14.33000 0.4253000 14.60000 0.8080000 -0.2662000     0.9131000 
1 1 1 28 40 4  o 19.23000 0.4192000 18.57000 0.4063000 19.88000 0.7333000 -1.306000      0.8384000 
1 1 1 28 40 6  o 8.462000 0.7983000 10.21000 0.5381000 6.711000 1.503000  3.501000       1.597000  
1 1 1 28 40 8  o 9.999000 0.9816000 10.80000 0.5329000 9.194000 1.889000  1.610000       1.963000  
1 1 1 28 40 10 o 18.80000 0.5826000 19.06000 0.6023000 18.55000 0.9973000 0.5085000      1.165000  
1 1 1 28 40 12 o 8.946000 0.9970000 8.730000 0.7659000 9.161000 1.841000  -0.4310000     1.994000  
1 1 1 28 40 14 o 4.639000 1.092000  3.983000 1.281000  5.295000 1.768000  -1.312000      2.183000  
1 1 1 28 40 16 o 9.835000 0.5942000 9.965000 0.8409000 9.706000 0.8396000 0.2587000      1.188000  
1 1 1 28 40 18 o 5.446000 1.108000  5.941000 1.597000  4.950000 1.535000  0.9914000      2.215000  
1 1 1 28 40 20 o 6.429000 0.9197000 5.217000 1.428000  7.642000 1.160000  -2.425000      1.839000  
1 1 1 28 40 22 o 8.751000 0.7908000 8.106000 1.077000  9.396000 1.158000  -1.290000      1.582000  
1 1 1 28 40 24 o 7.596000 0.9608000 6.519000 1.601000  8.674000 1.063000  -2.155000      1.922000  
1 1 1 28 40 26 f 5.241000 1.022000  4.684000 1.589000  5.798000 1.284000  -1.115000      2.043000  
1 1 1 28 40 28 o 3.518000 0.9942000 4.301000 1.535000  2.734000 1.264000  1.567000       1.988000  
1 1 1 28 40 30 o 4.633000 1.015000  3.423000 1.353000  5.842000 1.514000  -2.419000      2.031000  
1 1 1 28 40 32 o 3.035000 0.9271000 3.459000 1.392000  2.611000 1.225000  0.8482000      1.854000  
1 1 1 28 40 34 o 4.169000 1.786000  ?        ?         4.169000 1.786000  ?              ?         
1 1 1 28 41 1  o 7.225000 1.243000  5.379000 1.783000  9.072000 1.732000  -3.693000      2.485000  
1 1 1 28 41 3  o 11.52000 0.8345000 11.85000 0.6231000 11.19000 1.548000  0.6605000      1.669000  
1 1 1 28 41 5  o 4.662000 1.200000  3.458000 1.231000  5.867000 2.059000  -2.409000      2.399000  
1 1 1 28 41 7  o 7.351000 0.9569000 5.993000 1.025000  8.709000 1.616000  -2.716000      1.914000  
1 1 1 28 41 9  o 5.769000 0.9800000 6.796000 0.9438000 4.743000 1.718000  2.053000       1.960000  
1 1 1 28 41 11 o 3.308000 0.9409000 3.638000 1.326000  2.977000 1.335000  0.6611000      1.882000  
1 1 1 28 41 13 o 4.809000 1.037000  4.463000 1.138000  5.155000 1.733000  -0.6920000     2.073000  
1 1 1 28 41 15 o 4.223000 1.069000  4.410000 1.345000  4.037000 1.663000  0.3727000      2.139000  
1 1 1 28 41 17 o 5.912000 0.8972000 4.454000 1.255000  7.370000 1.283000  -2.916000      1.794000  
1 1 1 28 41 19 o 3.627000 1.013000  3.902000 1.485000  3.352000 1.379000  0.5501000      2.026000  
1 1 1 28 41 21 o 3.822000 1.101000  3.601000 1.502000  4.042000 1.611000  -0.4409000     2.202000  
1 1 1 28 41 23 o 3.329000 1.000000  3.647000 1.505000  3.012000 1.317000  0.6348000      2.000000  
1 1 1 28 41 25 o 5.079000 0.9839000 6.019000 1.299000  4.139000 1.478000  1.881000       1.968000  
1 1 1 28 41 27 o 4.627000 1.055000  3.906000 1.465000  5.349000 1.517000  -1.443000      2.109000  
1 1 1 28 41 29 o 4.793000 0.8328000 7.061000 1.173000  2.526000 1.182000  4.535000       1.666000  
1 1 1 28 41 31 o 10.77000 0.8414000 11.16000 0.8237000 10.39000 1.467000  0.7727000      1.683000  
1 1 1 28 42 0  o 2.372000 0.9131000 2.372000 0.9131000 2.372000 0.9131000 0.000000       0.000000  
1 1 1 28 42 2  o 4.796000 1.011000  3.916000 1.332000  5.676000 1.521000  -1.759000      2.022000  
1 1 1 28 42 4  o 12.10000 0.5304000 12.74000 0.5684000 11.46000 0.8957000 1.277000       1.061000  
1 1 1 28 42 6  o 7.073000 0.9312000 8.246000 0.6041000 5.900000 1.762000  2.347000       1.862000  
1 1 1 28 42 8  o 6.856000 0.7921000 5.940000 0.8702000 7.772000 1.324000  -1.833000      1.584000  
1 1 1 28 42 10 o 10.35000 0.6799000 10.90000 0.8657000 9.797000 1.049000  1.099000       1.360000  
1 1 1 28 42 12 o 13.10000 0.6405000 13.34000 0.7386000 12.87000 1.047000  0.4693000      1.281000  
1 1 1 28 42 14 o 4.337000 1.084000  4.618000 1.241000  4.056000 1.779000  0.5622000      2.169000  
1 1 1 28 42 16 o 4.958000 1.165000  4.833000 1.207000  5.082000 1.992000  -0.2493000     2.329000  
1 1 1 28 42 18 o 6.145000 1.050000  7.413000 0.8915000 4.877000 1.901000  2.537000       2.100000  
1 1 1 28 42 20 o 8.628000 0.8504000 7.140000 1.215000  10.12000 1.190000  -2.976000      1.701000  
1 1 1 28 42 22 o 11.36000 0.6743000 10.62000 1.151000  12.11000 0.7022000 -1.490000      1.349000  
1 1 1 28 42 24 o 7.770000 0.7966000 6.880000 1.213000  8.659000 1.033000  -1.779000      1.593000  
1 1 1 28 42 26 o 8.407000 0.7379000 8.060000 0.9758000 8.755000 1.107000  -0.6953000     1.476000  
1 1 1 28 42 28 o 3.476000 1.001000  3.330000 1.390000  3.622000 1.440000  -0.2924000     2.001000  
1 1 1 28 42 30 o 4.349000 1.096000  5.248000 1.635000  3.449000 1.461000  1.799000       2.193000  
1 1 1 28 43 1  o 7.221000 0.9970000 7.448000 1.420000  6.994000 1.400000  0.4549000      1.994000  
1 1 1 28 43 3  o 6.975000 0.9633000 6.799000 1.451000  7.151000 1.268000  -0.3520000     1.927000  
1 1 1 28 43 5  o 4.765000 0.9294000 3.512000 1.145000  6.018000 1.464000  -2.507000      1.859000  
1 1 1 28 43 7  o 3.789000 0.9713000 4.091000 1.171000  3.486000 1.550000  0.6053000      1.943000  
1 1 1 28 43 9  o 3.793000 1.023000  3.783000 1.210000  3.803000 1.650000  -0.1974000E-01 2.046000  
1 1 1 28 43 11 o 8.686000 0.9222000 8.562000 0.7112000 8.810000 1.702000  -0.2485000     1.844000  
1 1 1 28 43 13 o 8.737000 1.089000  10.43000 0.6357000 7.046000 2.083000  3.381000       2.178000  
1 1 1 28 43 15 o 3.686000 1.044000  3.592000 1.284000  3.779000 1.647000  -0.1876000     2.088000  
1 1 1 28 43 17 o 3.310000 1.012000  3.223000 1.349000  3.398000 1.511000  -0.1745000     2.025000  
1 1 1 28 43 19 o 3.572000 1.001000  3.166000 1.240000  3.978000 1.571000  -0.8113000     2.002000  
1 1 1 28 43 21 o 3.942000 1.023000  3.648000 1.298000  4.236000 1.581000  -0.5887000     2.045000  
1 1 1 28 43 23 o 3.337000 0.9395000 3.639000 1.253000  3.035000 1.400000  0.6038000      1.879000  
1 1 1 28 43 25 o 8.616000 0.8402000 7.746000 1.122000  9.485000 1.251000  -1.738000      1.680000  
1 1 1 28 43 27 o 3.953000 1.016000  4.279000 1.460000  3.628000 1.414000  0.6510000      2.033000  
1 1 1 28 43 29 o 5.158000 1.436000  5.083000 1.878000  5.233000 2.173000  -0.1506000     2.872000  
1 1 1 28 44 0  o 3.882000 1.671000  3.882000 1.671000  3.882000 1.671000  0.000000       0.000000  
1 1 1 28 44 2  o 6.820000 1.228000  6.129000 1.966000  7.510000 1.473000  -1.381000      2.457000  
1 1 1 28 44 4  o 6.670000 1.106000  6.170000 1.526000  7.171000 1.601000  -1.001000      2.212000  
1 1 1 28 44 6  o 6.672000 1.035000  6.034000 0.7784000 7.311000 1.918000  -1.277000      2.070000  
1 1 1 28 44 8  o 3.327000 1.007000  2.969000 1.160000  3.685000 1.647000  -0.7155000     2.014000  
1 1 1 28 44 10 o 7.650000 0.9645000 8.303000 0.9641000 6.998000 1.671000  1.306000       1.929000  
1 1 1 28 44 12 o 5.722000 0.9345000 7.127000 1.013000  4.317000 1.571000  2.810000       1.869000  
1 1 1 28 44 14 o 4.819000 1.008000  5.243000 1.229000  4.396000 1.599000  0.8472000      2.017000  
1 1 1 28 44 16 o 3.926000 1.055000  3.457000 1.304000  4.394000 1.659000  -0.9378000     2.110000  
1 1 1 28 44 18 o 6.635000 0.9221000 7.411000 0.9271000 5.859000 1.594000  1.552000       1.844000  
1 1 1 28 44 20 o 4.605000 1.038000  5.019000 1.385000  4.191000 1.548000  0.8287000      2.077000  
1 1 1 28 44 22 o 5.934000 1.066000  5.738000 1.166000  6.131000 1.784000  -0.3926000     2.131000  
1 1 1 28 44 24 o 3.970000 1.074000  2.870000 1.214000  5.070000 1.771000  -2.200000      2.147000  
1 1 1 28 44 26 o 4.084000 1.041000  3.311000 1.322000  4.857000 1.609000  -1.545000      2.082000  
1 1 1 28 45 1  f 3.578000 1.063000  3.327000 1.480000  3.828000 1.526000  -0.5005000     2.126000  
1 1 1 28 45 3  o 5.597000 1.105000  6.881000 1.579000  4.312000 1.547000  2.569000       2.211000  
1 1 1 28 45 5  o 7.938000 0.9655000 9.505000 1.123000  6.372000 1.571000  3.133000       1.931000  
1 1 1 28 45 7  o 4.907000 1.066000  4.525000 1.238000  5.290000 1.737000  -0.7649000     2.133000  
1 1 1 28 45 9  o 10.05000 0.6871000 9.669000 0.7826000 10.43000 1.130000  -0.7607000     1.374000  
1 1 1 28 45 11 o 4.293000 1.154000  3.657000 1.310000  4.929000 1.901000  -1.272000      2.309000  
1 1 1 28 45 13 o 4.387000 1.019000  3.936000 1.293000  4.839000 1.574000  -0.9038000     2.037000  
1 1 1 28 45 15 o 5.831000 1.002000  5.954000 1.117000  5.707000 1.665000  0.2469000      2.005000  
1 1 1 28 45 17 o 4.721000 0.9583000 5.604000 1.153000  3.837000 1.531000  1.767000       1.917000  
1 1 1 28 45 19 o 5.121000 1.059000  4.657000 1.180000  5.584000 1.758000  -0.9267000     2.117000  
1 1 1 28 45 21 o 6.255000 0.9951000 5.260000 1.167000  7.250000 1.612000  -1.991000      1.990000  
1 1 1 28 45 23 o 4.772000 1.053000  3.622000 1.278000  5.921000 1.675000  -2.298000      2.107000  
1 1 1 28 45 25 o 9.266000 1.194000  9.613000 0.7578000 8.920000 2.265000  0.6935000      2.389000  
1 1 1 28 46 0  o 4.012000 1.579000  4.012000 1.579000  4.012000 1.579000  0.000000       0.000000  
1 1 1 28 46 2  o 4.381000 1.123000  4.150000 1.667000  4.613000 1.505000  -0.4635000     2.246000  
1 1 1 28 46 4  o 7.478000 1.012000  9.380000 1.074000  5.575000 1.715000  3.805000       2.024000  
1 1 1 28 46 6  o 4.629000 1.146000  4.433000 1.543000  4.824000 1.695000  -0.3910000     2.292000  
1 1 1 28 46 8  f 5.361000 1.155000  4.246000 1.318000  6.477000 1.896000  -2.231000      2.309000  
1 1 1 28 46 10 o 5.035000 1.174000  5.163000 1.511000  4.906000 1.797000  0.2570000      2.348000  
1 1 1 28 46 12 o 3.150000 0.9277000 3.261000 1.298000  3.039000 1.325000  0.2218000      1.855000  
1 1 1 28 46 14 o 4.301000 1.080000  4.095000 1.322000  4.507000 1.709000  -0.4114000     2.161000  
1 1 1 28 46 16 o 3.187000 0.9440000 3.005000 1.264000  3.369000 1.403000  -0.3633000     1.888000  
1 1 1 28 46 18 o 4.046000 1.019000  4.270000 1.244000  3.822000 1.615000  0.4474000      2.039000  
1 1 1 28 46 20 o 3.593000 1.065000  2.927000 1.209000  4.259000 1.754000  -1.331000      2.131000  
1 1 1 28 46 22 o 10.72000 0.8673000 10.06000 0.7662000 11.37000 1.556000  -1.301000      1.735000  
1 1 1 28 47 1  o 5.168000 1.062000  6.428000 1.436000  3.908000 1.565000  2.520000       2.123000  
1 1 1 28 47 3  o 5.147000 1.232000  4.965000 1.731000  5.329000 1.754000  -0.3639000     2.464000  
1 1 1 28 47 5  f 6.724000 1.344000  6.884000 1.621000  6.564000 2.145000  0.3202000      2.689000  
1 1 1 28 47 7  o 4.159000 1.152000  4.818000 1.760000  3.501000 1.487000  1.317000       2.304000  
1 1 1 28 47 9  o 3.599000 1.078000  3.697000 1.537000  3.501000 1.512000  0.1959000      2.156000  
1 1 1 28 47 11 o 7.246000 0.9258000 7.292000 1.153000  7.200000 1.449000  0.9233000E-01  1.852000  
1 1 1 28 47 13 o 4.361000 1.027000  3.478000 1.210000  5.244000 1.661000  -1.766000      2.055000  
1 1 1 28 47 15 o 3.797000 0.9586000 4.327000 1.281000  3.266000 1.426000  1.061000       1.917000  
1 1 1 28 47 17 o 3.599000 1.021000  3.074000 1.256000  4.125000 1.609000  -1.052000      2.042000  
1 1 1 28 47 19 o 2.927000 0.9346000 2.835000 1.247000  3.020000 1.392000  -0.1846000     1.869000  
1 1 1 28 47 21 o 5.068000 2.042000  5.068000 2.042000  ?        ?         ?              ?         
1 1 1 28 48 0  o 3.843000 1.544000  3.843000 1.544000  3.843000 1.544000  0.000000       0.000000  
1 1 1 28 48 2  o 6.644000 1.291000  7.327000 1.506000  5.960000 2.096000  1.367000       2.581000  
1 1 1 28 48 4  o 5.298000 1.268000  5.245000 1.861000  5.350000 1.722000  -0.1054000     2.535000  
1 1 1 28 48 6  o 6.891000 1.065000  6.611000 1.633000  7.171000 1.366000  -0.5598000     2.129000  
1 1 1 28 48 8  o 7.945000 1.016000  8.931000 1.218000  6.959000 1.627000  1.971000       2.032000  
1 1 1 28 48 10 o 7.802000 0.8967000 7.574000 1.311000  8.031000 1.224000  -0.4567000     1.793000  
1 1 1 28 48 12 o 5.771000 1.202000  6.972000 1.600000  4.571000 1.795000  2.401000       2.404000  
1 1 1 28 48 14 o 4.815000 0.9581000 5.574000 1.140000  4.056000 1.541000  1.518000       1.916000  
1 1 1 28 48 16 o 6.022000 1.028000  5.125000 1.182000  6.920000 1.681000  -1.795000      2.055000  
1 1 1 28 49 1  o 3.609000 1.105000  3.633000 1.529000  3.586000 1.596000  0.4716000E-01  2.210000  
1 1 1 28 49 3  o 4.672000 1.210000  5.234000 1.782000  4.109000 1.635000  1.125000       2.419000  
1 1 1 28 49 5  o 4.716000 1.175000  5.010000 1.728000  4.422000 1.594000  0.5883000      2.351000  
1 1 1 28 49 7  o 4.907000 1.138000  5.842000 1.542000  3.973000 1.673000  1.869000       2.276000  
1 1 1 28 49 9  o 5.567000 1.115000  4.483000 1.654000  6.651000 1.494000  -2.168000      2.229000  
1 1 1 28 49 11 o 3.976000 1.158000  4.262000 1.633000  3.690000 1.641000  0.5727000      2.315000  
1 1 1 28 49 13 o 3.514000 1.053000  3.835000 1.560000  3.193000 1.416000  0.6422000      2.107000  
1 1 1 28 50 0  f 4.312000 1.689000  4.312000 1.689000  4.312000 1.689000  0.000000       0.000000  
1 1 1 28 50 2  o 4.604000 1.225000  4.745000 1.614000  4.464000 1.843000  0.2818000      2.450000  
1 1 1 28 50 4  o 3.965000 1.057000  3.003000 1.363000  4.927000 1.615000  -1.923000      2.113000  
1 1 1 28 50 6  o 4.053000 1.167000  4.427000 1.755000  3.679000 1.539000  0.7483000      2.334000  
1 1 1 28 50 8  o 8.866000 1.110000  7.496000 1.904000  10.24000 1.141000  -2.740000      2.219000  
1 1 1 29 0  1  o 19.55000 0.4195000 19.55000 0.4195000 19.55000 0.4195000 0.000000       0.000000  
1 1 1 29 0  3  o 19.20000 0.4087000 19.20000 0.4087000 19.20000 0.4087000 0.000000       0.000000  
1 1 1 29 0  5  o 20.49000 0.4159000 20.49000 0.4159000 20.49000 0.4159000 0.000000       0.000000  
1 1 1 29 0  7  f 20.53000 0.4168000 20.53000 0.4168000 20.53000 0.4168000 0.000000       0.000000  
1 1 1 29 0  9  o 74.88000 0.7580000 74.88000 0.7580000 74.88000 0.7580000 0.000000       0.000000  
1 1 1 29 0  11 o 70.82000 0.7232000 70.82000 0.7232000 70.82000 0.7232000 0.000000       0.000000  
1 1 1 29 0  13 o 72.19000 0.8494000 72.19000 0.8494000 72.19000 0.8494000 0.000000       0.000000  
1 1 1 29 0  15 o 34.19000 0.4461000 34.19000 0.4461000 34.19000 0.4461000 0.000000       0.000000  
1 1 1 29 0  17 o 17.68000 0.4811000 17.68000 0.4811000 17.68000 0.4811000 0.000000       0.000000  
1 1 1 29 0  19 o 35.41000 0.5381000 35.41000 0.5381000 35.41000 0.5381000 0.000000       0.000000  
1 1 1 29 0  21 o 30.59000 0.5271000 30.59000 0.5271000 30.59000 0.5271000 0.000000       0.000000  
1 1 1 29 0  23 o 8.247000 0.9094000 8.247000 0.9094000 8.247000 0.9094000 0.000000       0.000000  
1 1 1 29 0  25 o 23.56000 0.4508000 23.56000 0.4508000 23.56000 0.4508000 0.000000       0.000000  
1 1 1 29 0  27 o 9.695000 0.7339000 9.695000 0.7339000 9.695000 0.7339000 0.000000       0.000000  
1 1 1 29 0  29 o 10.35000 0.6674000 10.35000 0.6674000 10.35000 0.6674000 0.000000       0.000000  
1 1 1 29 0  31 o 4.236000 1.568000  4.236000 1.568000  4.236000 1.568000  0.000000       0.000000  
1 1 1 29 0  33 o 14.12000 0.5407000 14.12000 0.5407000 14.12000 0.5407000 0.000000       0.000000  
1 1 1 29 0  35 o 2.893000 1.219000  2.893000 1.219000  2.893000 1.219000  0.000000       0.000000  
1 1 1 29 0  37 o 7.730000 1.373000  7.730000 1.373000  7.730000 1.373000  0.000000       0.000000  
1 1 1 29 0  39 o 12.71000 0.6946000 12.71000 0.6946000 12.71000 0.6946000 0.000000       0.000000  
1 1 1 29 0  41 o 2.682000 1.199000  2.682000 1.199000  2.682000 1.199000  0.000000       0.000000  
1 1 1 29 0  43 o 4.000000 1.393000  4.000000 1.393000  4.000000 1.393000  0.000000       0.000000  
1 1 1 29 0  45 o 3.646000 1.486000  3.646000 1.486000  3.646000 1.486000  0.000000       0.000000  
1 1 1 29 0  47 o 7.252000 1.244000  7.252000 1.244000  7.252000 1.244000  0.000000       0.000000  
1 1 1 29 0  49 f 7.941000 1.180000  7.941000 1.180000  7.941000 1.180000  0.000000       0.000000  
1 1 1 29 0  51 o 4.492000 1.576000  4.492000 1.576000  4.492000 1.576000  0.000000       0.000000  
1 1 1 29 0  53 o 8.614000 0.8474000 8.614000 0.8474000 8.614000 0.8474000 0.000000       0.000000  
1 1 1 29 1  0  o 3.845000 1.304000  3.845000 1.304000  3.845000 1.304000  0.000000       0.000000  
1 1 1 29 1  2  o 16.03000 0.3232000 16.30000 0.4495000 15.77000 0.4644000 0.5301000      0.6464000 
1 1 1 29 1  4  o 28.29000 0.2922000 28.45000 0.4097000 28.14000 0.4168000 0.3143000      0.5845000 
1 1 1 29 1  6  o 23.59000 0.2871000 23.56000 0.4029000 23.63000 0.4092000 -0.7535000E-01 0.5742000 
1 1 1 29 1  8  o 25.70000 0.3004000 25.64000 0.4251000 25.76000 0.4247000 -0.1128000     0.6009000 
1 1 1 29 1  10 o 27.30000 0.2992000 27.14000 0.4213000 27.46000 0.4248000 -0.3223000     0.5983000 
1 1 1 29 1  12 o 9.062000 0.5753000 8.871000 0.9043000 9.253000 0.7114000 -0.3823000     1.151000  
1 1 1 29 1  14 o 25.52000 0.3238000 25.34000 0.4197000 25.71000 0.4933000 -0.3665000     0.6477000 
1 1 1 29 1  16 o 29.56000 0.3087000 29.46000 0.4320000 29.66000 0.4410000 -0.2002000     0.6173000 
1 1 1 29 1  18 o 26.55000 0.3320000 26.72000 0.4399000 26.38000 0.4973000 0.3414000      0.6640000 
1 1 1 29 1  20 o 16.68000 0.3696000 16.75000 0.5104000 16.62000 0.5347000 0.1308000      0.7392000 
1 1 1 29 1  22 o 19.34000 0.3370000 19.62000 0.4771000 19.07000 0.4761000 0.5518000      0.6740000 
1 1 1 29 1  24 o 36.33000 0.3679000 36.76000 0.4826000 35.91000 0.5554000 0.8453000      0.7358000 
1 1 1 29 1  26 o 16.20000 0.3585000 16.29000 0.4992000 16.12000 0.5148000 0.1779000      0.7171000 
1 1 1 29 1  28 o 15.83000 0.3597000 15.56000 0.5112000 16.10000 0.5062000 -0.5477000     0.7194000 
1 1 1 29 1  30 o 7.425000 0.7124000 7.313000 0.9160000 7.538000 1.091000  -0.2248000     1.425000  
1 1 1 29 1  32 o 10.51000 0.4992000 10.33000 0.6905000 10.69000 0.7211000 -0.3661000     0.9984000 
1 1 1 29 1  34 o 15.96000 0.3808000 15.16000 0.5535000 16.75000 0.5232000 -1.591000      0.7616000 
1 1 1 29 1  36 o 3.850000 1.033000  4.061000 1.481000  3.639000 1.441000  0.4221000      2.066000  
1 1 1 29 1  38 o 4.785000 0.9824000 4.712000 1.497000  4.858000 1.273000  -0.1460000     1.965000  
1 1 1 29 1  40 o 3.284000 0.9638000 3.481000 1.426000  3.087000 1.297000  0.3937000      1.928000  
1 1 1 29 1  42 o 3.633000 0.9732000 3.756000 1.383000  3.511000 1.369000  0.2448000      1.946000  
1 1 1 29 1  44 o 3.181000 0.9241000 3.069000 1.330000  3.293000 1.283000  -0.2235000     1.848000  
1 1 1 29 1  46 o 7.757000 1.278000  8.796000 0.9143000 6.718000 2.387000  2.079000       2.556000  
1 1 1 29 1  48 o 8.440000 0.7190000 7.331000 1.046000  9.550000 0.9866000 -2.220000      1.438000  
1 1 1 29 1  50 o 9.938000 0.5218000 11.14000 0.6816000 8.739000 0.7903000 2.397000       1.044000  
1 1 1 29 1  52 o 9.914000 0.6171000 9.459000 0.9566000 10.37000 0.7798000 -0.9115000     1.234000  
1 1 1 29 2  1  o 25.10000 0.2897000 25.12000 0.4111000 25.08000 0.4082000 0.4568000E-01  0.5793000 
1 1 1 29 2  3  o 4.462000 0.8252000 5.287000 1.062000  3.636000 1.263000  1.651000       1.650000  
1 1 1 29 2  5  o 26.53000 0.2897000 26.74000 0.4157000 26.33000 0.4035000 0.4134000      0.5793000 
1 1 1 29 2  7  o 35.85000 0.3166000 36.05000 0.4492000 35.65000 0.4462000 0.3985000      0.6332000 
1 1 1 29 2  9  o 47.15000 0.3718000 46.82000 0.5219000 47.47000 0.5298000 -0.6452000     0.7437000 
1 1 1 29 2  11 o 80.68000 0.6207000 81.29000 0.9438000 80.07000 0.8063000 1.222000       1.241000  
1 1 1 29 2  13 o 52.92000 0.4392000 52.99000 0.6640000 52.86000 0.5751000 0.1288000      0.8785000 
1 1 1 29 2  15 o 67.83000 0.5345000 68.07000 0.7009000 67.60000 0.8071000 0.4728000      1.069000  
1 1 1 29 2  17 o 24.73000 0.3325000 24.93000 0.4361000 24.53000 0.5020000 0.3940000      0.6650000 
1 1 1 29 2  19 o 10.06000 0.5365000 9.946000 0.7903000 10.18000 0.7257000 -0.2342000     1.073000  
1 1 1 29 2  21 o 26.90000 0.3200000 26.61000 0.4540000 27.18000 0.4510000 -0.5651000     0.6399000 
1 1 1 29 2  23 o 45.78000 0.3774000 45.90000 0.5329000 45.66000 0.5345000 0.2375000      0.7548000 
1 1 1 29 2  25 f 20.18000 0.3349000 20.26000 0.4746000 20.09000 0.4726000 0.1717000      0.6698000 
1 1 1 29 2  27 o 11.51000 0.4419000 11.52000 0.6363000 11.50000 0.6135000 0.2280000E-01  0.8838000 
1 1 1 29 2  29 o 30.95000 0.3474000 31.27000 0.4530000 30.63000 0.5268000 0.6391000      0.6948000 
1 1 1 29 2  31 o 20.14000 0.3687000 20.31000 0.5342000 19.98000 0.5082000 0.3301000      0.7374000 
1 1 1 29 2  33 o 10.97000 0.4872000 9.963000 0.7829000 11.99000 0.5802000 -2.024000      0.9745000 
1 1 1 29 2  35 o 15.03000 0.4481000 14.47000 0.6199000 15.59000 0.6472000 -1.118000      0.8962000 
1 1 1 29 2  37 o 15.18000 0.3895000 15.08000 0.5595000 15.29000 0.5420000 -0.2142000     0.7790000 
1 1 1 29 2  39 o 14.94000 0.4307000 14.22000 0.6793000 15.66000 0.5296000 -1.438000      0.8614000 
1 1 1 29 2  41 o 3.682000 0.9380000 3.812000 1.366000  3.551000 1.286000  0.2610000      1.876000  
1 1 1 29 2  43 o 5.947000 0.8933000 5.728000 1.419000  6.167000 1.086000  -0.4390000     1.787000  
1 1 1 29 2  45 f 9.750000 0.6514000 10.15000 0.9443000 9.349000 0.8977000 0.8014000      1.303000  
1 1 1 29 2  47 o 14.79000 0.5825000 15.68000 0.6782000 13.90000 0.9473000 1.776000       1.165000  
1 1 1 29 2  49 o 12.43000 0.4766000 12.90000 0.6549000 11.96000 0.6926000 0.9363000      0.9532000 
1 1 1 29 2  51 o 4.408000 0.9815000 5.139000 1.366000  3.678000 1.410000  1.461000       1.963000  
1 1 1 29 2  53 o 5.694000 0.9891000 4.587000 1.612000  6.800000 1.147000  -2.213000      1.978000  
1 1 1 29 3  0  o 26.45000 0.4229000 26.45000 0.4229000 26.45000 0.4229000 0.000000       0.000000  
1 1 1 29 3  2  o 10.37000 0.4255000 10.67000 0.6004000 10.07000 0.6030000 0.5964000      0.8510000 
1 1 1 29 3  4  o 34.03000 0.3095000 33.84000 0.4373000 34.22000 0.4380000 -0.3778000     0.6190000 
1 1 1 29 3  6  o 19.98000 0.2969000 19.59000 0.4229000 20.36000 0.4168000 -0.7767000     0.5938000 
1 1 1 29 3  8  o 14.28000 0.3521000 13.97000 0.5107000 14.59000 0.4849000 -0.6178000     0.7043000 
1 1 1 29 3  10 o 16.38000 0.3578000 16.34000 0.5312000 16.42000 0.4796000 -0.8202000E-01 0.7157000 
1 1 1 29 3  12 o 17.51000 0.3246000 17.31000 0.4498000 17.71000 0.4681000 -0.3986000     0.6492000 
1 1 1 29 3  14 o 12.21000 0.4016000 12.21000 0.5469000 12.22000 0.5883000 -0.1513000E-01 0.8032000 
1 1 1 29 3  16 o 17.82000 0.3940000 17.85000 0.4645000 17.79000 0.6365000 0.6515000E-01  0.7879000 
1 1 1 29 3  18 o 42.98000 0.3573000 42.63000 0.5025000 43.32000 0.5081000 -0.6903000     0.7146000 
1 1 1 29 3  20 o 21.84000 0.3952000 22.21000 0.6391000 21.47000 0.4651000 0.7373000      0.7904000 
1 1 1 29 3  22 o 27.02000 0.3810000 27.40000 0.5305000 26.64000 0.5469000 0.7646000      0.7619000 
1 1 1 29 3  24 o 16.98000 0.3597000 16.55000 0.5157000 17.42000 0.5016000 -0.8635000     0.7194000 
1 1 1 29 3  26 o 8.844000 0.5199000 9.721000 0.7022000 7.967000 0.7668000 1.754000       1.040000  
1 1 1 29 3  28 o 25.22000 0.3792000 25.00000 0.4548000 25.44000 0.6070000 -0.4420000     0.7585000 
1 1 1 29 3  30 o 15.73000 0.3806000 16.39000 0.5476000 15.08000 0.5286000 1.306000       0.7612000 
1 1 1 29 3  32 o 16.48000 0.3886000 16.84000 0.5558000 16.11000 0.5432000 0.7376000      0.7771000 
1 1 1 29 3  34 o 7.426000 0.7476000 7.473000 0.7978000 7.379000 1.265000  0.9434000E-01  1.495000  
1 1 1 29 3  36 o 14.02000 0.4317000 13.63000 0.5675000 14.42000 0.6507000 -0.7849000     0.8634000 
1 1 1 29 3  38 o 12.48000 0.4322000 11.98000 0.6389000 12.98000 0.5822000 -1.007000      0.8644000 
1 1 1 29 3  40 o 10.50000 0.5528000 10.60000 0.8582000 10.40000 0.6970000 0.1934000      1.106000  
1 1 1 29 3  42 o 3.430000 0.9284000 3.056000 1.288000  3.805000 1.338000  -0.7489000     1.857000  
1 1 1 29 3  44 o 4.188000 1.016000  4.422000 1.525000  3.954000 1.341000  0.4680000      2.031000  
1 1 1 29 3  46 o 3.465000 1.034000  3.423000 1.404000  3.507000 1.517000  -0.8334000E-01 2.067000  
1 1 1 29 3  48 o 6.594000 0.8893000 6.814000 1.174000  6.375000 1.336000  0.4393000      1.779000  
1 1 1 29 3  50 o 5.099000 0.9588000 4.814000 1.349000  5.384000 1.362000  -0.5702000     1.918000  
1 1 1 29 3  52 o 6.533000 0.8283000 5.992000 1.248000  7.073000 1.089000  -1.082000      1.657000  
1 1 1 29 4  1  o 45.34000 0.3603000 45.15000 0.5089000 45.54000 0.5102000 -0.3894000     0.7206000 
1 1 1 29 4  3  o 16.36000 0.3335000 16.51000 0.4599000 16.22000 0.4830000 0.2892000      0.6669000 
1 1 1 29 4  5  o 51.31000 0.4258000 51.34000 0.5570000 51.28000 0.6440000 0.5878000E-01  0.8515000 
1 1 1 29 4  7  o 13.82000 0.3784000 13.86000 0.5039000 13.78000 0.5646000 0.7752000E-01  0.7567000 
1 1 1 29 4  9  o 19.74000 0.3497000 19.73000 0.4929000 19.75000 0.4962000 -0.2537000E-01 0.6994000 
1 1 1 29 4  11 f 24.88000 0.3175000 24.57000 0.4106000 25.19000 0.4844000 -0.6130000     0.6350000 
1 1 1 29 4  13 f 30.13000 0.3350000 29.95000 0.4286000 30.31000 0.5148000 -0.3651000     0.6699000 
1 1 1 29 4  15 o 15.56000 0.4442000 16.02000 0.4787000 15.09000 0.7485000 0.9280000      0.8885000 
1 1 1 29 4  17 o 35.49000 0.4012000 35.84000 0.4601000 35.15000 0.6574000 0.6846000      0.8024000 
1 1 1 29 4  19 o 35.99000 0.3332000 35.71000 0.4679000 36.27000 0.4746000 -0.5580000     0.6664000 
1 1 1 29 4  21 o 9.174000 0.6070000 9.590000 0.8919000 8.758000 0.8235000 0.8322000      1.214000  
1 1 1 29 4  23 o 12.96000 0.4240000 13.18000 0.5701000 12.74000 0.6278000 0.4354000      0.8480000 
1 1 1 29 4  25 o 8.797000 0.6130000 8.473000 0.8594000 9.121000 0.8744000 -0.6477000     1.226000  
1 1 1 29 4  27 o 13.06000 0.4362000 13.50000 0.6462000 12.62000 0.5860000 0.8770000      0.8723000 
1 1 1 29 4  29 o 27.90000 0.3153000 27.73000 0.4517000 28.07000 0.4401000 -0.3333000     0.6307000 
1 1 1 29 4  31 o 9.074000 0.5587000 9.449000 0.8458000 8.699000 0.7301000 0.7499000      1.117000  
1 1 1 29 4  33 o 8.695000 0.7313000 9.152000 0.6498000 8.239000 1.310000  0.9123000      1.463000  
1 1 1 29 4  35 o 4.757000 0.9778000 3.921000 1.357000  5.592000 1.408000  -1.672000      1.956000  
1 1 1 29 4  37 f 9.855000 0.6091000 10.13000 0.8576000 9.576000 0.8652000 0.5588000      1.218000  
1 1 1 29 4  39 o 16.10000 0.5069000 15.83000 0.8663000 16.36000 0.5266000 -0.5310000     1.014000  
1 1 1 29 4  41 o 7.972000 0.6913000 7.953000 1.128000  7.992000 0.7990000 -0.3859000E-01 1.383000  
1 1 1 29 4  43 o 4.394000 0.8720000 5.738000 1.216000  3.050000 1.250000  2.688000       1.744000  
1 1 1 29 4  45 o 7.387000 0.9337000 7.760000 1.015000  7.013000 1.567000  0.7470000      1.867000  
1 1 1 29 4  47 o 5.362000 0.9708000 5.986000 1.385000  4.738000 1.360000  1.247000       1.942000  
1 1 1 29 4  49 o 3.522000 0.9321000 4.162000 1.363000  2.882000 1.272000  1.279000       1.864000  
1 1 1 29 4  51 o 8.198000 0.7792000 7.889000 1.148000  8.507000 1.054000  -0.6182000     1.558000  
1 1 1 29 4  53 o 2.962000 0.9106000 2.973000 1.302000  2.952000 1.273000  0.2072000E-01  1.821000  
1 1 1 29 5  0  o 36.65000 0.4545000 36.65000 0.4545000 36.65000 0.4545000 0.000000       0.000000  
1 1 1 29 5  2  o 39.74000 0.3602000 39.78000 0.4739000 39.70000 0.5426000 0.7801000E-01  0.7204000 
1 1 1 29 5  4  o 37.53000 0.3527000 37.47000 0.4608000 37.58000 0.5341000 -0.1085000     0.7055000 
1 1 1 29 5  6  o 23.54000 0.3147000 23.66000 0.4059000 23.42000 0.4809000 0.2391000      0.6293000 
1 1 1 29 5  8  o 53.67000 0.4416000 54.23000 0.6732000 53.10000 0.5717000 1.127000       0.8832000 
1 1 1 29 5  10 o 50.30000 0.3900000 50.20000 0.5525000 50.40000 0.5506000 -0.1970000     0.7801000 
1 1 1 29 5  12 o 25.13000 0.3059000 25.07000 0.4310000 25.20000 0.4341000 -0.1330000     0.6117000 
1 1 1 29 5  14 o 7.681000 0.6739000 8.554000 0.6854000 6.808000 1.160000  1.746000       1.348000  
1 1 1 29 5  16 o 10.34000 0.5143000 11.57000 0.5971000 9.105000 0.8376000 2.464000       1.029000  
1 1 1 29 5  18 o 10.79000 0.5238000 10.76000 0.6400000 10.83000 0.8293000 -0.6887000E-01 1.048000  
1 1 1 29 5  20 o 34.68000 0.3526000 35.09000 0.4627000 34.26000 0.5321000 0.8273000      0.7051000 
1 1 1 29 5  22 o 10.38000 0.4860000 10.65000 0.6582000 10.10000 0.7153000 0.5482000      0.9720000 
1 1 1 29 5  24 o 25.49000 0.3983000 25.00000 0.5113000 25.97000 0.6109000 -0.9748000     0.7966000 
1 1 1 29 5  26 o 18.99000 0.3389000 19.68000 0.4741000 18.30000 0.4843000 1.377000       0.6777000 
1 1 1 29 5  28 o 38.25000 0.3410000 38.47000 0.4870000 38.03000 0.4774000 0.4382000      0.6820000 
1 1 1 29 5  30 o 14.26000 0.4315000 14.10000 0.6843000 14.43000 0.5259000 -0.3262000     0.8630000 
1 1 1 29 5  32 o 11.07000 0.4552000 12.03000 0.5260000 10.11000 0.7431000 1.918000       0.9104000 
1 1 1 29 5  34 o 11.88000 0.4507000 12.34000 0.5291000 11.42000 0.7298000 0.9201000      0.9014000 
1 1 1 29 5  36 o 9.569000 0.5736000 10.15000 0.6983000 8.986000 0.9103000 1.167000       1.147000  
1 1 1 29 5  38 o 8.649000 0.6992000 7.356000 1.214000  9.941000 0.6943000 -2.585000      1.398000  
1 1 1 29 5  40 o 6.361000 0.8028000 6.339000 1.181000  6.383000 1.087000  -0.4447000E-01 1.606000  
1 1 1 29 5  42 o 8.629000 0.6583000 7.845000 1.096000  9.413000 0.7293000 -1.568000      1.317000  
1 1 1 29 5  44 o 9.249000 0.6670000 9.962000 0.7748000 8.536000 1.086000  1.427000       1.334000  
1 1 1 29 5  46 o 6.850000 0.8092000 7.788000 0.9272000 5.912000 1.326000  1.876000       1.618000  
1 1 1 29 5  48 o 2.813000 0.8722000 2.804000 1.211000  2.822000 1.256000  -0.1783000E-01 1.744000  
1 1 1 29 5  50 o 2.513000 0.8236000 2.250000 1.074000  2.777000 1.249000  -0.5276000     1.647000  
1 1 1 29 5  52 o 3.642000 0.8663000 2.224000 1.067000  5.059000 1.365000  -2.835000      1.733000  
1 1 1 29 6  1  o 2.892000 0.8757000 2.996000 1.235000  2.788000 1.241000  0.2078000      1.751000  
1 1 1 29 6  3  o 37.06000 0.3490000 37.21000 0.4558000 36.91000 0.5285000 0.2996000      0.6979000 
1 1 1 29 6  5  o 40.77000 0.3662000 41.03000 0.5541000 40.51000 0.4788000 0.5150000      0.7323000 
1 1 1 29 6  7  o 19.13000 0.3239000 19.20000 0.4853000 19.06000 0.4292000 0.1386000      0.6479000 
1 1 1 29 6  9  o 11.87000 0.4050000 11.89000 0.5514000 11.85000 0.5932000 0.3289000E-01  0.8099000 
1 1 1 29 6  11 o 58.20000 0.4357000 58.20000 0.6156000 58.20000 0.6166000 -0.1911000E-02 0.8713000 
1 1 1 29 6  13 o 53.39000 0.4385000 53.36000 0.5783000 53.42000 0.6593000 -0.6810000E-01 0.8770000 
1 1 1 29 6  15 o 20.24000 0.3154000 20.38000 0.4459000 20.09000 0.4461000 0.2901000      0.6308000 
1 1 1 29 6  17 o 5.114000 0.8823000 6.194000 1.039000  4.034000 1.426000  2.160000       1.765000  
1 1 1 29 6  19 o 21.19000 0.3209000 21.68000 0.4366000 20.71000 0.4703000 0.9660000      0.6418000 
1 1 1 29 6  21 o 16.37000 0.6064000 16.31000 0.6799000 16.42000 1.004000  -0.1061000     1.213000  
1 1 1 29 6  23 o 41.59000 0.3865000 42.30000 0.5100000 40.88000 0.5808000 1.421000       0.7729000 
1 1 1 29 6  25 o 17.30000 0.3477000 17.01000 0.4877000 17.59000 0.4956000 -0.5890000     0.6953000 
1 1 1 29 6  27 o 13.56000 0.3845000 13.85000 0.5354000 13.27000 0.5520000 0.5774000      0.7690000 
1 1 1 29 6  29 o 5.204000 0.9133000 6.832000 1.274000  3.575000 1.309000  3.257000       1.827000  
1 1 1 29 6  31 o 10.18000 0.4583000 9.810000 0.6689000 10.56000 0.6268000 -0.7470000     0.9167000 
1 1 1 29 6  33 f 15.81000 0.4828000 15.48000 0.4533000 16.14000 0.8525000 -0.6573000     0.9655000 
1 1 1 29 6  35 o 15.27000 0.3822000 14.58000 0.4881000 15.97000 0.5883000 -1.381000      0.7644000 
1 1 1 29 6  37 o 13.95000 0.4159000 14.11000 0.5050000 13.79000 0.6610000 0.3278000      0.8318000 
1 1 1 29 6  39 o 11.17000 0.5104000 11.64000 0.7658000 10.70000 0.6748000 0.9329000      1.021000  
1 1 1 29 6  41 o 4.453000 0.9368000 4.857000 1.365000  4.049000 1.283000  0.8079000      1.874000  
1 1 1 29 6  43 o 6.511000 0.9640000 6.243000 1.438000  6.778000 1.285000  -0.5351000     1.928000  
1 1 1 29 6  45 o 7.626000 0.7991000 7.729000 0.9507000 7.524000 1.285000  0.2050000      1.598000  
1 1 1 29 6  47 o 7.416000 0.7336000 6.520000 1.168000  8.311000 0.8880000 -1.791000      1.467000  
1 1 1 29 6  49 o 7.943000 0.6571000 7.299000 0.9907000 8.588000 0.8635000 -1.289000      1.314000  
1 1 1 29 6  51 o 4.026000 1.006000  4.518000 1.467000  3.533000 1.376000  0.9848000      2.011000  
1 1 1 29 6  53 o 5.692000 1.003000  5.202000 1.380000  6.182000 1.456000  -0.9797000     2.006000  
1 1 1 29 7  0  o 5.180000 1.344000  5.180000 1.344000  5.180000 1.344000  0.000000       0.000000  
1 1 1 29 7  2  o 32.58000 0.3297000 32.65000 0.4976000 32.52000 0.4326000 0.1287000      0.6594000 
1 1 1 29 7  4  o 26.71000 0.3174000 26.80000 0.4744000 26.62000 0.4217000 0.1804000      0.6347000 
1 1 1 29 7  6  o 14.79000 0.3533000 14.99000 0.5294000 14.58000 0.4678000 0.4124000      0.7065000 
1 1 1 29 7  8  o 67.18000 0.4891000 67.66000 0.6980000 66.69000 0.6854000 0.9736000      0.9783000 
1 1 1 29 7  10 o 40.70000 0.3430000 41.14000 0.4894000 40.27000 0.4808000 0.8732000      0.6860000 
1 1 1 29 7  12 o 32.38000 0.3329000 32.83000 0.4403000 31.94000 0.4993000 0.8903000      0.6657000 
1 1 1 29 7  14 o 28.44000 0.3058000 28.61000 0.4327000 28.26000 0.4324000 0.3450000      0.6117000 
1 1 1 29 7  16 o 19.12000 0.3255000 19.13000 0.4488000 19.12000 0.4716000 0.1368000E-01  0.6510000 
1 1 1 29 7  18 o 15.42000 0.5586000 14.42000 0.5961000 16.42000 0.9448000 -2.007000      1.117000  
1 1 1 29 7  20 o 11.24000 0.5142000 11.65000 0.6252000 10.83000 0.8166000 0.8233000      1.028000  
1 1 1 29 7  22 o 17.22000 0.3873000 16.60000 0.5903000 17.85000 0.5015000 -1.246000      0.7745000 
1 1 1 29 7  24 o 6.640000 0.8483000 7.784000 0.9268000 5.496000 1.421000  2.288000       1.697000  
1 1 1 29 7  26 o 5.433000 0.9146000 5.428000 1.379000  5.437000 1.202000  -0.9177000E-02 1.829000  
1 1 1 29 7  28 o 20.51000 0.3376000 21.10000 0.5161000 19.92000 0.4355000 1.175000       0.6753000 
1 1 1 29 7  30 o 22.69000 0.3037000 22.91000 0.4334000 22.47000 0.4257000 0.4453000      0.6075000 
1 1 1 29 7  32 o 13.38000 0.4419000 13.62000 0.4932000 13.14000 0.7334000 0.4807000      0.8838000 
1 1 1 29 7  34 o 18.19000 0.4028000 18.65000 0.5861000 17.72000 0.5528000 0.9333000      0.8056000 
1 1 1 29 7  36 o 12.08000 0.4635000 11.67000 0.6042000 12.49000 0.7031000 -0.8227000     0.9271000 
1 1 1 29 7  38 o 18.16000 0.3552000 18.09000 0.4414000 18.23000 0.5566000 -0.1375000     0.7104000 
1 1 1 29 7  40 o 3.316000 0.9609000 3.416000 1.425000  3.215000 1.290000  0.2009000      1.922000  
1 1 1 29 7  42 o 6.768000 0.8341000 7.381000 0.9819000 6.154000 1.349000  1.228000       1.668000  
1 1 1 29 7  44 o 12.21000 0.5185000 12.06000 0.8180000 12.35000 0.6376000 -0.2865000     1.037000  
1 1 1 29 7  46 o 4.103000 0.9917000 4.285000 1.383000  3.922000 1.421000  0.3635000      1.983000  
1 1 1 29 7  48 o 3.190000 0.8925000 3.749000 1.314000  2.630000 1.208000  1.119000       1.785000  
1 1 1 29 7  50 o 6.028000 0.9046000 5.640000 1.316000  6.416000 1.242000  -0.7763000     1.809000  
1 1 1 29 7  52 o 9.145000 0.6099000 8.483000 0.9048000 9.806000 0.8181000 -1.322000      1.220000  
1 1 1 29 8  1  o 26.48000 0.3635000 26.86000 0.5915000 26.10000 0.4226000 0.7569000      0.7269000 
1 1 1 29 8  3  o 23.25000 0.3538000 23.22000 0.5732000 23.27000 0.4149000 -0.5285000E-01 0.7076000 
1 1 1 29 8  5  o 9.189000 0.4694000 9.703000 0.6258000 8.676000 0.6997000 1.027000       0.9387000 
1 1 1 29 8  7  o 8.007000 0.6353000 8.592000 0.9533000 7.422000 0.8399000 1.171000       1.271000  
1 1 1 29 8  9  o 19.47000 0.3558000 18.94000 0.5572000 20.01000 0.4428000 -1.069000      0.7117000 
1 1 1 29 8  11 o 27.63000 0.3513000 27.19000 0.5084000 28.07000 0.4849000 -0.8749000     0.7025000 
1 1 1 29 8  13 o 9.668000 0.5765000 9.698000 0.9145000 9.639000 0.7021000 0.5900000E-01  1.153000  
1 1 1 29 8  15 o 27.40000 0.4283000 26.87000 0.6287000 27.93000 0.5817000 -1.060000      0.8565000 
1 1 1 29 8  17 o 25.28000 0.3596000 24.62000 0.5170000 25.93000 0.5000000 -1.318000      0.7193000 
1 1 1 29 8  19 o 20.17000 0.3442000 20.04000 0.4455000 20.30000 0.5248000 -0.2661000     0.6885000 
1 1 1 29 8  21 o 27.24000 0.3122000 26.45000 0.4356000 28.04000 0.4474000 -1.584000      0.6244000 
1 1 1 29 8  23 o 33.16000 0.3255000 33.12000 0.4647000 33.20000 0.4561000 -0.7647000E-01 0.6511000 
1 1 1 29 8  25 o 9.351000 0.6163000 10.44000 0.7672000 8.265000 0.9648000 2.172000       1.233000  
1 1 1 29 8  27 o 5.656000 0.8873000 4.433000 1.346000  6.879000 1.157000  -2.446000      1.775000  
1 1 1 29 8  29 o 9.340000 0.4967000 8.721000 0.7486000 9.959000 0.6531000 -1.239000      0.9935000 
1 1 1 29 8  31 o 9.976000 0.4717000 10.22000 0.5644000 9.732000 0.7560000 0.4861000      0.9434000 
1 1 1 29 8  33 o 8.439000 0.6643000 7.525000 0.8963000 9.352000 0.9808000 -1.826000      1.329000  
1 1 1 29 8  35 o 9.373000 0.5257000 8.603000 0.6719000 10.14000 0.8088000 -1.541000      1.051000  
1 1 1 29 8  37 o 14.12000 0.4060000 14.16000 0.4946000 14.09000 0.6440000 0.7342000E-01  0.8120000 
1 1 1 29 8  39 o 5.375000 0.8683000 5.489000 1.238000  5.261000 1.218000  0.2284000      1.737000  
1 1 1 29 8  41 o 11.92000 0.5391000 12.70000 0.7628000 11.14000 0.7619000 1.567000       1.078000  
1 1 1 29 8  43 o 3.642000 0.9674000 3.700000 1.455000  3.583000 1.275000  0.1168000      1.935000  
1 1 1 29 8  45 o 5.414000 1.095000  5.179000 1.538000  5.649000 1.560000  -0.4702000     2.190000  
1 1 1 29 8  47 f 4.689000 0.9822000 4.165000 1.455000  5.213000 1.320000  -1.048000      1.964000  
1 1 1 29 8  49 o 9.618000 0.5636000 9.439000 0.8365000 9.797000 0.7556000 -0.3572000     1.127000  
1 1 1 29 8  51 o 6.127000 0.8784000 7.037000 1.065000  5.217000 1.397000  1.820000       1.757000  
1 1 1 29 8  53 o 6.095000 1.178000  7.854000 1.695000  4.336000 1.637000  3.518000       2.356000  
1 1 1 29 9  0  o 17.92000 0.5188000 17.92000 0.5188000 17.92000 0.5188000 0.000000       0.000000  
1 1 1 29 9  2  o 3.167000 0.9599000 3.216000 1.395000  3.118000 1.319000  0.9820000E-01  1.920000  
1 1 1 29 9  4  f 16.27000 0.4471000 16.26000 0.7096000 16.29000 0.5440000 -0.2798000E-01 0.8941000 
1 1 1 29 9  6  o 14.52000 0.4159000 14.80000 0.5912000 14.25000 0.5851000 0.5532000      0.8318000 
1 1 1 29 9  8  o 11.45000 0.5172000 11.08000 0.7372000 11.82000 0.7258000 -0.7391000     1.034000  
1 1 1 29 9  10 o 32.94000 0.3675000 33.32000 0.4447000 32.55000 0.5852000 0.7798000      0.7350000 
1 1 1 29 9  12 f 19.65000 0.3659000 19.14000 0.4439000 20.15000 0.5818000 -1.013000      0.7317000 
1 1 1 29 9  14 o 26.06000 0.3454000 26.06000 0.4863000 26.06000 0.4905000 -0.1360000E-02 0.6908000 
1 1 1 29 9  16 o 44.70000 0.3643000 43.87000 0.5072000 45.52000 0.5230000 -1.647000      0.7286000 
1 1 1 29 9  18 o 23.63000 0.4063000 24.07000 0.5304000 23.19000 0.6157000 0.8804000      0.8127000 
1 1 1 29 9  20 o 15.67000 0.4393000 14.76000 0.6494000 16.57000 0.5919000 -1.814000      0.8786000 
1 1 1 29 9  22 o 12.94000 0.4729000 13.47000 0.7398000 12.40000 0.5892000 1.068000       0.9458000 
1 1 1 29 9  24 f 6.889000 0.7662000 6.006000 1.257000  7.773000 0.8767000 -1.767000      1.532000  
1 1 1 29 9  26 o 9.379000 0.5236000 9.993000 0.7276000 8.765000 0.7533000 1.228000       1.047000  
1 1 1 29 9  28 o 6.936000 0.7485000 6.242000 1.134000  7.631000 0.9772000 -1.388000      1.497000  
1 1 1 29 9  30 o 11.66000 0.4258000 11.98000 0.5176000 11.35000 0.6761000 0.6348000      0.8515000 
1 1 1 29 9  32 o 13.49000 0.4016000 13.67000 0.4636000 13.31000 0.6560000 0.3557000      0.8033000 
1 1 1 29 9  34 o 10.76000 0.4559000 10.71000 0.5432000 10.81000 0.7325000 -0.1007000     0.9119000 
1 1 1 29 9  36 o 11.82000 0.4503000 11.88000 0.5585000 11.76000 0.7065000 0.1220000      0.9006000 
1 1 1 29 9  38 o 9.487000 0.5375000 9.523000 0.6436000 9.450000 0.8611000 0.7300000E-01  1.075000  
1 1 1 29 9  40 o 3.665000 0.9753000 3.785000 1.353000  3.545000 1.405000  0.2395000      1.951000  
1 1 1 29 9  42 o 13.30000 0.5210000 13.63000 0.8732000 12.97000 0.5687000 0.6619000      1.042000  
1 1 1 29 9  44 o 7.093000 0.7303000 8.058000 0.9138000 6.128000 1.140000  1.930000       1.461000  
1 1 1 29 9  46 o 3.488000 0.9803000 3.011000 1.355000  3.966000 1.417000  -0.9548000     1.961000  
1 1 1 29 9  48 o 2.785000 0.8723000 2.934000 1.268000  2.636000 1.199000  0.2981000      1.745000  
1 1 1 29 9  50 o 6.367000 0.8428000 6.371000 1.161000  6.362000 1.222000  0.8992000E-02  1.686000  
1 1 1 29 9  52 o 6.124000 0.8665000 5.392000 1.361000  6.857000 1.073000  -1.465000      1.733000  
1 1 1 29 10 1  o 40.76000 0.3389000 41.07000 0.4812000 40.45000 0.4773000 0.6185000      0.6778000 
1 1 1 29 10 3  o 5.846000 0.9978000 6.069000 1.502000  5.622000 1.313000  0.4463000      1.996000  
1 1 1 29 10 5  o 35.62000 0.4198000 35.06000 0.6557000 36.17000 0.5243000 -1.104000      0.8395000 
1 1 1 29 10 7  o 38.35000 0.3938000 38.74000 0.4748000 37.97000 0.6284000 0.7629000      0.7876000 
1 1 1 29 10 9  o 34.29000 0.3750000 35.14000 0.4548000 33.44000 0.5964000 1.706000       0.7500000 
1 1 1 29 10 11 o 39.12000 0.3842000 39.30000 0.5516000 38.93000 0.5349000 0.3678000      0.7683000 
1 1 1 29 10 13 o 31.58000 0.3095000 31.60000 0.4377000 31.57000 0.4378000 0.3975000E-01  0.6190000 
1 1 1 29 10 15 o 19.04000 0.3658000 19.05000 0.5000000 19.03000 0.5341000 0.1631000E-01  0.7317000 
1 1 1 29 10 17 o 12.30000 0.4548000 12.43000 0.6680000 12.17000 0.6174000 0.2606000      0.9096000 
1 1 1 29 10 19 o 18.33000 0.3465000 18.32000 0.4460000 18.34000 0.5304000 -0.2762000E-01 0.6930000 
1 1 1 29 10 21 o 12.86000 0.5139000 13.09000 0.8496000 12.64000 0.5783000 0.4426000      1.028000  
1 1 1 29 10 23 o 28.06000 0.4850000 28.29000 0.8684000 27.83000 0.4322000 0.4559000      0.9700000 
1 1 1 29 10 25 o 21.63000 0.3181000 21.89000 0.4610000 21.36000 0.4385000 0.5276000      0.6362000 
1 1 1 29 10 27 o 20.82000 0.3729000 20.96000 0.6022000 20.68000 0.4401000 0.2847000      0.7458000 
1 1 1 29 10 29 o 10.98000 0.5179000 11.69000 0.7204000 10.27000 0.7442000 1.420000       1.036000  
1 1 1 29 10 31 o 12.47000 0.4762000 12.64000 0.5002000 12.30000 0.8106000 0.3452000      0.9525000 
1 1 1 29 10 33 o 8.939000 0.5915000 8.938000 0.6374000 8.939000 0.9967000 -0.7277000E-03 1.183000  
1 1 1 29 10 35 o 13.21000 0.4017000 12.36000 0.4922000 14.05000 0.6350000 -1.694000      0.8034000 
1 1 1 29 10 37 f 6.156000 0.7849000 6.646000 0.8672000 5.666000 1.309000  0.9804000      1.570000  
1 1 1 29 10 39 o 4.131000 0.9874000 4.299000 1.255000  3.964000 1.525000  0.3348000      1.975000  
1 1 1 29 10 41 o 3.213000 0.9020000 2.935000 1.245000  3.491000 1.306000  -0.5560000     1.804000  
1 1 1 29 10 43 o 3.022000 0.8891000 2.613000 1.211000  3.431000 1.302000  -0.8180000     1.778000  
1 1 1 29 10 45 f 3.440000 0.9703000 3.750000 1.417000  3.130000 1.326000  0.6195000      1.941000  
1 1 1 29 10 47 o 5.108000 1.017000  4.338000 1.605000  5.879000 1.247000  -1.541000      2.033000  
1 1 1 29 10 49 o 9.892000 0.5388000 9.531000 0.7670000 10.25000 0.7568000 -0.7204000     1.078000  
1 1 1 29 10 51 o 4.254000 0.9768000 3.607000 1.418000  4.901000 1.344000  -1.294000      1.954000  
1 1 1 29 11 0  o 62.24000 0.7589000 62.24000 0.7589000 62.24000 0.7589000 0.000000       0.000000  
1 1 1 29 11 2  o 30.80000 0.3325000 30.99000 0.5113000 30.62000 0.4251000 0.3712000      0.6649000 
1 1 1 29 11 4  o 17.00000 0.3487000 17.15000 0.5267000 16.85000 0.4571000 0.3025000      0.6974000 
1 1 1 29 11 6  o 26.05000 0.3172000 25.84000 0.4261000 26.26000 0.4701000 -0.4219000     0.6345000 
1 1 1 29 11 8  o 34.34000 0.3591000 34.09000 0.5096000 34.59000 0.5061000 -0.4949000     0.7182000 
1 1 1 29 11 10 o 5.429000 0.8151000 6.494000 0.9883000 4.365000 1.297000  2.129000       1.630000  
1 1 1 29 11 12 o 16.11000 0.3448000 16.27000 0.4885000 15.95000 0.4868000 0.3190000      0.6897000 
1 1 1 29 11 14 o 18.20000 0.3326000 18.12000 0.4692000 18.28000 0.4716000 -0.1586000     0.6652000 
1 1 1 29 11 16 o 22.28000 0.3320000 21.96000 0.4294000 22.59000 0.5063000 -0.6333000     0.6639000 
1 1 1 29 11 18 o 14.56000 0.3858000 14.84000 0.5475000 14.28000 0.5435000 0.5632000      0.7715000 
1 1 1 29 11 20 o 36.35000 0.3582000 36.12000 0.4658000 36.58000 0.5444000 -0.4574000     0.7165000 
1 1 1 29 11 22 o 25.35000 0.3072000 25.59000 0.4375000 25.11000 0.4313000 0.4821000      0.6144000 
1 1 1 29 11 24 o 13.39000 0.4655000 12.96000 0.7623000 13.82000 0.5345000 -0.8656000     0.9310000 
1 1 1 29 11 26 o 10.46000 0.6407000 9.115000 1.144000  11.81000 0.5769000 -2.692000      1.281000  
1 1 1 29 11 28 o 6.370000 0.7223000 6.652000 0.8454000 6.088000 1.171000  0.5643000      1.445000  
1 1 1 29 11 30 o 10.63000 0.4844000 10.06000 0.5795000 11.19000 0.7764000 -1.133000      0.9688000 
1 1 1 29 11 32 o 9.159000 0.5417000 8.464000 0.7317000 9.853000 0.7991000 -1.389000      1.083000  
1 1 1 29 11 34 o 7.964000 0.6814000 8.413000 0.6802000 7.515000 1.181000  0.8987000      1.363000  
1 1 1 29 11 36 o 8.717000 0.5524000 8.468000 0.7173000 8.965000 0.8403000 -0.4966000     1.105000  
1 1 1 29 11 38 o 9.622000 0.5858000 9.894000 0.6109000 9.351000 0.9996000 0.5428000      1.172000  
1 1 1 29 11 40 f 9.276000 0.5433000 9.467000 0.7105000 9.086000 0.8222000 0.3806000      1.087000  
1 1 1 29 11 42 o 4.177000 0.8971000 5.449000 1.314000  2.904000 1.222000  2.545000       1.794000  
1 1 1 29 11 44 o 10.50000 0.5804000 10.69000 0.8519000 10.31000 0.7885000 0.3855000      1.161000  
1 1 1 29 11 46 o 19.85000 0.4047000 20.61000 0.5965000 19.10000 0.5470000 1.512000       0.8093000 
1 1 1 29 11 48 o 7.922000 0.7804000 7.783000 1.233000  8.061000 0.9569000 -0.2776000     1.561000  
1 1 1 29 11 50 o 4.114000 0.9840000 3.347000 1.349000  4.882000 1.433000  -1.535000      1.968000  
1 1 1 29 11 52 o 3.793000 1.044000  3.540000 1.413000  4.046000 1.537000  -0.5055000     2.088000  
1 1 1 29 12 1  o 43.46000 0.4683000 44.29000 0.5970000 42.63000 0.7218000 1.661000       0.9367000 
1 1 1 29 12 3  o 54.13000 0.4405000 54.35000 0.5840000 53.90000 0.6595000 0.4529000      0.8809000 
1 1 1 29 12 5  o 32.23000 0.3910000 32.50000 0.6161000 31.97000 0.4815000 0.5346000      0.7819000 
1 1 1 29 12 7  o 29.78000 0.3711000 29.67000 0.4889000 29.89000 0.5585000 -0.2254000     0.7423000 
1 1 1 29 12 9  o 29.46000 0.3373000 29.11000 0.5174000 29.81000 0.4329000 -0.6966000     0.6746000 
1 1 1 29 12 11 o 37.42000 0.3295000 37.35000 0.4653000 37.49000 0.4666000 -0.1398000     0.6590000 
1 1 1 29 12 13 o 35.17000 0.3411000 34.93000 0.5116000 35.41000 0.4513000 -0.4821000     0.6822000 
1 1 1 29 12 15 o 49.12000 0.4142000 49.56000 0.6259000 48.67000 0.5426000 0.8899000      0.8284000 
1 1 1 29 12 17 o 9.376000 0.5291000 10.20000 0.7164000 8.549000 0.7789000 1.655000       1.058000  
1 1 1 29 12 19 o 4.124000 0.9917000 3.993000 1.334000  4.254000 1.467000  -0.2608000     1.983000  
1 1 1 29 12 21 f 30.55000 0.3138000 30.76000 0.4483000 30.34000 0.4391000 0.4197000      0.6275000 
1 1 1 29 12 23 o 10.14000 0.4885000 10.09000 0.7279000 10.20000 0.6518000 -0.1082000     0.9771000 
1 1 1 29 12 25 o 8.312000 0.6845000 7.346000 1.065000  9.277000 0.8602000 -1.931000      1.369000  
1 1 1 29 12 27 o 7.295000 0.7007000 7.803000 0.9220000 6.788000 1.055000  1.015000       1.401000  
1 1 1 29 12 29 o 14.78000 0.4033000 14.28000 0.4477000 15.29000 0.6708000 -1.012000      0.8065000 
1 1 1 29 12 31 f 24.57000 0.3257000 24.72000 0.3808000 24.43000 0.5285000 0.2879000      0.6514000 
1 1 1 29 12 33 o 5.927000 0.7528000 6.085000 0.9639000 5.768000 1.156000  0.3171000      1.506000  
1 1 1 29 12 35 o 18.11000 0.3498000 17.96000 0.4162000 18.26000 0.5623000 -0.3091000     0.6995000 
1 1 1 29 12 37 o 5.534000 0.8154000 6.085000 0.9176000 4.984000 1.348000  1.101000       1.631000  
1 1 1 29 12 39 o 6.979000 0.6864000 7.106000 0.8603000 6.852000 1.070000  0.2537000      1.373000  
1 1 1 29 12 41 o 14.00000 0.4134000 13.55000 0.6132000 14.44000 0.5546000 -0.8972000     0.8267000 
1 1 1 29 12 43 o 8.388000 0.5930000 8.804000 0.7912000 7.973000 0.8834000 0.8313000      1.186000  
1 1 1 29 12 45 o 7.884000 0.7639000 7.793000 1.142000  7.976000 1.015000  -0.1829000     1.528000  
1 1 1 29 12 47 o 5.130000 0.9967000 5.783000 1.389000  4.477000 1.430000  1.307000       1.993000  
1 1 1 29 12 49 o 7.942000 0.7162000 8.129000 1.086000  7.755000 0.9340000 0.3738000      1.432000  
1 1 1 29 12 51 o 4.742000 0.9464000 5.908000 1.223000  3.577000 1.445000  2.331000       1.893000  
1 1 1 29 13 0  o 58.84000 0.8800000 58.84000 0.8800000 58.84000 0.8800000 0.000000       0.000000  
1 1 1 29 13 2  o 30.35000 0.3872000 30.20000 0.4782000 30.50000 0.6092000 -0.3037000     0.7745000 
1 1 1 29 13 4  o 14.79000 0.3868000 15.31000 0.5843000 14.27000 0.5070000 1.039000       0.7736000 
1 1 1 29 13 6  o 22.73000 0.3539000 23.19000 0.5738000 22.28000 0.4144000 0.9145000      0.7078000 
1 1 1 29 13 8  o 14.22000 0.3773000 15.16000 0.5124000 13.28000 0.5539000 1.882000       0.7545000 
1 1 1 29 13 10 o 17.16000 0.3470000 17.33000 0.5080000 16.98000 0.4729000 0.3512000      0.6941000 
1 1 1 29 13 12 o 29.66000 0.3184000 29.57000 0.4758000 29.75000 0.4233000 -0.1743000     0.6369000 
1 1 1 29 13 14 f 10.15000 0.4863000 9.732000 0.7290000 10.57000 0.6438000 -0.8413000     0.9726000 
1 1 1 29 13 16 o 27.68000 0.3032000 27.68000 0.4281000 27.69000 0.4296000 -0.1543000E-01 0.6065000 
1 1 1 29 13 18 o 13.77000 0.4257000 13.57000 0.5316000 13.97000 0.6650000 -0.4002000     0.8513000 
1 1 1 29 13 20 o 45.41000 0.3973000 44.91000 0.5148000 45.91000 0.6052000 -0.9949000     0.7946000 
1 1 1 29 13 22 o 15.82000 0.3496000 16.39000 0.4827000 15.25000 0.5057000 1.150000       0.6991000 
1 1 1 29 13 24 f 26.27000 0.4010000 26.17000 0.6758000 26.36000 0.4318000 -0.1883000     0.8019000 
1 1 1 29 13 26 o 4.989000 0.9055000 4.732000 1.182000  5.245000 1.372000  -0.5134000     1.811000  
1 1 1 29 13 28 o 9.442000 0.5211000 9.415000 0.7072000 9.469000 0.7656000 -0.5443000E-01 1.042000  
1 1 1 29 13 30 o 10.48000 0.4718000 10.44000 0.5717000 10.52000 0.7507000 -0.7731000E-01 0.9436000 
1 1 1 29 13 32 o 13.11000 0.3987000 13.20000 0.4752000 13.02000 0.6403000 0.1816000      0.7974000 
1 1 1 29 13 34 o 11.26000 0.5299000 11.38000 0.5652000 11.15000 0.8965000 0.2374000      1.060000  
1 1 1 29 13 36 o 9.789000 0.4872000 9.662000 0.6254000 9.916000 0.7473000 -0.2533000     0.9745000 
1 1 1 29 13 38 o 2.802000 0.8444000 2.628000 1.112000  2.976000 1.271000  -0.3475000     1.689000  
1 1 1 29 13 40 o 12.90000 0.4270000 12.86000 0.5294000 12.94000 0.6701000 -0.7818000E-01 0.8540000 
1 1 1 29 13 42 o 5.861000 0.8168000 6.570000 1.021000  5.151000 1.275000  1.419000       1.634000  
1 1 1 29 13 44 o 3.582000 0.9289000 3.928000 1.327000  3.236000 1.300000  0.6919000      1.858000  
1 1 1 29 13 46 o 12.34000 0.5363000 12.02000 0.8270000 12.66000 0.6830000 -0.6399000     1.073000  
1 1 1 29 13 48 o 3.507000 0.9708000 3.545000 1.364000  3.469000 1.382000  0.7692000E-01  1.942000  
1 1 1 29 13 50 o 6.777000 0.9682000 7.755000 1.235000  5.799000 1.492000  1.956000       1.936000  
1 1 1 29 14 1  o 33.62000 0.4046000 33.73000 0.5028000 33.51000 0.6340000 0.2211000      0.8091000 
1 1 1 29 14 3  o 18.52000 0.3603000 17.77000 0.4912000 19.27000 0.5274000 -1.498000      0.7207000 
1 1 1 29 14 5  o 41.97000 0.3708000 41.91000 0.5587000 42.02000 0.4876000 -0.1111000     0.7416000 
1 1 1 29 14 7  o 23.27000 0.3428000 23.48000 0.5387000 23.07000 0.4241000 0.4094000      0.6856000 
1 1 1 29 14 9  o 23.78000 0.3152000 23.72000 0.4575000 23.85000 0.4335000 -0.1252000     0.6303000 
1 1 1 29 14 11 o 16.05000 0.3348000 16.37000 0.4552000 15.74000 0.4910000 0.6371000      0.6695000 
1 1 1 29 14 13 o 9.474000 0.4761000 9.940000 0.6243000 9.007000 0.7189000 0.9325000      0.9521000 
1 1 1 29 14 15 o 26.26000 0.3003000 26.09000 0.4218000 26.44000 0.4276000 -0.3573000     0.6007000 
1 1 1 29 14 17 o 39.09000 0.3413000 38.74000 0.4771000 39.44000 0.4882000 -0.7006000     0.6826000 
1 1 1 29 14 19 o 45.92000 0.3699000 45.38000 0.5208000 46.46000 0.5253000 -1.075000      0.7397000 
1 1 1 29 14 21 o 8.506000 0.5905000 7.798000 0.7931000 9.213000 0.8750000 -1.415000      1.181000  
1 1 1 29 14 23 o 28.74000 0.3654000 28.80000 0.5941000 28.68000 0.4258000 0.1132000      0.7309000 
1 1 1 29 14 25 f 14.50000 0.3748000 14.03000 0.4768000 14.97000 0.5786000 -0.9412000     0.7497000 
1 1 1 29 14 27 o 13.75000 0.3848000 13.00000 0.4972000 14.49000 0.5875000 -1.494000      0.7697000 
1 1 1 29 14 29 o 9.697000 0.4691000 9.364000 0.5809000 10.03000 0.7368000 -0.6658000     0.9383000 
1 1 1 29 14 31 o 14.28000 0.3851000 13.82000 0.5115000 14.74000 0.5758000 -0.9194000     0.7702000 
1 1 1 29 14 33 o 25.46000 0.3737000 25.28000 0.3804000 25.64000 0.6433000 -0.3537000     0.7473000 
1 1 1 29 14 35 o 8.926000 0.5471000 8.626000 0.6862000 9.226000 0.8522000 -0.6007000     1.094000  
1 1 1 29 14 37 o 2.859000 0.8748000 2.764000 1.185000  2.954000 1.287000  -0.1904000     1.750000  
1 1 1 29 14 39 o 19.84000 0.3369000 19.85000 0.4204000 19.83000 0.5265000 0.2810000E-01  0.6738000 
1 1 1 29 14 41 o 16.36000 0.3630000 16.01000 0.4446000 16.71000 0.5740000 -0.6990000     0.7260000 
1 1 1 29 14 43 o 3.623000 0.9557000 3.228000 1.297000  4.018000 1.404000  -0.7895000     1.911000  
1 1 1 29 14 45 o 5.526000 0.9175000 6.303000 1.111000  4.750000 1.460000  1.553000       1.835000  
1 1 1 29 14 47 o 6.336000 1.041000  6.086000 1.673000  6.585000 1.241000  -0.4988000     2.083000  
1 1 1 29 14 49 o 8.351000 0.7415000 8.594000 0.8993000 8.109000 1.179000  0.4846000      1.483000  
1 1 1 29 14 51 o 11.46000 0.6077000 12.11000 0.9943000 10.81000 0.6990000 1.303000       1.215000  
1 1 1 29 15 0  o 29.43000 0.5057000 29.43000 0.5057000 29.43000 0.5057000 0.000000       0.000000  
1 1 1 29 15 2  o 4.481000 0.9594000 5.149000 1.294000  3.813000 1.417000  1.336000       1.919000  
1 1 1 29 15 4  o 22.59000 0.2933000 22.78000 0.4129000 22.39000 0.4165000 0.3978000      0.5865000 
1 1 1 29 15 6  o 2.423000 0.7757000 2.145000 1.011000  2.702000 1.177000  -0.5572000     1.551000  
1 1 1 29 15 8  o 10.22000 0.4963000 9.521000 0.7393000 10.92000 0.6624000 -1.401000      0.9927000 
1 1 1 29 15 10 f 10.67000 0.4418000 10.77000 0.5659000 10.58000 0.6787000 0.1918000      0.8836000 
1 1 1 29 15 12 o 19.60000 0.3036000 20.00000 0.4183000 19.20000 0.4403000 0.8002000      0.6073000 
1 1 1 29 15 14 o 17.32000 0.3159000 17.54000 0.4335000 17.10000 0.4597000 0.4375000      0.6319000 
1 1 1 29 15 16 o 15.53000 0.3416000 16.36000 0.4626000 14.69000 0.5027000 1.668000       0.6831000 
1 1 1 29 15 18 o 4.586000 0.9168000 4.841000 1.278000  4.330000 1.315000  0.5108000      1.834000  
1 1 1 29 15 20 o 19.85000 0.4343000 19.98000 0.5492000 19.72000 0.6728000 0.2576000      0.8685000 
1 1 1 29 15 22 f 12.02000 0.4034000 12.17000 0.5742000 11.87000 0.5666000 0.3035000      0.8067000 
1 1 1 29 15 24 o 15.71000 0.4907000 16.30000 0.6430000 15.12000 0.7415000 1.181000       0.9814000 
1 1 1 29 15 26 o 13.92000 0.3745000 13.66000 0.4624000 14.18000 0.5892000 -0.5206000     0.7490000 
1 1 1 29 15 28 o 14.72000 0.4142000 15.05000 0.4471000 14.38000 0.6975000 0.6714000      0.8285000 
1 1 1 29 15 30 o 24.30000 0.3129000 24.12000 0.3796000 24.48000 0.4975000 -0.3597000     0.6258000 
1 1 1 29 15 32 o 21.51000 0.3919000 21.17000 0.4475000 21.85000 0.6434000 -0.6808000     0.7837000 
1 1 1 29 15 34 o 17.02000 0.4074000 17.27000 0.4022000 16.77000 0.7087000 0.4959000      0.8149000 
1 1 1 29 15 36 o 3.385000 0.9404000 3.006000 1.289000  3.764000 1.369000  -0.7575000     1.881000  
1 1 1 29 15 38 o 7.253000 0.6492000 6.653000 0.8734000 7.854000 0.9608000 -1.201000      1.298000  
1 1 1 29 15 40 o 7.858000 0.6259000 7.412000 0.8387000 8.303000 0.9292000 -0.8910000     1.252000  
1 1 1 29 15 42 o 6.007000 0.8342000 6.511000 1.040000  5.503000 1.304000  1.008000       1.668000  
1 1 1 29 15 44 o 8.191000 0.6110000 7.690000 0.9017000 8.692000 0.8249000 -1.001000      1.222000  
1 1 1 29 15 46 o 6.373000 0.8282000 6.046000 1.202000  6.700000 1.140000  -0.6532000     1.656000  
1 1 1 29 15 48 o 3.627000 1.038000  3.709000 1.477000  3.545000 1.460000  0.1639000      2.077000  
1 1 1 29 15 50 o 4.389000 0.9738000 4.167000 1.337000  4.611000 1.416000  -0.4433000     1.948000  
1 1 1 29 16 1  o 31.54000 0.3051000 31.44000 0.4246000 31.64000 0.4381000 -0.1953000     0.6101000 
1 1 1 29 16 3  o 10.66000 0.5304000 10.72000 0.6106000 10.60000 0.8675000 0.1151000      1.061000  
1 1 1 29 16 5  o 24.89000 0.2939000 24.67000 0.4100000 25.12000 0.4213000 -0.4521000     0.5879000 
1 1 1 29 16 7  o 15.18000 0.3354000 15.47000 0.4567000 14.89000 0.4915000 0.5789000      0.6709000 
1 1 1 29 16 9  o 22.55000 0.3038000 22.11000 0.4120000 22.99000 0.4466000 -0.8805000     0.6076000 
1 1 1 29 16 11 o 21.92000 0.3037000 21.85000 0.4162000 21.98000 0.4423000 -0.1302000     0.6074000 
1 1 1 29 16 13 o 15.06000 0.3345000 15.03000 0.4693000 15.09000 0.4767000 -0.6087000E-01 0.6689000 
1 1 1 29 16 15 o 9.749000 0.4437000 9.859000 0.5948000 9.640000 0.6586000 0.2184000      0.8874000 
1 1 1 29 16 17 o 34.62000 0.3825000 33.93000 0.5401000 35.32000 0.5417000 -1.399000      0.7650000 
1 1 1 29 16 19 f 17.80000 0.3170000 17.61000 0.4485000 17.99000 0.4480000 -0.3754000     0.6339000 
1 1 1 29 16 21 o 16.06000 0.3506000 16.30000 0.4551000 15.81000 0.5334000 0.4840000      0.7012000 
1 1 1 29 16 23 o 14.20000 0.3649000 13.71000 0.5487000 14.69000 0.4812000 -0.9755000     0.7298000 
1 1 1 29 16 25 o 30.48000 0.3174000 30.53000 0.3867000 30.44000 0.5033000 0.9441000E-01  0.6347000 
1 1 1 29 16 27 o 20.13000 0.3503000 19.71000 0.3948000 20.54000 0.5788000 -0.8263000     0.7006000 
1 1 1 29 16 29 o 9.663000 0.4948000 9.529000 0.6100000 9.798000 0.7793000 -0.2688000     0.9896000 
1 1 1 29 16 31 o 13.46000 0.4367000 12.76000 0.4462000 14.15000 0.7509000 -1.390000      0.8735000 
1 1 1 29 16 33 o 8.607000 0.5725000 8.594000 0.7453000 8.621000 0.8692000 -0.2761000E-01 1.145000  
1 1 1 29 16 35 o 8.041000 0.6005000 7.611000 0.7805000 8.470000 0.9128000 -0.8583000     1.201000  
1 1 1 29 16 37 o 4.914000 0.8796000 5.428000 0.9727000 4.400000 1.466000  1.028000       1.759000  
1 1 1 29 16 39 o 16.81000 0.3805000 16.78000 0.4843000 16.84000 0.5869000 -0.5978000E-01 0.7610000 
1 1 1 29 16 41 o 5.042000 0.8863000 4.868000 1.127000  5.216000 1.368000  -0.3478000     1.773000  
1 1 1 29 16 43 o 5.113000 0.8857000 4.209000 1.330000  6.017000 1.170000  -1.809000      1.771000  
1 1 1 29 16 45 o 3.648000 0.9870000 3.434000 1.317000  3.862000 1.470000  -0.4284000     1.974000  
1 1 1 29 16 47 o 10.13000 0.6167000 10.11000 0.8081000 10.16000 0.9318000 -0.5448000E-01 1.233000  
1 1 1 29 16 49 o 5.699000 1.008000  6.430000 1.422000  4.968000 1.430000  1.461000       2.017000  
1 1 1 29 17 0  o 17.87000 0.4314000 17.87000 0.4314000 17.87000 0.4314000 0.000000       0.000000  
1 1 1 29 17 2  o 12.32000 0.3895000 12.16000 0.5208000 12.47000 0.5794000 -0.3045000     0.7791000 
1 1 1 29 17 4  o 20.83000 0.3334000 21.14000 0.4088000 20.52000 0.5268000 0.6181000      0.6668000 
1 1 1 29 17 6  o 8.503000 0.5627000 8.000000 0.7833000 9.006000 0.8081000 -1.006000      1.125000  
1 1 1 29 17 8  o 21.56000 0.3317000 21.46000 0.4770000 21.66000 0.4610000 -0.1945000     0.6633000 
1 1 1 29 17 10 o 33.94000 0.3185000 33.26000 0.4397000 34.61000 0.4609000 -1.347000      0.6370000 
1 1 1 29 17 12 o 25.41000 0.3001000 25.49000 0.4178000 25.33000 0.4310000 0.1534000      0.6003000 
1 1 1 29 17 14 o 25.94000 0.2953000 25.53000 0.4158000 26.34000 0.4194000 -0.8147000     0.5906000 
1 1 1 29 17 16 o 19.40000 0.3885000 19.72000 0.5331000 19.09000 0.5653000 0.6365000      0.7771000 
1 1 1 29 17 18 o 11.24000 0.3992000 11.50000 0.5416000 10.98000 0.5864000 0.5183000      0.7983000 
1 1 1 29 17 20 o 4.232000 0.8239000 3.750000 1.186000  4.714000 1.144000  -0.9648000     1.648000  
1 1 1 29 17 22 o 6.225000 0.6700000 6.355000 0.9593000 6.096000 0.9355000 0.2582000      1.340000  
1 1 1 29 17 24 o 13.65000 0.3701000 13.08000 0.4629000 14.22000 0.5776000 -1.141000      0.7402000 
1 1 1 29 17 26 o 6.719000 0.7310000 6.547000 0.7712000 6.890000 1.242000  -0.3430000     1.462000  
1 1 1 29 17 28 o 22.70000 0.3273000 22.05000 0.4193000 23.35000 0.5026000 -1.300000      0.6545000 
1 1 1 29 17 30 o 19.01000 0.3770000 19.47000 0.3997000 18.54000 0.6393000 0.9372000      0.7539000 
1 1 1 29 17 32 o 4.381000 0.8648000 4.066000 1.123000  4.697000 1.315000  -0.6312000     1.730000  
1 1 1 29 17 34 o 9.402000 0.5865000 8.124000 0.7442000 10.68000 0.9068000 -2.555000      1.173000  
1 1 1 29 17 36 o 9.862000 0.5558000 9.515000 0.7766000 10.21000 0.7952000 -0.6935000     1.112000  
1 1 1 29 17 38 o 15.04000 0.3838000 14.77000 0.4851000 15.30000 0.5948000 -0.5246000     0.7675000 
1 1 1 29 17 40 o 6.177000 0.7503000 5.733000 0.9916000 6.620000 1.126000  -0.8872000     1.501000  
1 1 1 29 17 42 o 10.90000 0.5340000 11.46000 0.6167000 10.33000 0.8720000 1.129000       1.068000  
1 1 1 29 17 44 f 4.054000 0.9267000 3.797000 1.273000  4.311000 1.348000  -0.5135000     1.853000  
1 1 1 29 17 46 o 5.194000 0.9577000 4.475000 1.335000  5.913000 1.374000  -1.438000      1.915000  
1 1 1 29 17 48 o 8.170000 0.6381000 8.286000 0.8918000 8.054000 0.9129000 0.2323000      1.276000  
1 1 1 29 17 50 o 3.196000 0.9446000 4.022000 1.533000  2.371000 1.104000  1.651000       1.889000  
1 1 1 29 18 1  o 11.22000 0.4071000 11.30000 0.5462000 11.14000 0.6038000 0.1532000      0.8142000 
1 1 1 29 18 3  o 27.99000 0.2923000 27.47000 0.4078000 28.52000 0.4189000 -1.053000      0.5846000 
1 1 1 29 18 5  o 42.60000 0.3994000 42.31000 0.5451000 42.90000 0.5839000 -0.5893000     0.7988000 
1 1 1 29 18 7  o 17.86000 0.3114000 17.23000 0.4489000 18.48000 0.4316000 -1.257000      0.6227000 
1 1 1 29 18 9  o 41.96000 0.4173000 42.02000 0.6698000 41.89000 0.4979000 0.1312000      0.8346000 
1 1 1 29 18 11 o 6.902000 0.6680000 7.479000 0.8447000 6.325000 1.035000  1.154000       1.336000  
1 1 1 29 18 13 o 44.24000 0.4670000 44.14000 0.6016000 44.33000 0.7143000 -0.1895000     0.9339000 
1 1 1 29 18 15 o 13.70000 0.3639000 13.99000 0.4868000 13.41000 0.5412000 0.5753000      0.7279000 
1 1 1 29 18 17 o 10.53000 0.4158000 10.82000 0.5516000 10.24000 0.6223000 0.5806000      0.8316000 
1 1 1 29 18 19 o 11.19000 0.3884000 11.35000 0.5214000 11.03000 0.5759000 0.3186000      0.7768000 
1 1 1 29 18 21 o 26.75000 0.3355000 27.37000 0.4741000 26.13000 0.4749000 1.247000       0.6710000 
1 1 1 29 18 23 o 17.29000 0.3263000 17.00000 0.3666000 17.59000 0.5399000 -0.5910000     0.6526000 
1 1 1 29 18 25 o 27.18000 0.3449000 26.62000 0.3654000 27.74000 0.5852000 -1.118000      0.6899000 
1 1 1 29 18 27 f 26.14000 0.3579000 26.15000 0.3721000 26.14000 0.6116000 0.4850000E-02  0.7159000 
1 1 1 29 18 29 o 16.35000 0.3384000 16.40000 0.3998000 16.31000 0.5462000 0.8823000E-01  0.6769000 
1 1 1 29 18 31 o 9.222000 0.4825000 8.800000 0.6139000 9.644000 0.7446000 -0.8438000     0.9650000 
1 1 1 29 18 33 o 15.19000 0.3842000 15.27000 0.4645000 15.11000 0.6120000 0.1555000      0.7683000 
1 1 1 29 18 35 o 7.976000 0.5350000 7.820000 0.6560000 8.132000 0.8452000 -0.3122000     1.070000  
1 1 1 29 18 37 o 6.028000 0.8114000 5.983000 1.044000  6.074000 1.242000  -0.9193000E-01 1.623000  
1 1 1 29 18 39 o 3.131000 0.8628000 2.099000 0.9848000 4.163000 1.417000  -2.064000      1.726000  
1 1 1 29 18 41 o 3.196000 0.9422000 2.750000 1.179000  3.642000 1.470000  -0.8924000     1.884000  
1 1 1 29 18 43 o 6.524000 0.7288000 6.084000 1.070000  6.963000 0.9895000 -0.8789000     1.458000  
1 1 1 29 18 45 o 7.205000 0.7844000 6.101000 0.9764000 8.309000 1.228000  -2.208000      1.569000  
1 1 1 29 18 47 o 2.797000 0.8686000 2.583000 1.184000  3.012000 1.271000  -0.4292000     1.737000  
1 1 1 29 18 49 o 3.100000 0.9034000 3.576000 1.352000  2.624000 1.199000  0.9527000      1.807000  
1 1 1 29 19 0  o 13.25000 0.5015000 13.25000 0.5015000 13.25000 0.5015000 0.000000       0.000000  
1 1 1 29 19 2  o 10.99000 0.4187000 11.46000 0.5255000 10.52000 0.6520000 0.9411000      0.8374000 
1 1 1 29 19 4  o 29.43000 0.2947000 28.85000 0.4138000 30.01000 0.4198000 -1.157000      0.5895000 
1 1 1 29 19 6  o 34.40000 0.3456000 34.45000 0.4460000 34.35000 0.5280000 0.1053000      0.6912000 
1 1 1 29 19 8  o 28.43000 0.3006000 27.77000 0.4168000 29.09000 0.4334000 -1.318000      0.6013000 
1 1 1 29 19 10 o 21.30000 0.3358000 21.34000 0.4754000 21.27000 0.4743000 0.7106000E-01  0.6716000 
1 1 1 29 19 12 o 18.32000 0.3714000 18.85000 0.4285000 17.79000 0.6067000 1.058000       0.7428000 
1 1 1 29 19 14 o 25.89000 0.3694000 26.75000 0.4079000 25.03000 0.6160000 1.721000       0.7388000 
1 1 1 29 19 16 o 15.86000 0.3818000 16.00000 0.4344000 15.73000 0.6279000 0.2725000      0.7635000 
1 1 1 29 19 18 o 6.565000 0.7591000 6.677000 0.8722000 6.452000 1.243000  0.2250000      1.518000  
1 1 1 29 19 20 o 3.289000 0.9059000 3.257000 1.174000  3.321000 1.380000  -0.6332000E-01 1.812000  
1 1 1 29 19 22 o 23.14000 0.3258000 23.47000 0.4114000 22.81000 0.5053000 0.6598000      0.6516000 
1 1 1 29 19 24 o 8.343000 0.6303000 8.877000 0.5807000 7.809000 1.119000  1.068000       1.261000  
1 1 1 29 19 26 o 2.961000 0.8293000 3.401000 1.141000  2.522000 1.204000  0.8792000      1.659000  
1 1 1 29 19 28 o 9.155000 0.4919000 8.942000 0.6060000 9.369000 0.7751000 -0.4267000     0.9839000 
1 1 1 29 19 30 o 23.51000 0.3199000 23.34000 0.3814000 23.68000 0.5137000 -0.3385000     0.6399000 
1 1 1 29 19 32 o 12.42000 0.3840000 12.47000 0.4539000 12.36000 0.6196000 0.1065000      0.7680000 
1 1 1 29 19 34 o 6.021000 0.8038000 5.330000 0.9774000 6.713000 1.276000  -1.383000      1.608000  
1 1 1 29 19 36 o 4.717000 0.8942000 4.939000 1.119000  4.495000 1.395000  0.4442000      1.788000  
1 1 1 29 19 38 o 7.289000 0.6850000 6.988000 0.9349000 7.590000 1.002000  -0.6016000     1.370000  
1 1 1 29 19 40 o 8.708000 0.5404000 7.875000 0.7175000 9.540000 0.8083000 -1.665000      1.081000  
1 1 1 29 19 42 o 4.092000 0.9840000 3.604000 1.301000  4.579000 1.476000  -0.9744000     1.968000  
1 1 1 29 19 44 o 8.443000 0.6514000 8.856000 0.7041000 8.030000 1.096000  0.8252000      1.303000  
1 1 1 29 19 46 f 6.292000 0.8003000 7.321000 0.8905000 5.263000 1.330000  2.059000       1.601000  
1 1 1 29 19 48 f 6.346000 0.7744000 6.477000 1.066000  6.216000 1.123000  0.2616000      1.549000  
1 1 1 29 20 1  o 23.92000 0.3872000 23.56000 0.3935000 24.28000 0.6670000 -0.7191000     0.7744000 
1 1 1 29 20 3  o 24.78000 0.2823000 24.58000 0.3912000 24.98000 0.4070000 -0.4023000     0.5645000 
1 1 1 29 20 5  o 9.555000 0.4607000 9.515000 0.6410000 9.594000 0.6619000 -0.7902000E-01 0.9214000 
1 1 1 29 20 7  o 27.92000 0.2952000 27.98000 0.4229000 27.86000 0.4120000 0.1238000      0.5905000 
1 1 1 29 20 9  o 16.05000 0.4612000 16.03000 0.6151000 16.08000 0.6875000 -0.4958000E-01 0.9224000 
1 1 1 29 20 11 o 14.98000 0.3321000 15.59000 0.4622000 14.37000 0.4769000 1.213000       0.6641000 
1 1 1 29 20 13 o 24.09000 0.3336000 23.80000 0.4545000 24.38000 0.4885000 -0.5795000     0.6673000 
1 1 1 29 20 15 o 12.98000 0.3494000 13.43000 0.4791000 12.54000 0.5088000 0.8852000      0.6989000 
1 1 1 29 20 17 o 11.93000 0.3748000 12.38000 0.5339000 11.48000 0.5262000 0.8948000      0.7496000 
1 1 1 29 20 19 o 17.91000 0.2963000 17.94000 0.4152000 17.89000 0.4228000 0.4538000E-01  0.5925000 
1 1 1 29 20 21 o 12.29000 0.5026000 12.80000 0.4162000 11.78000 0.9149000 1.025000       1.005000  
1 1 1 29 20 23 o 17.65000 0.4718000 17.71000 0.3840000 17.59000 0.8620000 0.1258000      0.9436000 
1 1 1 29 20 25 o 21.81000 0.3892000 21.72000 0.4514000 21.89000 0.6342000 -0.1716000     0.7784000 
1 1 1 29 20 27 o 10.87000 0.4195000 11.10000 0.4562000 10.64000 0.7041000 0.4592000      0.8390000 
1 1 1 29 20 29 o 3.932000 0.7917000 4.832000 0.9644000 3.033000 1.256000  1.799000       1.583000  
1 1 1 29 20 31 o 10.80000 0.4207000 10.85000 0.4872000 10.75000 0.6860000 0.1006000      0.8414000 
1 1 1 29 20 33 o 3.063000 0.8573000 2.547000 1.051000  3.580000 1.355000  -1.033000      1.715000  
1 1 1 29 20 35 o 6.169000 0.6984000 4.645000 1.088000  7.693000 0.8756000 -3.048000      1.397000  
1 1 1 29 20 37 o 11.64000 0.4307000 10.92000 0.5713000 12.36000 0.6447000 -1.440000      0.8614000 
1 1 1 29 20 39 o 12.99000 0.4494000 12.89000 0.5869000 13.09000 0.6807000 -0.1965000     0.8988000 
1 1 1 29 20 41 o 6.099000 0.7959000 5.961000 0.8986000 6.237000 1.314000  -0.2758000     1.592000  
1 1 1 29 20 43 o 7.546000 0.9315000 8.889000 0.9332000 6.204000 1.613000  2.684000       1.863000  
1 1 1 29 20 45 o 6.179000 0.8684000 6.943000 0.9111000 5.414000 1.479000  1.528000       1.737000  
1 1 1 29 20 47 o 5.741000 0.9372000 5.837000 1.267000  5.645000 1.381000  0.1925000      1.874000  
1 1 1 29 20 49 o 4.635000 1.017000  5.967000 1.550000  3.304000 1.316000  2.663000       2.033000  
1 1 1 29 21 0  o 18.36000 0.4299000 18.36000 0.4299000 18.36000 0.4299000 0.000000       0.000000  
1 1 1 29 21 2  o 15.71000 0.3199000 16.19000 0.4269000 15.22000 0.4765000 0.9748000      0.6398000 
1 1 1 29 21 4  o 3.459000 0.8871000 3.273000 1.267000  3.645000 1.242000  -0.3716000     1.774000  
1 1 1 29 21 6  o 18.99000 0.4673000 19.18000 0.5523000 18.80000 0.7539000 0.3719000      0.9345000 
1 1 1 29 21 8  o 13.11000 0.4190000 13.02000 0.5116000 13.19000 0.6639000 -0.1720000     0.8381000 
1 1 1 29 21 10 o 35.12000 0.3603000 35.41000 0.5241000 34.84000 0.4944000 0.5769000      0.7205000 
1 1 1 29 21 12 o 10.17000 0.4243000 10.02000 0.5857000 10.32000 0.6140000 -0.3008000     0.8486000 
1 1 1 29 21 14 o 18.02000 0.3846000 18.10000 0.5656000 17.93000 0.5213000 0.1736000      0.7692000 
1 1 1 29 21 16 o 12.98000 0.5020000 12.98000 0.8750000 12.99000 0.4926000 -0.1468000E-01 1.004000  
1 1 1 29 21 18 o 15.24000 0.3906000 15.45000 0.6385000 15.04000 0.4502000 0.4099000      0.7812000 
1 1 1 29 21 20 o 13.66000 0.3974000 13.40000 0.5080000 13.92000 0.6112000 -0.5184000     0.7947000 
1 1 1 29 21 22 o 12.01000 0.5917000 12.06000 0.5188000 11.96000 1.064000  0.9865000E-01  1.183000  
1 1 1 29 21 24 o 13.63000 0.3856000 13.38000 0.4464000 13.89000 0.6290000 -0.5165000     0.7713000 
1 1 1 29 21 26 o 7.734000 0.5565000 7.916000 0.5400000 7.551000 0.9733000 0.3656000      1.113000  
1 1 1 29 21 28 f 6.446000 0.6308000 5.931000 0.8816000 6.962000 0.9023000 -1.031000      1.262000  
1 1 1 29 21 30 o 3.546000 0.8265000 3.903000 1.044000  3.189000 1.281000  0.7132000      1.653000  
1 1 1 29 21 32 o 10.15000 0.4354000 9.009000 0.5719000 11.29000 0.6567000 -2.279000      0.8708000 
1 1 1 29 21 34 o 4.873000 0.8790000 4.887000 0.9462000 4.859000 1.482000  0.2734000E-01  1.758000  
1 1 1 29 21 36 o 16.17000 0.3738000 16.08000 0.4838000 16.27000 0.5698000 -0.1820000     0.7475000 
1 1 1 29 21 38 f 12.81000 0.4147000 12.70000 0.4545000 12.91000 0.6939000 -0.2058000     0.8295000 
1 1 1 29 21 40 o 10.89000 0.5337000 10.80000 0.5197000 10.98000 0.9324000 -0.1799000     1.067000  
1 1 1 29 21 42 o 4.328000 0.9883000 4.389000 1.172000  4.267000 1.591000  0.1221000      1.977000  
1 1 1 29 21 44 o 4.886000 0.9807000 4.415000 1.483000  5.358000 1.284000  -0.9433000     1.961000  
1 1 1 29 21 46 o 8.249000 0.5954000 8.360000 0.7888000 8.137000 0.8922000 0.2234000      1.191000  
1 1 1 29 21 48 f 4.095000 0.9359000 4.414000 1.324000  3.777000 1.323000  0.6371000      1.872000  
1 1 1 29 22 1  o 38.28000 0.3529000 38.82000 0.4588000 37.74000 0.5364000 1.081000       0.7058000 
1 1 1 29 22 3  o 11.73000 0.4739000 12.18000 0.6477000 11.27000 0.6920000 0.9097000      0.9479000 
1 1 1 29 22 5  o 18.70000 0.2984000 18.71000 0.4262000 18.68000 0.4177000 0.3465000E-01  0.5968000 
1 1 1 29 22 7  o 41.32000 0.3765000 41.91000 0.4903000 40.73000 0.5714000 1.177000       0.7529000 
1 1 1 29 22 9  o 6.704000 0.6122000 7.353000 0.7520000 6.056000 0.9662000 1.297000       1.224000  
1 1 1 29 22 11 o 3.300000 0.8837000 4.081000 1.394000  2.518000 1.087000  1.563000       1.767000  
1 1 1 29 22 13 f 33.05000 0.3914000 32.73000 0.6411000 33.37000 0.4491000 -0.6367000     0.7827000 
1 1 1 29 22 15 o 25.01000 0.3035000 24.79000 0.4420000 25.24000 0.4161000 -0.4454000     0.6071000 
1 1 1 29 22 17 o 41.52000 0.5415000 41.71000 0.5446000 41.32000 0.9360000 0.3976000      1.083000  
1 1 1 29 22 19 o 23.62000 0.3511000 23.62000 0.3303000 23.62000 0.6196000 0.1625000E-02  0.7021000 
1 1 1 29 22 21 f 18.30000 0.3248000 18.30000 0.3248000 ?        ?         ?              ?         
1 1 1 29 22 23 o 20.59000 0.3425000 20.73000 0.4525000 20.44000 0.5144000 0.2913000      0.6851000 
1 1 1 29 22 25 o 15.22000 0.3563000 15.08000 0.4468000 15.35000 0.5550000 -0.2731000     0.7125000 
1 1 1 29 22 27 o 4.127000 0.8285000 3.626000 1.017000  4.628000 1.308000  -1.003000      1.657000  
1 1 1 29 22 29 o 6.169000 0.5919000 5.073000 0.7602000 7.265000 0.9074000 -2.192000      1.184000  
1 1 1 29 22 31 o 7.935000 0.4747000 7.612000 0.5543000 8.258000 0.7708000 -0.6463000     0.9494000 
1 1 1 29 22 33 o 11.61000 0.4076000 11.51000 0.4838000 11.71000 0.6562000 -0.2005000     0.8153000 
1 1 1 29 22 35 o 10.67000 0.4410000 10.62000 0.4894000 10.72000 0.7336000 -0.9708000E-01 0.8819000 
1 1 1 29 22 37 f 10.91000 0.4416000 9.938000 0.5392000 11.88000 0.6995000 -1.946000      0.8832000 
1 1 1 29 22 39 o 24.17000 0.3850000 24.85000 0.3814000 23.48000 0.6688000 1.369000       0.7699000 
1 1 1 29 22 41 o 7.186000 0.8137000 8.036000 0.6986000 6.336000 1.470000  1.701000       1.627000  
1 1 1 29 22 43 o 6.216000 0.8053000 7.163000 0.7759000 5.270000 1.412000  1.893000       1.611000  
1 1 1 29 22 45 o 8.645000 0.6778000 8.599000 0.9561000 8.692000 0.9610000 -0.9305000E-01 1.356000  
1 1 1 29 22 47 o 7.758000 0.7259000 8.494000 1.011000  7.021000 1.042000  1.473000       1.452000  
1 1 1 29 23 0  o 11.70000 0.9788000 11.70000 0.9788000 11.70000 0.9788000 0.000000       0.000000  
1 1 1 29 23 2  o 20.37000 0.2957000 20.50000 0.3993000 20.23000 0.4364000 0.2718000      0.5915000 
1 1 1 29 23 4  o 12.39000 0.3556000 12.82000 0.4824000 11.95000 0.5226000 0.8735000      0.7112000 
1 1 1 29 23 6  o 17.70000 0.2967000 17.48000 0.4215000 17.91000 0.4176000 -0.4325000     0.5933000 
1 1 1 29 23 8  o 8.175000 0.5115000 9.047000 0.6242000 7.302000 0.8104000 1.745000       1.023000  
1 1 1 29 23 10 o 18.73000 0.4281000 18.43000 0.7576000 19.03000 0.3991000 -0.6015000     0.8562000 
1 1 1 29 23 12 o 11.47000 0.3925000 12.59000 0.5106000 10.35000 0.5963000 2.242000       0.7851000 
1 1 1 29 23 14 o 27.48000 0.2864000 27.08000 0.3925000 27.89000 0.4172000 -0.8053000     0.5728000 
1 1 1 29 23 16 o 35.85000 0.6237000 34.93000 0.4237000 36.76000 1.173000  -1.837000      1.247000  
1 1 1 29 23 18 o 14.33000 0.4387000 15.25000 0.3274000 13.41000 0.8141000 1.840000       0.8775000 
1 1 1 29 23 20 o 21.07000 0.3474000 20.94000 0.3156000 21.21000 0.6191000 -0.2714000     0.6949000 
1 1 1 29 23 22 o 3.916000 0.7960000 4.073000 0.8652000 3.758000 1.336000  0.3151000      1.592000  
1 1 1 29 23 24 o 9.841000 0.4447000 9.330000 0.4782000 10.35000 0.7499000 -1.022000      0.8894000 
1 1 1 29 23 26 o 3.087000 0.7865000 3.381000 1.005000  2.794000 1.210000  0.5864000      1.573000  
1 1 1 29 23 28 o 16.58000 0.3432000 16.70000 0.4330000 16.46000 0.5327000 0.2356000      0.6865000 
1 1 1 29 23 30 o 16.44000 0.3408000 16.58000 0.4138000 16.31000 0.5417000 0.2654000      0.6817000 
1 1 1 29 23 32 o 12.10000 0.4072000 12.29000 0.4920000 11.91000 0.6489000 0.3823000      0.8143000 
1 1 1 29 23 34 o 13.92000 0.4207000 13.60000 0.4234000 14.23000 0.7272000 -0.6225000     0.8415000 
1 1 1 29 23 36 o 18.48000 0.3328000 18.77000 0.3926000 18.19000 0.5375000 0.5778000      0.6656000 
1 1 1 29 23 38 o 17.49000 0.4083000 17.57000 0.3947000 17.40000 0.7150000 0.1686000      0.8167000 
1 1 1 29 23 40 o 7.685000 0.7150000 7.210000 0.7537000 8.159000 1.215000  -0.9493000     1.430000  
1 1 1 29 23 42 o 3.720000 0.9216000 3.052000 1.154000  4.388000 1.437000  -1.336000      1.843000  
1 1 1 29 23 44 o 3.470000 0.8935000 3.636000 1.273000  3.305000 1.254000  0.3305000      1.787000  
1 1 1 29 23 46 o 11.17000 0.6341000 11.98000 1.015000  10.35000 0.7609000 1.632000       1.268000  
1 1 1 29 24 1  o 26.58000 0.2865000 26.54000 0.3993000 26.63000 0.4108000 -0.9173000E-01 0.5729000 
1 1 1 29 24 3  o 26.09000 0.4232000 26.73000 0.6899000 25.46000 0.4904000 1.271000       0.8465000 
1 1 1 29 24 5  o 2.923000 0.8214000 3.051000 1.178000  2.795000 1.145000  0.2566000      1.643000  
1 1 1 29 24 7  o 10.75000 0.5212000 11.20000 0.7093000 10.31000 0.7639000 0.8939000      1.042000  
1 1 1 29 24 9  o 9.595000 0.4187000 10.18000 0.5752000 9.012000 0.6086000 1.166000       0.8374000 
1 1 1 29 24 11 o 16.12000 0.3808000 16.38000 0.4741000 15.85000 0.5961000 0.5298000      0.7617000 
1 1 1 29 24 13 o 23.44000 0.3453000 23.35000 0.5200000 23.54000 0.4544000 -0.1953000     0.6906000 
1 1 1 29 24 15 o 20.95000 0.3661000 21.50000 0.3111000 20.40000 0.6629000 1.103000       0.7323000 
1 1 1 29 24 17 o 31.41000 0.3584000 31.43000 0.3507000 31.39000 0.6251000 0.3574000E-01  0.7167000 
1 1 1 29 24 19 o 8.541000 0.6824000 9.469000 0.7717000 7.613000 1.126000  1.856000       1.365000  
1 1 1 29 24 21 o 15.15000 0.6213000 14.63000 0.3263000 15.67000 1.199000  -1.041000      1.243000  
1 1 1 29 24 23 o 16.80000 0.3050000 15.91000 0.3285000 17.69000 0.5139000 -1.785000      0.6099000 
1 1 1 29 24 25 o 16.81000 0.3141000 16.28000 0.3169000 17.33000 0.5424000 -1.051000      0.6282000 
1 1 1 29 24 27 o 2.929000 0.7763000 2.554000 0.9315000 3.303000 1.242000  -0.7487000     1.553000  
1 1 1 29 24 29 o 4.823000 0.7522000 4.663000 0.7486000 4.983000 1.305000  -0.3206000     1.504000  
1 1 1 29 24 31 o 11.22000 0.4243000 10.93000 0.5043000 11.50000 0.6824000 -0.5695000     0.8485000 
1 1 1 29 24 33 o 3.586000 0.8857000 3.407000 1.203000  3.765000 1.300000  -0.3581000     1.771000  
1 1 1 29 24 35 o 6.311000 0.6701000 5.306000 0.9461000 7.316000 0.9494000 -2.010000      1.340000  
1 1 1 29 24 37 o 7.252000 0.6870000 6.919000 0.6464000 7.584000 1.212000  -0.6647000     1.374000  
1 1 1 29 24 39 o 12.95000 0.4812000 13.34000 0.4330000 12.55000 0.8594000 0.7868000      0.9623000 
1 1 1 29 24 41 o 6.803000 0.7127000 6.875000 0.7436000 6.730000 1.216000  0.1452000      1.425000  
1 1 1 29 24 43 o 7.012000 0.7090000 6.802000 0.8014000 7.221000 1.170000  -0.4189000     1.418000  
1 1 1 29 24 45 o 5.575000 0.9425000 6.805000 1.280000  4.346000 1.383000  2.458000       1.885000  
1 1 1 29 24 47 o 7.280000 1.414000  9.261000 2.439000  5.299000 1.429000  3.962000       2.827000  
1 1 1 29 25 0  o 6.402000 0.8510000 6.402000 0.8510000 6.402000 0.8510000 0.000000       0.000000  
1 1 1 29 25 2  o 8.562000 0.4976000 9.257000 0.6090000 7.868000 0.7871000 1.389000       0.9952000 
1 1 1 29 25 4  o 9.332000 0.4347000 9.437000 0.6207000 9.228000 0.6088000 0.2097000      0.8694000 
1 1 1 29 25 6  o 15.93000 0.6601000 15.53000 1.231000  16.34000 0.4776000 -0.8141000     1.320000  
1 1 1 29 25 8  o 10.34000 0.4578000 10.54000 0.5340000 10.14000 0.7436000 0.3977000      0.9155000 
1 1 1 29 25 10 o 27.17000 0.2971000 27.79000 0.4028000 26.55000 0.4368000 1.238000       0.5942000 
1 1 1 29 25 12 o 20.05000 0.2796000 20.36000 0.3806000 19.74000 0.4098000 0.6210000      0.5593000 
1 1 1 29 25 14 o 18.25000 0.3886000 18.52000 0.5340000 17.97000 0.5646000 0.5471000      0.7771000 
1 1 1 29 25 16 o 39.55000 0.4441000 38.98000 0.5664000 40.12000 0.6841000 -1.134000      0.8882000 
1 1 1 29 25 18 o 4.779000 1.026000  4.868000 1.437000  4.690000 1.465000  0.1776000      2.052000  
1 1 1 29 25 20 o 16.85000 0.4292000 16.55000 0.6743000 17.15000 0.5312000 -0.5997000     0.8584000 
1 1 1 29 25 22 f 8.349000 0.6571000 8.553000 0.9338000 8.146000 0.9248000 0.4075000      1.314000  
1 1 1 29 25 24 o 13.53000 0.5485000 12.04000 0.9391000 15.02000 0.5672000 -2.986000      1.097000  
1 1 1 29 25 26 o 14.82000 0.4177000 14.38000 0.6471000 15.26000 0.5282000 -0.8839000     0.8353000 
1 1 1 29 25 28 o 13.40000 0.3660000 13.36000 0.4312000 13.43000 0.5916000 -0.7586000E-01 0.7321000 
1 1 1 29 25 30 o 9.894000 0.4334000 9.664000 0.5221000 10.12000 0.6919000 -0.4588000     0.8668000 
1 1 1 29 25 32 o 10.58000 0.4343000 10.37000 0.5388000 10.79000 0.6814000 -0.4132000     0.8687000 
1 1 1 29 25 34 o 8.363000 0.5995000 9.163000 0.6887000 7.564000 0.9814000 1.599000       1.199000  
1 1 1 29 25 36 o 3.680000 0.9385000 3.304000 1.245000  4.057000 1.405000  -0.7529000     1.877000  
1 1 1 29 25 38 o 12.42000 0.4968000 12.81000 0.4110000 12.03000 0.9045000 0.7853000      0.9935000 
1 1 1 29 25 40 o 6.351000 0.8644000 5.333000 1.265000  7.369000 1.179000  -2.037000      1.729000  
1 1 1 29 25 42 o 11.95000 0.5003000 10.96000 0.6926000 12.94000 0.7222000 -1.975000      1.001000  
1 1 1 29 25 44 o 6.894000 1.172000  6.849000 1.813000  6.938000 1.486000  -0.8923000E-01 2.345000  
1 1 1 29 25 46 o 5.102000 1.405000  6.863000 2.490000  3.340000 1.303000  3.523000       2.810000  
1 1 1 29 26 1  o 10.77000 0.3979000 10.89000 0.5430000 10.66000 0.5817000 0.2343000      0.7958000 
1 1 1 29 26 3  o 11.47000 0.3956000 11.93000 0.5365000 11.01000 0.5816000 0.9229000      0.7913000 
1 1 1 29 26 5  o 7.655000 0.7294000 7.542000 1.261000  7.767000 0.7337000 -0.2244000     1.459000  
1 1 1 29 26 7  o 14.43000 0.4294000 14.70000 0.4166000 14.16000 0.7510000 0.5382000      0.8588000 
1 1 1 29 26 9  o 28.89000 0.3330000 29.04000 0.4630000 28.73000 0.4788000 0.3059000      0.6660000 
1 1 1 29 26 11 o 20.69000 0.4117000 21.57000 0.6398000 19.81000 0.5182000 1.751000       0.8233000 
1 1 1 29 26 13 o 6.645000 0.8732000 5.966000 1.265000  7.323000 1.204000  -1.356000      1.746000  
1 1 1 29 26 15 o 23.14000 0.3908000 22.89000 0.5100000 23.39000 0.5924000 -0.4998000     0.7817000 
1 1 1 29 26 17 o 15.40000 0.4774000 15.09000 0.7008000 15.70000 0.6485000 -0.6181000     0.9549000 
1 1 1 29 26 19 o 11.42000 0.5490000 11.00000 0.8180000 11.83000 0.7324000 -0.8294000     1.098000  
1 1 1 29 26 21 o 5.293000 0.9823000 5.874000 1.336000  4.711000 1.441000  1.162000       1.965000  
1 1 1 29 26 23 o 5.340000 0.9438000 5.329000 1.324000  5.351000 1.346000  -0.2181000E-01 1.888000  
1 1 1 29 26 25 o 6.584000 0.9385000 5.570000 1.551000  7.598000 1.057000  -2.028000      1.877000  
1 1 1 29 26 27 o 3.235000 0.9432000 3.359000 1.389000  3.112000 1.276000  0.2467000      1.886000  
1 1 1 29 26 29 f 10.33000 0.4998000 10.17000 0.7542000 10.50000 0.6561000 -0.3266000     0.9997000 
1 1 1 29 26 31 o 4.123000 0.8373000 3.267000 1.070000  4.979000 1.288000  -1.712000      1.675000  
1 1 1 29 26 33 o 5.742000 0.8782000 6.132000 0.8294000 5.353000 1.548000  0.7784000      1.756000  
1 1 1 29 26 35 o 10.92000 0.4762000 11.29000 0.5717000 10.56000 0.7617000 0.7259000      0.9523000 
1 1 1 29 26 37 o 6.960000 0.7260000 6.073000 0.6707000 7.847000 1.288000  -1.775000      1.452000  
1 1 1 29 26 39 o 3.834000 1.029000  3.633000 1.423000  4.036000 1.487000  -0.4029000     2.058000  
1 1 1 29 26 41 o 5.667000 1.136000  5.200000 1.593000  6.134000 1.621000  -0.9343000     2.273000  
1 1 1 29 26 43 o 3.722000 1.041000  3.891000 1.553000  3.554000 1.387000  0.3363000      2.082000  
1 1 1 29 26 45 o 4.482000 1.209000  5.555000 2.021000  3.409000 1.327000  2.146000       2.418000  
1 1 1 29 27 0  o 3.624000 1.130000  3.624000 1.130000  3.624000 1.130000  0.000000       0.000000  
1 1 1 29 27 2  o 2.520000 0.7648000 2.603000 1.089000  2.437000 1.074000  0.1657000      1.530000  
1 1 1 29 27 4  o 23.14000 0.3865000 23.62000 0.6685000 22.66000 0.3882000 0.9530000      0.7730000 
1 1 1 29 27 6  o 12.81000 0.3282000 13.17000 0.4207000 12.46000 0.5039000 0.7153000      0.6564000 
1 1 1 29 27 8  o 14.58000 0.2987000 14.61000 0.3831000 14.55000 0.4585000 0.5740000E-01  0.5975000 
1 1 1 29 27 10 o 20.03000 0.3960000 19.23000 0.5409000 20.82000 0.5787000 -1.597000      0.7921000 
1 1 1 29 27 12 o 8.561000 1.133000  10.35000 1.043000  6.776000 2.011000  3.570000       2.266000  
1 1 1 29 27 14 o 15.72000 0.4600000 15.30000 0.7128000 16.15000 0.5818000 -0.8463000     0.9200000 
1 1 1 29 27 16 o 27.56000 0.4084000 27.03000 0.6007000 28.08000 0.5533000 -1.049000      0.8167000 
1 1 1 29 27 18 o 23.94000 0.3640000 24.12000 0.4997000 23.76000 0.5293000 0.3594000      0.7279000 
1 1 1 29 27 20 o 3.238000 0.9081000 2.858000 1.241000  3.617000 1.326000  -0.7592000     1.816000  
1 1 1 29 27 22 o 10.95000 0.4899000 10.66000 0.7274000 11.25000 0.6565000 -0.5922000     0.9799000 
1 1 1 29 27 24 o 13.38000 0.5175000 12.16000 0.8452000 14.59000 0.5975000 -2.428000      1.035000  
1 1 1 29 27 26 o 20.54000 0.4039000 20.39000 0.6289000 20.69000 0.5069000 -0.2957000     0.8078000 
1 1 1 29 27 28 f 6.184000 0.8630000 5.613000 1.368000  6.754000 1.052000  -1.141000      1.726000  
1 1 1 29 27 30 o 9.249000 0.5590000 9.240000 0.7808000 9.259000 0.8001000 -0.1942000E-01 1.118000  
1 1 1 29 27 32 o 12.98000 0.5086000 12.29000 0.7969000 13.67000 0.6323000 -1.385000      1.017000  
1 1 1 29 27 34 o 6.627000 0.7580000 6.570000 1.167000  6.684000 0.9677000 -0.1137000     1.516000  
1 1 1 29 27 36 f 4.414000 0.7885000 2.737000 1.101000  6.091000 1.129000  -3.354000      1.577000  
1 1 1 29 27 38 o 9.256000 0.8419000 9.065000 1.431000  9.447000 0.8869000 -0.3813000     1.684000  
1 1 1 29 27 40 o 3.489000 0.9797000 3.013000 1.347000  3.964000 1.423000  -0.9503000     1.959000  
1 1 1 29 27 42 o 12.09000 0.5672000 12.32000 0.8597000 11.86000 0.7402000 0.4668000      1.134000  
1 1 1 29 27 44 o 3.605000 1.038000  3.732000 1.436000  3.478000 1.498000  0.2537000      2.076000  
1 1 1 29 28 1  o 14.29000 0.3417000 14.78000 0.4293000 13.79000 0.5318000 0.9920000      0.6835000 
1 1 1 29 28 3  o 11.95000 0.3392000 12.07000 0.4735000 11.82000 0.4858000 0.2462000      0.6784000 
1 1 1 29 28 5  o 11.33000 0.3396000 11.26000 0.4737000 11.41000 0.4868000 -0.1508000     0.6793000 
1 1 1 29 28 7  o 13.58000 0.2939000 13.65000 0.3851000 13.52000 0.4441000 0.1277000      0.5878000 
1 1 1 29 28 9  o 16.66000 0.5916000 16.51000 0.6231000 16.81000 1.006000  -0.3042000     1.183000  
1 1 1 29 28 11 o 25.81000 0.5128000 26.53000 0.8987000 25.09000 0.4941000 1.442000       1.026000  
1 1 1 29 28 13 o 11.80000 0.5310000 11.20000 0.8475000 12.41000 0.6400000 -1.213000      1.062000  
1 1 1 29 28 15 o 10.70000 0.8179000 12.07000 0.6855000 9.336000 1.485000  2.731000       1.636000  
1 1 1 29 28 17 o 7.235000 0.8710000 8.200000 1.210000  6.269000 1.253000  1.931000       1.742000  
1 1 1 29 28 19 o 3.342000 0.9358000 3.879000 1.392000  2.806000 1.251000  1.073000       1.872000  
1 1 1 29 28 21 o 3.561000 1.009000  3.584000 1.385000  3.538000 1.468000  0.4565000E-01  2.018000  
1 1 1 29 28 23 o 13.34000 0.4919000 13.13000 0.7773000 13.54000 0.6029000 -0.4072000     0.9838000 
1 1 1 29 28 25 o 8.266000 0.6890000 7.613000 1.097000  8.920000 0.8341000 -1.308000      1.378000  
1 1 1 29 28 27 o 9.633000 0.5940000 8.542000 0.9481000 10.72000 0.7158000 -2.182000      1.188000  
1 1 1 29 28 29 o 13.91000 0.5771000 13.01000 0.8871000 14.82000 0.7384000 -1.814000      1.154000  
1 1 1 29 28 31 o 12.95000 0.4943000 13.10000 0.7578000 12.81000 0.6349000 0.2876000      0.9886000 
1 1 1 29 28 33 o 4.129000 1.103000  4.088000 1.363000  4.169000 1.735000  -0.8144000E-01 2.206000  
1 1 1 29 28 35 o 9.808000 0.7005000 9.859000 0.9803000 9.757000 1.001000  0.1017000      1.401000  
1 1 1 29 28 37 o 12.55000 0.6206000 13.25000 0.9918000 11.85000 0.7463000 1.400000       1.241000  
1 1 1 29 28 39 o 3.565000 1.022000  4.072000 1.556000  3.059000 1.325000  1.013000       2.044000  
1 1 1 29 28 41 o 3.451000 1.030000  3.661000 1.528000  3.240000 1.381000  0.4211000      2.060000  
1 1 1 29 28 43 o 4.881000 1.042000  4.267000 1.499000  5.495000 1.447000  -1.228000      2.083000  
1 1 1 29 29 0  o 31.22000 0.5163000 31.22000 0.5163000 31.22000 0.5163000 0.000000       0.000000  
1 1 1 29 29 2  o 18.33000 0.3553000 18.56000 0.5397000 18.10000 0.4624000 0.4661000      0.7107000 
1 1 1 29 29 4  o 10.84000 0.3628000 11.09000 0.5148000 10.59000 0.5114000 0.4994000      0.7256000 
1 1 1 29 29 6  o 9.459000 0.5035000 9.433000 0.4934000 9.485000 0.8777000 -0.5138000E-01 1.007000  
1 1 1 29 29 8  f 19.38000 0.4013000 19.79000 0.5942000 18.97000 0.5396000 0.8133000      0.8027000 
1 1 1 29 29 10 o 8.373000 0.5904000 8.233000 0.8215000 8.513000 0.8482000 -0.2805000     1.181000  
1 1 1 29 29 12 o 13.15000 0.4926000 12.95000 0.7514000 13.34000 0.6371000 -0.3897000     0.9851000 
1 1 1 29 29 14 o 18.99000 0.3776000 18.84000 0.5260000 19.13000 0.5418000 -0.2910000     0.7551000 
1 1 1 29 29 16 f 5.347000 0.9636000 4.681000 1.385000  6.014000 1.340000  -1.333000      1.927000  
1 1 1 29 29 18 o 2.656000 0.8526000 2.517000 1.152000  2.794000 1.258000  -0.2776000     1.705000  
1 1 1 29 29 20 o 4.275000 1.121000  4.182000 1.572000  4.368000 1.598000  -0.1856000     2.242000  
1 1 1 29 29 22 o 8.524000 0.6410000 8.644000 0.9032000 8.404000 0.9099000 0.2398000      1.282000  
1 1 1 29 29 24 o 2.852000 0.8802000 2.628000 1.245000  3.075000 1.245000  -0.4463000     1.760000  
1 1 1 29 29 26 o 3.476000 0.9664000 3.285000 1.356000  3.666000 1.378000  -0.3810000     1.933000  
1 1 1 29 29 28 o 4.875000 0.9622000 4.690000 1.420000  5.060000 1.299000  -0.3700000     1.924000  
1 1 1 29 29 30 o 4.119000 0.9330000 3.533000 1.407000  4.704000 1.226000  -1.170000      1.866000  
1 1 1 29 29 32 o 5.499000 1.006000  5.251000 1.272000  5.747000 1.560000  -0.4955000     2.013000  
1 1 1 29 29 34 o 5.469000 1.028000  5.853000 1.312000  5.084000 1.584000  0.7691000      2.057000  
1 1 1 29 29 36 o 3.935000 1.088000  3.585000 1.581000  4.285000 1.495000  -0.6999000     2.176000  
1 1 1 29 29 38 o 4.199000 1.077000  4.109000 1.574000  4.289000 1.471000  -0.1800000     2.155000  
1 1 1 29 29 40 o 6.609000 0.9488000 5.464000 1.478000  7.753000 1.191000  -2.289000      1.898000  
1 1 1 29 29 42 o 6.052000 1.012000  6.338000 1.413000  5.766000 1.450000  0.5719000      2.024000  
1 1 1 29 30 1  o 24.48000 0.3159000 24.57000 0.3962000 24.40000 0.4921000 0.1674000      0.6318000 
1 1 1 29 30 3  o 4.121000 0.7774000 4.499000 1.082000  3.743000 1.117000  0.7562000      1.555000  
1 1 1 29 30 5  o 7.063000 0.4802000 6.349000 0.6682000 7.778000 0.6899000 -1.429000      0.9604000 
1 1 1 29 30 7  o 11.09000 0.4860000 11.67000 0.6667000 10.52000 0.7075000 1.155000       0.9721000 
1 1 1 29 30 9  o 11.11000 0.5547000 11.40000 0.6836000 10.82000 0.8738000 0.5807000      1.109000  
1 1 1 29 30 11 o 6.868000 0.7282000 6.135000 1.178000  7.601000 0.8566000 -1.466000      1.456000  
1 1 1 29 30 13 o 10.79000 0.5158000 10.91000 0.7307000 10.67000 0.7282000 0.2395000      1.032000  
1 1 1 29 30 15 o 10.43000 0.5411000 10.87000 0.7166000 9.989000 0.8110000 0.8779000      1.082000  
1 1 1 29 30 17 o 17.33000 0.3957000 17.38000 0.5329000 17.27000 0.5851000 0.1088000      0.7914000 
1 1 1 29 30 19 o 6.388000 0.8170000 7.135000 0.9962000 5.641000 1.295000  1.494000       1.634000  
1 1 1 29 30 21 o 5.033000 1.038000  4.939000 1.221000  5.126000 1.679000  -0.1874000     2.076000  
1 1 1 29 30 23 f 3.189000 0.9024000 3.380000 1.289000  2.997000 1.263000  0.3832000      1.805000  
1 1 1 29 30 25 o 5.578000 1.042000  5.441000 1.474000  5.715000 1.472000  -0.2740000     2.083000  
1 1 1 29 30 27 o 10.31000 0.5730000 9.082000 0.9058000 11.54000 0.7022000 -2.462000      1.146000  
1 1 1 29 30 29 o 12.39000 0.5290000 12.22000 0.8340000 12.55000 0.6511000 -0.3332000     1.058000  
1 1 1 29 30 31 o 8.488000 0.6942000 7.989000 0.9440000 8.986000 1.018000  -0.9971000     1.388000  
1 1 1 29 30 33 o 4.902000 1.740000  4.902000 1.740000  ?        ?         ?              ?         
1 1 1 29 30 35 o 4.708000 1.095000  4.747000 1.644000  4.670000 1.447000  0.7635000E-01  2.190000  
1 1 1 29 30 37 o 15.27000 0.4773000 14.78000 0.7218000 15.76000 0.6246000 -0.9792000     0.9546000 
1 1 1 29 30 39 o 8.329000 0.7379000 9.016000 0.9993000 7.641000 1.086000  1.375000       1.476000  
1 1 1 29 30 41 o 4.938000 1.097000  4.845000 1.575000  5.031000 1.526000  -0.1864000     2.193000  
1 1 1 29 31 0  o 7.352000 0.6876000 7.352000 0.6876000 7.352000 0.6876000 0.000000       0.000000  
1 1 1 29 31 2  o 9.891000 0.4465000 10.53000 0.6203000 9.252000 0.6423000 1.279000       0.8929000 
1 1 1 29 31 4  o 20.46000 0.2694000 20.49000 0.3894000 20.43000 0.3725000 0.5132000E-01  0.5389000 
1 1 1 29 31 6  o 19.46000 0.3695000 20.36000 0.5237000 18.55000 0.5214000 1.810000       0.7390000 
1 1 1 29 31 8  o 5.116000 0.9239000 4.493000 1.318000  5.739000 1.295000  -1.246000      1.848000  
1 1 1 29 31 10 o 6.865000 0.7538000 7.614000 0.9554000 6.115000 1.166000  1.498000       1.508000  
1 1 1 29 31 12 o 13.44000 0.5180000 12.48000 0.8542000 14.40000 0.5864000 -1.917000      1.036000  
1 1 1 29 31 14 o 17.69000 0.3924000 17.66000 0.5452000 17.71000 0.5646000 -0.4537000E-01 0.7848000 
1 1 1 29 31 16 o 6.859000 0.7844000 6.877000 1.056000  6.841000 1.160000  0.3653000E-01  1.569000  
1 1 1 29 31 18 o 13.83000 0.4242000 13.33000 0.5874000 14.33000 0.6122000 -1.005000      0.8485000 
1 1 1 29 31 20 o 8.775000 0.6468000 9.031000 0.8154000 8.520000 1.004000  0.5104000      1.294000  
1 1 1 29 31 22 o 9.653000 0.5780000 9.144000 0.7679000 10.16000 0.8641000 -1.018000      1.156000  
1 1 1 29 31 24 f 5.115000 1.028000  4.634000 1.574000  5.595000 1.322000  -0.9608000     2.055000  
1 1 1 29 31 26 o 16.39000 0.4702000 15.92000 0.7664000 16.85000 0.5449000 -0.9261000     0.9404000 
1 1 1 29 31 28 o 6.363000 1.073000  7.257000 1.356000  5.470000 1.663000  1.787000       2.146000  
1 1 1 29 31 30 o 8.882000 0.7841000 9.547000 0.9427000 8.217000 1.253000  1.330000       1.568000  
1 1 1 29 31 32 o 3.123000 1.018000  3.529000 1.600000  2.716000 1.260000  0.8125000      2.037000  
1 1 1 29 31 34 o 3.282000 0.9551000 2.829000 1.212000  3.735000 1.477000  -0.9057000     1.910000  
1 1 1 29 31 36 o 6.336000 0.8847000 5.878000 1.395000  6.794000 1.089000  -0.9160000     1.769000  
1 1 1 29 31 38 o 4.025000 1.059000  4.500000 1.599000  3.550000 1.390000  0.9503000      2.118000  
1 1 1 29 31 40 o 5.757000 1.021000  5.486000 1.563000  6.029000 1.314000  -0.5423000     2.042000  
1 1 1 29 31 42 o 4.878000 2.091000  4.878000 2.091000  ?        ?         ?              ?         
1 1 1 29 32 1  o 34.48000 0.4259000 34.42000 0.7051000 34.55000 0.4779000 -0.1360000     0.8518000 
1 1 1 29 32 3  o 10.22000 0.3590000 11.13000 0.4831000 9.319000 0.5312000 1.811000       0.7181000 
1 1 1 29 32 5  o 4.483000 0.9053000 3.801000 1.326000  5.166000 1.233000  -1.365000      1.811000  
1 1 1 29 32 7  o 11.40000 0.4619000 12.22000 0.6177000 10.58000 0.6868000 1.640000       0.9237000 
1 1 1 29 32 9  o 14.51000 0.5050000 15.25000 0.5469000 13.77000 0.8491000 1.483000       1.010000  
1 1 1 29 32 11 o 3.869000 0.8829000 2.786000 1.222000  4.952000 1.274000  -2.166000      1.766000  
1 1 1 29 32 13 o 10.87000 0.5103000 10.64000 0.7172000 11.11000 0.7263000 -0.4704000     1.021000  
1 1 1 29 32 15 f 11.62000 0.4781000 11.85000 0.6515000 11.40000 0.7000000 0.4449000      0.9563000 
1 1 1 29 32 17 o 9.275000 0.5782000 9.098000 0.7633000 9.452000 0.8687000 -0.3538000     1.156000  
1 1 1 29 32 19 o 3.467000 0.9638000 3.071000 1.287000  3.862000 1.435000  -0.7909000     1.928000  
1 1 1 29 32 21 f 14.33000 0.5530000 15.00000 0.5905000 13.66000 0.9352000 1.346000       1.106000  
1 1 1 29 32 23 o 5.126000 1.004000  5.033000 1.350000  5.219000 1.487000  -0.1854000     2.009000  
1 1 1 29 32 25 o 8.194000 0.6817000 7.847000 1.037000  8.542000 0.8856000 -0.6945000     1.363000  
1 1 1 29 32 27 o 3.597000 1.006000  4.447000 1.569000  2.747000 1.259000  1.700000       2.011000  
1 1 1 29 32 29 o 4.584000 0.9716000 4.396000 1.378000  4.773000 1.370000  -0.3770000     1.943000  
1 1 1 29 32 31 o 4.902000 1.050000  4.194000 1.560000  5.609000 1.405000  -1.415000      2.100000  
1 1 1 29 32 33 o 9.851000 0.6011000 9.950000 0.8199000 9.752000 0.8792000 0.1978000      1.202000  
1 1 1 29 32 35 o 3.905000 1.087000  3.549000 1.579000  4.262000 1.493000  -0.7128000     2.174000  
1 1 1 29 32 37 o 7.079000 1.120000  7.907000 1.376000  6.252000 1.768000  1.656000       2.240000  
1 1 1 29 32 39 o 6.721000 0.9965000 6.473000 1.589000  6.969000 1.203000  -0.4966000     1.993000  
1 1 1 29 32 41 o 8.360000 0.7931000 8.163000 1.030000  8.556000 1.206000  -0.3929000     1.586000  
1 1 1 29 33 0  o 3.138000 1.100000  3.138000 1.100000  3.138000 1.100000  0.000000       0.000000  
1 1 1 29 33 2  o 5.066000 0.6939000 5.294000 1.083000  4.839000 0.8673000 0.4554000      1.388000  
1 1 1 29 33 4  o 12.63000 0.4311000 12.63000 0.5938000 12.62000 0.6251000 0.8615000E-02  0.8622000 
1 1 1 29 33 6  o 17.40000 0.3722000 18.20000 0.5064000 16.61000 0.5457000 1.588000       0.7444000 
1 1 1 29 33 8  f 13.36000 0.4271000 13.71000 0.5821000 13.00000 0.6250000 0.7118000      0.8541000 
1 1 1 29 33 10 o 21.87000 0.3578000 21.65000 0.5029000 22.09000 0.5092000 -0.4315000     0.7157000 
1 1 1 29 33 12 o 30.99000 0.4534000 30.91000 0.6502000 31.07000 0.6320000 -0.1591000     0.9067000 
1 1 1 29 33 14 o 3.011000 0.9029000 3.077000 1.290000  2.946000 1.264000  0.1309000      1.806000  
1 1 1 29 33 16 f 11.53000 0.4882000 11.55000 0.6521000 11.50000 0.7267000 0.4596000E-01  0.9764000 
1 1 1 29 33 18 o 6.123000 0.8178000 4.556000 1.366000  7.691000 0.9003000 -3.135000      1.636000  
1 1 1 29 33 20 o 12.74000 0.4800000 12.89000 0.6492000 12.60000 0.7071000 0.2846000      0.9600000 
1 1 1 29 33 22 o 11.88000 0.5564000 11.63000 0.8454000 12.14000 0.7235000 -0.5073000     1.113000  
1 1 1 29 33 24 o 4.506000 1.182000  4.794000 1.882000  4.218000 1.431000  0.5764000      2.364000  
1 1 1 29 33 26 o 9.748000 0.7889000 8.182000 0.9375000 11.31000 1.269000  -3.131000      1.578000  
1 1 1 29 33 28 o 3.058000 0.9104000 3.210000 1.351000  2.905000 1.221000  0.3046000      1.821000  
1 1 1 29 33 30 o 3.628000 1.067000  3.341000 1.499000  3.916000 1.520000  -0.5748000     2.135000  
1 1 1 29 33 32 o 7.872000 0.8898000 8.069000 1.022000  7.676000 1.457000  0.3933000      1.780000  
1 1 1 29 33 34 o 3.170000 0.9473000 2.819000 1.264000  3.520000 1.412000  -0.7007000     1.895000  
1 1 1 29 33 36 o 7.843000 0.9033000 7.742000 1.234000  7.943000 1.320000  -0.2014000     1.807000  
1 1 1 29 33 38 o 4.039000 1.168000  4.116000 1.714000  3.963000 1.586000  0.1529000      2.335000  
1 1 1 29 33 40 o 4.147000 1.041000  3.595000 1.477000  4.698000 1.467000  -1.103000      2.082000  
1 1 1 29 34 1  o 5.309000 0.5931000 6.410000 0.8565000 4.207000 0.8207000 2.203000       1.186000  
1 1 1 29 34 3  o 9.646000 0.3793000 10.16000 0.6637000 9.132000 0.3674000 1.027000       0.7586000 
1 1 1 29 34 5  o 12.45000 0.4174000 12.61000 0.5791000 12.30000 0.6014000 0.3030000      0.8348000 
1 1 1 29 34 7  o 5.934000 0.8107000 6.286000 1.030000  5.583000 1.252000  0.7031000      1.621000  
1 1 1 29 34 9  o 4.414000 1.036000  4.424000 1.256000  4.405000 1.647000  0.1919000E-01  2.071000  
1 1 1 29 34 11 o 11.24000 0.4642000 11.81000 0.6226000 10.67000 0.6888000 1.140000       0.9284000 
1 1 1 29 34 13 o 20.12000 0.3744000 20.27000 0.5203000 19.97000 0.5384000 0.2994000      0.7487000 
1 1 1 29 34 15 o 12.69000 0.4628000 12.72000 0.5989000 12.66000 0.7057000 0.5699000E-01  0.9255000 
1 1 1 29 34 17 o 8.421000 0.6063000 8.638000 0.7584000 8.203000 0.9463000 0.4356000      1.213000  
1 1 1 29 34 19 o 4.226000 0.9349000 4.863000 1.303000  3.590000 1.341000  1.273000       1.870000  
1 1 1 29 34 21 o 5.715000 1.015000  5.671000 1.217000  5.759000 1.624000  -0.8806000E-01 2.030000  
1 1 1 29 34 23 o 6.533000 1.079000  5.130000 1.640000  7.935000 1.403000  -2.805000      2.158000  
1 1 1 29 34 25 o 3.254000 0.9225000 2.267000 1.097000  4.242000 1.483000  -1.975000      1.845000  
1 1 1 29 34 27 o 3.983000 1.083000  4.268000 1.676000  3.698000 1.374000  0.5700000      2.167000  
1 1 1 29 34 29 o 3.107000 0.9382000 3.154000 1.342000  3.060000 1.311000  0.9392000E-01  1.876000  
1 1 1 29 34 31 o 8.529000 0.6883000 7.326000 1.080000  9.732000 0.8535000 -2.405000      1.377000  
1 1 1 29 34 33 o 3.913000 0.9942000 4.346000 1.438000  3.481000 1.373000  0.8650000      1.988000  
1 1 1 29 34 35 o 4.582000 1.018000  3.962000 1.441000  5.202000 1.438000  -1.240000      2.036000  
1 1 1 29 34 37 o 4.545000 1.074000  5.038000 1.573000  4.051000 1.462000  0.9871000      2.148000  
1 1 1 29 34 39 o 3.801000 1.071000  3.338000 1.442000  4.265000 1.583000  -0.9266000     2.142000  
1 1 1 29 35 0  o 2.416000 1.052000  2.416000 1.052000  2.416000 1.052000  0.000000       0.000000  
1 1 1 29 35 2  o 5.186000 0.8004000 5.405000 1.410000  4.966000 0.7585000 0.4389000      1.601000  
1 1 1 29 35 4  f 6.025000 0.7083000 5.171000 1.071000  6.878000 0.9269000 -1.707000      1.417000  
1 1 1 29 35 6  o 6.997000 0.6537000 6.920000 0.8179000 7.074000 1.020000  -0.1539000     1.307000  
1 1 1 29 35 8  o 10.32000 0.4951000 10.74000 0.6234000 9.906000 0.7692000 0.8300000      0.9901000 
1 1 1 29 35 10 o 7.345000 0.6264000 8.098000 0.7938000 6.591000 0.9692000 1.507000       1.253000  
1 1 1 29 35 12 o 14.27000 0.4741000 13.87000 0.7251000 14.67000 0.6110000 -0.8003000     0.9483000 
1 1 1 29 35 14 o 8.141000 0.6569000 8.471000 0.8291000 7.811000 1.019000  0.6601000      1.314000  
1 1 1 29 35 16 o 10.03000 0.5325000 10.01000 0.7316000 10.04000 0.7740000 -0.2899000E-01 1.065000  
1 1 1 29 35 18 o 6.753000 0.8158000 6.021000 1.256000  7.485000 1.042000  -1.464000      1.632000  
1 1 1 29 35 20 o 7.174000 0.8384000 8.620000 0.8206000 5.728000 1.462000  2.892000       1.677000  
1 1 1 29 35 22 o 6.392000 1.042000  4.106000 1.557000  8.678000 1.385000  -4.572000      2.084000  
1 1 1 29 35 24 o 3.506000 0.9721000 3.974000 1.454000  3.037000 1.291000  0.9378000      1.944000  
1 1 1 29 35 26 o 7.109000 1.043000  6.169000 1.715000  8.049000 1.188000  -1.879000      2.086000  
1 1 1 29 35 28 o 3.379000 1.006000  3.805000 1.517000  2.953000 1.323000  0.8516000      2.013000  
1 1 1 29 35 30 o 3.716000 0.9753000 4.326000 1.436000  3.107000 1.321000  1.219000       1.951000  
1 1 1 29 35 32 o 7.665000 0.7643000 7.349000 1.071000  7.981000 1.091000  -0.6326000     1.529000  
1 1 1 29 35 34 o 4.111000 1.039000  4.116000 1.516000  4.107000 1.421000  0.8915000E-02  2.078000  
1 1 1 29 35 36 o 7.092000 1.022000  6.817000 1.597000  7.366000 1.277000  -0.5499000     2.044000  
1 1 1 29 35 38 o 3.310000 1.006000  3.803000 1.576000  2.817000 1.250000  0.9855000      2.012000  
1 1 1 29 36 1  o 8.665000 0.3798000 8.948000 0.5064000 8.382000 0.5662000 0.5652000      0.7596000 
1 1 1 29 36 3  o 13.56000 0.4611000 12.84000 0.4481000 14.27000 0.8060000 -1.430000      0.9222000 
1 1 1 29 36 5  o 9.396000 0.5034000 9.931000 0.6877000 8.861000 0.7354000 1.070000       1.007000  
1 1 1 29 36 7  o 12.87000 0.4462000 14.08000 0.5772000 11.65000 0.6806000 2.432000       0.8924000 
1 1 1 29 36 9  o 5.681000 0.8431000 5.172000 1.226000  6.190000 1.158000  -1.018000      1.686000  
1 1 1 29 36 11 o 4.308000 0.9651000 4.320000 1.347000  4.297000 1.382000  0.2266000E-01  1.930000  
1 1 1 29 36 13 o 4.986000 0.9334000 6.126000 1.188000  3.845000 1.440000  2.281000       1.867000  
1 1 1 29 36 15 o 5.598000 0.9273000 5.858000 1.206000  5.339000 1.409000  0.5186000      1.855000  
1 1 1 29 36 17 o 3.183000 0.9063000 3.457000 1.302000  2.910000 1.261000  0.5472000      1.813000  
1 1 1 29 36 19 o 7.274000 0.8824000 6.370000 1.315000  8.179000 1.177000  -1.809000      1.765000  
1 1 1 29 36 21 o 3.265000 0.9572000 3.427000 1.333000  3.103000 1.374000  0.3238000      1.914000  
1 1 1 29 36 23 o 4.173000 1.036000  3.864000 1.519000  4.482000 1.409000  -0.6188000     2.072000  
1 1 1 29 36 25 o 9.084000 0.8507000 9.989000 1.140000  8.179000 1.263000  1.809000       1.701000  
1 1 1 29 36 27 o 11.70000 0.5761000 12.72000 0.7750000 10.69000 0.8526000 2.029000       1.152000  
1 1 1 29 36 29 o 11.08000 0.5736000 11.75000 0.7479000 10.40000 0.8699000 1.355000       1.147000  
1 1 1 29 36 31 f 4.399000 1.031000  5.008000 1.484000  3.791000 1.433000  1.217000       2.063000  
1 1 1 29 36 33 o 8.337000 0.7335000 8.565000 1.015000  8.110000 1.060000  0.4551000      1.467000  
1 1 1 29 36 35 o 4.375000 1.055000  4.833000 1.522000  3.917000 1.459000  0.9168000      2.109000  
1 1 1 29 36 37 o 5.918000 1.900000  5.918000 1.900000  ?        ?         ?              ?         
1 1 1 29 37 0  o 5.790000 0.6501000 5.790000 0.6501000 5.790000 0.6501000 0.000000       0.000000  
1 1 1 29 37 2  o 13.78000 0.4621000 13.71000 0.3898000 13.84000 0.8380000 -0.1313000     0.9242000 
1 1 1 29 37 4  o 4.071000 1.002000  2.670000 1.080000  5.471000 1.689000  -2.801000      2.004000  
1 1 1 29 37 6  o 5.551000 0.9504000 6.172000 0.9961000 4.931000 1.619000  1.241000       1.901000  
1 1 1 29 37 8  o 3.155000 0.8969000 3.041000 1.248000  3.269000 1.289000  -0.2283000     1.794000  
1 1 1 29 37 10 f 8.737000 0.7327000 8.978000 0.8208000 8.495000 1.214000  0.4826000      1.465000  
1 1 1 29 37 12 o 11.18000 0.6236000 11.06000 0.9743000 11.31000 0.7785000 -0.2503000     1.247000  
1 1 1 29 37 14 o 3.900000 0.9681000 3.227000 1.342000  4.573000 1.396000  -1.346000      1.936000  
1 1 1 29 37 16 o 8.451000 0.7863000 7.760000 1.179000  9.141000 1.040000  -1.381000      1.573000  
1 1 1 29 37 18 o 6.540000 0.9908000 5.046000 1.685000  8.035000 1.043000  -2.989000      1.982000  
1 1 1 29 37 20 o 3.795000 0.9931000 3.573000 1.381000  4.018000 1.428000  -0.4454000     1.986000  
1 1 1 29 37 22 o 5.050000 1.049000  4.945000 1.619000  5.155000 1.333000  -0.2094000     2.097000  
1 1 1 29 37 24 o 4.053000 1.073000  4.096000 1.474000  4.009000 1.561000  0.8736000E-01  2.147000  
1 1 1 29 37 26 o 7.295000 0.8385000 6.197000 1.315000  8.392000 1.041000  -2.195000      1.677000  
1 1 1 29 37 28 o 4.889000 1.005000  5.428000 1.442000  4.350000 1.400000  1.078000       2.010000  
1 1 1 29 37 30 o 2.847000 0.9201000 2.719000 1.274000  2.975000 1.328000  -0.2569000     1.840000  
1 1 1 29 37 32 o 9.065000 0.7798000 8.602000 1.050000  9.527000 1.153000  -0.9251000     1.560000  
1 1 1 29 37 34 o 3.759000 1.075000  4.037000 1.555000  3.481000 1.484000  0.5557000      2.150000  
1 1 1 29 37 36 o 5.274000 2.063000  5.274000 2.063000  ?        ?         ?              ?         
1 1 1 29 38 1  o 4.048000 0.8126000 4.808000 1.101000  3.289000 1.195000  1.519000       1.625000  
1 1 1 29 38 3  o 3.576000 0.9797000 3.230000 1.217000  3.922000 1.536000  -0.6923000     1.959000  
1 1 1 29 38 5  o 11.89000 0.5633000 12.71000 0.4839000 11.07000 1.017000  1.643000       1.127000  
1 1 1 29 38 7  o 15.96000 0.4526000 16.07000 0.4385000 15.85000 0.7919000 0.2216000      0.9052000 
1 1 1 29 38 9  o 3.453000 0.9288000 3.145000 1.279000  3.760000 1.347000  -0.6151000     1.858000  
1 1 1 29 38 11 o 10.60000 0.5664000 11.20000 0.6796000 10.00000 0.9062000 1.199000       1.133000  
1 1 1 29 38 13 o 12.73000 0.5829000 13.30000 0.7464000 12.17000 0.8956000 1.128000       1.166000  
1 1 1 29 38 15 o 15.37000 0.4876000 14.94000 0.7453000 15.79000 0.6289000 -0.8569000     0.9751000 
1 1 1 29 38 17 o 2.953000 0.9141000 2.928000 1.287000  2.979000 1.299000  -0.5022000E-01 1.828000  
1 1 1 29 38 19 o 7.675000 0.8097000 6.748000 1.357000  8.603000 0.8834000 -1.856000      1.619000  
1 1 1 29 38 21 o 4.288000 1.049000  3.527000 1.373000  5.050000 1.587000  -1.523000      2.098000  
1 1 1 29 38 23 o 4.079000 1.027000  4.964000 1.553000  3.194000 1.344000  1.770000       2.054000  
1 1 1 29 38 25 o 5.207000 1.005000  4.853000 1.445000  5.562000 1.396000  -0.7091000     2.009000  
1 1 1 29 38 27 o 3.924000 1.051000  3.659000 1.463000  4.190000 1.511000  -0.5305000     2.103000  
1 1 1 29 38 29 o 4.904000 1.071000  5.117000 1.550000  4.690000 1.479000  0.4272000      2.142000  
1 1 1 29 38 31 o 5.069000 1.255000  4.854000 1.762000  5.284000 1.786000  -0.4297000     2.509000  
1 1 1 29 38 33 o 4.098000 1.043000  3.601000 1.392000  4.596000 1.554000  -0.9950000     2.086000  
1 1 1 29 39 0  o 12.58000 0.8297000 12.58000 0.8297000 12.58000 0.8297000 0.000000       0.000000  
1 1 1 29 39 2  o 6.848000 0.8793000 7.606000 0.5980000 6.090000 1.654000  1.516000       1.759000  
1 1 1 29 39 4  o 6.527000 0.8872000 7.127000 0.7114000 5.926000 1.625000  1.201000       1.774000  
1 1 1 29 39 6  o 7.033000 0.9826000 7.561000 0.6964000 6.505000 1.838000  1.055000       1.965000  
1 1 1 29 39 8  o 10.17000 0.8025000 10.27000 0.6220000 10.07000 1.480000  0.2038000      1.605000  
1 1 1 29 39 10 o 11.12000 0.8932000 11.94000 0.6007000 10.29000 1.682000  1.656000       1.786000  
1 1 1 29 39 12 o 20.74000 0.5662000 21.44000 0.9881000 20.04000 0.5530000 1.396000       1.132000  
1 1 1 29 39 14 o 8.859000 0.6327000 8.574000 0.8605000 9.143000 0.9278000 -0.5692000     1.265000  
1 1 1 29 39 16 o 5.117000 0.9807000 3.684000 1.454000  6.551000 1.317000  -2.868000      1.961000  
1 1 1 29 39 18 o 4.100000 1.063000  4.165000 1.473000  4.034000 1.533000  0.1310000      2.126000  
1 1 1 29 39 20 o 6.464000 1.110000  6.779000 1.110000  6.149000 1.921000  0.6299000      2.219000  
1 1 1 29 39 22 o 17.57000 0.4946000 17.85000 0.7480000 17.29000 0.6473000 0.5560000      0.9892000 
1 1 1 29 39 24 o 4.520000 1.029000  4.249000 1.515000  4.791000 1.393000  -0.5412000     2.058000  
1 1 1 29 39 26 o 3.307000 0.9732000 2.991000 1.288000  3.622000 1.460000  -0.6305000     1.946000  
1 1 1 29 39 28 o 4.318000 1.146000  3.917000 1.513000  4.718000 1.721000  -0.8012000     2.291000  
1 1 1 29 39 30 o 7.197000 0.9053000 7.799000 1.252000  6.596000 1.308000  1.203000       1.811000  
1 1 1 29 39 32 o 7.138000 0.8307000 8.433000 1.075000  5.843000 1.267000  2.590000       1.661000  
1 1 1 29 40 1  o 8.308000 1.058000  8.645000 0.6553000 7.970000 2.012000  0.6751000      2.116000  
1 1 1 29 40 3  o 6.625000 1.391000  6.387000 2.116000  6.863000 1.808000  -0.4763000     2.783000  
1 1 1 29 40 5  o 6.631000 1.180000  6.078000 0.8979000 7.184000 2.183000  -1.106000      2.361000  
1 1 1 29 40 7  o 8.328000 0.7567000 9.193000 0.6546000 7.463000 1.365000  1.730000       1.513000  
1 1 1 29 40 9  o 3.337000 0.9575000 2.805000 1.160000  3.870000 1.524000  -1.065000      1.915000  
1 1 1 29 40 11 f 6.889000 0.9224000 7.272000 0.8607000 6.507000 1.632000  0.7650000      1.845000  
1 1 1 29 40 13 o 9.829000 0.7542000 10.32000 0.9862000 9.340000 1.141000  0.9774000      1.508000  
1 1 1 29 40 15 f 5.193000 0.9324000 4.660000 1.489000  5.726000 1.123000  -1.066000      1.865000  
1 1 1 29 40 17 o 3.130000 0.9453000 3.125000 1.280000  3.134000 1.392000  -0.8557000E-02 1.891000  
1 1 1 29 40 19 f 6.079000 0.9067000 6.790000 1.048000  5.367000 1.480000  1.422000       1.813000  
1 1 1 29 40 21 o 9.425000 0.6391000 9.696000 0.8746000 9.154000 0.9320000 0.5429000      1.278000  
1 1 1 29 40 23 o 4.590000 1.092000  3.882000 1.606000  5.297000 1.479000  -1.416000      2.183000  
1 1 1 29 40 25 o 3.907000 1.074000  3.937000 1.475000  3.877000 1.561000  0.6004000E-01  2.148000  
1 1 1 29 40 27 f 4.527000 1.031000  5.392000 1.408000  3.662000 1.506000  1.730000       2.061000  
1 1 1 29 40 29 o 3.787000 1.003000  4.163000 1.465000  3.411000 1.371000  0.7526000      2.006000  
1 1 1 29 40 31 o 6.061000 1.083000  6.704000 1.300000  5.419000 1.732000  1.285000       2.166000  
1 1 1 29 41 0  o 2.163000 0.8867000 2.163000 0.8867000 2.163000 0.8867000 0.000000       0.000000  
1 1 1 29 41 2  o 4.975000 1.052000  3.486000 1.392000  6.463000 1.577000  -2.977000      2.104000  
1 1 1 29 41 4  o 5.440000 1.025000  6.009000 1.081000  4.870000 1.742000  1.139000       2.050000  
1 1 1 29 41 6  o 8.596000 0.7052000 8.406000 0.6274000 8.787000 1.263000  -0.3810000     1.410000  
1 1 1 29 41 8  o 4.196000 1.025000  4.249000 1.230000  4.143000 1.640000  0.1058000      2.050000  
1 1 1 29 41 10 o 8.000000 0.9127000 8.620000 1.070000  7.381000 1.479000  1.238000       1.825000  
1 1 1 29 41 12 f 9.936000 0.7453000 10.56000 0.6737000 9.315000 1.330000  1.241000       1.491000  
1 1 1 29 41 14 o 4.567000 1.131000  4.532000 1.184000  4.602000 1.927000  -0.6964000E-01 2.262000  
1 1 1 29 41 16 o 4.193000 1.022000  4.505000 1.379000  3.880000 1.509000  0.6249000      2.044000  
1 1 1 29 41 18 o 7.804000 0.7747000 7.242000 1.142000  8.366000 1.047000  -1.124000      1.549000  
1 1 1 29 41 20 o 4.568000 1.041000  4.373000 1.405000  4.763000 1.536000  -0.3906000     2.082000  
1 1 1 29 41 22 o 4.708000 0.9645000 2.734000 1.237000  6.681000 1.480000  -3.947000      1.929000  
1 1 1 29 41 24 o 3.314000 1.010000  3.029000 1.368000  3.599000 1.488000  -0.5706000     2.021000  
1 1 1 29 41 26 o 5.170000 1.015000  4.745000 1.525000  5.594000 1.341000  -0.8487000     2.030000  
1 1 1 29 41 28 o 4.340000 1.013000  3.944000 1.426000  4.736000 1.440000  -0.7922000     2.027000  
1 1 1 29 41 30 o 10.61000 0.7923000 11.31000 0.7525000 9.908000 1.395000  1.406000       1.585000  
1 1 1 29 42 1  o 5.227000 1.240000  4.396000 1.619000  6.058000 1.880000  -1.662000      2.481000  
1 1 1 29 42 3  o 11.22000 0.7796000 11.53000 0.6451000 10.92000 1.419000  0.6081000      1.559000  
1 1 1 29 42 5  f 9.895000 0.8289000 10.36000 0.5979000 9.433000 1.546000  0.9253000      1.658000  
1 1 1 29 42 7  o 5.741000 1.034000  4.719000 1.105000  6.763000 1.747000  -2.044000      2.068000  
1 1 1 29 42 9  o 10.01000 0.8018000 9.871000 0.6121000 10.15000 1.482000  -0.2788000     1.604000  
1 1 1 29 42 11 o 4.867000 1.043000  4.580000 1.164000  5.155000 1.730000  -0.5746000     2.086000  
1 1 1 29 42 13 o 4.128000 1.035000  3.713000 1.260000  4.543000 1.642000  -0.8297000     2.070000  
1 1 1 29 42 15 o 9.245000 0.7458000 9.990000 0.6144000 8.499000 1.359000  1.490000       1.492000  
1 1 1 29 42 17 o 10.53000 0.6610000 11.53000 0.6210000 9.522000 1.167000  2.009000       1.322000  
1 1 1 29 42 19 o 4.524000 1.109000  4.386000 1.513000  4.663000 1.621000  -0.2767000     2.217000  
1 1 1 29 42 21 o 9.728000 0.7359000 9.232000 1.200000  10.22000 0.8525000 -0.9908000     1.472000  
1 1 1 29 42 23 o 3.718000 0.9781000 4.234000 1.373000  3.202000 1.394000  1.032000       1.956000  
1 1 1 29 42 25 o 9.176000 0.7846000 9.926000 1.218000  8.426000 0.9891000 1.500000       1.569000  
1 1 1 29 42 27 o 3.489000 1.002000  3.240000 1.391000  3.738000 1.443000  -0.4981000     2.004000  
1 1 1 29 42 29 f 3.270000 1.548000  ?        ?         3.270000 1.548000  ?              ?         
1 1 1 29 43 0  o 5.818000 1.481000  5.818000 1.481000  5.818000 1.481000  0.000000       0.000000  
1 1 1 29 43 2  f 10.20000 0.7636000 11.47000 0.8700000 8.927000 1.255000  2.548000       1.527000  
1 1 1 29 43 4  o 4.208000 1.151000  4.400000 1.640000  4.016000 1.616000  0.3845000      2.302000  
1 1 1 29 43 6  o 5.693000 0.8534000 5.553000 0.9094000 5.834000 1.444000  -0.2808000     1.707000  
1 1 1 29 43 8  o 3.064000 0.9668000 2.323000 1.037000  3.804000 1.632000  -1.481000      1.934000  
1 1 1 29 43 10 o 4.650000 1.059000  3.971000 1.337000  5.329000 1.642000  -1.358000      2.117000  
1 1 1 29 43 12 o 5.630000 1.063000  5.702000 1.179000  5.559000 1.770000  0.1432000      2.127000  
1 1 1 29 43 14 o 6.233000 0.9678000 6.673000 0.9294000 5.793000 1.698000  0.8801000      1.936000  
1 1 1 29 43 16 o 3.438000 0.9856000 3.419000 1.266000  3.456000 1.511000  -0.3665000E-01 1.971000  
1 1 1 29 43 18 o 2.872000 0.9279000 2.623000 1.148000  3.121000 1.458000  -0.4988000     1.856000  
1 1 1 29 43 20 o 5.190000 1.124000  4.477000 1.255000  5.903000 1.865000  -1.427000      2.248000  
1 1 1 29 43 22 o 10.89000 0.6186000 10.61000 0.7655000 11.17000 0.9720000 -0.5530000     1.237000  
1 1 1 29 43 24 o 6.040000 0.9159000 5.694000 1.361000  6.387000 1.226000  -0.6930000     1.832000  
1 1 1 29 43 26 o 4.580000 1.106000  4.280000 1.475000  4.879000 1.647000  -0.5989000     2.211000  
1 1 1 29 44 1  o 3.950000 1.095000  4.202000 1.557000  3.697000 1.539000  0.5044000      2.189000  
1 1 1 29 44 3  o 4.430000 1.122000  4.534000 1.573000  4.326000 1.601000  0.2081000      2.245000  
1 1 1 29 44 5  o 11.51000 0.6617000 12.10000 0.9466000 10.91000 0.9247000 1.183000       1.323000  
1 1 1 29 44 7  o 10.29000 0.6720000 10.40000 0.7149000 10.19000 1.138000  0.2008000      1.344000  
1 1 1 29 44 9  o 4.008000 1.059000  4.273000 1.389000  3.743000 1.599000  0.5305000      2.118000  
1 1 1 29 44 11 o 5.269000 0.9984000 4.223000 1.161000  6.316000 1.625000  -2.094000      1.997000  
1 1 1 29 44 13 o 3.463000 0.9748000 3.365000 1.215000  3.560000 1.525000  -0.1954000     1.950000  
1 1 1 29 44 15 o 4.670000 1.008000  5.495000 1.210000  3.846000 1.613000  1.649000       2.016000  
1 1 1 29 44 17 o 4.698000 1.055000  4.986000 1.324000  4.410000 1.643000  0.5764000      2.110000  
1 1 1 29 44 19 o 3.239000 0.9716000 2.480000 1.091000  3.998000 1.608000  -1.518000      1.943000  
1 1 1 29 44 21 o 7.282000 0.8837000 6.114000 1.120000  8.450000 1.367000  -2.336000      1.767000  
1 1 1 29 44 23 o 8.340000 0.7924000 7.952000 0.8582000 8.729000 1.332000  -0.7770000     1.585000  
1 1 1 29 44 25 o 5.610000 2.234000  5.610000 2.234000  ?        ?         ?              ?         
1 1 1 29 45 0  o 11.33000 1.015000  11.33000 1.015000  11.33000 1.015000  0.000000       0.000000  
1 1 1 29 45 2  o 7.462000 0.9882000 7.635000 1.263000  7.288000 1.520000  0.3469000      1.976000  
1 1 1 29 45 4  o 4.691000 1.198000  5.302000 1.891000  4.081000 1.471000  1.221000       2.396000  
1 1 1 29 45 6  o 3.593000 1.080000  3.498000 1.499000  3.687000 1.555000  -0.1893000     2.160000  
1 1 1 29 45 8  o 6.227000 1.016000  5.169000 1.204000  7.285000 1.637000  -2.116000      2.032000  
1 1 1 29 45 10 o 5.785000 0.9432000 6.616000 1.109000  4.953000 1.526000  1.663000       1.886000  
1 1 1 29 45 12 o 4.124000 1.044000  3.659000 1.321000  4.589000 1.617000  -0.9295000     2.088000  
1 1 1 29 45 14 o 3.869000 0.9993000 3.532000 1.303000  4.206000 1.515000  -0.6740000     1.999000  
1 1 1 29 45 16 o 2.399000 0.8241000 1.982000 0.9622000 2.816000 1.338000  -0.8340000     1.648000  
1 1 1 29 45 18 o 5.375000 0.9557000 6.116000 1.013000  4.635000 1.621000  1.480000       1.911000  
1 1 1 29 45 20 o 4.837000 0.9944000 5.252000 1.172000  4.422000 1.607000  0.8303000      1.989000  
1 1 1 29 45 22 o 6.643000 1.319000  5.577000 1.178000  7.709000 2.359000  -2.132000      2.637000  
1 1 1 29 46 1  o 4.972000 1.199000  5.031000 1.690000  4.913000 1.702000  0.1173000      2.399000  
1 1 1 29 46 3  o 4.685000 1.026000  5.685000 1.437000  3.686000 1.466000  2.000000       2.053000  
1 1 1 29 46 5  o 12.87000 0.6867000 13.65000 0.9268000 12.09000 1.014000  1.559000       1.373000  
1 1 1 29 46 7  o 5.819000 1.158000  4.550000 1.747000  7.089000 1.521000  -2.538000      2.316000  
1 1 1 29 46 9  o 6.349000 1.079000  6.592000 1.515000  6.105000 1.537000  0.4868000      2.158000  
1 1 1 29 46 11 o 4.358000 1.113000  3.989000 1.514000  4.727000 1.632000  -0.7382000     2.227000  
1 1 1 29 46 13 o 4.308000 0.9751000 4.781000 1.221000  3.835000 1.521000  0.9458000      1.950000  
1 1 1 29 46 15 o 5.342000 1.018000  5.599000 1.142000  5.084000 1.686000  0.5154000      2.036000  
1 1 1 29 46 17 o 3.245000 0.9708000 2.812000 1.190000  3.678000 1.534000  -0.8667000     1.942000  
1 1 1 29 46 19 f 4.458000 1.127000  4.222000 1.531000  4.695000 1.655000  -0.4736000     2.254000  
1 1 1 29 47 0  o 4.716000 1.683000  4.716000 1.683000  4.716000 1.683000  0.000000       0.000000  
1 1 1 29 47 2  o 3.515000 1.052000  3.554000 1.482000  3.475000 1.494000  0.7843000E-01  2.104000  
1 1 1 29 47 4  o 3.432000 1.025000  3.481000 1.481000  3.382000 1.417000  0.9844000E-01  2.049000  
1 1 1 29 47 6  o 4.352000 1.178000  3.564000 1.498000  5.141000 1.818000  -1.577000      2.355000  
1 1 1 29 47 8  o 4.835000 1.207000  4.150000 1.675000  5.521000 1.737000  -1.370000      2.413000  
1 1 1 29 47 10 o 7.324000 1.155000  8.109000 1.393000  6.540000 1.843000  1.569000       2.310000  
1 1 1 29 47 12 o 5.095000 1.121000  5.269000 1.511000  4.921000 1.656000  0.3481000      2.241000  
1 1 1 29 47 14 o 3.951000 1.070000  3.672000 1.302000  4.231000 1.699000  -0.5597000     2.140000  
1 1 1 29 47 16 o 3.251000 0.9454000 3.385000 1.305000  3.116000 1.368000  0.2685000      1.891000  
1 1 1 29 48 1  o 4.329000 1.192000  4.915000 1.794000  3.743000 1.568000  1.172000       2.383000  
1 1 1 29 48 3  o 3.662000 1.042000  3.578000 1.460000  3.747000 1.487000  -0.1690000     2.084000  
1 1 1 29 48 5  o 5.596000 1.351000  4.771000 1.698000  6.422000 2.102000  -1.651000      2.702000  
1 1 1 29 48 7  o 4.521000 1.246000  4.744000 1.926000  4.298000 1.582000  0.4460000      2.492000  
1 1 1 29 48 9  o 5.322000 1.247000  4.882000 1.698000  5.762000 1.828000  -0.8802000     2.495000  
1 1 1 29 48 11 o 6.418000 1.125000  6.705000 1.563000  6.131000 1.619000  0.5742000      2.250000  
1 1 1 29 48 13 o 5.354000 1.361000  5.291000 1.610000  5.416000 2.195000  -0.1257000     2.723000  
1 1 1 29 49 0  o 13.68000 0.9734000 13.68000 0.9734000 13.68000 0.9734000 0.000000       0.000000  
1 1 1 29 49 2  o 5.055000 1.218000  6.212000 1.788000  3.898000 1.655000  2.315000       2.436000  
1 1 1 29 49 4  o 4.279000 1.259000  4.603000 1.950000  3.956000 1.593000  0.6471000      2.518000  
1 1 1 29 49 6  o 6.095000 1.149000  5.648000 1.616000  6.542000 1.634000  -0.8941000     2.298000  
1 1 1 29 49 8  o 4.339000 1.292000  4.403000 1.960000  4.275000 1.685000  0.1282000      2.585000  
1 1 1 30 0  0  o 71.15000 1.024000  71.15000 1.024000  71.15000 1.024000  0.000000       0.000000  
1 1 1 30 0  2  o 49.05000 0.5414000 49.05000 0.5414000 49.05000 0.5414000 0.000000       0.000000  
1 1 1 30 0  4  o 27.22000 0.4276000 27.22000 0.4276000 27.22000 0.4276000 0.000000       0.000000  
1 1 1 30 0  6  o 45.04000 0.5135000 45.04000 0.5135000 45.04000 0.5135000 0.000000       0.000000  
1 1 1 30 0  8  o 4.747000 1.301000  4.747000 1.301000  4.747000 1.301000  0.000000       0.000000  
1 1 1 30 0  10 o 39.07000 0.4740000 39.07000 0.4740000 39.07000 0.4740000 0.000000       0.000000  
1 1 1 30 0  12 o 22.45000 0.4959000 22.45000 0.4959000 22.45000 0.4959000 0.000000       0.000000  
1 1 1 30 0  14 o 48.25000 0.5379000 48.25000 0.5379000 48.25000 0.5379000 0.000000       0.000000  
1 1 1 30 0  16 o 16.64000 0.5229000 16.64000 0.5229000 16.64000 0.5229000 0.000000       0.000000  
1 1 1 30 0  18 o 14.63000 0.5443000 14.63000 0.5443000 14.63000 0.5443000 0.000000       0.000000  
1 1 1 30 0  20 o 5.004000 1.322000  5.004000 1.322000  5.004000 1.322000  0.000000       0.000000  
1 1 1 30 0  22 o 8.908000 0.8578000 8.908000 0.8578000 8.908000 0.8578000 0.000000       0.000000  
1 1 1 30 0  24 o 6.753000 1.035000  6.753000 1.035000  6.753000 1.035000  0.000000       0.000000  
1 1 1 30 0  26 o 4.252000 1.337000  4.252000 1.337000  4.252000 1.337000  0.000000       0.000000  
1 1 1 30 0  28 o 22.74000 0.4445000 22.74000 0.4445000 22.74000 0.4445000 0.000000       0.000000  
1 1 1 30 0  30 o 4.089000 1.544000  4.089000 1.544000  4.089000 1.544000  0.000000       0.000000  
1 1 1 30 0  32 o 5.697000 1.068000  5.697000 1.068000  5.697000 1.068000  0.000000       0.000000  
1 1 1 30 0  34 o 14.66000 0.5420000 14.66000 0.5420000 14.66000 0.5420000 0.000000       0.000000  
1 1 1 30 0  36 o 12.58000 0.7030000 12.58000 0.7030000 12.58000 0.7030000 0.000000       0.000000  
1 1 1 30 0  38 o 2.899000 1.248000  2.899000 1.248000  2.899000 1.248000  0.000000       0.000000  
1 1 1 30 0  40 o 3.229000 1.330000  3.229000 1.330000  3.229000 1.330000  0.000000       0.000000  
1 1 1 30 0  42 o 6.020000 1.781000  6.020000 1.781000  6.020000 1.781000  0.000000       0.000000  
1 1 1 30 0  44 o 3.364000 1.369000  3.364000 1.369000  3.364000 1.369000  0.000000       0.000000  
1 1 1 30 0  46 o 5.076000 1.384000  5.076000 1.384000  5.076000 1.384000  0.000000       0.000000  
1 1 1 30 0  48 o 3.253000 1.429000  3.253000 1.429000  3.253000 1.429000  0.000000       0.000000  
1 1 1 30 0  50 o 3.289000 1.332000  3.289000 1.332000  3.289000 1.332000  0.000000       0.000000  
1 1 1 30 0  52 o 12.13000 0.6924000 12.13000 0.6924000 12.13000 0.6924000 0.000000       0.000000  
1 1 1 30 1  1  o 45.95000 0.3680000 45.97000 0.5217000 45.93000 0.5193000 0.3901000E-01  0.7360000 
1 1 1 30 1  3  o 28.92000 0.2995000 29.01000 0.4212000 28.83000 0.4258000 0.1735000      0.5989000 
1 1 1 30 1  5  o 13.38000 0.3641000 13.66000 0.5022000 13.11000 0.5274000 0.5524000      0.7283000 
1 1 1 30 1  7  o 21.12000 0.3107000 20.91000 0.4402000 21.34000 0.4386000 -0.4261000     0.6214000 
1 1 1 30 1  9  o 43.90000 0.3587000 43.75000 0.5067000 44.05000 0.5077000 -0.2963000     0.7173000 
1 1 1 30 1  11 f 11.11000 0.4574000 11.37000 0.6566000 10.85000 0.6369000 0.5198000      0.9147000 
1 1 1 30 1  13 o 33.68000 0.3900000 33.83000 0.4473000 33.53000 0.6390000 0.2955000      0.7800000 
1 1 1 30 1  15 o 30.69000 0.3283000 30.57000 0.4310000 30.80000 0.4953000 -0.2316000     0.6566000 
1 1 1 30 1  17 f 20.89000 0.3373000 21.12000 0.5032000 20.67000 0.4491000 0.4527000      0.6745000 
1 1 1 30 1  19 o 25.86000 0.3190000 25.93000 0.4458000 25.79000 0.4565000 0.1337000      0.6381000 
1 1 1 30 1  21 o 23.12000 0.3154000 23.65000 0.4510000 22.60000 0.4411000 1.048000       0.6308000 
1 1 1 30 1  23 o 14.66000 0.3850000 14.54000 0.5535000 14.79000 0.5352000 -0.2535000     0.7699000 
1 1 1 30 1  25 o 13.35000 0.3986000 13.71000 0.5457000 13.00000 0.5811000 0.7071000      0.7972000 
1 1 1 30 1  27 o 25.17000 0.3080000 25.26000 0.4360000 25.08000 0.4351000 0.1818000      0.6159000 
1 1 1 30 1  29 o 8.452000 0.6245000 8.717000 0.7685000 8.187000 0.9845000 0.5299000      1.249000  
1 1 1 30 1  31 o 18.27000 0.3625000 18.67000 0.5776000 17.87000 0.4380000 0.7948000      0.7249000 
1 1 1 30 1  33 o 11.04000 0.4761000 10.28000 0.7149000 11.81000 0.6290000 -1.535000      0.9522000 
1 1 1 30 1  35 o 13.81000 0.4172000 14.16000 0.4924000 13.46000 0.6736000 0.6984000      0.8344000 
1 1 1 30 1  37 o 10.58000 0.5550000 10.10000 0.8756000 11.05000 0.6822000 -0.9506000     1.110000  
1 1 1 30 1  39 f 9.134000 0.6774000 10.38000 0.8437000 7.890000 1.060000  2.489000       1.355000  
1 1 1 30 1  41 f 6.521000 0.9503000 7.349000 1.477000  5.694000 1.196000  1.655000       1.901000  
1 1 1 30 1  43 o 8.964000 0.6768000 8.239000 1.037000  9.690000 0.8704000 -1.451000      1.354000  
1 1 1 30 1  45 o 5.938000 1.004000  5.791000 1.426000  6.086000 1.413000  -0.2949000     2.007000  
1 1 1 30 1  47 o 8.178000 0.7584000 8.163000 1.003000  8.193000 1.138000  -0.2949000E-01 1.517000  
1 1 1 30 1  49 o 9.263000 0.6803000 8.685000 1.118000  9.842000 0.7759000 -1.157000      1.361000  
1 1 1 30 1  51 o 9.438000 0.5800000 8.807000 0.8388000 10.07000 0.8012000 -1.263000      1.160000  
1 1 1 30 2  0  o 16.25000 0.4818000 16.25000 0.4818000 16.25000 0.4818000 0.000000       0.000000  
1 1 1 30 2  2  o 9.153000 0.5018000 9.458000 0.7019000 8.848000 0.7174000 0.6099000      1.004000  
1 1 1 30 2  4  o 12.17000 0.4022000 12.35000 0.5551000 11.99000 0.5821000 0.3650000      0.8043000 
1 1 1 30 2  6  o 22.55000 0.3004000 22.54000 0.4189000 22.56000 0.4306000 -0.2186000E-01 0.6007000 
1 1 1 30 2  8  o 60.60000 0.4869000 59.98000 0.7314000 61.23000 0.6430000 -1.252000      0.9738000 
1 1 1 30 2  10 o 36.68000 0.3551000 36.94000 0.5381000 36.42000 0.4636000 0.5189000      0.7103000 
1 1 1 30 2  12 o 36.48000 0.3557000 35.71000 0.4604000 37.24000 0.5424000 -1.533000      0.7114000 
1 1 1 30 2  14 o 4.569000 0.9548000 3.608000 1.308000  5.530000 1.391000  -1.922000      1.910000  
1 1 1 30 2  16 o 19.09000 0.3473000 18.87000 0.4593000 19.31000 0.5211000 -0.4348000     0.6947000 
1 1 1 30 2  18 o 18.56000 0.3523000 18.75000 0.5252000 18.36000 0.4697000 0.3942000      0.7046000 
1 1 1 30 2  20 o 38.71000 0.3466000 38.82000 0.4883000 38.61000 0.4921000 0.2069000      0.6933000 
1 1 1 30 2  22 f 31.19000 0.3208000 30.80000 0.4522000 31.58000 0.4551000 -0.7791000     0.6416000 
1 1 1 30 2  24 o 5.607000 0.8562000 5.739000 1.234000  5.476000 1.187000  0.2627000      1.712000  
1 1 1 30 2  26 o 6.383000 0.8176000 6.776000 1.023000  5.991000 1.276000  0.7856000      1.635000  
1 1 1 30 2  28 o 5.939000 0.7468000 5.974000 1.099000  5.904000 1.011000  0.7078000E-01  1.494000  
1 1 1 30 2  30 o 11.44000 0.4168000 11.76000 0.5831000 11.13000 0.5956000 0.6287000      0.8335000 
1 1 1 30 2  32 o 10.95000 0.5051000 10.85000 0.7665000 11.05000 0.6580000 -0.2023000     1.010000  
1 1 1 30 2  34 o 11.79000 0.4416000 11.82000 0.6623000 11.77000 0.5843000 0.4806000E-01  0.8832000 
1 1 1 30 2  36 o 13.02000 0.4669000 13.26000 0.5558000 12.77000 0.7503000 0.4928000      0.9337000 
1 1 1 30 2  38 o 4.450000 1.012000  4.716000 1.501000  4.184000 1.357000  0.5314000      2.024000  
1 1 1 30 2  40 o 8.029000 0.7657000 6.828000 1.337000  9.229000 0.7462000 -2.402000      1.531000  
1 1 1 30 2  42 o 4.041000 0.9676000 4.027000 1.420000  4.055000 1.315000  -0.2845000E-01 1.935000  
1 1 1 30 2  44 o 4.400000 1.001000  3.912000 1.417000  4.887000 1.412000  -0.9752000     2.001000  
1 1 1 30 2  46 o 3.422000 0.9997000 3.017000 1.329000  3.828000 1.493000  -0.8110000     1.999000  
1 1 1 30 2  48 o 4.222000 1.075000  4.543000 1.553000  3.902000 1.485000  0.6412000      2.149000  
1 1 1 30 2  50 o 5.172000 1.054000  5.225000 1.589000  5.120000 1.387000  0.1052000      2.109000  
1 1 1 30 2  52 o 8.996000 0.6751000 9.899000 0.9953000 8.093000 0.9122000 1.807000       1.350000  
1 1 1 30 3  1  o 27.88000 0.3008000 27.77000 0.4325000 27.98000 0.4183000 -0.2066000     0.6017000 
1 1 1 30 3  3  o 26.17000 0.3023000 26.10000 0.4247000 26.23000 0.4304000 -0.1330000     0.6046000 
1 1 1 30 3  5  o 45.18000 0.3630000 45.37000 0.5125000 44.99000 0.5143000 0.3745000      0.7261000 
1 1 1 30 3  7  o 32.88000 0.3341000 32.34000 0.5021000 33.41000 0.4410000 -1.070000      0.6682000 
1 1 1 30 3  9  o 43.02000 0.3831000 43.21000 0.5791000 42.82000 0.5018000 0.3926000      0.7663000 
1 1 1 30 3  11 o 66.34000 0.4855000 66.17000 0.6854000 66.51000 0.6878000 -0.3328000     0.9710000 
1 1 1 30 3  13 o 14.48000 0.3917000 14.46000 0.4914000 14.49000 0.6100000 -0.2837000E-01 0.7834000 
1 1 1 30 3  15 o 6.133000 0.8071000 5.533000 1.130000  6.732000 1.153000  -1.199000      1.614000  
1 1 1 30 3  17 o 22.02000 0.3180000 21.92000 0.4411000 22.11000 0.4581000 -0.1900000     0.6359000 
1 1 1 30 3  19 o 15.84000 0.3860000 15.84000 0.5568000 15.84000 0.5349000 -0.1365000E-02 0.7721000 
1 1 1 30 3  21 o 18.69000 0.3798000 18.80000 0.4911000 18.58000 0.5796000 0.2240000      0.7597000 
1 1 1 30 3  23 o 4.062000 0.9825000 4.665000 1.426000  3.458000 1.352000  1.207000       1.965000  
1 1 1 30 3  25 f 3.169000 0.9280000 2.808000 1.221000  3.529000 1.398000  -0.7201000     1.856000  
1 1 1 30 3  27 o 31.86000 0.3193000 31.68000 0.4507000 32.04000 0.4523000 -0.3665000     0.6385000 
1 1 1 30 3  29 o 12.20000 0.4376000 12.72000 0.6387000 11.68000 0.5983000 1.039000       0.8752000 
1 1 1 30 3  31 o 12.80000 0.4583000 13.60000 0.6179000 12.01000 0.6770000 1.591000       0.9166000 
1 1 1 30 3  33 o 4.887000 0.9356000 4.956000 1.343000  4.817000 1.303000  0.1396000      1.871000  
1 1 1 30 3  35 o 10.31000 0.5126000 10.49000 0.6896000 10.12000 0.7587000 0.3661000      1.025000  
1 1 1 30 3  37 o 9.485000 0.6067000 9.722000 0.7955000 9.248000 0.9163000 0.4742000      1.213000  
1 1 1 30 3  39 o 10.09000 0.5539000 10.80000 0.8333000 9.375000 0.7301000 1.425000       1.108000  
1 1 1 30 3  41 o 13.02000 0.4291000 12.91000 0.6276000 13.13000 0.5854000 -0.2208000     0.8582000 
1 1 1 30 3  43 o 3.492000 0.9951000 3.732000 1.477000  3.252000 1.334000  0.4793000      1.990000  
1 1 1 30 3  45 o 12.98000 0.5801000 13.30000 0.6733000 12.67000 0.9449000 0.6300000      1.160000  
1 1 1 30 3  47 o 5.726000 0.9712000 6.927000 1.111000  4.524000 1.593000  2.403000       1.942000  
1 1 1 30 3  49 o 8.306000 0.6666000 8.809000 0.8766000 7.804000 1.005000  1.005000       1.333000  
1 1 1 30 3  51 o 6.207000 0.9199000 6.696000 1.115000  5.718000 1.463000  0.9781000      1.840000  
1 1 1 30 4  0  o 33.01000 0.4491000 33.01000 0.4491000 33.01000 0.4491000 0.000000       0.000000  
1 1 1 30 4  2  o 28.31000 0.3020000 28.37000 0.4245000 28.25000 0.4296000 0.1211000      0.6040000 
1 1 1 30 4  4  o 37.98000 0.3311000 37.66000 0.4628000 38.29000 0.4736000 -0.6281000     0.6621000 
1 1 1 30 4  6  o 10.23000 0.4758000 9.573000 0.7550000 10.88000 0.5793000 -1.306000      0.9516000 
1 1 1 30 4  8  o 39.95000 0.3685000 40.00000 0.5573000 39.90000 0.4823000 0.9943000E-01  0.7370000 
1 1 1 30 4  10 o 43.71000 0.3588000 43.38000 0.5051000 44.04000 0.5097000 -0.6586000     0.7175000 
1 1 1 30 4  12 o 23.28000 0.3084000 23.22000 0.4399000 23.33000 0.4324000 -0.1086000     0.6168000 
1 1 1 30 4  14 o 9.764000 0.5882000 9.973000 0.6546000 9.555000 0.9775000 0.4181000      1.176000  
1 1 1 30 4  16 o 44.41000 0.3641000 44.54000 0.5143000 44.28000 0.5155000 0.2563000      0.7282000 
1 1 1 30 4  18 o 43.66000 0.3892000 43.32000 0.5848000 44.01000 0.5138000 -0.6954000     0.7785000 
1 1 1 30 4  20 o 10.98000 0.4622000 11.45000 0.6225000 10.50000 0.6833000 0.9496000      0.9244000 
1 1 1 30 4  22 o 16.53000 0.4191000 16.00000 0.5861000 17.07000 0.5993000 -1.070000      0.8382000 
1 1 1 30 4  24 o 22.55000 0.3568000 22.07000 0.4711000 23.03000 0.5361000 -0.9613000     0.7137000 
1 1 1 30 4  26 o 8.810000 0.5526000 8.843000 0.8106000 8.778000 0.7513000 0.6526000E-01  1.105000  
1 1 1 30 4  28 o 17.91000 0.3487000 17.90000 0.5222000 17.92000 0.4623000 -0.2058000E-01 0.6974000 
1 1 1 30 4  30 o 18.44000 0.4127000 18.11000 0.6464000 18.77000 0.5132000 -0.6568000     0.8253000 
1 1 1 30 4  32 o 14.40000 0.3891000 14.36000 0.5216000 14.44000 0.5776000 -0.8356000E-01 0.7782000 
1 1 1 30 4  34 o 19.50000 0.3556000 19.76000 0.4643000 19.25000 0.5389000 0.5132000      0.7113000 
1 1 1 30 4  36 o 15.23000 0.4377000 14.89000 0.6363000 15.58000 0.6011000 -0.6839000     0.8753000 
1 1 1 30 4  38 o 21.48000 0.3466000 21.68000 0.5104000 21.27000 0.4692000 0.4134000      0.6933000 
1 1 1 30 4  40 o 2.773000 0.8748000 2.549000 1.204000  2.998000 1.269000  -0.4492000     1.750000  
1 1 1 30 4  42 o 7.273000 0.7300000 7.512000 1.105000  7.035000 0.9540000 0.4774000      1.460000  
1 1 1 30 4  44 o 12.96000 0.5760000 13.26000 0.6359000 12.66000 0.9606000 0.6069000      1.152000  
1 1 1 30 4  46 o 4.068000 0.9414000 3.131000 1.350000  5.005000 1.312000  -1.874000      1.883000  
1 1 1 30 4  48 o 4.059000 1.095000  4.223000 1.407000  3.894000 1.678000  0.3287000      2.190000  
1 1 1 30 4  50 o 7.105000 0.7604000 7.852000 0.9772000 6.359000 1.165000  1.493000       1.521000  
1 1 1 30 4  52 o 13.03000 0.4424000 13.40000 0.5961000 12.66000 0.6538000 0.7392000      0.8847000 
1 1 1 30 5  1  f 22.02000 0.3023000 21.86000 0.4311000 22.18000 0.4238000 -0.3226000     0.6045000 
1 1 1 30 5  3  o 39.52000 0.3643000 39.23000 0.5464000 39.80000 0.4819000 -0.5718000     0.7286000 
1 1 1 30 5  5  o 16.02000 0.3637000 16.61000 0.5409000 15.43000 0.4865000 1.186000       0.7275000 
1 1 1 30 5  7  o 17.72000 0.3303000 17.79000 0.4742000 17.66000 0.4599000 0.1350000      0.6606000 
1 1 1 30 5  9  o 54.24000 0.4483000 53.24000 0.5776000 55.24000 0.6858000 -2.003000      0.8966000 
1 1 1 30 5  11 o 23.64000 0.3592000 23.95000 0.5087000 23.34000 0.5072000 0.6137000      0.7183000 
1 1 1 30 5  13 o 41.94000 0.4295000 41.32000 0.4901000 42.56000 0.7056000 -1.246000      0.8591000 
1 1 1 30 5  15 o 44.83000 0.4558000 44.36000 0.5177000 45.30000 0.7503000 -0.9417000     0.9115000 
1 1 1 30 5  17 o 22.83000 0.3165000 22.67000 0.4465000 22.99000 0.4488000 -0.3263000     0.6330000 
1 1 1 30 5  19 o 11.04000 0.4650000 11.38000 0.6513000 10.70000 0.6639000 0.6766000      0.9301000 
1 1 1 30 5  21 o 30.08000 0.3506000 30.46000 0.4514000 29.70000 0.5366000 0.7547000      0.7012000 
1 1 1 30 5  23 o 32.08000 0.3273000 31.27000 0.4611000 32.88000 0.4647000 -1.613000      0.6547000 
1 1 1 30 5  25 o 16.38000 0.3488000 16.18000 0.4968000 16.58000 0.4896000 -0.4063000     0.6975000 
1 1 1 30 5  27 o 8.586000 0.6645000 8.291000 1.074000  8.882000 0.7826000 -0.5913000     1.329000  
1 1 1 30 5  29 o 17.00000 0.3283000 16.89000 0.4731000 17.11000 0.4552000 -0.2216000     0.6565000 
1 1 1 30 5  31 o 8.510000 0.5984000 8.849000 0.7420000 8.172000 0.9390000 0.6766000      1.197000  
1 1 1 30 5  33 o 13.29000 0.4156000 13.14000 0.4964000 13.43000 0.6666000 -0.2898000     0.8311000 
1 1 1 30 5  35 o 7.788000 0.7689000 6.773000 1.288000  8.803000 0.8398000 -2.030000      1.538000  
1 1 1 30 5  37 o 13.23000 0.4657000 13.31000 0.5889000 13.16000 0.7215000 0.1469000      0.9313000 
1 1 1 30 5  39 f 9.464000 0.5552000 9.766000 0.8022000 9.163000 0.7678000 0.6032000      1.110000  
1 1 1 30 5  41 o 6.818000 0.8303000 6.093000 1.389000  7.544000 0.9105000 -1.450000      1.661000  
1 1 1 30 5  43 f 8.930000 0.6817000 7.842000 0.9618000 10.02000 0.9664000 -2.176000      1.363000  
1 1 1 30 5  45 o 3.686000 0.9812000 3.965000 1.433000  3.407000 1.340000  0.5576000      1.962000  
1 1 1 30 5  47 o 3.020000 0.9231000 2.785000 1.258000  3.256000 1.352000  -0.4707000     1.846000  
1 1 1 30 5  49 o 2.583000 0.8483000 2.478000 1.148000  2.687000 1.249000  -0.2093000     1.697000  
1 1 1 30 5  51 o 3.171000 0.9125000 2.934000 1.230000  3.408000 1.348000  -0.4742000     1.825000  
1 1 1 30 6  0  o 27.55000 0.4916000 27.55000 0.4916000 27.55000 0.4916000 0.000000       0.000000  
1 1 1 30 6  2  f 5.041000 0.9256000 5.117000 1.368000  4.965000 1.247000  0.1522000      1.851000  
1 1 1 30 6  4  o 25.84000 0.3428000 25.94000 0.4790000 25.74000 0.4904000 0.1991000      0.6856000 
1 1 1 30 6  6  o 21.86000 0.3323000 22.07000 0.4344000 21.65000 0.5031000 0.4128000      0.6647000 
1 1 1 30 6  8  o 39.83000 0.3675000 39.89000 0.4852000 39.76000 0.5521000 0.1303000      0.7350000 
1 1 1 30 6  10 o 48.30000 0.4658000 48.18000 0.5382000 48.42000 0.7604000 -0.2434000     0.9316000 
1 1 1 30 6  12 o 41.72000 0.4282000 41.60000 0.4903000 41.85000 0.7020000 -0.2520000     0.8563000 
1 1 1 30 6  14 o 9.174000 0.5721000 9.285000 0.7327000 9.063000 0.8790000 0.2222000      1.144000  
1 1 1 30 6  16 o 7.224000 0.7498000 9.140000 0.7324000 5.308000 1.309000  3.832000       1.500000  
1 1 1 30 6  18 o 35.31000 0.4023000 34.80000 0.4525000 35.82000 0.6654000 -1.029000      0.8046000 
1 1 1 30 6  20 o 20.72000 0.4152000 21.15000 0.4886000 20.29000 0.6713000 0.8622000      0.8303000 
1 1 1 30 6  22 f 8.868000 0.5790000 9.115000 0.7853000 8.620000 0.8512000 0.4951000      1.158000  
1 1 1 30 6  24 o 31.28000 0.3678000 30.97000 0.5306000 31.59000 0.5094000 -0.6151000     0.7356000 
1 1 1 30 6  26 f 5.108000 0.9026000 4.938000 1.347000  5.278000 1.202000  -0.3400000     1.805000  
1 1 1 30 6  28 o 7.663000 0.6108000 7.617000 0.9303000 7.710000 0.7917000 -0.9395000E-01 1.222000  
1 1 1 30 6  30 o 19.00000 0.3213000 19.23000 0.4651000 18.76000 0.4436000 0.4684000      0.6427000 
1 1 1 30 6  32 o 13.39000 0.4400000 13.32000 0.4844000 13.45000 0.7346000 -0.1253000     0.8799000 
1 1 1 30 6  34 o 6.450000 0.7465000 6.218000 1.015000  6.682000 1.095000  -0.4645000     1.493000  
1 1 1 30 6  36 o 16.06000 0.3773000 16.02000 0.4637000 16.10000 0.5952000 -0.7296000E-01 0.7546000 
1 1 1 30 6  38 o 26.48000 0.3521000 26.59000 0.4591000 26.36000 0.5339000 0.2334000      0.7041000 
1 1 1 30 6  40 o 8.499000 0.6011000 8.441000 0.8788000 8.558000 0.8203000 -0.1167000     1.202000  
1 1 1 30 6  42 o 8.855000 0.8134000 8.081000 1.324000  9.629000 0.9448000 -1.547000      1.627000  
1 1 1 30 6  44 o 9.204000 0.6558000 9.263000 0.8218000 9.144000 1.022000  0.1182000      1.312000  
1 1 1 30 6  46 o 5.324000 0.9582000 5.320000 1.410000  5.329000 1.298000  -0.8560000E-02 1.916000  
1 1 1 30 6  48 o 8.221000 0.6715000 7.690000 1.001000  8.752000 0.8955000 -1.062000      1.343000  
1 1 1 30 6  50 f 6.981000 0.8334000 6.067000 1.194000  7.895000 1.163000  -1.828000      1.667000  
1 1 1 30 6  52 o 7.045000 1.064000  7.140000 1.398000  6.950000 1.603000  0.1897000      2.127000  
1 1 1 30 7  1  o 26.82000 0.3470000 26.80000 0.4941000 26.84000 0.4874000 -0.3679000E-01 0.6940000 
1 1 1 30 7  3  o 7.194000 0.7691000 7.253000 0.8922000 7.136000 1.253000  0.1169000      1.538000  
1 1 1 30 7  5  o 8.841000 0.5765000 9.820000 0.6825000 7.861000 0.9292000 1.959000       1.153000  
1 1 1 30 7  7  o 27.18000 0.3036000 27.96000 0.4336000 26.40000 0.4252000 1.561000       0.6073000 
1 1 1 30 7  9  o 31.24000 0.3794000 31.58000 0.4450000 30.91000 0.6147000 0.6645000      0.7588000 
1 1 1 30 7  11 o 7.498000 0.7332000 7.599000 0.8325000 7.397000 1.207000  0.2016000      1.466000  
1 1 1 30 7  13 o 6.242000 0.8177000 5.758000 1.159000  6.726000 1.154000  -0.9686000     1.635000  
1 1 1 30 7  15 o 32.31000 0.3972000 31.97000 0.4508000 32.65000 0.6542000 -0.6818000     0.7945000 
1 1 1 30 7  17 o 13.19000 0.4086000 13.48000 0.5336000 12.90000 0.6190000 0.5763000      0.8172000 
1 1 1 30 7  19 o 17.30000 0.3783000 16.95000 0.4801000 17.64000 0.5848000 -0.6894000     0.7567000 
1 1 1 30 7  21 o 7.868000 0.7534000 8.031000 0.9431000 7.705000 1.175000  0.3266000      1.507000  
1 1 1 30 7  23 o 42.74000 0.4413000 43.21000 0.7239000 42.27000 0.5050000 0.9375000      0.8826000 
1 1 1 30 7  25 o 8.827000 0.6097000 8.909000 0.9534000 8.745000 0.7601000 0.1638000      1.219000  
1 1 1 30 7  27 f 12.95000 0.4135000 12.83000 0.6341000 13.08000 0.5308000 -0.2542000     0.8269000 
1 1 1 30 7  29 o 15.03000 0.3525000 15.12000 0.5013000 14.95000 0.4957000 0.1652000      0.7050000 
1 1 1 30 7  31 o 2.333000 0.7699000 2.430000 1.096000  2.235000 1.081000  0.1948000      1.540000  
1 1 1 30 7  33 o 6.906000 0.6926000 7.116000 0.7790000 6.697000 1.145000  0.4184000      1.385000  
1 1 1 30 7  35 o 15.99000 0.3784000 16.23000 0.4795000 15.75000 0.5854000 0.4746000      0.7567000 
1 1 1 30 7  37 o 16.45000 0.3847000 15.93000 0.4589000 16.96000 0.6175000 -1.030000      0.7693000 
1 1 1 30 7  39 o 9.928000 0.5993000 9.439000 0.9763000 10.42000 0.6954000 -0.9789000     1.199000  
1 1 1 30 7  41 o 4.993000 0.9833000 4.997000 1.312000  4.989000 1.465000  0.7423000E-02  1.967000  
1 1 1 30 7  43 o 5.041000 0.9995000 4.762000 1.543000  5.319000 1.270000  -0.5575000     1.999000  
1 1 1 30 7  45 f 6.214000 0.8342000 6.935000 1.043000  5.493000 1.303000  1.442000       1.668000  
1 1 1 30 7  47 o 6.549000 0.8237000 7.108000 1.094000  5.990000 1.231000  1.118000       1.647000  
1 1 1 30 7  49 o 4.747000 1.010000  5.002000 1.396000  4.492000 1.461000  0.5103000      2.021000  
1 1 1 30 7  51 o 3.574000 0.9652000 3.937000 1.406000  3.212000 1.323000  0.7241000      1.930000  
1 1 1 30 8  0  f 10.62000 0.7412000 10.62000 0.7412000 10.62000 0.7412000 0.000000       0.000000  
1 1 1 30 8  2  o 44.40000 0.4403000 44.56000 0.5095000 44.24000 0.7182000 0.3220000      0.8805000 
1 1 1 30 8  4  o 48.78000 0.4155000 48.28000 0.5389000 49.28000 0.6326000 -1.004000      0.8310000 
1 1 1 30 8  6  o 22.17000 0.3284000 22.09000 0.4248000 22.24000 0.5010000 -0.1520000     0.6568000 
1 1 1 30 8  8  o 50.63000 0.4790000 49.95000 0.5560000 51.32000 0.7801000 -1.362000      0.9580000 
1 1 1 30 8  10 o 21.85000 0.3650000 21.82000 0.5176000 21.88000 0.5147000 -0.6249000E-01 0.7299000 
1 1 1 30 8  12 o 3.151000 0.9146000 3.390000 1.295000  2.911000 1.292000  0.4792000      1.829000  
1 1 1 30 8  14 o 36.73000 0.3304000 36.49000 0.4639000 36.96000 0.4707000 -0.4677000     0.6609000 
1 1 1 30 8  16 o 38.15000 0.3677000 37.56000 0.4713000 38.73000 0.5646000 -1.173000      0.7355000 
1 1 1 30 8  18 o 29.43000 0.3358000 29.12000 0.4371000 29.74000 0.5098000 -0.6238000     0.6715000 
1 1 1 30 8  20 o 10.69000 0.5378000 10.93000 0.8324000 10.45000 0.6813000 0.4766000      1.076000  
1 1 1 30 8  22 o 8.501000 0.6740000 8.957000 0.8736000 8.044000 1.027000  0.9137000      1.348000  
1 1 1 30 8  24 o 15.27000 0.4110000 14.61000 0.5521000 15.93000 0.6090000 -1.329000      0.8220000 
1 1 1 30 8  26 o 11.64000 0.4808000 11.98000 0.7262000 11.30000 0.6305000 0.6816000      0.9617000 
1 1 1 30 8  28 o 12.14000 0.3978000 12.26000 0.5633000 12.03000 0.5620000 0.2367000      0.7957000 
1 1 1 30 8  30 o 3.546000 0.9838000 3.702000 1.390000  3.389000 1.393000  0.3127000      1.968000  
1 1 1 30 8  32 o 10.30000 0.5001000 10.18000 0.5518000 10.42000 0.8343000 -0.2420000     1.000000  
1 1 1 30 8  34 o 13.29000 0.4030000 13.66000 0.4823000 12.92000 0.6457000 0.7377000      0.8060000 
1 1 1 30 8  36 o 18.10000 0.3484000 17.87000 0.4279000 18.34000 0.5501000 -0.4728000     0.6969000 
1 1 1 30 8  38 o 6.990000 0.7150000 6.314000 0.9213000 7.666000 1.094000  -1.352000      1.430000  
1 1 1 30 8  40 o 3.851000 1.035000  3.521000 1.474000  4.181000 1.454000  -0.6601000     2.070000  
1 1 1 30 8  42 o 5.643000 0.8444000 6.200000 1.134000  5.086000 1.251000  1.114000       1.689000  
1 1 1 30 8  44 f 4.450000 1.112000  3.893000 1.515000  5.008000 1.628000  -1.115000      2.224000  
1 1 1 30 8  46 o 7.570000 0.7390000 7.436000 1.112000  7.705000 0.9735000 -0.2695000     1.478000  
1 1 1 30 8  48 o 7.372000 0.7400000 7.360000 1.015000  7.384000 1.077000  -0.2361000E-01 1.480000  
1 1 1 30 8  50 o 2.753000 0.8572000 3.043000 1.279000  2.462000 1.141000  0.5807000      1.714000  
1 1 1 30 9  1  o 12.96000 0.4521000 12.80000 0.6371000 13.11000 0.6417000 -0.3090000     0.9043000 
1 1 1 30 9  3  o 21.13000 0.3081000 21.39000 0.4344000 20.86000 0.4369000 0.5239000      0.6161000 
1 1 1 30 9  5  o 12.43000 0.4157000 12.51000 0.5577000 12.34000 0.6166000 0.1618000      0.8315000 
1 1 1 30 9  7  o 35.15000 0.3464000 35.58000 0.4673000 34.72000 0.5115000 0.8590000      0.6928000 
1 1 1 30 9  9  o 57.24000 0.4698000 58.01000 0.7195000 56.48000 0.6044000 1.528000       0.9397000 
1 1 1 30 9  11 o 38.53000 0.3682000 38.02000 0.5583000 39.03000 0.4801000 -1.004000      0.7363000 
1 1 1 30 9  13 f 16.72000 0.3808000 16.82000 0.5881000 16.61000 0.4839000 0.2153000      0.7616000 
1 1 1 30 9  15 o 30.92000 0.3477000 30.67000 0.5345000 31.16000 0.4450000 -0.4949000     0.6955000 
1 1 1 30 9  17 o 16.63000 0.4903000 16.23000 0.8138000 17.04000 0.5472000 -0.8119000     0.9806000 
1 1 1 30 9  19 o 17.69000 0.3763000 17.94000 0.5501000 17.44000 0.5136000 0.5017000      0.7526000 
1 1 1 30 9  21 o 20.61000 0.3778000 20.83000 0.5939000 20.40000 0.4671000 0.4286000      0.7556000 
1 1 1 30 9  23 o 7.728000 0.5819000 7.731000 0.8292000 7.725000 0.8166000 0.5870000E-02  1.164000  
1 1 1 30 9  25 o 12.20000 0.5540000 11.83000 0.8824000 12.57000 0.6701000 -0.7446000     1.108000  
1 1 1 30 9  27 o 8.334000 0.6020000 7.989000 0.8513000 8.679000 0.8514000 -0.6897000     1.204000  
1 1 1 30 9  29 o 7.564000 0.5916000 7.267000 0.8335000 7.861000 0.8396000 -0.5945000     1.183000  
1 1 1 30 9  31 o 7.101000 0.6426000 6.808000 0.8090000 7.393000 0.9986000 -0.5843000     1.285000  
1 1 1 30 9  33 o 16.51000 0.3576000 16.22000 0.4289000 16.79000 0.5723000 -0.5674000     0.7151000 
1 1 1 30 9  35 o 4.682000 0.8422000 5.688000 0.9630000 3.676000 1.382000  2.012000       1.684000  
1 1 1 30 9  37 o 4.789000 0.9321000 4.412000 1.195000  5.166000 1.431000  -0.7535000     1.864000  
1 1 1 30 9  39 o 15.77000 0.4437000 15.96000 0.4648000 15.59000 0.7560000 0.3661000      0.8874000 
1 1 1 30 9  41 o 9.630000 0.5578000 8.090000 0.9051000 11.17000 0.6521000 -3.082000      1.116000  
1 1 1 30 9  43 o 5.842000 0.9217000 5.003000 1.362000  6.680000 1.242000  -1.677000      1.843000  
1 1 1 30 9  45 o 8.491000 0.6931000 8.940000 1.038000  8.042000 0.9183000 0.8971000      1.386000  
1 1 1 30 9  47 o 4.647000 0.9174000 3.423000 1.365000  5.872000 1.226000  -2.449000      1.835000  
1 1 1 30 9  49 o 3.359000 0.9560000 3.081000 1.321000  3.636000 1.382000  -0.5540000     1.912000  
1 1 1 30 9  51 o 3.243000 0.9368000 3.599000 1.396000  2.887000 1.250000  0.7114000      1.874000  
1 1 1 30 10 0  o 11.81000 0.6038000 11.81000 0.6038000 11.81000 0.6038000 0.000000       0.000000  
1 1 1 30 10 2  o 25.04000 0.3418000 25.06000 0.4946000 25.02000 0.4719000 0.4007000E-01  0.6837000 
1 1 1 30 10 4  f 34.64000 0.3406000 34.81000 0.4564000 34.46000 0.5058000 0.3462000      0.6813000 
1 1 1 30 10 6  o 8.594000 0.6684000 9.403000 0.9164000 7.786000 0.9734000 1.617000       1.337000  
1 1 1 30 10 8  o 39.34000 0.3713000 39.12000 0.5658000 39.57000 0.4810000 -0.4503000     0.7426000 
1 1 1 30 10 10 o 12.68000 0.4465000 12.27000 0.6852000 13.10000 0.5726000 -0.8350000     0.8930000 
1 1 1 30 10 12 o 16.12000 0.3999000 16.01000 0.6196000 16.24000 0.5058000 -0.2350000     0.7998000 
1 1 1 30 10 14 o 23.52000 0.3844000 22.87000 0.4686000 24.16000 0.6095000 -1.292000      0.7688000 
1 1 1 30 10 16 o 6.974000 0.9202000 6.169000 1.614000  7.778000 0.8849000 -1.609000      1.840000  
1 1 1 30 10 18 o 14.00000 0.5155000 14.37000 0.8287000 13.63000 0.6135000 0.7365000      1.031000  
1 1 1 30 10 20 o 58.68000 0.4801000 58.86000 0.7294000 58.50000 0.6244000 0.3653000      0.9601000 
1 1 1 30 10 22 o 15.06000 0.3534000 15.31000 0.4892000 14.82000 0.5101000 0.4840000      0.7068000 
1 1 1 30 10 24 o 19.47000 0.3426000 19.62000 0.5311000 19.32000 0.4329000 0.2970000      0.6852000 
1 1 1 30 10 26 o 22.97000 0.3342000 22.64000 0.4467000 23.30000 0.4971000 -0.6563000     0.6683000 
1 1 1 30 10 28 o 20.91000 0.3308000 21.28000 0.4324000 20.53000 0.5007000 0.7448000      0.6615000 
1 1 1 30 10 30 o 19.58000 0.3335000 19.99000 0.3950000 19.18000 0.5374000 0.8045000      0.6670000 
1 1 1 30 10 32 f 11.47000 0.5017000 12.36000 0.4980000 10.58000 0.8711000 1.777000       1.003000  
1 1 1 30 10 34 o 11.31000 0.4299000 10.94000 0.5363000 11.68000 0.6721000 -0.7448000     0.8598000 
1 1 1 30 10 36 o 23.01000 0.3253000 22.99000 0.3919000 23.03000 0.5195000 -0.3977000E-01 0.6507000 
1 1 1 30 10 38 f 10.64000 0.5573000 10.81000 0.5752000 10.47000 0.9547000 0.3414000      1.115000  
1 1 1 30 10 40 o 8.837000 0.5639000 8.571000 0.7559000 9.104000 0.8369000 -0.5327000     1.128000  
1 1 1 30 10 42 o 5.856000 0.8353000 5.832000 1.131000  5.880000 1.229000  -0.4787000E-01 1.671000  
1 1 1 30 10 44 f 4.299000 1.026000  3.799000 1.401000  4.798000 1.500000  -0.9982000     2.053000  
1 1 1 30 10 46 o 11.58000 0.6168000 11.41000 1.012000  11.75000 0.7052000 -0.3444000     1.234000  
1 1 1 30 10 48 o 7.771000 0.7386000 7.883000 1.041000  7.660000 1.048000  0.2230000      1.477000  
1 1 1 30 10 50 o 3.822000 0.9778000 3.781000 1.364000  3.864000 1.402000  -0.8316000E-01 1.956000  
1 1 1 30 11 1  o 21.75000 0.3396000 21.46000 0.4758000 22.04000 0.4847000 -0.5854000     0.6792000 
1 1 1 30 11 3  o 26.84000 0.4956000 26.97000 0.8723000 26.71000 0.4708000 0.2596000      0.9912000 
1 1 1 30 11 5  o 13.20000 0.4296000 12.87000 0.6789000 13.53000 0.5264000 -0.6547000     0.8591000 
1 1 1 30 11 7  o 16.76000 0.3341000 16.77000 0.4714000 16.75000 0.4736000 0.1653000E-01  0.6682000 
1 1 1 30 11 9  o 27.44000 0.3264000 27.32000 0.4767000 27.56000 0.4461000 -0.2362000     0.6529000 
1 1 1 30 11 11 o 27.88000 0.3705000 27.71000 0.5690000 28.06000 0.4748000 -0.3494000     0.7411000 
1 1 1 30 11 13 o 23.57000 0.3497000 22.60000 0.4870000 24.54000 0.5020000 -1.940000      0.6994000 
1 1 1 30 11 15 o 39.44000 0.4109000 39.77000 0.6658000 39.12000 0.4816000 0.6515000      0.8217000 
1 1 1 30 11 17 o 24.04000 0.3103000 24.31000 0.4348000 23.76000 0.4427000 0.5475000      0.6205000 
1 1 1 30 11 19 o 6.902000 0.7029000 7.296000 0.8625000 6.509000 1.110000  0.7870000      1.406000  
1 1 1 30 11 21 o 24.54000 0.3904000 24.88000 0.6513000 24.20000 0.4307000 0.6855000      0.7808000 
1 1 1 30 11 23 o 22.98000 0.3967000 22.82000 0.6652000 23.15000 0.4322000 -0.3326000     0.7933000 
1 1 1 30 11 25 o 10.21000 0.6586000 9.681000 1.115000  10.73000 0.7022000 -1.047000      1.317000  
1 1 1 30 11 27 o 7.808000 0.5827000 7.559000 0.8902000 8.056000 0.7520000 -0.4969000     1.165000  
1 1 1 30 11 29 o 5.528000 0.8878000 5.941000 1.017000  5.116000 1.455000  0.8245000      1.776000  
1 1 1 30 11 31 o 9.419000 0.4965000 9.055000 0.5899000 9.784000 0.7987000 -0.7286000     0.9929000 
1 1 1 30 11 33 o 17.61000 0.4014000 17.72000 0.4049000 17.49000 0.6933000 0.2231000      0.8029000 
1 1 1 30 11 35 o 5.200000 0.8635000 5.082000 1.069000  5.318000 1.356000  -0.2358000     1.727000  
1 1 1 30 11 37 o 3.162000 0.8779000 3.431000 1.216000  2.894000 1.267000  0.5369000      1.756000  
1 1 1 30 11 39 o 13.00000 0.4091000 12.59000 0.5136000 13.41000 0.6369000 -0.8228000     0.8182000 
1 1 1 30 11 41 o 4.695000 0.8964000 3.734000 1.376000  5.657000 1.149000  -1.924000      1.793000  
1 1 1 30 11 43 o 6.765000 0.7825000 6.580000 1.069000  6.951000 1.143000  -0.3705000     1.565000  
1 1 1 30 11 45 o 14.63000 0.4145000 14.81000 0.5699000 14.45000 0.6021000 0.3531000      0.8291000 
1 1 1 30 11 47 o 3.392000 0.9680000 3.242000 1.392000  3.542000 1.346000  -0.2996000     1.936000  
1 1 1 30 11 49 o 3.227000 0.9396000 3.339000 1.346000  3.114000 1.311000  0.2247000      1.879000  
1 1 1 30 11 51 o 8.215000 0.9351000 8.132000 1.412000  8.298000 1.227000  -0.1657000     1.870000  
1 1 1 30 12 0  o 13.92000 0.5829000 13.92000 0.5829000 13.92000 0.5829000 0.000000       0.000000  
1 1 1 30 12 2  o 18.69000 0.3885000 19.37000 0.6353000 18.01000 0.4475000 1.369000       0.7770000 
1 1 1 30 12 4  o 31.43000 0.5007000 30.94000 0.9020000 31.91000 0.4348000 -0.9694000     1.001000  
1 1 1 30 12 6  f 6.239000 0.7215000 6.121000 1.081000  6.356000 0.9555000 -0.2350000     1.443000  
1 1 1 30 12 8  o 32.92000 0.4230000 32.67000 0.5876000 33.18000 0.6086000 -0.5117000     0.8460000 
1 1 1 30 12 10 o 22.81000 0.3280000 22.70000 0.4541000 22.92000 0.4734000 -0.2218000     0.6560000 
1 1 1 30 12 12 o 38.15000 0.3341000 37.73000 0.4740000 38.57000 0.4710000 -0.8391000     0.6682000 
1 1 1 30 12 14 o 39.29000 0.3379000 39.32000 0.4783000 39.25000 0.4775000 0.6760000E-01  0.6758000 
1 1 1 30 12 16 o 8.046000 0.5519000 7.857000 0.7854000 8.236000 0.7757000 -0.3790000     1.104000  
1 1 1 30 12 18 o 15.14000 0.3857000 15.71000 0.4674000 14.57000 0.6136000 1.136000       0.7713000 
1 1 1 30 12 20 f 33.51000 0.3203000 33.20000 0.4512000 33.82000 0.4549000 -0.6196000     0.6407000 
1 1 1 30 12 22 o 11.37000 0.4411000 12.27000 0.6552000 10.47000 0.5906000 1.796000       0.8821000 
1 1 1 30 12 24 f 19.37000 0.4134000 18.96000 0.7070000 19.79000 0.4288000 -0.8271000     0.8268000 
1 1 1 30 12 26 o 13.06000 0.4297000 13.14000 0.6994000 12.98000 0.4995000 0.1685000      0.8595000 
1 1 1 30 12 28 o 6.010000 0.8175000 5.555000 1.081000  6.464000 1.227000  -0.9085000     1.635000  
1 1 1 30 12 30 o 11.90000 0.4184000 11.92000 0.4951000 11.88000 0.6746000 0.3975000E-01  0.8368000 
1 1 1 30 12 32 o 20.85000 0.3928000 20.85000 0.4485000 20.86000 0.6449000 -0.9710000E-02 0.7856000 
1 1 1 30 12 34 o 11.43000 0.4990000 10.92000 0.5276000 11.93000 0.8470000 -1.014000      0.9979000 
1 1 1 30 12 36 o 8.986000 0.5324000 8.768000 0.6591000 9.203000 0.8363000 -0.4348000     1.065000  
1 1 1 30 12 38 o 7.836000 0.5776000 7.196000 0.7539000 8.476000 0.8752000 -1.281000      1.155000  
1 1 1 30 12 40 o 10.03000 0.5228000 10.30000 0.6595000 9.759000 0.8115000 0.5448000      1.046000  
1 1 1 30 12 42 o 3.974000 0.9663000 4.417000 1.338000  3.530000 1.394000  0.8876000      1.933000  
1 1 1 30 12 44 o 3.824000 0.9941000 3.402000 1.300000  4.247000 1.504000  -0.8444000     1.988000  
1 1 1 30 12 46 o 3.228000 0.9561000 3.136000 1.337000  3.320000 1.367000  -0.1833000     1.912000  
1 1 1 30 12 48 o 4.596000 0.9538000 3.321000 1.439000  5.872000 1.253000  -2.550000      1.908000  
1 1 1 30 12 50 o 3.861000 1.041000  3.508000 1.389000  4.215000 1.550000  -0.7077000     2.081000  
1 1 1 30 13 1  o 34.34000 0.3477000 34.91000 0.5325000 33.76000 0.4474000 1.151000       0.6955000 
1 1 1 30 13 3  o 23.45000 0.3029000 23.44000 0.4288000 23.47000 0.4279000 -0.3022000E-01 0.6058000 
1 1 1 30 13 5  o 11.07000 0.4773000 11.39000 0.7153000 10.75000 0.6322000 0.6433000      0.9546000 
1 1 1 30 13 7  o 13.72000 0.3941000 13.47000 0.5680000 13.97000 0.5464000 -0.5009000     0.7882000 
1 1 1 30 13 9  o 22.49000 0.3039000 22.43000 0.4151000 22.56000 0.4439000 -0.1248000     0.6077000 
1 1 1 30 13 11 o 9.345000 0.4852000 9.043000 0.6670000 9.647000 0.7049000 -0.6041000     0.9704000 
1 1 1 30 13 13 o 41.88000 0.3495000 41.74000 0.4930000 42.02000 0.4955000 -0.2856000     0.6989000 
1 1 1 30 13 15 o 36.25000 0.3268000 36.87000 0.4668000 35.62000 0.4576000 1.252000       0.6537000 
1 1 1 30 13 17 o 30.60000 0.3425000 30.89000 0.4395000 30.31000 0.5254000 0.5837000      0.6849000 
1 1 1 30 13 19 o 26.48000 0.3349000 26.31000 0.4292000 26.64000 0.5142000 -0.3268000     0.6698000 
1 1 1 30 13 21 o 21.67000 0.3813000 21.90000 0.5493000 21.45000 0.5289000 0.4503000      0.7625000 
1 1 1 30 13 23 o 12.16000 0.4624000 11.44000 0.6644000 12.88000 0.6433000 -1.431000      0.9248000 
1 1 1 30 13 25 o 3.936000 0.8888000 4.207000 1.260000  3.665000 1.254000  0.5426000      1.778000  
1 1 1 30 13 27 o 11.10000 0.5039000 10.65000 0.6706000 11.55000 0.7523000 -0.8996000     1.008000  
1 1 1 30 13 29 f 22.37000 0.3192000 22.64000 0.3954000 22.09000 0.5011000 0.5431000      0.6383000 
1 1 1 30 13 31 o 10.17000 0.4699000 10.19000 0.5250000 10.14000 0.7796000 0.5066000E-01  0.9398000 
1 1 1 30 13 33 o 30.57000 0.5493000 30.37000 0.4550000 30.76000 0.9999000 -0.3857000     1.099000  
1 1 1 30 13 35 o 16.24000 0.3631000 16.34000 0.4589000 16.15000 0.5627000 0.1935000      0.7261000 
1 1 1 30 13 37 o 4.535000 0.9205000 4.438000 1.228000  4.632000 1.372000  -0.1935000     1.841000  
1 1 1 30 13 39 o 10.46000 0.4888000 9.868000 0.6270000 11.06000 0.7501000 -1.190000      0.9776000 
1 1 1 30 13 41 o 2.575000 0.8133000 2.400000 1.066000  2.749000 1.229000  -0.3492000     1.627000  
1 1 1 30 13 43 o 5.453000 0.8949000 5.085000 1.340000  5.821000 1.186000  -0.7362000     1.790000  
1 1 1 30 13 45 o 4.089000 0.9627000 4.728000 1.364000  3.451000 1.358000  1.278000       1.925000  
1 1 1 30 13 47 f 8.936000 0.5868000 8.752000 0.8539000 9.120000 0.8050000 -0.3678000     1.174000  
1 1 1 30 13 49 o 4.572000 1.083000  5.645000 1.623000  3.499000 1.433000  2.145000       2.165000  
1 1 1 30 14 0  o 24.53000 0.5443000 24.53000 0.5443000 24.53000 0.5443000 0.000000       0.000000  
1 1 1 30 14 2  o 27.30000 0.3004000 27.59000 0.4242000 27.01000 0.4253000 0.5835000      0.6007000 
1 1 1 30 14 4  o 33.39000 0.3512000 33.49000 0.4988000 33.30000 0.4945000 0.1902000      0.7024000 
1 1 1 30 14 6  o 15.27000 0.3611000 15.28000 0.5339000 15.26000 0.4862000 0.1463000E-01  0.7221000 
1 1 1 30 14 8  o 8.649000 0.5578000 8.035000 0.7755000 9.264000 0.8020000 -1.229000      1.116000  
1 1 1 30 14 10 o 5.062000 0.8608000 4.851000 1.174000  5.274000 1.259000  -0.4231000     1.722000  
1 1 1 30 14 12 o 18.34000 0.3164000 18.59000 0.4427000 18.08000 0.4522000 0.5033000      0.6328000 
1 1 1 30 14 14 o 30.47000 0.3105000 30.30000 0.4383000 30.65000 0.4399000 -0.3584000     0.6210000 
1 1 1 30 14 16 o 41.32000 0.3471000 41.34000 0.4895000 41.31000 0.4922000 0.2404000E-01  0.6942000 
1 1 1 30 14 18 o 17.19000 0.3694000 18.08000 0.4413000 16.31000 0.5927000 1.768000       0.7389000 
1 1 1 30 14 20 o 24.18000 0.3004000 23.87000 0.4242000 24.50000 0.4254000 -0.6245000     0.6008000 
1 1 1 30 14 22 o 35.97000 0.3965000 36.81000 0.6524000 35.12000 0.4508000 1.693000       0.7930000 
1 1 1 30 14 24 o 9.768000 0.4433000 9.934000 0.6195000 9.603000 0.6342000 0.3314000      0.8866000 
1 1 1 30 14 26 o 11.45000 0.4834000 11.88000 0.4985000 11.02000 0.8283000 0.8660000      0.9667000 
1 1 1 30 14 28 o 11.78000 0.4323000 11.82000 0.5411000 11.74000 0.6744000 0.8728000E-01  0.8646000 
1 1 1 30 14 30 o 7.340000 0.6442000 6.760000 0.9097000 7.919000 0.9125000 -1.159000      1.288000  
1 1 1 30 14 32 o 18.96000 0.3891000 18.08000 0.3913000 19.85000 0.6727000 -1.775000      0.7783000 
1 1 1 30 14 34 o 13.52000 0.4087000 13.62000 0.5281000 13.42000 0.6238000 0.1946000      0.8173000 
1 1 1 30 14 36 o 2.797000 0.8394000 2.197000 1.019000  3.397000 1.334000  -1.200000      1.679000  
1 1 1 30 14 38 o 3.644000 0.9248000 3.118000 1.219000  4.170000 1.391000  -1.051000      1.850000  
1 1 1 30 14 40 o 4.959000 0.8467000 3.759000 1.213000  6.158000 1.182000  -2.399000      1.693000  
1 1 1 30 14 42 f 5.359000 0.8967000 4.678000 1.346000  6.040000 1.186000  -1.362000      1.793000  
1 1 1 30 14 44 o 2.731000 0.8459000 2.084000 1.000000  3.379000 1.364000  -1.295000      1.692000  
1 1 1 30 14 46 o 6.121000 0.8441000 6.385000 1.177000  5.858000 1.210000  0.5267000      1.688000  
1 1 1 30 14 48 o 7.400000 0.8040000 6.808000 1.045000  7.992000 1.222000  -1.184000      1.608000  
1 1 1 30 14 50 o 7.384000 0.8813000 7.190000 1.435000  7.578000 1.023000  -0.3875000     1.763000  
1 1 1 30 15 1  o 32.64000 0.5177000 32.97000 0.4930000 32.30000 0.9106000 0.6757000      1.035000  
1 1 1 30 15 3  o 3.738000 0.8870000 4.171000 1.227000  3.305000 1.282000  0.8654000      1.774000  
1 1 1 30 15 5  o 27.29000 0.2945000 26.89000 0.4086000 27.68000 0.4243000 -0.7934000     0.5890000 
1 1 1 30 15 7  o 17.12000 0.3241000 16.87000 0.4495000 17.36000 0.4669000 -0.4859000     0.6481000 
1 1 1 30 15 9  o 17.74000 0.3253000 17.66000 0.4403000 17.83000 0.4789000 -0.1674000     0.6505000 
1 1 1 30 15 11 o 31.69000 0.3126000 31.36000 0.4326000 32.01000 0.4513000 -0.6507000     0.6252000 
1 1 1 30 15 13 o 12.76000 0.3737000 12.82000 0.5214000 12.70000 0.5355000 0.1203000      0.7474000 
1 1 1 30 15 15 o 3.680000 0.8717000 4.609000 1.280000  2.750000 1.184000  1.859000       1.743000  
1 1 1 30 15 17 o 14.92000 0.4395000 14.71000 0.6290000 15.14000 0.6139000 -0.4319000     0.8789000 
1 1 1 30 15 19 o 4.871000 0.8820000 5.023000 1.171000  4.720000 1.320000  0.3030000      1.764000  
1 1 1 30 15 21 o 23.56000 0.3213000 24.02000 0.4847000 23.11000 0.4218000 0.9141000      0.6426000 
1 1 1 30 15 23 o 24.88000 0.3512000 25.39000 0.5647000 24.38000 0.4177000 1.005000       0.7025000 
1 1 1 30 15 25 o 16.77000 0.3832000 16.56000 0.4390000 16.97000 0.6283000 -0.4078000     0.7665000 
1 1 1 30 15 27 o 5.998000 0.7491000 6.483000 0.7964000 5.513000 1.269000  0.9705000      1.498000  
1 1 1 30 15 29 o 24.84000 0.3188000 24.85000 0.3938000 24.83000 0.5013000 0.1696000E-01  0.6375000 
1 1 1 30 15 31 o 8.605000 0.6545000 8.140000 0.7934000 9.070000 1.041000  -0.9307000     1.309000  
1 1 1 30 15 33 o 9.610000 0.5761000 9.456000 0.5633000 9.764000 1.005000  -0.3078000     1.152000  
1 1 1 30 15 35 o 5.725000 0.8144000 5.431000 1.168000  6.019000 1.136000  -0.5876000     1.629000  
1 1 1 30 15 37 o 6.457000 0.7049000 6.669000 0.7813000 6.244000 1.174000  0.4255000      1.410000  
1 1 1 30 15 39 o 10.06000 0.5122000 10.21000 0.6244000 9.911000 0.8120000 0.2977000      1.024000  
1 1 1 30 15 41 o 18.11000 0.4009000 17.75000 0.4349000 18.46000 0.6737000 -0.7081000     0.8018000 
1 1 1 30 15 43 o 10.50000 0.5044000 9.956000 0.7238000 11.05000 0.7026000 -1.094000      1.009000  
1 1 1 30 15 45 o 2.932000 0.8783000 2.298000 1.074000  3.566000 1.390000  -1.269000      1.757000  
1 1 1 30 15 47 o 14.96000 0.4622000 14.62000 0.5890000 15.29000 0.7126000 -0.6647000     0.9245000 
1 1 1 30 15 49 o 8.597000 0.6253000 7.988000 0.9096000 9.206000 0.8582000 -1.218000      1.251000  
1 1 1 30 16 0  f 10.49000 0.7906000 10.49000 0.7906000 10.49000 0.7906000 0.000000       0.000000  
1 1 1 30 16 2  o 29.24000 0.3410000 28.43000 0.4128000 30.05000 0.5428000 -1.618000      0.6819000 
1 1 1 30 16 4  o 20.11000 0.3004000 19.92000 0.4135000 20.30000 0.4360000 -0.3822000     0.6009000 
1 1 1 30 16 6  o 26.10000 0.3251000 25.94000 0.4964000 26.26000 0.4198000 -0.3164000     0.6501000 
1 1 1 30 16 8  o 18.61000 0.3305000 18.45000 0.4402000 18.76000 0.4930000 -0.3054000     0.6609000 
1 1 1 30 16 10 o 20.76000 0.3129000 20.36000 0.4230000 21.17000 0.4611000 -0.8095000     0.6258000 
1 1 1 30 16 12 o 12.80000 0.3801000 12.30000 0.5264000 13.30000 0.5485000 -1.003000      0.7603000 
1 1 1 30 16 14 o 11.44000 0.5292000 11.30000 0.7625000 11.58000 0.7340000 -0.2794000     1.058000  
1 1 1 30 16 16 o 24.06000 0.3037000 24.17000 0.4226000 23.94000 0.4363000 0.2252000      0.6075000 
1 1 1 30 16 18 o 21.66000 0.3019000 21.50000 0.4225000 21.82000 0.4313000 -0.3169000     0.6037000 
1 1 1 30 16 20 o 10.53000 0.4225000 10.43000 0.6311000 10.62000 0.5619000 -0.1952000     0.8450000 
1 1 1 30 16 22 f 22.17000 0.3167000 21.85000 0.4723000 22.50000 0.4219000 -0.6516000     0.6333000 
1 1 1 30 16 24 o 31.18000 0.3696000 31.66000 0.4238000 30.70000 0.6056000 0.9572000      0.7392000 
1 1 1 30 16 26 o 4.054000 0.8711000 4.374000 1.103000  3.733000 1.348000  0.6411000      1.742000  
1 1 1 30 16 28 o 3.460000 0.8178000 4.166000 1.190000  2.754000 1.122000  1.412000       1.636000  
1 1 1 30 16 30 o 17.07000 0.3341000 16.83000 0.4138000 17.32000 0.5247000 -0.4891000     0.6683000 
1 1 1 30 16 32 o 4.608000 0.8318000 4.210000 1.051000  5.006000 1.289000  -0.7959000     1.664000  
1 1 1 30 16 34 o 4.715000 0.8897000 4.763000 1.180000  4.668000 1.332000  0.9487000E-01  1.779000  
1 1 1 30 16 36 o 6.050000 0.7061000 5.852000 0.8210000 6.248000 1.149000  -0.3959000     1.412000  
1 1 1 30 16 38 o 3.528000 0.9668000 3.204000 1.280000  3.851000 1.450000  -0.6477000     1.934000  
1 1 1 30 16 40 o 3.322000 0.9153000 3.207000 1.225000  3.436000 1.360000  -0.2290000     1.831000  
1 1 1 30 16 42 f 5.554000 0.8346000 4.471000 1.148000  6.637000 1.212000  -2.166000      1.669000  
1 1 1 30 16 44 o 4.893000 0.9828000 4.604000 1.351000  5.183000 1.428000  -0.5793000     1.966000  
1 1 1 30 16 46 o 10.31000 0.6042000 10.44000 0.8118000 10.18000 0.8951000 0.2643000      1.208000  
1 1 1 30 16 48 o 4.682000 0.8832000 5.798000 1.136000  3.566000 1.353000  2.232000       1.766000  
1 1 1 30 17 1  o 40.36000 0.3409000 40.16000 0.4761000 40.56000 0.4880000 -0.3992000     0.6818000 
1 1 1 30 17 3  o 12.53000 0.5084000 12.77000 0.5430000 12.28000 0.8597000 0.4898000      1.017000  
1 1 1 30 17 5  o 18.09000 0.3258000 18.06000 0.4644000 18.11000 0.4571000 -0.4925000E-01 0.6516000 
1 1 1 30 17 7  o 28.73000 0.3255000 28.29000 0.4916000 29.17000 0.4269000 -0.8791000     0.6511000 
1 1 1 30 17 9  o 7.661000 0.6198000 7.876000 0.7791000 7.446000 0.9642000 0.4299000      1.240000  
1 1 1 30 17 11 o 28.63000 0.3023000 28.56000 0.4199000 28.70000 0.4350000 -0.1356000     0.6046000 
1 1 1 30 17 13 o 20.60000 0.3175000 21.35000 0.4250000 19.86000 0.4719000 1.498000       0.6350000 
1 1 1 30 17 15 o 22.28000 0.2955000 22.44000 0.4110000 22.13000 0.4247000 0.3027000      0.5910000 
1 1 1 30 17 17 o 22.78000 0.3010000 22.68000 0.4126000 22.88000 0.4384000 -0.2071000     0.6020000 
1 1 1 30 17 19 o 7.268000 0.6047000 6.923000 0.8557000 7.612000 0.8545000 -0.6885000     1.209000  
1 1 1 30 17 21 o 17.65000 0.3013000 17.84000 0.4221000 17.45000 0.4301000 0.3948000      0.6026000 
1 1 1 30 17 23 o 19.23000 0.3715000 18.49000 0.4114000 19.96000 0.6186000 -1.472000      0.7429000 
1 1 1 30 17 25 o 18.68000 0.3300000 18.59000 0.3818000 18.77000 0.5383000 -0.1880000     0.6599000 
1 1 1 30 17 27 o 16.36000 0.3931000 16.44000 0.4026000 16.28000 0.6752000 0.1637000      0.7861000 
1 1 1 30 17 29 f 13.14000 0.3806000 13.00000 0.4679000 13.28000 0.6005000 -0.2785000     0.7612000 
1 1 1 30 17 31 o 10.69000 0.4345000 10.69000 0.5572000 10.70000 0.6669000 -0.9735000E-02 0.8690000 
1 1 1 30 17 33 o 5.626000 0.8869000 5.374000 1.086000  5.879000 1.402000  -0.5054000     1.774000  
1 1 1 30 17 35 o 9.932000 0.5529000 9.985000 0.7974000 9.879000 0.7663000 0.1059000      1.106000  
1 1 1 30 17 37 o 3.541000 0.8734000 2.633000 1.106000  4.448000 1.352000  -1.816000      1.747000  
1 1 1 30 17 39 o 15.78000 0.3968000 15.51000 0.5281000 16.06000 0.5924000 -0.5538000     0.7936000 
1 1 1 30 17 41 o 13.50000 0.4245000 13.97000 0.4716000 13.03000 0.7060000 0.9378000      0.8490000 
1 1 1 30 17 43 o 6.968000 0.7051000 7.529000 0.9001000 6.407000 1.085000  1.122000       1.410000  
1 1 1 30 17 45 o 3.814000 0.9458000 4.506000 1.313000  3.122000 1.361000  1.384000       1.892000  
1 1 1 30 17 47 o 4.497000 0.9717000 4.669000 1.357000  4.325000 1.391000  0.3432000      1.943000  
1 1 1 30 17 49 o 7.421000 0.7288000 7.739000 1.026000  7.103000 1.035000  0.6358000      1.458000  
1 1 1 30 18 0  o 53.68000 0.6507000 53.68000 0.6507000 53.68000 0.6507000 0.000000       0.000000  
1 1 1 30 18 2  o 13.08000 0.3719000 12.91000 0.4930000 13.25000 0.5570000 -0.3420000     0.7438000 
1 1 1 30 18 4  o 7.737000 0.6450000 8.147000 0.7407000 7.327000 1.056000  0.8195000      1.290000  
1 1 1 30 18 6  f 25.57000 0.3052000 25.63000 0.4467000 25.50000 0.4160000 0.1278000      0.6104000 
1 1 1 30 18 8  o 27.37000 0.3240000 27.68000 0.4866000 27.06000 0.4280000 0.6202000      0.6480000 
1 1 1 30 18 10 o 24.72000 0.3733000 24.63000 0.5241000 24.82000 0.5317000 -0.1981000     0.7466000 
1 1 1 30 18 12 o 11.57000 0.4065000 11.93000 0.5529000 11.21000 0.5960000 0.7170000      0.8129000 
1 1 1 30 18 14 o 12.81000 0.3647000 12.98000 0.5110000 12.65000 0.5206000 0.3374000      0.7295000 
1 1 1 30 18 16 o 13.46000 0.3595000 13.90000 0.4534000 13.02000 0.5579000 0.8856000      0.7189000 
1 1 1 30 18 18 o 13.21000 0.3590000 13.21000 0.4968000 13.21000 0.5182000 0.2466000E-02  0.7179000 
1 1 1 30 18 20 o 10.81000 0.4074000 10.89000 0.5032000 10.74000 0.6410000 0.1527000      0.8149000 
1 1 1 30 18 22 o 20.25000 0.3473000 20.14000 0.3634000 20.36000 0.5919000 -0.2196000     0.6945000 
1 1 1 30 18 24 o 11.62000 0.4190000 11.57000 0.4347000 11.66000 0.7164000 -0.8706000E-01 0.8380000 
1 1 1 30 18 26 o 5.712000 0.8041000 5.274000 0.8669000 6.150000 1.355000  -0.8757000     1.608000  
1 1 1 30 18 28 o 23.68000 0.3039000 24.25000 0.3656000 23.11000 0.4854000 1.142000       0.6077000 
1 1 1 30 18 30 o 17.59000 0.3410000 17.89000 0.4354000 17.28000 0.5248000 0.6094000      0.6819000 
1 1 1 30 18 32 o 4.870000 0.8219000 5.764000 0.9952000 3.976000 1.308000  1.789000       1.644000  
1 1 1 30 18 34 o 3.027000 0.8633000 2.893000 1.143000  3.161000 1.294000  -0.2680000     1.727000  
1 1 1 30 18 36 o 3.780000 0.9454000 3.753000 1.309000  3.807000 1.364000  -0.5395000E-01 1.891000  
1 1 1 30 18 38 o 11.77000 0.4345000 11.83000 0.4999000 11.72000 0.7109000 0.1169000      0.8691000 
1 1 1 30 18 40 o 15.50000 0.4651000 16.20000 0.5285000 14.81000 0.7655000 1.388000       0.9302000 
1 1 1 30 18 42 o 9.911000 0.5309000 10.09000 0.5878000 9.736000 0.8843000 0.3503000      1.062000  
1 1 1 30 18 44 o 3.547000 1.020000  3.408000 1.291000  3.686000 1.580000  -0.2780000     2.040000  
1 1 1 30 18 46 o 3.865000 0.9910000 3.728000 1.389000  4.002000 1.414000  -0.2741000     1.982000  
1 1 1 30 18 48 o 3.128000 0.9062000 3.270000 1.293000  2.985000 1.270000  0.2850000      1.812000  
1 1 1 30 19 1  o 10.15000 0.4585000 10.27000 0.5988000 10.02000 0.6945000 0.2522000      0.9170000 
1 1 1 30 19 3  o 6.542000 0.6492000 5.829000 0.9731000 7.255000 0.8596000 -1.426000      1.298000  
1 1 1 30 19 5  o 29.81000 0.3296000 29.73000 0.4261000 29.90000 0.5031000 -0.1679000     0.6593000 
1 1 1 30 19 7  o 28.85000 0.4379000 28.62000 0.6275000 29.07000 0.6109000 -0.4577000     0.8758000 
1 1 1 30 19 9  o 44.45000 0.3879000 43.91000 0.5077000 44.99000 0.5868000 -1.082000      0.7759000 
1 1 1 30 19 11 o 39.74000 0.3401000 39.59000 0.4747000 39.89000 0.4870000 -0.3078000     0.6801000 
1 1 1 30 19 13 f 22.16000 0.2971000 22.11000 0.4072000 22.21000 0.4326000 -0.1002000     0.5941000 
1 1 1 30 19 15 o 16.30000 0.3919000 17.58000 0.4573000 15.02000 0.6365000 2.556000       0.7837000 
1 1 1 30 19 17 o 12.10000 0.4318000 11.76000 0.5501000 12.44000 0.6656000 -0.6743000     0.8635000 
1 1 1 30 19 19 o 4.744000 0.7134000 4.811000 1.049000  4.678000 0.9674000 0.1328000      1.427000  
1 1 1 30 19 21 o 18.37000 0.3568000 17.73000 0.3705000 19.00000 0.6099000 -1.275000      0.7136000 
1 1 1 30 19 23 o 17.96000 0.3885000 18.03000 0.4070000 17.89000 0.6618000 0.1413000      0.7770000 
1 1 1 30 19 25 o 10.50000 0.4337000 9.617000 0.5089000 11.38000 0.7025000 -1.763000      0.8675000 
1 1 1 30 19 27 o 9.616000 0.4530000 9.466000 0.5445000 9.766000 0.7240000 -0.2995000     0.9060000 
1 1 1 30 19 29 o 14.22000 0.3700000 14.45000 0.4487000 13.99000 0.5884000 0.4640000      0.7400000 
1 1 1 30 19 31 o 10.17000 0.4485000 10.19000 0.5297000 10.15000 0.7238000 0.3569000E-01  0.8969000 
1 1 1 30 19 33 o 7.006000 0.7144000 6.058000 0.9191000 7.953000 1.094000  -1.895000      1.429000  
1 1 1 30 19 35 o 4.208000 0.9011000 3.935000 1.161000  4.480000 1.378000  -0.5456000     1.802000  
1 1 1 30 19 37 o 3.019000 0.8960000 3.258000 1.302000  2.781000 1.231000  0.4772000      1.792000  
1 1 1 30 19 39 o 15.11000 0.4205000 14.73000 0.4574000 15.49000 0.7058000 -0.7653000     0.8410000 
1 1 1 30 19 41 o 5.796000 0.8839000 6.673000 1.025000  4.919000 1.441000  1.754000       1.768000  
1 1 1 30 19 43 o 3.880000 1.023000  3.557000 1.241000  4.203000 1.626000  -0.6458000     2.045000  
1 1 1 30 19 45 o 3.979000 0.9379000 4.485000 1.309000  3.472000 1.344000  1.013000       1.876000  
1 1 1 30 19 47 o 4.405000 0.9171000 5.234000 1.257000  3.575000 1.336000  1.659000       1.834000  
1 1 1 30 20 0  o 26.17000 0.4585000 26.17000 0.4585000 26.17000 0.4585000 0.000000       0.000000  
1 1 1 30 20 2  f 12.73000 0.3682000 13.14000 0.4885000 12.33000 0.5511000 0.8063000      0.7364000 
1 1 1 30 20 4  o 8.604000 0.4913000 8.943000 0.7094000 8.265000 0.6801000 0.6778000      0.9827000 
1 1 1 30 20 6  o 15.76000 0.3303000 16.17000 0.4586000 15.34000 0.4754000 0.8367000      0.6605000 
1 1 1 30 20 8  o 11.67000 0.4422000 11.74000 0.6477000 11.61000 0.6021000 0.1252000      0.8843000 
1 1 1 30 20 10 o 26.94000 0.3343000 27.17000 0.4594000 26.71000 0.4857000 0.4576000      0.6686000 
1 1 1 30 20 12 o 7.301000 0.6712000 6.671000 0.8547000 7.930000 1.035000  -1.259000      1.342000  
1 1 1 30 20 14 o 23.17000 0.3496000 23.32000 0.4414000 23.03000 0.5423000 0.2855000      0.6992000 
1 1 1 30 20 16 o 16.27000 0.3105000 16.59000 0.4259000 15.94000 0.4521000 0.6445000      0.6211000 
1 1 1 30 20 18 o 12.89000 0.3398000 12.61000 0.4633000 13.17000 0.4972000 -0.5624000     0.6796000 
1 1 1 30 20 20 f 3.367000 0.9184000 2.896000 1.046000  3.838000 1.510000  -0.9422000     1.837000  
1 1 1 30 20 22 o 5.197000 0.8978000 5.988000 0.8831000 4.407000 1.563000  1.581000       1.796000  
1 1 1 30 20 24 o 3.638000 0.8938000 3.156000 1.149000  4.120000 1.369000  -0.9638000     1.788000  
1 1 1 30 20 26 o 15.91000 0.3300000 15.75000 0.3706000 16.06000 0.5461000 -0.3020000     0.6600000 
1 1 1 30 20 28 o 4.264000 0.8374000 3.500000 1.085000  5.028000 1.276000  -1.528000      1.675000  
1 1 1 30 20 30 o 11.01000 0.4225000 11.81000 0.4519000 10.22000 0.7141000 1.592000       0.8451000 
1 1 1 30 20 32 o 10.43000 0.4523000 10.59000 0.5036000 10.26000 0.7515000 0.3286000      0.9046000 
1 1 1 30 20 34 o 9.744000 0.4604000 9.470000 0.5696000 10.02000 0.7236000 -0.5482000     0.9209000 
1 1 1 30 20 36 o 6.036000 0.7320000 5.548000 0.9626000 6.525000 1.103000  -0.9772000     1.464000  
1 1 1 30 20 38 o 11.76000 0.4699000 11.57000 0.5003000 11.96000 0.7957000 -0.3930000     0.9399000 
1 1 1 30 20 40 o 3.539000 0.9207000 3.824000 1.212000  3.254000 1.387000  0.5704000      1.841000  
1 1 1 30 20 42 o 6.096000 0.9401000 5.406000 1.161000  6.785000 1.479000  -1.379000      1.880000  
1 1 1 30 20 44 o 2.914000 0.8840000 2.853000 1.197000  2.975000 1.301000  -0.1221000     1.768000  
1 1 1 30 20 46 o 5.875000 0.8387000 7.155000 1.005000  4.595000 1.343000  2.560000       1.677000  
1 1 1 30 20 48 o 4.839000 1.950000  ?        ?         4.839000 1.950000  ?              ?         
1 1 1 30 21 1  o 10.65000 0.4281000 11.18000 0.5473000 10.12000 0.6583000 1.064000       0.8561000 
1 1 1 30 21 3  o 20.39000 0.3572000 20.66000 0.5127000 20.13000 0.4975000 0.5321000      0.7144000 
1 1 1 30 21 5  o 7.532000 0.6233000 7.691000 0.7541000 7.372000 0.9926000 0.3191000      1.247000  
1 1 1 30 21 7  o 21.18000 0.3024000 20.52000 0.4229000 21.83000 0.4323000 -1.308000      0.6048000 
1 1 1 30 21 9  o 29.51000 0.3535000 29.36000 0.4887000 29.66000 0.5109000 -0.3063000     0.7070000 
1 1 1 30 21 11 o 12.32000 0.3642000 12.97000 0.5399000 11.68000 0.4890000 1.292000       0.7285000 
1 1 1 30 21 13 o 14.46000 0.3467000 15.16000 0.4845000 13.77000 0.4962000 1.385000       0.6935000 
1 1 1 30 21 15 o 12.73000 0.3529000 12.74000 0.5023000 12.72000 0.4958000 0.2165000E-01  0.7058000 
1 1 1 30 21 17 o 19.07000 0.2894000 19.06000 0.4019000 19.09000 0.4164000 -0.3349000E-01 0.5787000 
1 1 1 30 21 19 o 12.63000 0.5428000 12.47000 0.3976000 12.79000 1.010000  -0.3229000     1.086000  
1 1 1 30 21 21 o 6.705000 0.6009000 6.421000 0.6807000 6.990000 0.9903000 -0.5683000     1.202000  
1 1 1 30 21 23 o 18.63000 0.3312000 18.93000 0.3996000 18.34000 0.5282000 0.5906000      0.6623000 
1 1 1 30 21 25 o 2.797000 0.8264000 2.294000 0.9968000 3.300000 1.318000  -1.005000      1.653000  
1 1 1 30 21 27 o 5.272000 0.7439000 5.080000 0.9653000 5.465000 1.132000  -0.3850000     1.488000  
1 1 1 30 21 29 o 4.141000 0.8310000 4.056000 1.017000  4.227000 1.314000  -0.1705000     1.662000  
1 1 1 30 21 31 o 7.025000 0.5546000 7.234000 0.6435000 6.817000 0.9033000 0.4166000      1.109000  
1 1 1 30 21 33 o 7.409000 0.6820000 7.617000 0.6539000 7.202000 1.197000  0.4146000      1.364000  
1 1 1 30 21 35 o 2.838000 0.8504000 2.541000 1.105000  3.135000 1.293000  -0.5940000     1.701000  
1 1 1 30 21 37 o 6.102000 0.7191000 5.547000 0.9095000 6.658000 1.114000  -1.111000      1.438000  
1 1 1 30 21 39 o 16.56000 0.3738000 15.86000 0.4164000 17.26000 0.6210000 -1.397000      0.7477000 
1 1 1 30 21 41 o 15.88000 0.4518000 16.54000 0.4878000 15.22000 0.7607000 1.324000       0.9037000 
1 1 1 30 21 43 o 2.487000 0.7849000 2.641000 1.109000  2.333000 1.111000  0.3083000      1.570000  
1 1 1 30 21 45 o 3.895000 0.8466000 2.391000 1.073000  5.399000 1.310000  -3.008000      1.693000  
1 1 1 30 21 47 o 3.062000 0.9238000 2.756000 1.269000  3.368000 1.343000  -0.6120000     1.848000  
1 1 1 30 22 0  o 3.470000 1.493000  3.470000 1.493000  3.470000 1.493000  0.000000       0.000000  
1 1 1 30 22 2  o 18.43000 0.3118000 18.80000 0.4133000 18.05000 0.4669000 0.7518000      0.6235000 
1 1 1 30 22 4  o 30.70000 0.2994000 30.68000 0.4233000 30.73000 0.4236000 -0.4919000E-01 0.5989000 
1 1 1 30 22 6  o 13.14000 0.3890000 13.37000 0.5003000 12.91000 0.5958000 0.4516000      0.7780000 
1 1 1 30 22 8  o 19.60000 0.3464000 19.65000 0.4547000 19.54000 0.5226000 0.1032000      0.6927000 
1 1 1 30 22 10 o 16.90000 0.3468000 17.15000 0.5473000 16.65000 0.4261000 0.5021000      0.6936000 
1 1 1 30 22 12 o 7.856000 0.4973000 7.957000 0.6826000 7.755000 0.7235000 0.2022000      0.9947000 
1 1 1 30 22 14 o 16.98000 0.4029000 17.47000 0.6552000 16.48000 0.4692000 0.9943000      0.8059000 
1 1 1 30 22 16 o 29.22000 0.3498000 29.13000 0.5140000 29.32000 0.4746000 -0.1817000     0.6996000 
1 1 1 30 22 18 o 16.54000 0.4741000 16.35000 0.4187000 16.73000 0.8508000 -0.3800000     0.9483000 
1 1 1 30 22 20 o 20.25000 0.4009000 20.78000 0.4078000 19.71000 0.6903000 1.069000       0.8018000 
1 1 1 30 22 22 o 9.331000 0.4922000 8.465000 0.6662000 10.20000 0.7248000 -1.732000      0.9844000 
1 1 1 30 22 24 o 11.07000 0.4558000 10.80000 0.6119000 11.34000 0.6757000 -0.5432000     0.9116000 
1 1 1 30 22 26 o 14.43000 0.3334000 14.40000 0.3831000 14.45000 0.5456000 -0.5725000E-01 0.6667000 
1 1 1 30 22 28 o 6.853000 0.5668000 6.482000 0.6323000 7.225000 0.9409000 -0.7427000     1.134000  
1 1 1 30 22 30 o 16.37000 0.3334000 15.81000 0.4190000 16.93000 0.5188000 -1.117000      0.6668000 
1 1 1 30 22 32 o 14.21000 0.3565000 14.33000 0.3859000 14.09000 0.5996000 0.2470000      0.7130000 
1 1 1 30 22 34 f 11.74000 0.4196000 11.42000 0.5291000 12.06000 0.6513000 -0.6420000     0.8391000 
1 1 1 30 22 36 o 6.598000 0.6568000 6.585000 0.7119000 6.611000 1.104000  -0.2589000E-01 1.314000  
1 1 1 30 22 38 o 10.86000 0.4438000 11.04000 0.4880000 10.69000 0.7414000 0.3504000      0.8876000 
1 1 1 30 22 40 o 6.167000 0.8808000 6.876000 0.8112000 5.457000 1.564000  1.419000       1.762000  
1 1 1 30 22 42 o 3.840000 0.9579000 3.867000 1.276000  3.812000 1.429000  0.5512000E-01  1.916000  
1 1 1 30 22 44 o 3.190000 0.9330000 2.580000 1.132000  3.799000 1.483000  -1.219000      1.866000  
1 1 1 30 22 46 o 4.361000 1.020000  3.772000 1.503000  4.949000 1.380000  -1.177000      2.040000  
1 1 1 30 23 1  o 5.870000 0.7449000 6.434000 0.8734000 5.306000 1.207000  1.128000       1.490000  
1 1 1 30 23 3  o 9.947000 0.5170000 10.44000 0.6856000 9.452000 0.7739000 0.9886000      1.034000  
1 1 1 30 23 5  o 12.71000 0.3615000 12.53000 0.5323000 12.89000 0.4892000 -0.3617000     0.7230000 
1 1 1 30 23 7  o 18.20000 0.3402000 18.30000 0.4505000 18.11000 0.5100000 0.1918000      0.6804000 
1 1 1 30 23 9  o 6.299000 0.6269000 6.634000 0.9040000 5.965000 0.8687000 0.6687000      1.254000  
1 1 1 30 23 11 o 15.38000 0.3694000 15.89000 0.5885000 14.87000 0.4467000 1.019000       0.7389000 
1 1 1 30 23 13 o 27.62000 0.3116000 27.57000 0.3991000 27.67000 0.4786000 -0.9713000E-01 0.6231000 
1 1 1 30 23 15 o 25.31000 0.3127000 25.41000 0.3904000 25.20000 0.4885000 0.2134000      0.6254000 
1 1 1 30 23 17 o 10.77000 0.5018000 11.89000 0.3631000 9.657000 0.9356000 2.233000       1.004000  
1 1 1 30 23 19 o 22.56000 0.3032000 23.02000 0.3304000 22.10000 0.5086000 0.9254000      0.6065000 
1 1 1 30 23 21 o 19.46000 0.3129000 20.07000 0.3475000 18.84000 0.5203000 1.229000       0.6257000 
1 1 1 30 23 23 o 3.838000 0.8161000 4.325000 0.9636000 3.352000 1.317000  0.9722000      1.632000  
1 1 1 30 23 25 o 15.67000 0.3279000 15.05000 0.3451000 16.29000 0.5578000 -1.234000      0.6559000 
1 1 1 30 23 27 o 7.322000 0.5874000 7.756000 0.7411000 6.888000 0.9115000 0.8683000      1.175000  
1 1 1 30 23 29 o 11.32000 0.4324000 10.77000 0.5736000 11.87000 0.6472000 -1.098000      0.8648000 
1 1 1 30 23 31 o 10.03000 0.5851000 8.511000 0.9522000 11.54000 0.6803000 -3.032000      1.170000  
1 1 1 30 23 33 o 12.05000 0.4270000 11.03000 0.4481000 13.07000 0.7269000 -2.041000      0.8539000 
1 1 1 30 23 35 o 6.799000 0.6385000 6.969000 0.7617000 6.630000 1.025000  0.3398000      1.277000  
1 1 1 30 23 37 o 7.658000 0.6512000 6.840000 0.7291000 8.476000 1.079000  -1.636000      1.302000  
1 1 1 30 23 39 o 4.821000 0.9678000 4.247000 1.133000  5.395000 1.569000  -1.148000      1.936000  
1 1 1 30 23 41 o 2.836000 0.8620000 2.257000 1.010000  3.414000 1.397000  -1.157000      1.724000  
1 1 1 30 23 43 o 3.242000 0.9179000 3.541000 1.297000  2.943000 1.299000  0.5981000      1.836000  
1 1 1 30 23 45 o 10.33000 0.5613000 10.95000 0.7924000 9.704000 0.7954000 1.250000       1.123000  
1 1 1 30 24 0  o 3.145000 1.213000  3.145000 1.213000  3.145000 1.213000  0.000000       0.000000  
1 1 1 30 24 2  o 10.99000 0.4423000 11.23000 0.5484000 10.74000 0.6940000 0.4901000      0.8845000 
1 1 1 30 24 4  o 11.75000 0.3923000 11.31000 0.5563000 12.19000 0.5534000 -0.8778000     0.7846000 
1 1 1 30 24 6  o 14.21000 0.4179000 14.33000 0.5938000 14.09000 0.5882000 0.2384000      0.8358000 
1 1 1 30 24 8  o 9.437000 0.4330000 9.278000 0.5704000 9.596000 0.6518000 -0.3175000     0.8661000 
1 1 1 30 24 10 o 2.809000 0.7876000 2.767000 1.079000  2.851000 1.148000  -0.8420000E-01 1.575000  
1 1 1 30 24 12 o 21.77000 0.2793000 22.22000 0.3756000 21.32000 0.4136000 0.9028000      0.5587000 
1 1 1 30 24 14 o 13.95000 0.3053000 14.10000 0.3974000 13.81000 0.4635000 0.2952000      0.6106000 
1 1 1 30 24 16 o 9.812000 0.4873000 10.10000 0.3769000 9.520000 0.8988000 0.5845000      0.9746000 
1 1 1 30 24 18 o 18.99000 0.4334000 19.82000 0.4306000 18.16000 0.7523000 1.663000       0.8668000 
1 1 1 30 24 20 f 16.05000 0.3969000 16.67000 0.3396000 15.43000 0.7174000 1.243000       0.7937000 
1 1 1 30 24 22 o 16.83000 0.3164000 15.94000 0.3326000 17.72000 0.5384000 -1.781000      0.6328000 
1 1 1 30 24 24 o 22.48000 0.3132000 23.21000 0.3726000 21.75000 0.5036000 1.460000       0.6265000 
1 1 1 30 24 26 o 12.13000 0.3515000 11.85000 0.3788000 12.42000 0.5921000 -0.5725000     0.7029000 
1 1 1 30 24 28 o 12.90000 0.3712000 12.56000 0.4514000 13.23000 0.5893000 -0.6719000     0.7423000 
1 1 1 30 24 30 o 11.68000 0.4133000 11.13000 0.5290000 12.24000 0.6351000 -1.102000      0.8266000 
1 1 1 30 24 32 o 9.030000 0.5349000 8.747000 0.7271000 9.314000 0.7848000 -0.5677000     1.070000  
1 1 1 30 24 34 o 8.719000 0.6375000 9.451000 0.9018000 7.986000 0.9013000 1.465000       1.275000  
1 1 1 30 24 36 o 3.534000 0.9447000 2.501000 1.064000  4.567000 1.561000  -2.067000      1.889000  
1 1 1 30 24 38 o 4.821000 0.9939000 4.887000 1.147000  4.755000 1.623000  0.1316000      1.988000  
1 1 1 30 24 40 o 8.325000 0.7275000 9.899000 0.7288000 6.752000 1.259000  3.146000       1.455000  
1 1 1 30 24 42 o 5.308000 1.065000  5.243000 1.540000  5.373000 1.471000  -0.1302000     2.129000  
1 1 1 30 24 44 o 3.003000 0.9418000 2.770000 1.178000  3.237000 1.470000  -0.4664000     1.884000  
1 1 1 30 25 1  o 17.32000 0.2922000 17.68000 0.3871000 16.96000 0.4377000 0.7188000      0.5843000 
1 1 1 30 25 3  o 14.57000 0.3139000 14.81000 0.4378000 14.32000 0.4500000 0.4883000      0.6278000 
1 1 1 30 25 5  o 5.018000 0.7272000 5.291000 0.9776000 4.745000 1.077000  0.5458000      1.454000  
1 1 1 30 25 7  o 7.864000 0.6723000 6.848000 1.105000  8.880000 0.7658000 -2.032000      1.345000  
1 1 1 30 25 9  o 20.42000 0.3517000 20.09000 0.5436000 20.75000 0.4465000 -0.6623000     0.7035000 
1 1 1 30 25 11 o 32.46000 0.3680000 32.45000 0.4163000 32.46000 0.6069000 -0.6329000E-02 0.7359000 
1 1 1 30 25 13 o 32.58000 0.3150000 32.46000 0.4167000 32.70000 0.4725000 -0.2496000     0.6300000 
1 1 1 30 25 15 o 2.619000 0.8606000 2.499000 1.193000  2.738000 1.241000  -0.2393000     1.721000  
1 1 1 30 25 17 o 4.596000 1.043000  5.748000 1.538000  3.445000 1.409000  2.303000       2.086000  
1 1 1 30 25 19 o 6.420000 0.8161000 6.931000 1.107000  5.908000 1.199000  1.023000       1.632000  
1 1 1 30 25 21 o 10.13000 0.5868000 10.28000 0.7225000 9.978000 0.9247000 0.2993000      1.174000  
1 1 1 30 25 23 o 11.94000 0.5245000 10.74000 0.8533000 13.14000 0.6103000 -2.398000      1.049000  
1 1 1 30 25 25 o 13.74000 0.4350000 12.67000 0.6848000 14.82000 0.5365000 -2.145000      0.8700000 
1 1 1 30 25 27 o 14.48000 0.3486000 14.14000 0.4035000 14.82000 0.5685000 -0.6752000     0.6971000 
1 1 1 30 25 29 f 3.327000 0.8264000 2.900000 1.066000  3.754000 1.263000  -0.8543000     1.653000  
1 1 1 30 25 31 o 17.25000 0.3450000 16.81000 0.4412000 17.69000 0.5304000 -0.8766000     0.6899000 
1 1 1 30 25 33 o 10.64000 0.5737000 10.80000 0.5764000 10.48000 0.9921000 0.3248000      1.147000  
1 1 1 30 25 35 f 3.380000 0.9331000 2.625000 1.032000  4.136000 1.555000  -1.511000      1.866000  
1 1 1 30 25 37 o 3.896000 0.9615000 3.694000 1.250000  4.098000 1.461000  -0.4039000     1.923000  
1 1 1 30 25 39 o 7.402000 1.013000  6.354000 1.775000  8.449000 0.9784000 -2.095000      2.026000  
1 1 1 30 25 41 o 6.489000 0.9479000 7.005000 1.296000  5.972000 1.383000  1.033000       1.896000  
1 1 1 30 25 43 o 2.743000 0.8697000 3.021000 1.321000  2.464000 1.131000  0.5578000      1.739000  
1 1 1 30 25 45 o 3.476000 1.323000  ?        ?         3.476000 1.323000  ?              ?         
1 1 1 30 26 0  o 14.38000 0.4300000 14.38000 0.4300000 14.38000 0.4300000 0.000000       0.000000  
1 1 1 30 26 2  o 12.44000 0.3513000 12.87000 0.4570000 12.01000 0.5337000 0.8580000      0.7026000 
1 1 1 30 26 4  o 18.18000 0.2822000 18.03000 0.3914000 18.33000 0.4066000 -0.3064000     0.5643000 
1 1 1 30 26 6  o 17.64000 0.3744000 17.88000 0.5114000 17.40000 0.5469000 0.4771000      0.7488000 
1 1 1 30 26 8  o 13.64000 0.3148000 13.86000 0.4107000 13.42000 0.4771000 0.4411000      0.6295000 
1 1 1 30 26 10 o 5.888000 0.5764000 5.836000 0.7821000 5.941000 0.8469000 -0.1050000     1.153000  
1 1 1 30 26 12 o 13.80000 0.2622000 13.43000 0.3575000 14.18000 0.3837000 -0.7427000     0.5245000 
1 1 1 30 26 14 o 13.71000 0.6454000 12.81000 1.149000  14.62000 0.5886000 -1.819000      1.291000  
1 1 1 30 26 16 o 15.03000 0.4444000 14.75000 0.6158000 15.31000 0.6410000 -0.5674000     0.8889000 
1 1 1 30 26 18 o 17.01000 0.4260000 17.60000 0.5641000 16.41000 0.6384000 1.191000       0.8520000 
1 1 1 30 26 20 o 5.565000 0.8083000 6.280000 1.118000  4.851000 1.168000  1.429000       1.617000  
1 1 1 30 26 22 o 19.99000 0.4522000 19.01000 0.6483000 20.97000 0.6306000 -1.969000      0.9044000 
1 1 1 30 26 24 o 13.41000 0.4978000 12.50000 0.8047000 14.33000 0.5861000 -1.828000      0.9955000 
1 1 1 30 26 26 o 4.746000 0.9376000 3.995000 1.450000  5.497000 1.189000  -1.502000      1.875000  
1 1 1 30 26 28 f 3.320000 0.9405000 3.043000 1.369000  3.597000 1.290000  -0.5534000     1.881000  
1 1 1 30 26 30 o 9.668000 0.6190000 10.29000 0.9567000 9.045000 0.7856000 1.247000       1.238000  
1 1 1 30 26 32 o 6.431000 0.6621000 6.756000 0.7487000 6.105000 1.092000  0.6509000      1.324000  
1 1 1 30 26 34 o 10.27000 0.7063000 9.951000 0.6056000 10.60000 1.276000  -0.6449000     1.413000  
1 1 1 30 26 36 o 4.510000 1.002000  3.873000 1.495000  5.147000 1.336000  -1.274000      2.004000  
1 1 1 30 26 38 o 4.602000 1.125000  4.491000 1.719000  4.714000 1.452000  -0.2234000     2.251000  
1 1 1 30 26 40 o 12.94000 0.5232000 12.23000 0.8031000 13.65000 0.6709000 -1.418000      1.046000  
1 1 1 30 26 42 o 9.457000 0.6486000 9.592000 0.9415000 9.322000 0.8925000 0.2693000      1.297000  
1 1 1 30 26 44 o 3.115000 0.9610000 3.336000 1.423000  2.894000 1.291000  0.4419000      1.922000  
1 1 1 30 27 1  o 4.240000 0.8348000 3.828000 1.134000  4.651000 1.225000  -0.8234000     1.670000  
1 1 1 30 27 3  o 10.17000 0.3799000 10.55000 0.4996000 9.794000 0.5726000 0.7564000      0.7599000 
1 1 1 30 27 5  o 10.08000 0.5339000 9.699000 0.9203000 10.47000 0.5417000 -0.7675000     1.068000  
1 1 1 30 27 7  o 10.64000 0.4263000 10.94000 0.4854000 10.34000 0.7009000 0.5981000      0.8526000 
1 1 1 30 27 9  f 11.62000 0.3060000 11.48000 0.4155000 11.75000 0.4493000 -0.2668000     0.6119000 
1 1 1 30 27 11 o 18.94000 0.5074000 18.85000 0.8718000 19.03000 0.5195000 -0.1817000     1.015000  
1 1 1 30 27 13 o 12.74000 0.4547000 12.75000 0.6272000 12.73000 0.6585000 0.1867000E-01  0.9095000 
1 1 1 30 27 15 f 7.716000 0.7189000 8.174000 0.9008000 7.258000 1.121000  0.9163000      1.438000  
1 1 1 30 27 17 o 18.89000 0.5606000 20.04000 0.6388000 17.74000 0.9215000 2.297000       1.121000  
1 1 1 30 27 19 o 14.62000 0.4385000 14.71000 0.5729000 14.52000 0.6640000 0.1850000      0.8770000 
1 1 1 30 27 21 o 4.123000 0.9417000 5.091000 1.302000  3.154000 1.361000  1.937000       1.883000  
1 1 1 30 27 23 o 3.123000 0.9359000 3.127000 1.342000  3.119000 1.305000  0.7376000E-02  1.872000  
1 1 1 30 27 25 o 2.903000 0.8693000 2.827000 1.235000  2.978000 1.223000  -0.1506000     1.739000  
1 1 1 30 27 27 o 6.453000 0.7643000 6.974000 1.050000  5.932000 1.111000  1.042000       1.529000  
1 1 1 30 27 29 f 8.152000 0.7656000 7.679000 1.269000  8.625000 0.8572000 -0.9464000     1.531000  
1 1 1 30 27 31 o 11.36000 0.5184000 10.48000 0.8172000 12.23000 0.6380000 -1.751000      1.037000  
1 1 1 30 27 33 f 7.590000 0.9764000 7.846000 1.069000  7.334000 1.634000  0.5120000      1.953000  
1 1 1 30 27 35 o 4.708000 1.029000  3.891000 1.614000  5.526000 1.276000  -1.635000      2.057000  
1 1 1 30 27 37 o 10.25000 0.7031000 9.601000 1.189000  10.90000 0.7515000 -1.297000      1.406000  
1 1 1 30 27 39 o 3.199000 0.9347000 3.835000 1.453000  2.562000 1.176000  1.272000       1.869000  
1 1 1 30 27 41 o 8.099000 0.7571000 8.019000 1.102000  8.179000 1.038000  -0.1599000     1.514000  
1 1 1 30 27 43 o 4.233000 1.106000  4.482000 1.509000  3.983000 1.619000  0.4991000      2.213000  
1 1 1 30 28 0  o 18.93000 0.4561000 18.93000 0.4561000 18.93000 0.4561000 0.000000       0.000000  
1 1 1 30 28 2  o 11.04000 0.4623000 11.78000 0.5080000 10.31000 0.7725000 1.471000       0.9246000 
1 1 1 30 28 4  o 22.41000 0.3340000 22.61000 0.5490000 22.22000 0.3807000 0.3811000      0.6681000 
1 1 1 30 28 6  o 15.86000 0.3536000 16.56000 0.4331000 15.16000 0.5592000 1.404000       0.7073000 
1 1 1 30 28 8  o 13.02000 0.3131000 13.60000 0.4151000 12.44000 0.4688000 1.161000       0.6261000 
1 1 1 30 28 10 o 6.868000 0.7320000 6.185000 1.171000  7.552000 0.8791000 -1.367000      1.464000  
1 1 1 30 28 12 o 10.69000 0.5060000 11.54000 0.7072000 9.847000 0.7238000 1.689000       1.012000  
1 1 1 30 28 14 o 14.08000 0.4180000 14.23000 0.5861000 13.93000 0.5963000 0.3072000      0.8361000 
1 1 1 30 28 16 o 29.51000 0.3800000 29.97000 0.5101000 29.05000 0.5633000 0.9255000      0.7599000 
1 1 1 30 28 18 o 16.85000 0.4234000 17.38000 0.5309000 16.32000 0.6599000 1.057000       0.8469000 
1 1 1 30 28 20 o 6.477000 0.9198000 4.862000 1.372000  8.091000 1.225000  -3.229000      1.840000  
1 1 1 30 28 22 o 20.16000 0.5798000 19.86000 0.6841000 20.46000 0.9364000 -0.5965000     1.160000  
1 1 1 30 28 24 o 5.408000 0.8806000 3.810000 1.379000  7.007000 1.096000  -3.197000      1.761000  
1 1 1 30 28 26 o 6.392000 0.9876000 6.515000 1.457000  6.269000 1.334000  0.2457000      1.975000  
1 1 1 30 28 28 o 6.103000 0.9573000 6.659000 1.516000  5.547000 1.169000  1.112000       1.915000  
1 1 1 30 28 30 o 6.600000 0.8336000 6.342000 1.293000  6.858000 1.052000  -0.5159000     1.667000  
1 1 1 30 28 32 o 10.85000 0.8073000 10.85000 0.8073000 ?        ?         ?              ?         
1 1 1 30 28 34 o 6.800000 0.8632000 6.687000 1.264000  6.912000 1.175000  -0.2256000     1.726000  
1 1 1 30 28 36 o 3.895000 1.082000  4.100000 1.619000  3.689000 1.437000  0.4107000      2.164000  
1 1 1 30 28 38 o 6.932000 0.9353000 7.578000 1.044000  6.287000 1.552000  1.291000       1.871000  
1 1 1 30 28 40 f 8.804000 0.7006000 9.056000 0.9468000 8.552000 1.033000  0.5040000      1.401000  
1 1 1 30 28 42 o 10.22000 0.6371000 10.04000 0.9078000 10.39000 0.8942000 -0.3469000     1.274000  
1 1 1 30 29 1  o 10.86000 0.4291000 11.48000 0.4913000 10.24000 0.7036000 1.234000       0.8581000 
1 1 1 30 29 3  o 12.05000 0.3324000 11.69000 0.4855000 12.42000 0.4541000 -0.7243000     0.6648000 
1 1 1 30 29 5  o 13.76000 0.3160000 14.34000 0.4502000 13.19000 0.4434000 1.156000       0.6319000 
1 1 1 30 29 7  o 18.79000 0.2717000 18.92000 0.3791000 18.65000 0.3894000 0.2759000      0.5434000 
1 1 1 30 29 9  o 4.869000 0.9311000 5.563000 1.257000  4.176000 1.374000  1.387000       1.862000  
1 1 1 30 29 11 o 3.728000 1.002000  3.667000 1.489000  3.790000 1.342000  -0.1233000     2.004000  
1 1 1 30 29 13 f 24.60000 0.3588000 24.19000 0.4986000 25.01000 0.5161000 -0.8176000     0.7176000 
1 1 1 30 29 15 o 18.07000 0.3903000 18.14000 0.5417000 18.01000 0.5621000 0.1250000      0.7807000 
1 1 1 30 29 17 o 11.78000 0.5290000 12.91000 0.6405000 10.64000 0.8420000 2.270000       1.058000  
1 1 1 30 29 19 o 5.016000 0.9493000 4.899000 1.379000  5.133000 1.305000  -0.2338000     1.899000  
1 1 1 30 29 21 o 6.368000 0.9939000 8.207000 0.9644000 4.528000 1.738000  3.679000       1.988000  
1 1 1 30 29 23 o 6.037000 0.9052000 5.986000 1.420000  6.089000 1.123000  -0.1039000     1.810000  
1 1 1 30 29 25 o 5.461000 1.085000  4.813000 1.473000  6.108000 1.595000  -1.295000      2.171000  
1 1 1 30 29 27 o 3.339000 1.049000  3.794000 1.711000  2.883000 1.214000  0.9109000      2.098000  
1 1 1 30 29 29 o 5.568000 0.9176000 5.272000 1.404000  5.863000 1.181000  -0.5917000     1.835000  
1 1 1 30 29 31 o 4.475000 1.169000  4.165000 1.413000  4.785000 1.863000  -0.6201000     2.338000  
1 1 1 30 29 33 o 13.76000 0.4603000 13.62000 0.6504000 13.90000 0.6516000 -0.2756000     0.9206000 
1 1 1 30 29 35 o 6.780000 0.9730000 4.964000 1.731000  8.597000 0.8885000 -3.633000      1.946000  
1 1 1 30 29 37 o 6.203000 0.9293000 5.523000 1.422000  6.884000 1.196000  -1.362000      1.859000  
1 1 1 30 29 39 o 5.640000 0.9309000 4.097000 1.453000  7.184000 1.164000  -3.087000      1.862000  
1 1 1 30 29 41 o 4.970000 1.054000  5.571000 1.469000  4.369000 1.512000  1.201000       2.108000  
1 1 1 30 30 0  o 36.37000 0.4949000 36.37000 0.4949000 36.37000 0.4949000 0.000000       0.000000  
1 1 1 30 30 2  o 15.38000 0.3737000 15.39000 0.4120000 15.37000 0.6236000 0.2584000E-01  0.7475000 
1 1 1 30 30 4  o 8.531000 0.4073000 8.951000 0.5555000 8.111000 0.5959000 0.8403000      0.8147000 
1 1 1 30 30 6  o 4.453000 0.6866000 3.976000 0.9816000 4.930000 0.9604000 -0.9542000     1.373000  
1 1 1 30 30 8  o 22.38000 0.4096000 23.05000 0.4892000 21.72000 0.6571000 1.326000       0.8192000 
1 1 1 30 30 10 o 12.48000 0.4424000 12.19000 0.6318000 12.77000 0.6194000 -0.5743000     0.8848000 
1 1 1 30 30 12 o 18.28000 0.3774000 18.32000 0.5424000 18.25000 0.5248000 0.7556000E-01  0.7547000 
1 1 1 30 30 14 o 18.41000 0.3787000 18.60000 0.5306000 18.21000 0.5404000 0.3901000      0.7574000 
1 1 1 30 30 16 o 11.44000 0.5019000 11.55000 0.7012000 11.32000 0.7184000 0.2286000      1.004000  
1 1 1 30 30 18 o 19.93000 0.3920000 19.90000 0.5127000 19.96000 0.5931000 -0.5741000E-01 0.7840000 
1 1 1 30 30 20 o 5.681000 0.8822000 5.786000 1.220000  5.576000 1.275000  0.2107000      1.764000  
1 1 1 30 30 22 o 13.02000 0.5006000 12.72000 0.6939000 13.33000 0.7218000 -0.6110000     1.001000  
1 1 1 30 30 24 o 14.66000 0.5304000 14.82000 0.7143000 14.50000 0.7842000 0.3137000      1.061000  
1 1 1 30 30 26 o 6.061000 0.9738000 4.878000 1.629000  7.244000 1.067000  -2.366000      1.948000  
1 1 1 30 30 28 o 3.676000 1.034000  3.535000 1.402000  3.817000 1.520000  -0.2816000     2.068000  
1 1 1 30 30 30 o 8.578000 1.210000  8.578000 1.210000  ?        ?         ?              ?         
1 1 1 30 30 32 o 10.19000 0.9623000 9.405000 1.724000  10.97000 0.8557000 -1.561000      1.925000  
1 1 1 30 30 34 o 5.127000 1.058000  4.398000 1.644000  5.856000 1.332000  -1.458000      2.116000  
1 1 1 30 30 36 o 3.601000 0.9971000 3.330000 1.383000  3.872000 1.437000  -0.5415000     1.994000  
1 1 1 30 30 38 o 5.365000 1.002000  4.743000 1.424000  5.986000 1.410000  -1.243000      2.004000  
1 1 1 30 30 40 o 6.977000 0.8505000 7.107000 1.160000  6.847000 1.244000  0.2600000      1.701000  
1 1 1 30 31 1  o 9.298000 0.3954000 9.626000 0.5088000 8.970000 0.6053000 0.6555000      0.7907000 
1 1 1 30 31 3  o 8.953000 0.3842000 9.490000 0.5125000 8.416000 0.5725000 1.074000       0.7684000 
1 1 1 30 31 5  o 4.230000 0.7462000 4.369000 0.9443000 4.091000 1.156000  0.2783000      1.492000  
1 1 1 30 31 7  o 2.905000 0.8442000 3.408000 1.261000  2.401000 1.123000  1.006000       1.688000  
1 1 1 30 31 9  o 14.10000 0.4921000 13.99000 0.5677000 14.21000 0.8040000 -0.2121000     0.9842000 
1 1 1 30 31 11 o 14.44000 0.4540000 14.09000 0.7188000 14.80000 0.5547000 -0.7080000     0.9080000 
1 1 1 30 31 13 o 3.518000 0.8759000 2.504000 1.134000  4.532000 1.335000  -2.028000      1.752000  
1 1 1 30 31 15 o 13.65000 0.4333000 13.32000 0.5837000 13.98000 0.6405000 -0.6588000     0.8666000 
1 1 1 30 31 17 o 8.026000 0.6363000 8.221000 0.8268000 7.831000 0.9674000 0.3899000      1.273000  
1 1 1 30 31 19 o 3.294000 0.9155000 2.804000 1.202000  3.785000 1.381000  -0.9804000     1.831000  
1 1 1 30 31 21 o 3.732000 1.054000  3.499000 1.371000  3.965000 1.600000  -0.4665000     2.107000  
1 1 1 30 31 23 o 3.884000 1.022000  3.475000 1.449000  4.294000 1.442000  -0.8194000     2.044000  
1 1 1 30 31 25 o 2.665000 0.8716000 2.703000 1.278000  2.628000 1.186000  0.7513000E-01  1.743000  
1 1 1 30 31 27 o 8.201000 0.8212000 7.416000 1.138000  8.985000 1.184000  -1.569000      1.642000  
1 1 1 30 31 29 o 14.23000 0.5142000 13.91000 0.7005000 14.55000 0.7531000 -0.6360000     1.028000  
1 1 1 30 31 31 o 6.023000 0.9829000 4.344000 1.674000  7.702000 1.030000  -3.357000      1.966000  
1 1 1 30 31 33 o 6.435000 0.8762000 7.790000 1.082000  5.080000 1.378000  2.710000       1.752000  
1 1 1 30 31 35 o 3.795000 1.009000  4.025000 1.458000  3.566000 1.396000  0.4589000      2.019000  
1 1 1 30 31 37 o 3.394000 0.9927000 2.634000 1.225000  4.155000 1.562000  -1.521000      1.985000  
1 1 1 30 31 39 o 8.443000 0.8165000 7.454000 1.181000  9.433000 1.127000  -1.979000      1.633000  
1 1 1 30 32 0  o 17.36000 0.4775000 17.36000 0.4775000 17.36000 0.4775000 0.000000       0.000000  
1 1 1 30 32 2  o 14.77000 0.3326000 14.67000 0.5330000 14.87000 0.3981000 -0.2051000     0.6652000 
1 1 1 30 32 4  o 13.00000 0.2987000 12.92000 0.4322000 13.08000 0.4123000 -0.1601000     0.5973000 
1 1 1 30 32 6  o 7.433000 0.6476000 8.679000 0.7836000 6.187000 1.031000  2.492000       1.295000  
1 1 1 30 32 8  o 8.805000 0.5941000 9.718000 0.7466000 7.891000 0.9243000 1.827000       1.188000  
1 1 1 30 32 10 o 6.196000 0.8200000 6.247000 1.158000  6.145000 1.161000  0.1027000      1.640000  
1 1 1 30 32 12 f 27.55000 0.3600000 27.14000 0.5045000 27.96000 0.5138000 -0.8234000     0.7200000 
1 1 1 30 32 14 o 13.83000 0.4338000 14.33000 0.5942000 13.33000 0.6323000 0.9960000      0.8677000 
1 1 1 30 32 16 o 5.803000 0.8945000 6.383000 1.068000  5.222000 1.435000  1.161000       1.789000  
1 1 1 30 32 18 o 4.587000 0.9407000 4.810000 1.257000  4.363000 1.400000  0.4475000      1.881000  
1 1 1 30 32 20 o 11.39000 0.7123000 12.85000 0.6602000 9.925000 1.262000  2.923000       1.425000  
1 1 1 30 32 22 o 5.387000 0.9103000 4.126000 1.352000  6.649000 1.220000  -2.523000      1.821000  
1 1 1 30 32 24 o 6.042000 1.129000  4.991000 1.569000  7.093000 1.622000  -2.101000      2.257000  
1 1 1 30 32 26 o 5.362000 0.9680000 5.265000 1.443000  5.458000 1.291000  -0.1925000     1.936000  
1 1 1 30 32 28 o 6.697000 0.8977000 7.009000 1.196000  6.384000 1.339000  0.6251000      1.795000  
1 1 1 30 32 30 o 3.760000 1.012000  3.787000 1.400000  3.734000 1.462000  0.5225000E-01  2.024000  
1 1 1 30 32 32 o 4.011000 1.087000  3.432000 1.386000  4.591000 1.674000  -1.159000      2.174000  
1 1 1 30 32 34 o 3.142000 1.034000  3.759000 1.682000  2.524000 1.202000  1.236000       2.067000  
1 1 1 30 32 36 o 2.894000 0.8972000 3.146000 1.347000  2.642000 1.185000  0.5038000      1.794000  
1 1 1 30 32 38 o 3.486000 0.9638000 3.052000 1.305000  3.921000 1.419000  -0.8685000     1.928000  
1 1 1 30 33 1  o 10.05000 0.5488000 10.55000 0.9300000 9.555000 0.5829000 0.9973000      1.098000  
1 1 1 30 33 3  o 3.147000 0.7803000 3.612000 1.254000  2.682000 0.9296000 0.9297000      1.561000  
1 1 1 30 33 5  o 14.28000 0.3935000 14.41000 0.5637000 14.15000 0.5493000 0.2635000      0.7871000 
1 1 1 30 33 7  o 5.617000 0.8497000 5.650000 1.171000  5.584000 1.231000  0.6532000E-01  1.699000  
1 1 1 30 33 9  o 14.01000 0.4877000 13.75000 0.5911000 14.26000 0.7758000 -0.5044000     0.9754000 
1 1 1 30 33 11 o 9.940000 0.6128000 9.886000 0.9949000 9.995000 0.7157000 -0.1086000     1.226000  
1 1 1 30 33 13 o 12.79000 0.4579000 12.55000 0.6447000 13.02000 0.6505000 -0.4708000     0.9159000 
1 1 1 30 33 15 o 6.796000 0.7515000 6.654000 1.035000  6.938000 1.090000  -0.2842000     1.503000  
1 1 1 30 33 17 o 3.683000 0.9565000 3.789000 1.311000  3.577000 1.393000  0.2126000      1.913000  
1 1 1 30 33 19 o 9.200000 0.5958000 9.132000 0.8182000 9.268000 0.8663000 -0.1354000     1.192000  
1 1 1 30 33 21 o 8.623000 0.7038000 8.388000 1.065000  8.857000 0.9205000 -0.4684000     1.408000  
1 1 1 30 33 23 o 9.630000 0.7245000 9.005000 0.9707000 10.26000 1.076000  -1.250000      1.449000  
1 1 1 30 33 25 o 5.776000 0.9117000 5.934000 1.239000  5.618000 1.338000  0.3158000      1.823000  
1 1 1 30 33 27 o 4.889000 1.091000  4.304000 1.547000  5.475000 1.540000  -1.171000      2.183000  
1 1 1 30 33 29 o 3.677000 0.9736000 3.294000 1.305000  4.059000 1.445000  -0.7652000     1.947000  
1 1 1 30 33 31 o 4.925000 0.9986000 5.982000 1.399000  3.867000 1.426000  2.115000       1.997000  
1 1 1 30 33 33 o 4.551000 1.052000  4.012000 1.580000  5.089000 1.388000  -1.077000      2.103000  
1 1 1 30 33 35 o 4.070000 1.187000  3.638000 1.526000  4.503000 1.820000  -0.8651000     2.375000  
1 1 1 30 33 37 o 3.022000 0.9295000 2.451000 1.147000  3.593000 1.463000  -1.141000      1.859000  
1 1 1 30 34 0  o 2.196000 0.9766000 2.196000 0.9766000 2.196000 0.9766000 0.000000       0.000000  
1 1 1 30 34 2  o 4.984000 0.6994000 4.777000 1.226000  5.192000 0.6743000 -0.4142000     1.399000  
1 1 1 30 34 4  o 10.80000 0.4552000 11.19000 0.6804000 10.41000 0.6049000 0.7807000      0.9104000 
1 1 1 30 34 6  o 3.091000 0.8977000 3.365000 1.327000  2.817000 1.210000  0.5482000      1.795000  
1 1 1 30 34 8  o 7.394000 0.6839000 6.932000 0.9901000 7.855000 0.9438000 -0.9228000     1.368000  
1 1 1 30 34 10 o 3.022000 0.9022000 3.125000 1.308000  2.920000 1.242000  0.2050000      1.804000  
1 1 1 30 34 12 o 12.23000 0.5443000 11.41000 0.9090000 13.05000 0.5990000 -1.643000      1.089000  
1 1 1 30 34 14 o 11.33000 0.5140000 11.37000 0.7134000 11.29000 0.7402000 0.7525000E-01  1.028000  
1 1 1 30 34 16 o 5.695000 0.9172000 4.878000 1.361000  6.512000 1.230000  -1.634000      1.834000  
1 1 1 30 34 18 o 4.615000 0.8958000 3.000000 1.279000  6.230000 1.255000  -3.230000      1.792000  
1 1 1 30 34 20 o 5.337000 1.234000  3.510000 1.484000  7.163000 1.973000  -3.653000      2.469000  
1 1 1 30 34 22 o 7.581000 0.7339000 7.664000 0.9046000 7.498000 1.156000  0.1660000      1.468000  
1 1 1 30 34 24 o 5.535000 0.9406000 5.228000 1.302000  5.842000 1.357000  -0.6131000     1.881000  
1 1 1 30 34 26 o 8.731000 0.8006000 7.995000 1.223000  9.467000 1.033000  -1.472000      1.601000  
1 1 1 30 34 28 o 9.645000 0.6356000 10.90000 0.7928000 8.394000 0.9938000 2.501000       1.271000  
1 1 1 30 34 30 o 3.864000 0.9771000 3.879000 1.426000  3.849000 1.337000  0.3005000E-01  1.954000  
1 1 1 30 34 32 o 6.127000 1.006000  6.096000 1.611000  6.159000 1.207000  -0.6331000E-01 2.013000  
1 1 1 30 34 34 o 6.641000 1.014000  7.059000 1.464000  6.224000 1.405000  0.8352000      2.029000  
1 1 1 30 34 36 o 3.433000 0.9744000 3.797000 1.406000  3.069000 1.350000  0.7278000      1.949000  
1 1 1 30 35 1  o 5.399000 0.6807000 5.463000 1.024000  5.335000 0.8972000 0.1284000      1.361000  
1 1 1 30 35 3  o 6.596000 0.6655000 7.432000 0.8322000 5.760000 1.039000  1.672000       1.331000  
1 1 1 30 35 5  o 3.837000 0.9026000 3.560000 1.299000  4.113000 1.254000  -0.5533000     1.805000  
1 1 1 30 35 7  o 12.25000 0.4340000 12.73000 0.5758000 11.77000 0.6495000 0.9671000      0.8680000 
1 1 1 30 35 9  o 7.160000 0.7951000 6.856000 0.9587000 7.464000 1.269000  -0.6076000     1.590000  
1 1 1 30 35 11 o 10.15000 0.5199000 10.36000 0.7491000 9.929000 0.7212000 0.4337000      1.040000  
1 1 1 30 35 13 o 4.197000 0.9265000 5.373000 1.315000  3.022000 1.305000  2.351000       1.853000  
1 1 1 30 35 15 o 5.039000 0.9602000 5.496000 1.254000  4.582000 1.455000  0.9138000      1.920000  
1 1 1 30 35 17 o 9.619000 0.7100000 10.36000 0.8891000 8.879000 1.107000  1.480000       1.420000  
1 1 1 30 35 19 o 13.38000 0.5510000 13.38000 0.8099000 13.38000 0.7474000 0.7935000E-03  1.102000  
1 1 1 30 35 21 o 6.861000 0.8100000 7.154000 1.063000  6.567000 1.223000  0.5870000      1.620000  
1 1 1 30 35 23 o 7.942000 1.053000  8.494000 1.640000  7.389000 1.320000  1.105000       2.106000  
1 1 1 30 35 25 o 8.639000 0.7353000 8.131000 1.070000  9.147000 1.009000  -1.016000      1.471000  
1 1 1 30 35 27 o 9.907000 0.6328000 8.993000 0.9117000 10.82000 0.8777000 -1.827000      1.266000  
1 1 1 30 35 29 o 6.329000 0.8313000 6.412000 1.158000  6.246000 1.193000  0.1660000      1.663000  
1 1 1 30 35 31 o 3.990000 1.050000  3.572000 1.402000  4.408000 1.564000  -0.8357000     2.101000  
1 1 1 30 35 33 o 5.606000 0.9984000 5.895000 1.407000  5.316000 1.417000  0.5789000      1.997000  
1 1 1 30 35 35 o 6.574000 0.9354000 5.500000 1.504000  7.648000 1.112000  -2.148000      1.871000  
1 1 1 30 36 0  o 5.726000 1.023000  5.726000 1.023000  5.726000 1.023000  0.000000       0.000000  
1 1 1 30 36 2  o 5.864000 0.5490000 6.693000 0.8182000 5.034000 0.7323000 1.660000       1.098000  
1 1 1 30 36 4  o 14.81000 0.3916000 14.25000 0.5990000 15.37000 0.5047000 -1.120000      0.7833000 
1 1 1 30 36 6  o 4.153000 0.9383000 3.850000 1.354000  4.457000 1.299000  -0.6067000     1.877000  
1 1 1 30 36 8  o 5.195000 0.9108000 5.945000 1.136000  4.445000 1.424000  1.500000       1.822000  
1 1 1 30 36 10 o 5.156000 0.9010000 4.732000 1.275000  5.581000 1.273000  -0.8487000     1.802000  
1 1 1 30 36 12 o 16.15000 0.4581000 16.28000 0.6819000 16.01000 0.6118000 0.2702000      0.9161000 
1 1 1 30 36 14 o 12.52000 0.5599000 12.47000 0.7601000 12.57000 0.8222000 -0.1061000     1.120000  
1 1 1 30 36 16 f 2.902000 0.9019000 2.670000 1.216000  3.134000 1.332000  -0.4641000     1.804000  
1 1 1 30 36 18 o 6.637000 0.8350000 6.159000 1.212000  7.116000 1.149000  -0.9566000     1.670000  
1 1 1 30 36 20 o 6.932000 0.9371000 6.778000 1.456000  7.086000 1.180000  -0.3074000     1.874000  
1 1 1 30 36 22 o 11.46000 0.6397000 10.94000 0.9285000 11.99000 0.8802000 -1.049000      1.279000  
1 1 1 30 36 24 o 7.185000 0.8398000 7.353000 1.158000  7.017000 1.217000  0.3363000      1.680000  
1 1 1 30 36 26 o 6.557000 0.8872000 6.406000 1.333000  6.709000 1.171000  -0.3031000     1.774000  
1 1 1 30 36 28 o 10.55000 0.6237000 11.23000 0.7872000 9.878000 0.9678000 1.350000       1.247000  
1 1 1 30 36 30 o 5.044000 1.009000  5.206000 1.356000  4.882000 1.496000  0.3242000      2.019000  
1 1 1 30 36 32 o 5.066000 0.9963000 5.932000 1.341000  4.199000 1.473000  1.732000       1.993000  
1 1 1 30 36 34 o 3.494000 1.005000  3.780000 1.508000  3.209000 1.328000  0.5712000      2.009000  
1 1 1 30 37 1  o 20.20000 0.4931000 19.28000 0.3771000 21.12000 0.9114000 -1.842000      0.9863000 
1 1 1 30 37 3  o 2.960000 0.8718000 2.746000 1.087000  3.173000 1.363000  -0.4279000     1.744000  
1 1 1 30 37 5  o 3.458000 0.9826000 3.463000 1.322000  3.454000 1.454000  0.8390000E-02  1.965000  
1 1 1 30 37 7  o 3.780000 0.9262000 4.130000 1.296000  3.429000 1.324000  0.7012000      1.852000  
1 1 1 30 37 9  o 4.040000 1.098000  4.122000 1.283000  3.958000 1.781000  0.1640000      2.195000  
1 1 1 30 37 11 o 4.485000 1.061000  3.538000 1.459000  5.433000 1.541000  -1.895000      2.122000  
1 1 1 30 37 13 o 4.950000 1.084000  4.728000 1.584000  5.172000 1.479000  -0.4444000     2.167000  
1 1 1 30 37 15 o 8.756000 0.6461000 8.646000 0.8544000 8.867000 0.9693000 -0.2202000     1.292000  
1 1 1 30 37 17 o 3.237000 0.9308000 2.944000 1.256000  3.530000 1.374000  -0.5858000     1.862000  
1 1 1 30 37 19 o 6.085000 1.092000  6.291000 1.522000  5.880000 1.567000  0.4110000      2.185000  
1 1 1 30 37 21 o 3.458000 1.002000  3.113000 1.301000  3.804000 1.525000  -0.6909000     2.004000  
1 1 1 30 37 23 o 5.718000 1.008000  4.643000 1.687000  6.793000 1.105000  -2.151000      2.017000  
1 1 1 30 37 25 o 5.046000 0.9837000 6.380000 1.335000  3.712000 1.445000  2.668000       1.967000  
1 1 1 30 37 27 o 8.081000 0.7402000 8.213000 1.034000  7.950000 1.060000  0.2632000      1.480000  
1 1 1 30 37 29 o 3.278000 0.9721000 3.424000 1.385000  3.132000 1.364000  0.2924000      1.944000  
1 1 1 30 37 31 o 3.205000 0.9823000 2.635000 1.208000  3.774000 1.549000  -1.139000      1.965000  
1 1 1 30 37 33 o 4.618000 1.044000  3.992000 1.560000  5.245000 1.389000  -1.253000      2.089000  
1 1 1 30 38 0  o 4.136000 1.830000  4.136000 1.830000  4.136000 1.830000  0.000000       0.000000  
1 1 1 30 38 2  o 9.196000 0.9213000 9.703000 0.5487000 8.690000 1.759000  1.012000       1.843000  
1 1 1 30 38 4  o 4.127000 1.071000  4.363000 1.209000  3.890000 1.769000  0.4731000      2.143000  
1 1 1 30 38 6  o 12.58000 0.7809000 12.72000 0.5230000 12.43000 1.472000  0.2974000      1.562000  
1 1 1 30 38 8  o 8.620000 0.6834000 9.253000 0.8312000 7.987000 1.085000  1.266000       1.367000  
1 1 1 30 38 10 o 3.981000 0.9854000 3.592000 1.403000  4.370000 1.384000  -0.7777000     1.971000  
1 1 1 30 38 12 o 12.72000 0.5573000 13.68000 0.8155000 11.76000 0.7598000 1.925000       1.115000  
1 1 1 30 38 14 o 6.897000 0.8433000 6.436000 1.225000  7.357000 1.159000  -0.9212000     1.687000  
1 1 1 30 38 16 o 10.15000 0.7511000 8.559000 1.174000  11.73000 0.9378000 -3.172000      1.502000  
1 1 1 30 38 18 o 14.30000 0.5410000 14.73000 0.6739000 13.88000 0.8465000 0.8485000      1.082000  
1 1 1 30 38 20 o 4.121000 1.067000  4.546000 1.423000  3.695000 1.590000  0.8511000      2.134000  
1 1 1 30 38 22 o 2.926000 0.8842000 3.118000 1.288000  2.733000 1.212000  0.3851000      1.768000  
1 1 1 30 38 24 o 7.094000 0.8341000 6.059000 1.297000  8.130000 1.049000  -2.071000      1.668000  
1 1 1 30 38 26 o 7.078000 0.8628000 6.126000 1.305000  8.031000 1.129000  -1.905000      1.726000  
1 1 1 30 38 28 o 4.466000 1.057000  5.463000 1.603000  3.470000 1.379000  1.993000       2.114000  
1 1 1 30 38 30 o 6.785000 0.8459000 7.193000 1.157000  6.376000 1.234000  0.8165000      1.692000  
1 1 1 30 38 32 o 3.218000 0.9785000 3.505000 1.444000  2.932000 1.320000  0.5721000      1.957000  
1 1 1 30 39 1  o 8.508000 0.7593000 9.331000 0.6063000 7.685000 1.392000  1.646000       1.519000  
1 1 1 30 39 3  o 3.407000 1.015000  3.958000 1.558000  2.855000 1.301000  1.103000       2.030000  
1 1 1 30 39 5  o 9.116000 0.6938000 8.946000 0.6178000 9.285000 1.242000  -0.3393000     1.388000  
1 1 1 30 39 7  o 13.54000 0.4793000 13.95000 0.4581000 13.13000 0.8421000 0.8129000      0.9587000 
1 1 1 30 39 9  o 14.26000 0.5394000 14.77000 0.5666000 13.75000 0.9182000 1.018000       1.079000  
1 1 1 30 39 11 o 5.928000 0.9778000 6.953000 1.306000  4.902000 1.456000  2.051000       1.956000  
1 1 1 30 39 13 o 3.154000 0.9849000 3.150000 1.408000  3.158000 1.377000  -0.7902000E-02 1.970000  
1 1 1 30 39 15 o 6.392000 0.9071000 6.793000 1.133000  5.991000 1.417000  0.8019000      1.814000  
1 1 1 30 39 17 o 3.252000 0.9752000 3.566000 1.442000  2.938000 1.313000  0.6277000      1.950000  
1 1 1 30 39 19 o 3.267000 0.9625000 3.300000 1.367000  3.233000 1.355000  0.6741000E-01  1.925000  
1 1 1 30 39 21 o 4.433000 1.017000  4.502000 1.406000  4.363000 1.469000  0.1382000      2.034000  
1 1 1 30 39 23 o 3.546000 0.9571000 3.243000 1.278000  3.849000 1.425000  -0.6067000     1.914000  
1 1 1 30 39 25 o 7.780000 0.7969000 5.942000 1.294000  9.618000 0.9301000 -3.676000      1.594000  
1 1 1 30 39 27 o 6.470000 1.012000  6.606000 1.489000  6.333000 1.371000  0.2727000      2.024000  
1 1 1 30 39 29 o 4.740000 1.063000  4.892000 1.614000  4.587000 1.384000  0.3049000      2.126000  
1 1 1 30 39 31 o 3.983000 1.173000  3.390000 1.427000  4.577000 1.862000  -1.187000      2.346000  
1 1 1 30 40 0  o 1.992000 0.8781000 1.992000 0.8781000 1.992000 0.8781000 0.000000       0.000000  
1 1 1 30 40 2  o 10.49000 0.5626000 10.70000 0.5852000 10.28000 0.9610000 0.4182000      1.125000  
1 1 1 30 40 4  o 9.127000 0.6721000 8.822000 0.7937000 9.432000 1.085000  -0.6101000     1.344000  
1 1 1 30 40 6  o 5.633000 1.030000  4.775000 1.055000  6.490000 1.769000  -1.715000      2.060000  
1 1 1 30 40 8  o 7.765000 0.9683000 7.360000 0.7751000 8.171000 1.775000  -0.8112000     1.937000  
1 1 1 30 40 10 o 4.271000 1.071000  4.621000 1.288000  3.921000 1.711000  0.7000000      2.142000  
1 1 1 30 40 12 o 6.885000 1.226000  6.179000 1.629000  7.592000 1.831000  -1.413000      2.451000  
1 1 1 30 40 14 o 3.551000 0.9706000 3.201000 1.327000  3.900000 1.417000  -0.6986000     1.941000  
1 1 1 30 40 16 o 3.403000 0.9767000 3.167000 1.295000  3.639000 1.462000  -0.4721000     1.953000  
1 1 1 30 40 18 o 10.19000 0.5738000 10.75000 0.7643000 9.621000 0.8561000 1.130000       1.148000  
1 1 1 30 40 20 o 4.684000 1.138000  4.349000 1.414000  5.020000 1.783000  -0.6703000     2.276000  
1 1 1 30 40 22 o 4.016000 0.9354000 4.999000 1.313000  3.033000 1.333000  1.966000       1.871000  
1 1 1 30 40 24 o 4.651000 1.024000  4.391000 1.485000  4.911000 1.409000  -0.5198000     2.048000  
1 1 1 30 40 26 o 6.779000 0.9105000 5.564000 1.433000  7.993000 1.124000  -2.429000      1.821000  
1 1 1 30 40 28 o 3.412000 1.033000  3.608000 1.527000  3.215000 1.391000  0.3929000      2.066000  
1 1 1 30 40 30 o 4.389000 1.954000  ?        ?         4.389000 1.954000  ?              ?         
1 1 1 30 41 1  o 3.731000 1.136000  4.584000 1.835000  2.879000 1.339000  1.704000       2.272000  
1 1 1 30 41 3  o 13.52000 0.5832000 13.91000 0.5976000 13.13000 1.002000  0.7795000      1.166000  
1 1 1 30 41 5  o 17.37000 0.5811000 17.80000 0.5498000 16.95000 1.024000  0.8586000      1.162000  
1 1 1 30 41 7  o 3.580000 1.057000  2.176000 0.9776000 4.985000 1.875000  -2.809000      2.115000  
1 1 1 30 41 9  o 9.208000 0.6360000 8.543000 0.6174000 9.873000 1.112000  -1.330000      1.272000  
1 1 1 30 41 11 o 8.980000 0.6864000 8.715000 0.6843000 9.244000 1.190000  -0.5285000     1.373000  
1 1 1 30 41 13 o 7.908000 0.7555000 7.685000 0.8333000 8.131000 1.261000  -0.4457000     1.511000  
1 1 1 30 41 15 o 3.784000 1.036000  4.328000 1.498000  3.239000 1.432000  1.089000       2.072000  
1 1 1 30 41 17 o 7.547000 0.7674000 8.155000 0.9498000 6.938000 1.206000  1.216000       1.535000  
1 1 1 30 41 19 o 3.229000 0.9168000 2.386000 1.110000  4.071000 1.460000  -1.685000      1.834000  
1 1 1 30 41 21 o 4.026000 0.9757000 2.924000 1.283000  5.129000 1.470000  -2.205000      1.951000  
1 1 1 30 41 23 o 2.935000 0.9230000 3.004000 1.337000  2.867000 1.273000  0.1374000      1.846000  
1 1 1 30 41 25 o 3.791000 1.075000  3.509000 1.458000  4.073000 1.580000  -0.5634000     2.150000  
1 1 1 30 41 27 o 4.766000 1.051000  5.272000 1.466000  4.261000 1.508000  1.011000       2.103000  
1 1 1 30 42 0  f 3.821000 1.558000  3.821000 1.558000  3.821000 1.558000  0.000000       0.000000  
1 1 1 30 42 2  o 5.738000 1.118000  6.202000 1.657000  5.274000 1.502000  0.9279000      2.237000  
1 1 1 30 42 4  o 6.820000 1.062000  7.012000 1.399000  6.628000 1.599000  0.3838000      2.125000  
1 1 1 30 42 6  o 4.049000 1.019000  2.548000 1.043000  5.549000 1.752000  -3.001000      2.039000  
1 1 1 30 42 8  o 5.489000 0.9680000 5.771000 1.153000  5.207000 1.555000  0.5637000      1.936000  
1 1 1 30 42 10 f 5.059000 1.046000  4.795000 1.107000  5.322000 1.774000  -0.5269000     2.091000  
1 1 1 30 42 12 o 3.521000 0.9971000 2.735000 1.209000  4.306000 1.586000  -1.572000      1.994000  
1 1 1 30 42 14 o 3.306000 0.9478000 3.599000 1.271000  3.013000 1.407000  0.5861000      1.896000  
1 1 1 30 42 16 o 3.446000 0.9740000 3.004000 1.216000  3.887000 1.521000  -0.8832000     1.948000  
1 1 1 30 42 18 o 3.941000 1.041000  4.467000 1.431000  3.414000 1.511000  1.053000       2.082000  
1 1 1 30 42 20 o 7.015000 0.8684000 4.609000 1.374000  9.421000 1.063000  -4.812000      1.737000  
1 1 1 30 42 22 f 3.630000 1.058000  3.675000 1.497000  3.586000 1.495000  0.8919000E-01  2.115000  
1 1 1 30 42 24 o 4.174000 1.105000  3.932000 1.605000  4.415000 1.519000  -0.4835000     2.210000  
1 1 1 30 42 26 o 5.081000 1.095000  4.411000 1.579000  5.750000 1.516000  -1.339000      2.189000  
1 1 1 30 43 1  o 10.14000 0.7534000 9.435000 1.174000  10.84000 0.9444000 -1.409000      1.507000  
1 1 1 30 43 3  o 4.045000 1.117000  3.502000 1.548000  4.588000 1.610000  -1.086000      2.233000  
1 1 1 30 43 5  o 8.779000 0.8876000 9.972000 1.036000  7.586000 1.442000  2.386000       1.775000  
1 1 1 30 43 7  o 9.850000 0.6324000 9.470000 0.6881000 10.23000 1.061000  -0.7600000     1.265000  
1 1 1 30 43 9  o 6.196000 1.052000  5.249000 1.296000  7.143000 1.658000  -1.894000      2.105000  
1 1 1 30 43 11 o 3.744000 1.024000  3.137000 1.215000  4.350000 1.648000  -1.213000      2.047000  
1 1 1 30 43 13 o 6.419000 0.9381000 7.236000 0.8539000 5.603000 1.671000  1.633000       1.876000  
1 1 1 30 43 15 o 8.986000 0.7378000 9.593000 0.6691000 8.378000 1.315000  1.215000       1.476000  
1 1 1 30 43 17 o 3.845000 0.9275000 4.659000 1.198000  3.031000 1.416000  1.628000       1.855000  
1 1 1 30 43 19 o 3.246000 0.9586000 3.949000 1.486000  2.544000 1.212000  1.406000       1.917000  
1 1 1 30 43 21 o 4.130000 1.171000  3.834000 1.516000  4.427000 1.785000  -0.5927000     2.342000  
1 1 1 30 43 23 o 3.976000 1.001000  4.759000 1.472000  3.193000 1.358000  1.566000       2.003000  
1 1 1 30 44 0  o 10.93000 1.327000  10.93000 1.327000  10.93000 1.327000  0.000000       0.000000  
1 1 1 30 44 2  o 5.073000 1.136000  5.510000 1.725000  4.636000 1.480000  0.8737000      2.273000  
1 1 1 30 44 4  o 4.602000 1.143000  4.252000 1.557000  4.953000 1.673000  -0.7013000     2.285000  
1 1 1 30 44 6  o 4.726000 1.104000  3.662000 1.506000  5.790000 1.615000  -2.128000      2.208000  
1 1 1 30 44 8  f 4.938000 1.073000  4.041000 1.339000  5.834000 1.678000  -1.793000      2.146000  
1 1 1 30 44 10 o 5.244000 1.100000  4.681000 1.386000  5.807000 1.709000  -1.125000      2.200000  
1 1 1 30 44 12 o 3.225000 0.9087000 3.953000 1.378000  2.497000 1.186000  1.456000       1.817000  
1 1 1 30 44 14 o 2.509000 0.8191000 2.712000 1.173000  2.307000 1.143000  0.4047000      1.638000  
1 1 1 30 44 16 o 4.131000 1.006000  4.219000 1.253000  4.044000 1.573000  0.1748000      2.011000  
1 1 1 30 44 18 o 3.325000 1.018000  2.786000 1.162000  3.864000 1.671000  -1.078000      2.035000  
1 1 1 30 44 20 o 4.208000 1.074000  4.185000 1.317000  4.231000 1.696000  -0.4618000E-01 2.148000  
1 1 1 30 44 22 o 3.016000 0.9953000 2.609000 1.183000  3.423000 1.601000  -0.8145000     1.991000  
1 1 1 30 45 1  o 8.505000 0.8377000 9.218000 1.154000  7.793000 1.214000  1.424000       1.675000  
1 1 1 30 45 3  o 3.157000 1.051000  3.708000 1.683000  2.606000 1.260000  1.102000       2.103000  
1 1 1 30 45 5  o 4.026000 1.101000  4.192000 1.569000  3.859000 1.546000  0.3327000      2.203000  
1 1 1 30 45 7  f 3.798000 1.057000  3.901000 1.473000  3.696000 1.515000  0.2052000      2.113000  
1 1 1 30 45 9  o 6.832000 1.149000  6.901000 1.658000  6.764000 1.591000  0.1377000      2.298000  
1 1 1 30 45 11 o 4.434000 0.9776000 5.723000 1.378000  3.144000 1.387000  2.579000       1.955000  
1 1 1 30 45 13 o 9.027000 0.6808000 8.613000 0.7088000 9.442000 1.163000  -0.8295000     1.362000  
1 1 1 30 45 15 f 6.773000 0.9857000 7.845000 0.8002000 5.701000 1.802000  2.144000       1.971000  
1 1 1 30 45 17 o 3.687000 0.9881000 3.967000 1.305000  3.406000 1.484000  0.5603000      1.976000  
1 1 1 30 45 19 o 5.699000 1.345000  5.468000 1.403000  5.929000 2.295000  -0.4610000     2.690000  
1 1 1 30 46 0  o 13.55000 0.8907000 13.55000 0.8907000 13.55000 0.8907000 0.000000       0.000000  
1 1 1 30 46 2  o 10.52000 0.7839000 10.87000 1.073000  10.18000 1.143000  0.6853000      1.568000  
1 1 1 30 46 4  o 3.190000 1.022000  3.165000 1.418000  3.214000 1.473000  -0.4846000E-01 2.044000  
1 1 1 30 46 6  o 4.750000 1.130000  4.701000 1.612000  4.798000 1.584000  -0.9676000E-01 2.260000  
1 1 1 30 46 8  o 7.867000 1.005000  8.334000 1.255000  7.401000 1.571000  0.9333000      2.011000  
1 1 1 30 46 10 o 5.357000 1.181000  4.441000 1.689000  6.273000 1.653000  -1.832000      2.363000  
1 1 1 30 46 12 f 4.742000 1.322000  3.859000 1.651000  5.625000 2.065000  -1.765000      2.643000  
1 1 1 30 46 14 o 7.350000 0.8791000 7.655000 0.9491000 7.044000 1.480000  0.6116000      1.758000  
1 1 1 30 46 16 o 5.731000 1.121000  7.002000 0.9687000 4.460000 2.022000  2.541000       2.242000  
1 1 1 30 47 1  o 5.542000 1.110000  6.633000 1.480000  4.451000 1.654000  2.182000       2.220000  
1 1 1 30 47 3  o 5.453000 1.203000  6.712000 1.713000  4.194000 1.691000  2.518000       2.407000  
1 1 1 30 47 5  o 5.241000 1.141000  5.786000 1.631000  4.696000 1.595000  1.090000       2.282000  
1 1 1 30 47 7  o 4.563000 1.193000  3.632000 1.529000  5.494000 1.833000  -1.862000      2.386000  
1 1 1 30 47 9  o 4.421000 1.118000  3.581000 1.593000  5.261000 1.568000  -1.679000      2.236000  
1 1 1 30 47 11 o 5.713000 1.344000  5.771000 1.892000  5.656000 1.908000  0.1149000      2.687000  
1 1 1 30 47 13 o 3.672000 1.178000  4.366000 1.847000  2.978000 1.463000  1.388000       2.356000  
1 1 1 30 48 0  f 12.73000 0.9922000 12.73000 0.9922000 12.73000 0.9922000 0.000000       0.000000  
1 1 1 30 48 2  o 9.630000 0.8659000 10.48000 1.077000  8.784000 1.356000  1.692000       1.732000  
1 1 1 30 48 4  o 3.463000 1.071000  3.692000 1.606000  3.235000 1.418000  0.4573000      2.143000  
1 1 1 30 48 6  o 6.176000 1.200000  6.079000 1.665000  6.273000 1.729000  -0.1938000     2.400000  
1 1 1 31 0  1  o 25.52000 0.4337000 25.52000 0.4337000 25.52000 0.4337000 0.000000       0.000000  
1 1 1 31 0  3  o 23.54000 0.4371000 23.54000 0.4371000 23.54000 0.4371000 0.000000       0.000000  
1 1 1 31 0  5  o 4.389000 1.324000  4.389000 1.324000  4.389000 1.324000  0.000000       0.000000  
1 1 1 31 0  7  f 30.65000 0.4386000 30.65000 0.4386000 30.65000 0.4386000 0.000000       0.000000  
1 1 1 31 0  9  o 13.09000 0.6205000 13.09000 0.6205000 13.09000 0.6205000 0.000000       0.000000  
1 1 1 31 0  11 o 20.17000 0.4617000 20.17000 0.4617000 20.17000 0.4617000 0.000000       0.000000  
1 1 1 31 0  13 o 8.426000 0.7856000 8.426000 0.7856000 8.426000 0.7856000 0.000000       0.000000  
1 1 1 31 0  15 o 29.04000 0.4898000 29.04000 0.4898000 29.04000 0.4898000 0.000000       0.000000  
1 1 1 31 0  17 o 18.89000 0.4595000 18.89000 0.4595000 18.89000 0.4595000 0.000000       0.000000  
1 1 1 31 0  19 o 25.88000 0.4393000 25.88000 0.4393000 25.88000 0.4393000 0.000000       0.000000  
1 1 1 31 0  21 o 3.232000 1.282000  3.232000 1.282000  3.232000 1.282000  0.000000       0.000000  
1 1 1 31 0  23 o 11.12000 0.6798000 11.12000 0.6798000 11.12000 0.6798000 0.000000       0.000000  
1 1 1 31 0  25 o 11.92000 0.5953000 11.92000 0.5953000 11.92000 0.5953000 0.000000       0.000000  
1 1 1 31 0  27 o 3.680000 1.274000  3.680000 1.274000  3.680000 1.274000  0.000000       0.000000  
1 1 1 31 0  29 o 3.662000 1.539000  3.662000 1.539000  3.662000 1.539000  0.000000       0.000000  
1 1 1 31 0  31 o 5.191000 1.149000  5.191000 1.149000  5.191000 1.149000  0.000000       0.000000  
1 1 1 31 0  33 o 3.717000 1.357000  3.717000 1.357000  3.717000 1.357000  0.000000       0.000000  
1 1 1 31 0  35 o 4.935000 1.180000  4.935000 1.180000  4.935000 1.180000  0.000000       0.000000  
1 1 1 31 0  37 o 6.718000 1.001000  6.718000 1.001000  6.718000 1.001000  0.000000       0.000000  
1 1 1 31 0  39 o 3.974000 1.352000  3.974000 1.352000  3.974000 1.352000  0.000000       0.000000  
1 1 1 31 0  41 o 4.731000 1.413000  4.731000 1.413000  4.731000 1.413000  0.000000       0.000000  
1 1 1 31 0  43 o 3.941000 1.420000  3.941000 1.420000  3.941000 1.420000  0.000000       0.000000  
1 1 1 31 0  45 o 3.995000 1.462000  3.995000 1.462000  3.995000 1.462000  0.000000       0.000000  
1 1 1 31 0  47 o 4.918000 1.693000  4.918000 1.693000  4.918000 1.693000  0.000000       0.000000  
1 1 1 31 0  49 f 6.809000 1.116000  6.809000 1.116000  6.809000 1.116000  0.000000       0.000000  
1 1 1 31 0  51 o 2.657000 1.202000  2.657000 1.202000  2.657000 1.202000  0.000000       0.000000  
1 1 1 31 1  0  o 47.60000 0.5354000 47.60000 0.5354000 47.60000 0.5354000 0.000000       0.000000  
1 1 1 31 1  2  f 18.17000 0.3332000 17.89000 0.4837000 18.45000 0.4583000 -0.5628000     0.6663000 
1 1 1 31 1  4  o 23.36000 0.3025000 23.92000 0.4239000 22.80000 0.4318000 1.117000       0.6051000 
1 1 1 31 1  6  o 31.50000 0.3142000 31.14000 0.4433000 31.86000 0.4455000 -0.7198000     0.6284000 
1 1 1 31 1  8  o 4.705000 0.9569000 4.277000 1.439000  5.133000 1.261000  -0.8565000     1.914000  
1 1 1 31 1  10 o 20.76000 0.3333000 21.11000 0.4367000 20.41000 0.5037000 0.7001000      0.6667000 
1 1 1 31 1  12 o 15.51000 0.3520000 15.70000 0.5021000 15.32000 0.4934000 0.3815000      0.7040000 
1 1 1 31 1  14 o 20.73000 0.3293000 21.21000 0.4328000 20.25000 0.4964000 0.9637000      0.6585000 
1 1 1 31 1  16 o 19.42000 0.3389000 19.11000 0.5064000 19.73000 0.4506000 -0.6183000     0.6778000 
1 1 1 31 1  18 o 18.75000 0.3322000 18.77000 0.4674000 18.73000 0.4722000 0.3393000E-01  0.6644000 
1 1 1 31 1  20 o 17.33000 0.3585000 17.35000 0.5098000 17.30000 0.5041000 0.4645000E-01  0.7169000 
1 1 1 31 1  22 o 11.65000 0.4426000 11.48000 0.6386000 11.82000 0.6130000 -0.3336000     0.8852000 
1 1 1 31 1  24 o 19.12000 0.3304000 19.26000 0.4646000 18.97000 0.4700000 0.2968000      0.6608000 
1 1 1 31 1  26 o 7.586000 0.6510000 7.447000 0.8629000 7.726000 0.9750000 -0.2790000     1.302000  
1 1 1 31 1  28 o 6.664000 0.7281000 7.214000 1.035000  6.114000 1.024000  1.101000       1.456000  
1 1 1 31 1  30 o 10.65000 0.5029000 10.88000 0.7801000 10.42000 0.6349000 0.4665000      1.006000  
1 1 1 31 1  32 o 5.938000 0.8511000 5.527000 1.439000  6.349000 0.9097000 -0.8217000     1.702000  
1 1 1 31 1  34 o 5.216000 0.8320000 4.978000 1.230000  5.455000 1.120000  -0.4767000     1.664000  
1 1 1 31 1  36 o 2.865000 0.8635000 3.122000 1.254000  2.608000 1.187000  0.5147000      1.727000  
1 1 1 31 1  38 o 8.394000 0.5668000 8.636000 0.7544000 8.153000 0.8462000 0.4832000      1.134000  
1 1 1 31 1  40 o 5.767000 0.8850000 6.278000 1.158000  5.255000 1.339000  1.023000       1.770000  
1 1 1 31 1  42 o 8.313000 1.087000  10.02000 0.9056000 6.606000 1.977000  3.415000       2.175000  
1 1 1 31 1  44 o 6.959000 0.9775000 7.289000 1.432000  6.629000 1.331000  0.6597000      1.955000  
1 1 1 31 1  46 o 3.188000 0.9516000 3.611000 1.406000  2.765000 1.282000  0.8455000      1.903000  
1 1 1 31 1  48 o 3.571000 1.050000  3.752000 1.606000  3.390000 1.351000  0.3626000      2.099000  
1 1 1 31 1  50 o 5.374000 1.051000  5.355000 1.489000  5.393000 1.483000  -0.3809000E-01 2.102000  
1 1 1 31 2  1  o 32.76000 0.3172000 32.40000 0.4502000 33.11000 0.4469000 -0.7102000     0.6344000 
1 1 1 31 2  3  o 13.33000 0.3981000 13.36000 0.5741000 13.31000 0.5516000 0.5064000E-01  0.7961000 
1 1 1 31 2  5  o 18.91000 0.3486000 18.87000 0.5243000 18.95000 0.4596000 -0.8117000E-01 0.6972000 
1 1 1 31 2  7  o 13.32000 0.4148000 13.16000 0.6278000 13.48000 0.5425000 -0.3194000     0.8297000 
1 1 1 31 2  9  o 19.19000 0.3187000 19.02000 0.4457000 19.35000 0.4555000 -0.3317000     0.6373000 
1 1 1 31 2  11 o 19.84000 0.3359000 19.89000 0.4407000 19.79000 0.5069000 0.9349000E-01  0.6717000 
1 1 1 31 2  13 o 19.89000 0.3301000 19.47000 0.4375000 20.32000 0.4944000 -0.8526000     0.6602000 
1 1 1 31 2  15 o 11.70000 0.4310000 11.74000 0.6052000 11.66000 0.6140000 0.8397000E-01  0.8621000 
1 1 1 31 2  17 o 13.21000 0.4018000 12.95000 0.5767000 13.47000 0.5597000 -0.5284000     0.8037000 
1 1 1 31 2  19 o 26.83000 0.3164000 26.52000 0.4399000 27.14000 0.4547000 -0.6233000     0.6327000 
1 1 1 31 2  21 o 20.52000 0.3592000 21.14000 0.4636000 19.91000 0.5488000 1.238000       0.7184000 
1 1 1 31 2  23 o 21.91000 0.3186000 22.09000 0.4534000 21.73000 0.4477000 0.3672000      0.6372000 
1 1 1 31 2  25 o 15.44000 0.3956000 15.74000 0.5050000 15.13000 0.6090000 0.6118000      0.7912000 
1 1 1 31 2  27 o 4.243000 0.8846000 4.525000 1.222000  3.960000 1.280000  0.5643000      1.769000  
1 1 1 31 2  29 o 10.15000 0.4949000 10.50000 0.6520000 9.792000 0.7447000 0.7079000      0.9898000 
1 1 1 31 2  31 o 11.95000 0.5736000 11.47000 0.9785000 12.43000 0.5990000 -0.9621000     1.147000  
1 1 1 31 2  33 o 7.251000 0.6578000 7.980000 0.8210000 6.522000 1.028000  1.459000       1.316000  
1 1 1 31 2  35 o 8.148000 0.5873000 9.186000 0.6686000 7.110000 0.9657000 2.076000       1.175000  
1 1 1 31 2  37 o 6.845000 0.9886000 5.974000 1.705000  7.716000 1.001000  -1.742000      1.977000  
1 1 1 31 2  39 f 6.683000 0.7967000 6.910000 1.070000  6.456000 1.180000  0.4543000      1.593000  
1 1 1 31 2  41 o 3.413000 0.9652000 3.707000 1.449000  3.118000 1.276000  0.5893000      1.930000  
1 1 1 31 2  43 o 8.873000 1.126000  10.18000 0.8106000 7.562000 2.100000  2.622000       2.251000  
1 1 1 31 2  45 o 11.16000 0.5877000 10.94000 0.7821000 11.39000 0.8773000 -0.4495000     1.175000  
1 1 1 31 2  47 o 8.547000 0.6420000 9.235000 0.8623000 7.860000 0.9515000 1.375000       1.284000  
1 1 1 31 2  49 o 5.889000 0.9750000 5.728000 1.521000  6.050000 1.220000  -0.3220000     1.950000  
1 1 1 31 2  51 o 7.621000 0.7472000 7.541000 1.083000  7.701000 1.030000  -0.1602000     1.494000  
1 1 1 31 3  0  o 13.02000 0.5443000 13.02000 0.5443000 13.02000 0.5443000 0.000000       0.000000  
1 1 1 31 3  2  o 21.91000 0.3129000 21.66000 0.4470000 22.16000 0.4380000 -0.5080000     0.6259000 
1 1 1 31 3  4  o 17.58000 0.3712000 18.05000 0.5434000 17.11000 0.5057000 0.9384000      0.7423000 
1 1 1 31 3  6  o 10.52000 0.4896000 11.15000 0.7325000 9.899000 0.6499000 1.248000       0.9792000 
1 1 1 31 3  8  o 16.57000 0.3462000 16.53000 0.4893000 16.61000 0.4899000 -0.7395000E-01 0.6924000 
1 1 1 31 3  10 o 40.42000 0.3453000 39.67000 0.4835000 41.17000 0.4930000 -1.498000      0.6905000 
1 1 1 31 3  12 o 16.70000 0.4055000 16.56000 0.4809000 16.83000 0.6530000 -0.2662000     0.8109000 
1 1 1 31 3  14 o 8.553000 0.5492000 8.713000 0.7398000 8.392000 0.8120000 0.3204000      1.098000  
1 1 1 31 3  16 o 27.40000 0.3252000 27.18000 0.4820000 27.62000 0.4366000 -0.4456000     0.6504000 
1 1 1 31 3  18 o 9.807000 0.4825000 10.16000 0.6717000 9.452000 0.6928000 0.7093000      0.9650000 
1 1 1 31 3  20 o 16.72000 0.3589000 16.83000 0.5026000 16.61000 0.5123000 0.2177000      0.7177000 
1 1 1 31 3  22 o 9.903000 0.5689000 9.473000 0.7621000 10.33000 0.8448000 -0.8598000     1.138000  
1 1 1 31 3  24 o 12.23000 0.4233000 11.68000 0.6176000 12.77000 0.5792000 -1.089000      0.8466000 
1 1 1 31 3  26 o 28.47000 0.3114000 29.00000 0.4480000 27.94000 0.4327000 1.065000       0.6228000 
1 1 1 31 3  28 o 9.916000 0.4526000 10.41000 0.6046000 9.420000 0.6736000 0.9928000      0.9051000 
1 1 1 31 3  30 o 4.141000 0.9533000 4.179000 1.399000  4.104000 1.295000  0.7496000E-01  1.907000  
1 1 1 31 3  32 o 11.16000 0.4381000 10.90000 0.6279000 11.41000 0.6111000 -0.5108000     0.8762000 
1 1 1 31 3  34 o 18.46000 0.3739000 18.86000 0.5882000 18.06000 0.4619000 0.8037000      0.7479000 
1 1 1 31 3  36 o 7.471000 0.8099000 7.186000 1.179000  7.756000 1.110000  -0.5702000     1.620000  
1 1 1 31 3  38 o 5.677000 0.9754000 5.829000 1.593000  5.525000 1.125000  0.3036000      1.951000  
1 1 1 31 3  40 o 6.691000 0.7437000 6.388000 1.140000  6.994000 0.9560000 -0.6060000     1.487000  
1 1 1 31 3  42 o 4.566000 0.9789000 4.123000 1.424000  5.009000 1.343000  -0.8856000     1.958000  
1 1 1 31 3  44 o 2.886000 0.9887000 2.353000 1.121000  3.419000 1.629000  -1.067000      1.977000  
1 1 1 31 3  46 o 3.347000 0.9437000 2.798000 1.246000  3.897000 1.417000  -1.099000      1.887000  
1 1 1 31 3  48 o 4.070000 0.9683000 4.949000 1.404000  3.191000 1.334000  1.757000       1.937000  
1 1 1 31 3  50 o 3.889000 1.036000  4.534000 1.583000  3.243000 1.337000  1.291000       2.072000  
1 1 1 31 4  1  o 7.355000 0.6826000 7.547000 0.9677000 7.163000 0.9630000 0.3842000      1.365000  
1 1 1 31 4  3  o 8.688000 0.5844000 8.621000 0.8515000 8.754000 0.8007000 -0.1332000     1.169000  
1 1 1 31 4  5  o 33.35000 0.3185000 33.46000 0.4515000 33.24000 0.4493000 0.2152000      0.6370000 
1 1 1 31 4  7  o 34.57000 0.3197000 34.74000 0.4524000 34.41000 0.4518000 0.3281000      0.6393000 
1 1 1 31 4  9  o 3.285000 0.8994000 3.674000 1.318000  2.896000 1.224000  0.7776000      1.799000  
1 1 1 31 4  11 o 35.25000 0.3481000 35.25000 0.4604000 35.26000 0.5222000 -0.9491000E-02 0.6962000 
1 1 1 31 4  13 o 19.61000 0.3465000 19.75000 0.4428000 19.48000 0.5332000 0.2649000      0.6931000 
1 1 1 31 4  15 o 24.23000 0.3101000 23.89000 0.4315000 24.57000 0.4456000 -0.6779000     0.6203000 
1 1 1 31 4  17 o 5.508000 0.8862000 6.413000 1.191000  4.603000 1.313000  1.810000       1.772000  
1 1 1 31 4  19 o 19.29000 0.3599000 19.11000 0.4677000 19.47000 0.5471000 -0.3599000     0.7198000 
1 1 1 31 4  21 o 24.26000 0.3461000 23.80000 0.4522000 24.72000 0.5241000 -0.9119000     0.6922000 
1 1 1 31 4  23 o 25.67000 0.3155000 25.38000 0.4436000 25.96000 0.4487000 -0.5806000     0.6309000 
1 1 1 31 4  25 o 7.466000 0.6440000 7.042000 1.037000  7.889000 0.7639000 -0.8473000     1.288000  
1 1 1 31 4  27 o 8.248000 0.6472000 8.330000 1.040000  8.165000 0.7709000 0.1659000      1.294000  
1 1 1 31 4  29 o 3.894000 0.9068000 4.167000 1.294000  3.622000 1.271000  0.5453000      1.814000  
1 1 1 31 4  31 o 31.55000 0.3249000 32.05000 0.4634000 31.05000 0.4556000 0.9944000      0.6498000 
1 1 1 31 4  33 o 5.215000 0.8905000 5.006000 1.327000  5.423000 1.188000  -0.4172000     1.781000  
1 1 1 31 4  35 f 4.910000 0.9543000 3.965000 1.442000  5.855000 1.251000  -1.890000      1.909000  
1 1 1 31 4  37 o 8.043000 0.6010000 7.512000 0.8318000 8.574000 0.8677000 -1.062000      1.202000  
1 1 1 31 4  39 o 8.069000 0.6888000 8.137000 1.041000  8.002000 0.9028000 0.1352000      1.378000  
1 1 1 31 4  41 o 9.613000 0.5776000 9.749000 0.8646000 9.477000 0.7662000 0.2721000      1.155000  
1 1 1 31 4  43 o 10.23000 0.8856000 10.82000 0.7408000 9.635000 1.609000  1.183000       1.771000  
1 1 1 31 4  45 o 7.660000 0.7749000 6.639000 1.283000  8.681000 0.8689000 -2.042000      1.550000  
1 1 1 31 4  47 o 6.726000 0.7620000 6.363000 1.116000  7.090000 1.038000  -0.7263000     1.524000  
1 1 1 31 4  49 o 3.645000 0.9776000 3.904000 1.408000  3.386000 1.357000  0.5183000      1.955000  
1 1 1 31 4  51 o 4.297000 1.093000  3.263000 1.422000  5.330000 1.661000  -2.068000      2.186000  
1 1 1 31 5  0  o 59.02000 0.8816000 59.02000 0.8816000 59.02000 0.8816000 0.000000       0.000000  
1 1 1 31 5  2  o 26.78000 0.3560000 26.39000 0.5053000 27.17000 0.5016000 -0.7795000     0.7120000 
1 1 1 31 5  4  o 18.16000 0.3280000 18.53000 0.4575000 17.79000 0.4702000 0.7359000      0.6560000 
1 1 1 31 5  6  o 16.80000 0.3418000 16.76000 0.4694000 16.83000 0.4970000 -0.6497000E-01 0.6836000 
1 1 1 31 5  8  o 36.60000 0.3547000 37.07000 0.4723000 36.12000 0.5294000 0.9581000      0.7095000 
1 1 1 31 5  10 o 29.14000 0.3318000 29.34000 0.4449000 28.95000 0.4925000 0.3897000      0.6637000 
1 1 1 31 5  12 o 26.32000 0.3086000 26.43000 0.4301000 26.20000 0.4427000 0.2331000      0.6172000 
1 1 1 31 5  14 f 14.53000 0.4697000 13.91000 0.5425000 15.14000 0.7668000 -1.229000      0.9393000 
1 1 1 31 5  16 o 6.288000 0.8447000 6.331000 1.056000  6.244000 1.319000  0.8699000E-01  1.689000  
1 1 1 31 5  18 o 10.10000 0.5384000 10.10000 0.7024000 10.11000 0.8161000 -0.1701000E-01 1.077000  
1 1 1 31 5  20 o 25.14000 0.3124000 25.42000 0.4379000 24.86000 0.4457000 0.5550000      0.6248000 
1 1 1 31 5  22 o 12.35000 0.4263000 12.69000 0.5816000 12.01000 0.6233000 0.6841000      0.8525000 
1 1 1 31 5  24 o 13.09000 0.4077000 12.82000 0.6094000 13.35000 0.5419000 -0.5238000     0.8155000 
1 1 1 31 5  26 o 15.65000 0.4172000 16.29000 0.6641000 15.01000 0.5050000 1.276000       0.8343000 
1 1 1 31 5  28 o 14.39000 0.3675000 14.08000 0.5262000 14.70000 0.5131000 -0.6147000     0.7350000 
1 1 1 31 5  30 o 5.642000 0.8926000 5.532000 1.159000  5.751000 1.358000  -0.2186000     1.785000  
1 1 1 31 5  32 o 16.21000 0.4036000 16.80000 0.5510000 15.63000 0.5899000 1.174000       0.8072000 
1 1 1 31 5  34 o 10.61000 0.4596000 10.49000 0.5991000 10.73000 0.6972000 -0.2422000     0.9192000 
1 1 1 31 5  36 o 5.737000 0.8719000 6.947000 1.048000  4.527000 1.394000  2.420000       1.744000  
1 1 1 31 5  38 o 14.40000 0.4061000 13.97000 0.5074000 14.83000 0.6341000 -0.8696000     0.8121000 
1 1 1 31 5  40 o 3.778000 0.9874000 4.507000 1.529000  3.050000 1.250000  1.456000       1.975000  
1 1 1 31 5  42 o 3.468000 0.9508000 4.187000 1.415000  2.750000 1.270000  1.437000       1.902000  
1 1 1 31 5  44 o 8.674000 0.6119000 8.502000 0.8612000 8.846000 0.8696000 -0.3438000     1.224000  
1 1 1 31 5  46 o 4.776000 0.9624000 5.265000 1.307000  4.287000 1.413000  0.9777000      1.925000  
1 1 1 31 5  48 o 5.695000 0.9589000 5.466000 1.341000  5.923000 1.371000  -0.4563000     1.918000  
1 1 1 31 5  50 o 4.951000 1.000000  5.077000 1.406000  4.825000 1.423000  0.2516000      2.000000  
1 1 1 31 6  1  o 3.866000 0.9781000 3.723000 1.325000  4.009000 1.439000  -0.2859000     1.956000  
1 1 1 31 6  3  o 4.615000 0.9548000 4.681000 1.318000  4.549000 1.382000  0.1322000      1.910000  
1 1 1 31 6  5  o 20.61000 0.3414000 20.32000 0.4410000 20.90000 0.5214000 -0.5821000     0.6829000 
1 1 1 31 6  7  o 17.39000 0.3841000 17.36000 0.4691000 17.42000 0.6082000 -0.6569000E-01 0.7681000 
1 1 1 31 6  9  o 8.943000 0.6946000 9.844000 0.7014000 8.042000 1.199000  1.802000       1.389000  
1 1 1 31 6  11 o 20.70000 0.3469000 20.98000 0.4460000 20.42000 0.5315000 0.5599000      0.6939000 
1 1 1 31 6  13 o 27.66000 0.3820000 28.02000 0.4308000 27.29000 0.6310000 0.7314000      0.7640000 
1 1 1 31 6  15 o 18.17000 0.3646000 18.46000 0.4744000 17.88000 0.5539000 0.5880000      0.7293000 
1 1 1 31 6  17 o 18.56000 0.3224000 18.47000 0.4438000 18.65000 0.4678000 -0.1793000     0.6448000 
1 1 1 31 6  19 o 19.73000 0.3418000 20.29000 0.4947000 19.16000 0.4717000 1.134000       0.6836000 
1 1 1 31 6  21 o 19.21000 0.3587000 19.27000 0.5186000 19.15000 0.4958000 0.1220000      0.7175000 
1 1 1 31 6  23 o 37.47000 0.3683000 37.68000 0.5574000 37.25000 0.4816000 0.4347000      0.7367000 
1 1 1 31 6  25 o 7.808000 0.7688000 6.504000 1.369000  9.112000 0.7006000 -2.608000      1.538000  
1 1 1 31 6  27 o 3.624000 0.9340000 3.700000 1.299000  3.548000 1.342000  0.1518000      1.868000  
1 1 1 31 6  29 o 15.44000 0.3788000 15.62000 0.5446000 15.26000 0.5265000 0.3588000      0.7575000 
1 1 1 31 6  31 o 6.947000 0.7506000 7.588000 1.058000  6.306000 1.065000  1.283000       1.501000  
1 1 1 31 6  33 o 17.06000 0.3651000 17.03000 0.4756000 17.10000 0.5541000 -0.6928000E-01 0.7302000 
1 1 1 31 6  35 o 21.39000 0.3352000 21.23000 0.4071000 21.55000 0.5327000 -0.3191000     0.6705000 
1 1 1 31 6  37 o 17.72000 0.3744000 17.71000 0.5184000 17.73000 0.5404000 -0.2624000E-01 0.7488000 
1 1 1 31 6  39 o 5.842000 0.9113000 4.671000 1.375000  7.013000 1.196000  -2.342000      1.823000  
1 1 1 31 6  41 o 3.536000 1.053000  3.724000 1.553000  3.347000 1.423000  0.3774000      2.106000  
1 1 1 31 6  43 o 3.906000 1.021000  3.308000 1.348000  4.503000 1.533000  -1.196000      2.041000  
1 1 1 31 6  45 o 5.503000 0.9259000 5.910000 1.316000  5.096000 1.303000  0.8141000      1.852000  
1 1 1 31 6  47 o 9.846000 0.5576000 9.441000 0.8300000 10.25000 0.7450000 -0.8107000     1.115000  
1 1 1 31 6  49 o 3.677000 0.9576000 3.661000 1.380000  3.693000 1.328000  -0.3257000E-01 1.915000  
1 1 1 31 7  0  o 17.48000 0.4773000 17.48000 0.4773000 17.48000 0.4773000 0.000000       0.000000  
1 1 1 31 7  2  f 11.64000 0.4153000 11.59000 0.6067000 11.69000 0.5673000 -0.1054000     0.8306000 
1 1 1 31 7  4  o 30.78000 0.3134000 30.64000 0.4367000 30.93000 0.4495000 -0.2849000     0.6267000 
1 1 1 31 7  6  o 35.82000 0.3886000 36.14000 0.4612000 35.49000 0.6256000 0.6527000      0.7772000 
1 1 1 31 7  8  o 16.74000 0.4166000 17.57000 0.4627000 15.92000 0.6928000 1.654000       0.8331000 
1 1 1 31 7  10 o 35.19000 0.3519000 35.23000 0.4580000 35.16000 0.5343000 0.6786000E-01  0.7037000 
1 1 1 31 7  12 o 20.30000 0.3455000 20.22000 0.4528000 20.39000 0.5221000 -0.1655000     0.6911000 
1 1 1 31 7  14 o 33.26000 0.4011000 33.00000 0.4560000 33.51000 0.6601000 -0.5172000     0.8023000 
1 1 1 31 7  16 o 24.76000 0.3311000 25.02000 0.4309000 24.51000 0.5029000 0.5130000      0.6622000 
1 1 1 31 7  18 o 9.605000 0.5374000 8.906000 0.6731000 10.30000 0.8380000 -1.398000      1.075000  
1 1 1 31 7  20 o 22.85000 0.3620000 22.61000 0.5048000 23.08000 0.5189000 -0.4690000     0.7239000 
1 1 1 31 7  22 o 5.379000 0.8972000 4.464000 1.428000  6.295000 1.087000  -1.831000      1.794000  
1 1 1 31 7  24 o 24.33000 0.3146000 24.69000 0.4626000 23.97000 0.4264000 0.7190000      0.6291000 
1 1 1 31 7  26 o 11.42000 0.4503000 10.85000 0.7243000 11.99000 0.5351000 -1.143000      0.9005000 
1 1 1 31 7  28 o 15.98000 0.3421000 16.68000 0.4712000 15.27000 0.4961000 1.406000       0.6842000 
1 1 1 31 7  30 o 29.99000 0.3394000 30.05000 0.4466000 29.93000 0.5112000 0.1247000      0.6787000 
1 1 1 31 7  32 o 4.033000 0.9322000 3.620000 1.225000  4.445000 1.405000  -0.8249000     1.864000  
1 1 1 31 7  34 o 4.468000 0.8884000 5.026000 1.132000  3.910000 1.369000  1.117000       1.777000  
1 1 1 31 7  36 f 16.45000 0.3576000 15.80000 0.4561000 17.09000 0.5509000 -1.298000      0.7152000 
1 1 1 31 7  38 f 21.91000 0.3690000 21.80000 0.4944000 22.02000 0.5479000 -0.2176000     0.7379000 
1 1 1 31 7  40 o 22.41000 0.3905000 22.17000 0.5461000 22.66000 0.5583000 -0.4926000     0.7810000 
1 1 1 31 7  42 o 15.91000 0.4428000 16.63000 0.6811000 15.20000 0.5660000 1.436000       0.8856000 
1 1 1 31 7  44 o 9.122000 0.5783000 9.298000 0.7988000 8.945000 0.8364000 0.3538000      1.157000  
1 1 1 31 7  46 o 8.562000 0.6195000 8.161000 0.8651000 8.963000 0.8871000 -0.8020000     1.239000  
1 1 1 31 7  48 o 4.912000 0.9347000 6.191000 1.217000  3.634000 1.419000  2.557000       1.869000  
1 1 1 31 7  50 o 6.150000 0.9218000 4.697000 1.371000  7.603000 1.233000  -2.906000      1.844000  
1 1 1 31 8  1  o 20.80000 0.3132000 20.77000 0.4468000 20.83000 0.4390000 -0.5614000E-01 0.6264000 
1 1 1 31 8  3  o 26.83000 0.3215000 27.67000 0.4295000 25.99000 0.4784000 1.678000       0.6429000 
1 1 1 31 8  5  o 21.81000 0.3646000 22.39000 0.4351000 21.24000 0.5851000 1.145000       0.7291000 
1 1 1 31 8  7  o 34.53000 0.3523000 35.38000 0.4626000 33.68000 0.5314000 1.704000       0.7046000 
1 1 1 31 8  9  o 26.00000 0.3260000 26.34000 0.4348000 25.66000 0.4857000 0.6754000      0.6519000 
1 1 1 31 8  11 o 10.86000 0.4645000 11.02000 0.6458000 10.70000 0.6679000 0.3250000      0.9290000 
1 1 1 31 8  13 o 44.97000 0.3670000 44.98000 0.5204000 44.97000 0.5176000 0.1636000E-01  0.7339000 
1 1 1 31 8  15 o 44.81000 0.3984000 44.49000 0.5173000 45.13000 0.6062000 -0.6379000     0.7969000 
1 1 1 31 8  17 o 8.449000 0.5906000 8.060000 0.9139000 8.838000 0.7483000 -0.7783000     1.181000  
1 1 1 31 8  19 o 19.05000 0.4114000 19.11000 0.6097000 18.99000 0.5525000 0.1171000      0.8228000 
1 1 1 31 8  21 o 3.012000 0.9045000 2.529000 1.140000  3.495000 1.405000  -0.9659000     1.809000  
1 1 1 31 8  23 o 13.10000 0.4507000 13.54000 0.7121000 12.65000 0.5527000 0.8851000      0.9014000 
1 1 1 31 8  25 o 4.688000 0.9533000 4.839000 1.426000  4.537000 1.266000  0.3022000      1.907000  
1 1 1 31 8  27 o 14.39000 0.4374000 14.54000 0.6384000 14.23000 0.5980000 0.3099000      0.8747000 
1 1 1 31 8  29 f 6.827000 0.6396000 6.798000 0.8843000 6.856000 0.9244000 -0.5809000E-01 1.279000  
1 1 1 31 8  31 o 16.21000 0.4025000 16.32000 0.4225000 16.11000 0.6851000 0.2080000      0.8049000 
1 1 1 31 8  33 o 22.55000 0.3239000 22.08000 0.4000000 23.01000 0.5095000 -0.9300000     0.6478000 
1 1 1 31 8  35 o 10.18000 0.4904000 10.08000 0.5759000 10.27000 0.7940000 -0.1875000     0.9808000 
1 1 1 31 8  37 o 3.547000 0.9021000 3.810000 1.226000  3.284000 1.324000  0.5265000      1.804000  
1 1 1 31 8  39 o 9.609000 0.6991000 8.740000 0.9088000 10.48000 1.063000  -1.738000      1.398000  
1 1 1 31 8  41 o 9.199000 0.6073000 9.366000 0.8526000 9.033000 0.8649000 0.3326000      1.215000  
1 1 1 31 8  43 o 6.172000 0.9840000 5.939000 1.516000  6.405000 1.255000  -0.4658000     1.968000  
1 1 1 31 8  45 o 18.86000 0.3892000 18.69000 0.5728000 19.03000 0.5271000 -0.3349000     0.7784000 
1 1 1 31 8  47 o 10.90000 0.5256000 10.39000 0.7675000 11.40000 0.7183000 -1.018000      1.051000  
1 1 1 31 8  49 o 5.792000 0.8483000 5.848000 1.244000  5.735000 1.154000  0.1129000      1.697000  
1 1 1 31 9  0  o 64.20000 0.7707000 64.20000 0.7707000 64.20000 0.7707000 0.000000       0.000000  
1 1 1 31 9  2  o 25.45000 0.3754000 24.91000 0.4797000 26.00000 0.5777000 -1.085000      0.7509000 
1 1 1 31 9  4  f 33.75000 0.3444000 34.39000 0.4556000 33.11000 0.5167000 1.286000       0.6889000 
1 1 1 31 9  6  o 44.19000 0.3934000 44.40000 0.5978000 43.99000 0.5115000 0.4084000      0.7867000 
1 1 1 31 9  8  o 46.07000 0.4038000 46.31000 0.5263000 45.82000 0.6126000 0.4913000      0.8076000 
1 1 1 31 9  10 o 25.56000 0.3058000 25.52000 0.4275000 25.60000 0.4374000 -0.8634000E-01 0.6116000 
1 1 1 31 9  12 o 38.46000 0.3623000 38.12000 0.5420000 38.80000 0.4809000 -0.6820000     0.7246000 
1 1 1 31 9  14 o 27.96000 0.3276000 27.42000 0.4852000 28.51000 0.4404000 -1.089000      0.6552000 
1 1 1 31 9  16 o 13.85000 0.4293000 14.24000 0.5715000 13.46000 0.6407000 0.7791000      0.8586000 
1 1 1 31 9  18 f 16.84000 0.3455000 16.74000 0.4806000 16.94000 0.4965000 -0.2086000     0.6910000 
1 1 1 31 9  20 o 28.43000 0.3890000 28.24000 0.5911000 28.62000 0.5060000 -0.3795000     0.7781000 
1 1 1 31 9  22 o 15.74000 0.3751000 16.52000 0.4742000 14.96000 0.5814000 1.558000       0.7503000 
1 1 1 31 9  24 o 11.21000 0.4979000 10.39000 0.7366000 12.03000 0.6700000 -1.644000      0.9957000 
1 1 1 31 9  26 o 10.90000 0.4904000 10.45000 0.8145000 11.35000 0.5465000 -0.8997000     0.9809000 
1 1 1 31 9  28 o 10.60000 0.4563000 10.58000 0.6231000 10.61000 0.6667000 -0.3369000E-01 0.9125000 
1 1 1 31 9  30 o 19.07000 0.3164000 18.52000 0.4537000 19.61000 0.4412000 -1.095000      0.6328000 
1 1 1 31 9  32 o 2.340000 0.7612000 2.212000 0.9999000 2.468000 1.148000  -0.2566000     1.522000  
1 1 1 31 9  34 o 4.420000 0.9079000 4.718000 1.193000  4.122000 1.369000  0.5959000      1.816000  
1 1 1 31 9  36 o 10.54000 0.4590000 10.63000 0.5688000 10.44000 0.7205000 0.1869000      0.9180000 
1 1 1 31 9  38 o 11.69000 0.4465000 11.70000 0.5462000 11.68000 0.7064000 0.1713000E-01  0.8930000 
1 1 1 31 9  40 f 20.69000 0.3620000 20.86000 0.4632000 20.52000 0.5563000 0.3367000      0.7239000 
1 1 1 31 9  42 o 14.97000 0.4467000 15.06000 0.5771000 14.88000 0.6819000 0.1830000      0.8934000 
1 1 1 31 9  44 o 16.59000 0.4416000 16.76000 0.6750000 16.41000 0.5695000 0.3497000      0.8831000 
1 1 1 31 9  46 o 5.310000 0.9531000 5.087000 1.370000  5.532000 1.326000  -0.4449000     1.906000  
1 1 1 31 9  48 o 5.032000 0.9818000 5.061000 1.397000  5.003000 1.380000  0.5828000E-01  1.964000  
1 1 1 31 9  50 o 4.156000 0.9941000 4.475000 1.416000  3.836000 1.395000  0.6382000      1.988000  
1 1 1 31 10 1  o 13.11000 0.4549000 13.10000 0.6429000 13.13000 0.6436000 -0.3029000E-01 0.9097000 
1 1 1 31 10 3  o 26.29000 0.3228000 26.15000 0.4849000 26.43000 0.4263000 -0.2749000     0.6457000 
1 1 1 31 10 5  o 17.61000 0.3439000 18.11000 0.5040000 17.10000 0.4681000 1.008000       0.6879000 
1 1 1 31 10 7  o 25.68000 0.3280000 25.61000 0.4835000 25.75000 0.4434000 -0.1391000     0.6561000 
1 1 1 31 10 9  o 26.59000 0.3259000 27.10000 0.4801000 26.09000 0.4409000 1.010000       0.6518000 
1 1 1 31 10 11 o 31.00000 0.3329000 30.76000 0.4917000 31.23000 0.4489000 -0.4686000     0.6658000 
1 1 1 31 10 13 o 32.15000 0.4025000 31.78000 0.6648000 32.53000 0.4539000 -0.7441000     0.8049000 
1 1 1 31 10 15 o 7.749000 0.7309000 7.730000 1.196000  7.768000 0.8401000 -0.3794000E-01 1.462000  
1 1 1 31 10 17 o 28.23000 0.3438000 28.20000 0.4899000 28.25000 0.4825000 -0.4983000E-01 0.6876000 
1 1 1 31 10 19 o 25.19000 0.3086000 25.42000 0.4204000 24.96000 0.4519000 0.4607000      0.6172000 
1 1 1 31 10 21 o 12.93000 0.3933000 13.33000 0.5391000 12.52000 0.5728000 0.8041000      0.7866000 
1 1 1 31 10 23 o 4.678000 0.8716000 4.376000 1.357000  4.979000 1.094000  -0.6032000     1.743000  
1 1 1 31 10 25 o 17.64000 0.3607000 17.52000 0.4780000 17.77000 0.5404000 -0.2495000     0.7214000 
1 1 1 31 10 27 o 13.26000 0.4520000 13.07000 0.5786000 13.45000 0.6946000 -0.3819000     0.9040000 
1 1 1 31 10 29 o 11.46000 0.4046000 11.86000 0.5613000 11.06000 0.5827000 0.7991000      0.8091000 
1 1 1 31 10 31 o 11.11000 0.4947000 11.68000 0.5085000 10.55000 0.8487000 1.127000       0.9894000 
1 1 1 31 10 33 o 6.827000 0.6599000 6.432000 0.8719000 7.222000 0.9907000 -0.7902000     1.320000  
1 1 1 31 10 35 o 11.01000 0.4497000 11.39000 0.5299000 10.62000 0.7268000 0.7744000      0.8995000 
1 1 1 31 10 37 o 2.615000 0.8084000 2.840000 1.170000  2.390000 1.116000  0.4503000      1.617000  
1 1 1 31 10 39 f 6.568000 0.7541000 5.947000 1.042000  7.189000 1.091000  -1.242000      1.508000  
1 1 1 31 10 41 o 2.822000 0.8653000 2.794000 1.222000  2.850000 1.226000  -0.5659000E-01 1.731000  
1 1 1 31 10 43 o 4.975000 1.019000  5.303000 1.361000  4.646000 1.517000  0.6566000      2.038000  
1 1 1 31 10 45 o 15.38000 0.4327000 14.41000 0.6470000 16.35000 0.5746000 -1.937000      0.8654000 
1 1 1 31 10 47 o 5.898000 0.8889000 6.189000 1.165000  5.607000 1.343000  0.5823000      1.778000  
1 1 1 31 10 49 o 6.047000 0.8636000 6.310000 1.180000  5.785000 1.261000  0.5246000      1.727000  
1 1 1 31 11 0  o 29.71000 0.4992000 29.71000 0.4992000 29.71000 0.4992000 0.000000       0.000000  
1 1 1 31 11 2  o 16.42000 0.3390000 16.61000 0.4861000 16.22000 0.4726000 0.3955000      0.6780000 
1 1 1 31 11 4  o 6.013000 0.7761000 5.415000 1.211000  6.611000 0.9707000 -1.196000      1.552000  
1 1 1 31 11 6  o 24.07000 0.3092000 24.10000 0.4360000 24.05000 0.4385000 0.4900000E-01  0.6184000 
1 1 1 31 11 8  o 30.79000 0.3748000 30.76000 0.5320000 30.82000 0.5281000 -0.6170000E-01 0.7496000 
1 1 1 31 11 10 o 17.76000 0.3969000 18.10000 0.5677000 17.42000 0.5548000 0.6815000      0.7938000 
1 1 1 31 11 12 o 30.92000 0.3438000 30.56000 0.5267000 31.28000 0.4419000 -0.7208000     0.6875000 
1 1 1 31 11 14 o 27.32000 0.4025000 26.95000 0.6453000 27.70000 0.4813000 -0.7476000     0.8051000 
1 1 1 31 11 16 o 20.83000 0.3629000 20.53000 0.5258000 21.12000 0.5004000 -0.5826000     0.7258000 
1 1 1 31 11 18 o 13.28000 0.4478000 13.47000 0.7088000 13.09000 0.5474000 0.3792000      0.8956000 
1 1 1 31 11 20 o 4.015000 1.025000  4.849000 1.593000  3.180000 1.291000  1.669000       2.050000  
1 1 1 31 11 22 o 13.18000 0.5201000 13.51000 0.8144000 12.86000 0.6472000 0.6586000      1.040000  
1 1 1 31 11 24 o 14.49000 0.3448000 14.08000 0.4885000 14.90000 0.4868000 -0.8243000     0.6897000 
1 1 1 31 11 26 o 16.61000 0.3571000 16.42000 0.5059000 16.80000 0.5040000 -0.3788000     0.7141000 
1 1 1 31 11 28 o 14.62000 0.3975000 15.14000 0.5208000 14.11000 0.6007000 1.028000       0.7951000 
1 1 1 31 11 30 o 11.97000 0.4072000 12.11000 0.4831000 11.82000 0.6558000 0.2893000      0.8145000 
1 1 1 31 11 32 o 3.467000 0.8880000 2.759000 1.151000  4.176000 1.352000  -1.416000      1.776000  
1 1 1 31 11 34 o 6.085000 0.9317000 5.906000 1.037000  6.263000 1.549000  -0.3567000     1.863000  
1 1 1 31 11 36 o 4.346000 0.8444000 5.036000 1.009000  3.656000 1.354000  1.381000       1.689000  
1 1 1 31 11 38 o 7.360000 0.6544000 6.973000 0.9147000 7.747000 0.9359000 -0.7736000     1.309000  
1 1 1 31 11 40 o 5.385000 0.8672000 5.123000 1.117000  5.646000 1.327000  -0.5234000     1.734000  
1 1 1 31 11 42 o 2.976000 0.8719000 2.365000 1.105000  3.588000 1.349000  -1.222000      1.744000  
1 1 1 31 11 44 o 7.917000 0.6698000 7.550000 0.9490000 8.283000 0.9453000 -0.7329000     1.340000  
1 1 1 31 11 46 o 6.115000 0.8520000 5.076000 1.331000  7.154000 1.064000  -2.078000      1.704000  
1 1 1 31 11 48 o 5.589000 0.8902000 5.126000 1.344000  6.051000 1.168000  -0.9250000     1.780000  
1 1 1 31 11 50 o 5.668000 1.911000  5.668000 1.911000  ?        ?         ?              ?         
1 1 1 31 12 1  o 9.299000 0.5586000 9.076000 0.8425000 9.522000 0.7338000 -0.4458000     1.117000  
1 1 1 31 12 3  o 8.227000 0.5603000 8.292000 0.7754000 8.163000 0.8089000 0.1297000      1.121000  
1 1 1 31 12 5  o 4.438000 0.9507000 4.422000 1.388000  4.455000 1.300000  -0.3339000E-01 1.901000  
1 1 1 31 12 7  o 19.64000 0.3685000 19.71000 0.5713000 19.58000 0.4658000 0.1271000      0.7371000 
1 1 1 31 12 9  f 15.28000 0.3632000 15.98000 0.4875000 14.57000 0.5384000 1.409000       0.7264000 
1 1 1 31 12 11 o 27.83000 0.3213000 27.72000 0.4263000 27.94000 0.4810000 -0.2168000     0.6427000 
1 1 1 31 12 13 o 31.58000 0.3358000 31.89000 0.5076000 31.27000 0.4398000 0.6187000      0.6716000 
1 1 1 31 12 15 o 8.054000 0.5760000 8.888000 0.7104000 7.221000 0.9068000 1.667000       1.152000  
1 1 1 31 12 17 o 21.29000 0.3335000 21.67000 0.4307000 20.92000 0.5094000 0.7528000      0.6671000 
1 1 1 31 12 19 o 7.817000 0.5909000 7.677000 0.8316000 7.957000 0.8396000 -0.2798000     1.182000  
1 1 1 31 12 21 o 4.914000 1.115000  5.160000 1.886000  4.668000 1.189000  0.4922000      2.229000  
1 1 1 31 12 23 o 18.60000 0.4145000 18.91000 0.7036000 18.28000 0.4382000 0.6340000      0.8289000 
1 1 1 31 12 25 o 12.63000 0.4100000 13.00000 0.5668000 12.25000 0.5926000 0.7506000      0.8201000 
1 1 1 31 12 27 o 7.584000 0.6011000 7.114000 0.9479000 8.054000 0.7395000 -0.9402000     1.202000  
1 1 1 31 12 29 o 6.464000 0.7077000 5.576000 1.008000  7.352000 0.9936000 -1.777000      1.415000  
1 1 1 31 12 31 o 4.472000 0.8897000 4.563000 1.232000  4.380000 1.284000  0.1824000      1.779000  
1 1 1 31 12 33 o 15.22000 0.4300000 14.99000 0.4526000 15.45000 0.7312000 -0.4622000     0.8599000 
1 1 1 31 12 35 o 6.152000 0.7623000 6.563000 0.8699000 5.740000 1.252000  0.8232000      1.525000  
1 1 1 31 12 37 o 6.636000 0.7094000 6.714000 0.9283000 6.558000 1.073000  0.1557000      1.419000  
1 1 1 31 12 39 o 3.407000 0.8751000 3.955000 1.214000  2.860000 1.261000  1.095000       1.750000  
1 1 1 31 12 41 o 11.48000 0.5086000 11.62000 0.5521000 11.34000 0.8542000 0.2814000      1.017000  
1 1 1 31 12 43 o 6.629000 0.8198000 6.070000 1.120000  7.188000 1.198000  -1.118000      1.640000  
1 1 1 31 12 45 o 5.866000 0.8911000 7.099000 1.085000  4.633000 1.414000  2.465000       1.782000  
1 1 1 31 12 47 o 5.845000 0.8740000 5.188000 1.302000  6.502000 1.166000  -1.314000      1.748000  
1 1 1 31 12 49 o 4.576000 1.028000  5.128000 1.430000  4.025000 1.477000  1.103000       2.056000  
1 1 1 31 13 0  o 5.047000 1.267000  5.047000 1.267000  5.047000 1.267000  0.000000       0.000000  
1 1 1 31 13 2  o 3.334000 0.9327000 3.303000 1.345000  3.366000 1.292000  -0.6325000E-01 1.865000  
1 1 1 31 13 4  o 19.72000 0.3479000 19.50000 0.5345000 19.93000 0.4454000 -0.4279000     0.6957000 
1 1 1 31 13 6  o 11.07000 0.4392000 11.27000 0.6103000 10.88000 0.6319000 0.3961000      0.8785000 
1 1 1 31 13 8  o 12.05000 0.4213000 12.16000 0.5566000 11.93000 0.6325000 0.2367000      0.8425000 
1 1 1 31 13 10 f 32.86000 0.3529000 32.59000 0.5017000 33.12000 0.4965000 -0.5273000     0.7059000 
1 1 1 31 13 12 o 16.69000 0.3299000 16.83000 0.4568000 16.55000 0.4761000 0.2784000      0.6598000 
1 1 1 31 13 14 o 28.85000 0.3062000 28.75000 0.4303000 28.96000 0.4356000 -0.2044000     0.6123000 
1 1 1 31 13 16 o 10.69000 0.4426000 10.54000 0.6209000 10.84000 0.6309000 -0.2947000     0.8852000 
1 1 1 31 13 18 o 10.49000 0.5423000 11.56000 0.7335000 9.412000 0.7990000 2.146000       1.085000  
1 1 1 31 13 20 o 3.666000 0.9129000 3.798000 1.297000  3.533000 1.285000  0.2656000      1.826000  
1 1 1 31 13 22 o 18.02000 0.3124000 18.17000 0.4532000 17.88000 0.4301000 0.2965000      0.6248000 
1 1 1 31 13 24 o 21.56000 0.3749000 22.28000 0.6200000 20.84000 0.4215000 1.434000       0.7497000 
1 1 1 31 13 26 o 12.08000 0.4432000 11.82000 0.7244000 12.34000 0.5109000 -0.5154000     0.8865000 
1 1 1 31 13 28 o 8.388000 0.5459000 8.692000 0.6665000 8.083000 0.8648000 0.6083000      1.092000  
1 1 1 31 13 30 o 6.784000 0.6826000 6.861000 0.8252000 6.707000 1.088000  0.1544000      1.365000  
1 1 1 31 13 32 o 6.777000 1.101000  7.879000 0.7605000 5.675000 2.066000  2.204000       2.202000  
1 1 1 31 13 34 o 9.173000 0.5090000 9.452000 0.6270000 8.894000 0.8021000 0.5576000      1.018000  
1 1 1 31 13 36 o 3.354000 0.9089000 3.149000 1.248000  3.559000 1.322000  -0.4102000     1.818000  
1 1 1 31 13 38 o 11.95000 0.4397000 12.18000 0.5564000 11.71000 0.6809000 0.4725000      0.8793000 
1 1 1 31 13 40 o 10.49000 0.5550000 11.04000 0.5733000 9.931000 0.9506000 1.112000       1.110000  
1 1 1 31 13 42 o 8.953000 0.5598000 9.333000 0.7712000 8.573000 0.8115000 0.7603000      1.120000  
1 1 1 31 13 44 o 6.415000 0.8038000 6.527000 1.101000  6.302000 1.171000  0.2244000      1.608000  
1 1 1 31 13 46 f 10.91000 0.5559000 10.58000 0.8588000 11.23000 0.7061000 -0.6588000     1.112000  
1 1 1 31 13 48 o 4.612000 1.025000  5.214000 1.360000  4.011000 1.533000  1.202000       2.049000  
1 1 1 31 14 1  o 8.877000 0.5276000 7.672000 0.7658000 10.08000 0.7258000 -2.410000      1.055000  
1 1 1 31 14 3  o 31.45000 0.3935000 30.49000 0.6519000 32.40000 0.4410000 -1.907000      0.7870000 
1 1 1 31 14 5  o 26.74000 0.2983000 26.93000 0.4194000 26.56000 0.4242000 0.3703000      0.5966000 
1 1 1 31 14 7  o 9.804000 0.5077000 9.844000 0.7022000 9.764000 0.7335000 0.7930000E-01  1.015000  
1 1 1 31 14 9  o 17.55000 0.3331000 17.86000 0.4508000 17.24000 0.4906000 0.6234000      0.6663000 
1 1 1 31 14 11 o 16.76000 0.3414000 16.55000 0.4609000 16.97000 0.5039000 -0.4160000     0.6829000 
1 1 1 31 14 13 o 6.100000 0.7016000 5.936000 0.9958000 6.264000 0.9887000 -0.3277000     1.403000  
1 1 1 31 14 15 o 19.84000 0.3427000 19.97000 0.4309000 19.70000 0.5331000 0.2675000      0.6855000 
1 1 1 31 14 17 o 12.53000 0.4961000 12.70000 0.5457000 12.36000 0.8285000 0.3450000      0.9921000 
1 1 1 31 14 19 o 17.72000 0.3387000 17.34000 0.4961000 18.09000 0.4613000 -0.7515000     0.6774000 
1 1 1 31 14 21 o 9.679000 0.4904000 10.15000 0.7231000 9.204000 0.6627000 0.9497000      0.9809000 
1 1 1 31 14 23 o 20.53000 0.3210000 20.49000 0.4919000 20.57000 0.4124000 -0.7756000E-01 0.6419000 
1 1 1 31 14 25 o 12.55000 0.3856000 12.34000 0.5784000 12.76000 0.5102000 -0.4170000     0.7713000 
1 1 1 31 14 27 o 7.662000 0.6369000 7.024000 0.9274000 8.300000 0.8731000 -1.276000      1.274000  
1 1 1 31 14 29 o 7.681000 0.5800000 7.901000 0.7481000 7.461000 0.8864000 0.4402000      1.160000  
1 1 1 31 14 31 o 20.24000 0.3867000 20.65000 0.3910000 19.83000 0.6672000 0.8166000      0.7734000 
1 1 1 31 14 33 o 3.920000 0.9381000 3.482000 1.262000  4.359000 1.388000  -0.8775000     1.876000  
1 1 1 31 14 35 o 4.888000 0.9044000 4.235000 1.284000  5.542000 1.274000  -1.307000      1.809000  
1 1 1 31 14 37 o 5.262000 0.8482000 5.277000 1.092000  5.247000 1.299000  0.2937000E-01  1.696000  
1 1 1 31 14 39 o 19.16000 0.3425000 19.92000 0.4073000 18.40000 0.5508000 1.523000       0.6850000 
1 1 1 31 14 41 o 11.52000 0.4622000 11.26000 0.5691000 11.78000 0.7284000 -0.5259000     0.9244000 
1 1 1 31 14 43 o 10.68000 0.4780000 11.29000 0.6546000 10.07000 0.6967000 1.219000       0.9560000 
1 1 1 31 14 45 o 8.677000 0.6278000 9.296000 0.8512000 8.058000 0.9231000 1.238000       1.256000  
1 1 1 31 14 47 o 5.286000 1.068000  5.412000 1.536000  5.160000 1.484000  0.2527000      2.136000  
1 1 1 31 14 49 o 7.394000 0.9768000 7.492000 1.386000  7.296000 1.376000  0.1951000      1.954000  
1 1 1 31 15 0  o 14.69000 0.6568000 14.69000 0.6568000 14.69000 0.6568000 0.000000       0.000000  
1 1 1 31 15 2  o 35.10000 0.3521000 35.14000 0.5370000 35.06000 0.4555000 0.8248000E-01  0.7041000 
1 1 1 31 15 4  o 4.077000 0.9319000 3.197000 1.320000  4.958000 1.316000  -1.760000      1.864000  
1 1 1 31 15 6  o 15.78000 0.3340000 15.61000 0.4729000 15.96000 0.4718000 -0.3523000     0.6680000 
1 1 1 31 15 8  o 14.92000 0.3645000 15.08000 0.4759000 14.75000 0.5522000 0.3291000      0.7290000 
1 1 1 31 15 10 o 33.81000 0.3402000 33.61000 0.4976000 34.00000 0.4641000 -0.3946000     0.6804000 
1 1 1 31 15 12 o 5.540000 0.8154000 5.688000 1.096000  5.391000 1.208000  0.2968000      1.631000  
1 1 1 31 15 14 o 9.280000 0.6096000 8.881000 0.8781000 9.679000 0.8459000 -0.7975000     1.219000  
1 1 1 31 15 16 o 16.92000 0.3293000 16.79000 0.4608000 17.04000 0.4704000 -0.2546000     0.6585000 
1 1 1 31 15 18 o 14.41000 0.4063000 14.58000 0.5166000 14.24000 0.6272000 0.3351000      0.8126000 
1 1 1 31 15 20 o 21.39000 0.2946000 21.58000 0.4182000 21.19000 0.4150000 0.3946000      0.5892000 
1 1 1 31 15 22 o 5.668000 0.7332000 7.029000 0.8274000 4.307000 1.211000  2.722000       1.466000  
1 1 1 31 15 24 o 22.47000 0.3274000 22.52000 0.4761000 22.41000 0.4497000 0.1136000      0.6549000 
1 1 1 31 15 26 o 3.942000 0.8715000 3.096000 1.144000  4.789000 1.315000  -1.693000      1.743000  
1 1 1 31 15 28 o 20.12000 0.3762000 19.84000 0.3917000 20.41000 0.6424000 -0.5670000     0.7525000 
1 1 1 31 15 30 o 3.823000 0.8329000 4.938000 1.165000  2.708000 1.190000  2.230000       1.666000  
1 1 1 31 15 32 o 3.702000 0.9274000 2.679000 1.096000  4.726000 1.497000  -2.047000      1.855000  
1 1 1 31 15 34 o 4.439000 0.9268000 4.322000 1.304000  4.556000 1.317000  -0.2337000     1.854000  
1 1 1 31 15 36 o 4.654000 0.9127000 4.411000 1.283000  4.898000 1.298000  -0.4879000     1.825000  
1 1 1 31 15 38 o 16.52000 0.3555000 16.79000 0.4251000 16.25000 0.5700000 0.5378000      0.7110000 
1 1 1 31 15 40 o 7.929000 0.6947000 7.321000 0.7323000 8.536000 1.181000  -1.215000      1.389000  
1 1 1 31 15 42 o 8.168000 0.6225000 7.321000 0.8160000 9.014000 0.9403000 -1.693000      1.245000  
1 1 1 31 15 44 o 3.612000 0.9130000 4.407000 1.344000  2.818000 1.236000  1.590000       1.826000  
1 1 1 31 15 46 o 11.85000 0.5771000 10.36000 0.8798000 13.33000 0.7469000 -2.963000      1.154000  
1 1 1 31 15 48 o 7.951000 0.7569000 8.124000 1.164000  7.778000 0.9676000 0.3458000      1.514000  
1 1 1 31 16 1  f 24.50000 0.3740000 24.65000 0.5275000 24.35000 0.5304000 0.3071000      0.7481000 
1 1 1 31 16 3  o 19.83000 0.3157000 19.99000 0.4738000 19.68000 0.4173000 0.3121000      0.6314000 
1 1 1 31 16 5  o 28.92000 0.3285000 29.52000 0.5036000 28.33000 0.4219000 1.198000       0.6570000 
1 1 1 31 16 7  o 11.13000 0.4222000 11.58000 0.5635000 10.67000 0.6289000 0.9177000      0.8444000 
1 1 1 31 16 9  o 28.38000 0.3067000 27.79000 0.4221000 28.98000 0.4452000 -1.184000      0.6135000 
1 1 1 31 16 11 o 24.49000 0.3737000 24.22000 0.5320000 24.76000 0.5250000 -0.5378000     0.7475000 
1 1 1 31 16 13 o 30.86000 0.3220000 30.93000 0.4262000 30.78000 0.4828000 0.1513000      0.6440000 
1 1 1 31 16 15 o 14.50000 0.3489000 14.58000 0.4835000 14.43000 0.5031000 0.1518000      0.6977000 
1 1 1 31 16 17 o 9.430000 0.4966000 9.215000 0.6887000 9.644000 0.7156000 -0.4286000     0.9932000 
1 1 1 31 16 19 o 3.538000 0.8544000 3.488000 1.214000  3.587000 1.202000  -0.9901000E-01 1.709000  
1 1 1 31 16 21 o 16.08000 0.3289000 16.17000 0.4861000 15.98000 0.4433000 0.1934000      0.6579000 
1 1 1 31 16 23 o 13.90000 0.3577000 13.67000 0.4867000 14.13000 0.5242000 -0.4543000     0.7153000 
1 1 1 31 16 25 f 18.51000 0.3312000 18.42000 0.3991000 18.61000 0.5288000 -0.1828000     0.6625000 
1 1 1 31 16 27 o 5.979000 0.8168000 6.319000 0.7868000 5.640000 1.432000  0.6791000      1.634000  
1 1 1 31 16 29 o 10.57000 0.4343000 9.844000 0.5583000 11.29000 0.6653000 -1.445000      0.8685000 
1 1 1 31 16 31 o 17.35000 0.3836000 17.47000 0.5624000 17.23000 0.5217000 0.2420000      0.7671000 
1 1 1 31 16 33 f 3.835000 0.8430000 4.610000 1.106000  3.061000 1.272000  1.549000       1.686000  
1 1 1 31 16 35 o 4.870000 0.8638000 3.960000 1.213000  5.781000 1.230000  -1.821000      1.728000  
1 1 1 31 16 37 o 13.64000 0.4168000 14.18000 0.5380000 13.09000 0.6368000 1.096000       0.8336000 
1 1 1 31 16 39 o 17.18000 0.3959000 16.92000 0.4315000 17.45000 0.6638000 -0.5300000     0.7917000 
1 1 1 31 16 41 o 14.20000 0.4158000 14.18000 0.4854000 14.22000 0.6751000 -0.3237000E-01 0.8315000 
1 1 1 31 16 43 o 8.573000 0.5536000 9.030000 0.7608000 8.116000 0.8044000 0.9140000      1.107000  
1 1 1 31 16 45 f 12.03000 0.5474000 11.93000 0.7351000 12.13000 0.8114000 -0.2027000     1.095000  
1 1 1 31 16 47 o 9.435000 0.5666000 9.624000 0.7983000 9.245000 0.8043000 0.3794000      1.133000  
1 1 1 31 17 2  o 17.45000 0.3528000 17.47000 0.4384000 17.42000 0.5529000 0.4659000E-01  0.7057000 
1 1 1 31 17 4  o 11.46000 0.4098000 11.47000 0.5683000 11.44000 0.5906000 0.2790000E-01  0.8196000 
1 1 1 31 17 6  o 4.641000 0.9305000 4.935000 1.321000  4.347000 1.311000  0.5876000      1.861000  
1 1 1 31 17 8  o 24.71000 0.3291000 24.00000 0.4235000 25.43000 0.5039000 -1.430000      0.6582000 
1 1 1 31 17 10 o 7.084000 0.6543000 7.357000 0.8040000 6.812000 1.033000  0.5452000      1.309000  
1 1 1 31 17 12 o 16.64000 0.3280000 17.00000 0.4536000 16.28000 0.4739000 0.7135000      0.6560000 
1 1 1 31 17 14 o 12.37000 0.3648000 12.15000 0.5307000 12.58000 0.5006000 -0.4306000     0.7296000 
1 1 1 31 17 16 o 19.08000 0.3190000 19.35000 0.4627000 18.81000 0.4393000 0.5383000      0.6381000 
1 1 1 31 17 18 o 15.49000 0.3449000 15.29000 0.4532000 15.69000 0.5200000 -0.4017000     0.6898000 
1 1 1 31 17 20 o 11.37000 0.3696000 11.37000 0.5229000 11.38000 0.5224000 -0.1336000E-01 0.7391000 
1 1 1 31 17 22 o 29.02000 0.3394000 29.03000 0.4815000 29.01000 0.4786000 0.1847000E-01  0.6789000 
1 1 1 31 17 24 o 7.817000 0.7151000 7.436000 0.6538000 8.199000 1.272000  -0.7622000     1.430000  
1 1 1 31 17 26 o 3.377000 0.9110000 3.236000 1.134000  3.518000 1.426000  -0.2827000     1.822000  
1 1 1 31 17 28 o 8.188000 0.5362000 8.867000 0.6045000 7.509000 0.8858000 1.358000       1.072000  
1 1 1 31 17 30 o 5.416000 0.7851000 4.594000 1.182000  6.237000 1.034000  -1.644000      1.570000  
1 1 1 31 17 32 o 10.37000 0.5095000 10.30000 0.5554000 10.43000 0.8544000 -0.1332000     1.019000  
1 1 1 31 17 34 f 10.23000 0.4779000 9.780000 0.6806000 10.68000 0.6709000 -0.8995000     0.9557000 
1 1 1 31 17 36 o 7.406000 0.6312000 6.782000 0.8825000 8.031000 0.9028000 -1.249000      1.262000  
1 1 1 31 17 38 o 13.84000 0.4609000 13.94000 0.5584000 13.74000 0.7334000 0.1962000      0.9218000 
1 1 1 31 17 40 o 9.839000 0.5522000 10.15000 0.5801000 9.525000 0.9398000 0.6277000      1.104000  
1 1 1 31 17 42 o 5.759000 0.8774000 6.116000 0.9708000 5.401000 1.462000  0.7147000      1.755000  
1 1 1 31 17 44 o 3.158000 0.9358000 3.166000 1.267000  3.150000 1.378000  0.1542000E-01  1.872000  
1 1 1 31 17 46 o 5.771000 0.8452000 5.729000 1.175000  5.813000 1.215000  -0.8410000E-01 1.690000  
1 1 1 31 18 1  o 13.74000 0.4254000 13.63000 0.4941000 13.85000 0.6927000 -0.2183000     0.8508000 
1 1 1 31 18 3  o 9.785000 0.4562000 9.877000 0.6577000 9.693000 0.6323000 0.1840000      0.9123000 
1 1 1 31 18 5  o 21.08000 0.2994000 21.09000 0.4308000 21.08000 0.4158000 0.1501000E-01  0.5988000 
1 1 1 31 18 7  o 26.55000 0.4224000 26.65000 0.6850000 26.45000 0.4942000 0.2032000      0.8447000 
1 1 1 31 18 9  o 26.49000 0.3365000 26.75000 0.5263000 26.23000 0.4193000 0.5234000      0.6729000 
1 1 1 31 18 11 o 21.02000 0.3059000 21.05000 0.4290000 20.98000 0.4363000 0.6481000E-01  0.6119000 
1 1 1 31 18 13 f 30.87000 0.3233000 30.72000 0.4739000 31.01000 0.4401000 -0.2818000     0.6467000 
1 1 1 31 18 15 o 24.85000 0.3199000 25.32000 0.4423000 24.38000 0.4622000 0.9354000      0.6397000 
1 1 1 31 18 17 o 12.24000 0.3571000 12.07000 0.4832000 12.41000 0.5258000 -0.3379000     0.7141000 
1 1 1 31 18 19 o 3.981000 0.8485000 3.943000 1.157000  4.019000 1.242000  -0.7593000E-01 1.697000  
1 1 1 31 18 21 o 6.703000 0.5928000 6.580000 0.7873000 6.826000 0.8864000 -0.2456000     1.186000  
1 1 1 31 18 23 o 17.00000 0.3892000 16.78000 0.3818000 17.21000 0.6783000 -0.4300000     0.7784000 
1 1 1 31 18 25 o 2.828000 0.8264000 2.112000 0.9511000 3.544000 1.352000  -1.433000      1.653000  
1 1 1 31 18 27 o 5.793000 0.7214000 6.421000 0.7209000 5.165000 1.250000  1.256000       1.443000  
1 1 1 31 18 29 o 13.11000 0.3859000 13.66000 0.4660000 12.56000 0.6152000 1.092000       0.7718000 
1 1 1 31 18 31 o 6.786000 0.6525000 6.742000 0.8665000 6.831000 0.9757000 -0.8852000E-01 1.305000  
1 1 1 31 18 33 f 9.391000 0.4984000 9.568000 0.5903000 9.215000 0.8031000 0.3530000      0.9967000 
1 1 1 31 18 35 o 9.037000 0.5639000 8.117000 0.8268000 9.957000 0.7669000 -1.840000      1.128000  
1 1 1 31 18 37 o 19.20000 0.3443000 19.12000 0.4011000 19.29000 0.5597000 -0.1644000     0.6886000 
1 1 1 31 18 39 o 21.68000 0.3674000 21.43000 0.4762000 21.92000 0.5596000 -0.4889000     0.7348000 
1 1 1 31 18 41 o 18.01000 0.3774000 18.42000 0.4312000 17.60000 0.6196000 0.8137000      0.7549000 
1 1 1 31 18 43 o 3.354000 1.086000  2.127000 0.9771000 4.581000 1.939000  -2.454000      2.171000  
1 1 1 31 18 45 o 3.378000 0.9342000 2.915000 1.267000  3.842000 1.373000  -0.9271000     1.868000  
1 1 1 31 18 47 o 3.708000 0.9225000 2.824000 1.247000  4.591000 1.359000  -1.767000      1.845000  
1 1 1 31 19 0  o 22.09000 0.5408000 22.09000 0.5408000 22.09000 0.5408000 0.000000       0.000000  
1 1 1 31 19 2  o 20.04000 0.3321000 19.73000 0.4233000 20.35000 0.5119000 -0.6174000     0.6642000 
1 1 1 31 19 4  o 28.41000 0.4232000 29.19000 0.5986000 27.64000 0.5984000 1.551000       0.8464000 
1 1 1 31 19 6  o 8.281000 0.5208000 7.990000 0.7671000 8.571000 0.7047000 -0.5803000     1.042000  
1 1 1 31 19 8  o 17.88000 0.3150000 18.01000 0.4375000 17.75000 0.4534000 0.2541000      0.6300000 
1 1 1 31 19 10 o 8.846000 0.4950000 8.776000 0.6855000 8.916000 0.7143000 -0.1409000     0.9901000 
1 1 1 31 19 12 o 9.370000 0.4594000 9.833000 0.6507000 8.907000 0.6487000 0.9259000      0.9188000 
1 1 1 31 19 14 o 3.095000 0.8524000 2.692000 1.130000  3.498000 1.277000  -0.8057000     1.705000  
1 1 1 31 19 16 o 3.556000 0.8371000 4.101000 1.129000  3.010000 1.236000  1.091000       1.674000  
1 1 1 31 19 18 o 4.593000 0.8031000 5.008000 0.9863000 4.179000 1.268000  0.8287000      1.606000  
1 1 1 31 19 20 o 10.02000 0.4039000 10.13000 0.5349000 9.906000 0.6054000 0.2285000      0.8079000 
1 1 1 31 19 22 o 6.008000 0.6969000 6.344000 0.7492000 5.673000 1.175000  0.6706000      1.394000  
1 1 1 31 19 24 o 6.891000 0.5833000 5.957000 0.7529000 7.826000 0.8912000 -1.869000      1.167000  
1 1 1 31 19 26 o 4.232000 0.8209000 3.879000 1.055000  4.585000 1.258000  -0.7054000     1.642000  
1 1 1 31 19 28 o 2.688000 0.8087000 2.287000 1.011000  3.089000 1.263000  -0.8013000     1.617000  
1 1 1 31 19 30 o 14.38000 0.3499000 14.10000 0.4240000 14.65000 0.5567000 -0.5422000     0.6998000 
1 1 1 31 19 32 o 18.01000 0.3914000 18.17000 0.4214000 17.84000 0.6596000 0.3298000      0.7827000 
1 1 1 31 19 34 o 9.338000 0.5119000 8.639000 0.7119000 10.04000 0.7359000 -1.396000      1.024000  
1 1 1 31 19 36 o 12.65000 0.4153000 12.83000 0.4818000 12.47000 0.6765000 0.3639000      0.8305000 
1 1 1 31 19 38 o 13.03000 0.4124000 12.81000 0.4808000 13.25000 0.6701000 -0.4376000     0.8247000 
1 1 1 31 19 40 o 17.61000 0.3692000 17.69000 0.4326000 17.53000 0.5985000 0.1592000      0.7384000 
1 1 1 31 19 42 o 5.643000 0.9747000 5.885000 0.9070000 5.401000 1.725000  0.4841000      1.949000  
1 1 1 31 19 44 o 3.554000 0.9021000 4.070000 1.294000  3.038000 1.258000  1.032000       1.804000  
1 1 1 31 19 46 o 3.724000 0.9515000 3.767000 1.299000  3.681000 1.391000  0.8627000E-01  1.903000  
1 1 1 31 20 1  o 8.765000 0.6046000 9.221000 0.7786000 8.310000 0.9251000 0.9117000      1.209000  
1 1 1 31 20 3  o 8.127000 0.5805000 7.843000 0.7391000 8.411000 0.8953000 -0.5677000     1.161000  
1 1 1 31 20 5  o 6.329000 0.6639000 6.009000 0.9769000 6.650000 0.8994000 -0.6414000     1.328000  
1 1 1 31 20 7  o 24.71000 0.3659000 24.04000 0.5497000 25.38000 0.4829000 -1.345000      0.7317000 
1 1 1 31 20 9  o 19.17000 0.3228000 19.50000 0.4736000 18.85000 0.4387000 0.6504000      0.6455000 
1 1 1 31 20 11 o 6.189000 0.6593000 6.326000 0.9463000 6.053000 0.9183000 0.2726000      1.319000  
1 1 1 31 20 13 o 11.47000 0.3803000 11.14000 0.5383000 11.80000 0.5373000 -0.6592000     0.7606000 
1 1 1 31 20 15 o 8.846000 0.5804000 9.498000 0.5660000 8.195000 1.014000  1.303000       1.161000  
1 1 1 31 20 17 o 3.324000 1.018000  2.335000 1.033000  4.314000 1.754000  -1.978000      2.035000  
1 1 1 31 20 19 o 19.40000 0.5909000 18.56000 0.4075000 20.24000 1.109000  -1.673000      1.182000  
1 1 1 31 20 21 o 8.164000 0.5148000 7.752000 0.6667000 8.576000 0.7846000 -0.8240000     1.030000  
1 1 1 31 20 23 o 8.820000 0.4725000 8.648000 0.5208000 8.991000 0.7886000 -0.3429000     0.9450000 
1 1 1 31 20 25 o 6.209000 0.6851000 6.767000 0.6833000 5.650000 1.188000  1.118000       1.370000  
1 1 1 31 20 27 o 2.319000 0.7393000 2.046000 0.9153000 2.591000 1.161000  -0.5447000     1.479000  
1 1 1 31 20 29 o 2.769000 0.8138000 2.452000 1.018000  3.085000 1.270000  -0.6331000     1.628000  
1 1 1 31 20 31 o 7.045000 0.6039000 7.473000 0.6354000 6.617000 1.027000  0.8559000      1.208000  
1 1 1 31 20 33 o 8.032000 0.5632000 7.705000 0.7775000 8.359000 0.8149000 -0.6534000     1.126000  
1 1 1 31 20 35 o 8.470000 0.5759000 8.000000 0.8059000 8.941000 0.8229000 -0.9410000     1.152000  
1 1 1 31 20 37 o 16.04000 0.3951000 15.83000 0.4205000 16.25000 0.6689000 -0.4250000     0.7901000 
1 1 1 31 20 39 o 17.51000 0.3917000 17.40000 0.5102000 17.61000 0.5943000 -0.2097000     0.7833000 
1 1 1 31 20 41 o 9.506000 0.6241000 9.293000 0.6440000 9.720000 1.069000  -0.4271000     1.248000  
1 1 1 31 20 43 o 2.906000 0.9180000 2.536000 1.130000  3.275000 1.447000  -0.7383000     1.836000  
1 1 1 31 20 45 o 7.950000 0.6650000 8.277000 0.8642000 7.623000 1.011000  0.6545000      1.330000  
1 1 1 31 21 0  o 12.90000 0.5069000 12.90000 0.5069000 12.90000 0.5069000 0.000000       0.000000  
1 1 1 31 21 2  o 23.93000 0.4141000 25.04000 0.4798000 22.82000 0.6752000 2.221000       0.8283000 
1 1 1 31 21 4  o 9.246000 0.5301000 10.18000 0.5899000 8.312000 0.8808000 1.867000       1.060000  
1 1 1 31 21 6  o 18.25000 0.3096000 18.34000 0.4579000 18.17000 0.4168000 0.1671000      0.6192000 
1 1 1 31 21 8  o 22.40000 0.5606000 21.65000 1.023000  23.15000 0.4598000 -1.492000      1.121000  
1 1 1 31 21 10 o 3.661000 0.8577000 3.246000 1.217000  4.077000 1.209000  -0.8305000     1.715000  
1 1 1 31 21 12 o 3.342000 0.9145000 3.108000 1.185000  3.577000 1.393000  -0.4689000     1.829000  
1 1 1 31 21 14 o 24.83000 0.3920000 25.77000 0.4453000 23.90000 0.6454000 1.875000       0.7841000 
1 1 1 31 21 16 o 8.707000 0.4898000 8.806000 0.6053000 8.608000 0.7703000 0.1985000      0.9797000 
1 1 1 31 21 18 o 17.83000 0.2968000 17.70000 0.4111000 17.97000 0.4282000 -0.2655000     0.5936000 
1 1 1 31 21 20 f 16.21000 0.3285000 16.51000 0.3483000 15.90000 0.5571000 0.6096000      0.6570000 
1 1 1 31 21 22 o 12.07000 0.3922000 11.68000 0.4596000 12.46000 0.6357000 -0.7756000     0.7844000 
1 1 1 31 21 24 o 8.910000 0.4999000 9.416000 0.5758000 8.404000 0.8175000 1.011000       0.9999000 
1 1 1 31 21 26 o 5.602000 0.7377000 5.035000 1.050000  6.169000 1.037000  -1.134000      1.475000  
1 1 1 31 21 28 o 13.31000 0.3581000 13.11000 0.4083000 13.51000 0.5884000 -0.4031000     0.7161000 
1 1 1 31 21 30 o 11.74000 0.3755000 11.45000 0.4565000 12.04000 0.5962000 -0.5818000     0.7509000 
1 1 1 31 21 32 o 4.115000 0.8942000 4.140000 1.055000  4.090000 1.444000  0.5008000E-01  1.788000  
1 1 1 31 21 34 o 6.755000 0.6782000 5.142000 1.032000  8.368000 0.8800000 -3.226000      1.356000  
1 1 1 31 21 36 o 8.843000 0.6192000 8.646000 0.6879000 9.040000 1.030000  -0.3935000     1.238000  
1 1 1 31 21 38 o 14.76000 0.3879000 14.66000 0.4578000 14.86000 0.6262000 -0.1901000     0.7757000 
1 1 1 31 21 40 o 11.31000 0.5582000 10.65000 0.6733000 11.97000 0.8906000 -1.320000      1.116000  
1 1 1 31 21 42 o 3.461000 0.8974000 3.623000 1.171000  3.298000 1.360000  0.3249000      1.795000  
1 1 1 31 21 44 o 4.277000 1.003000  4.582000 1.307000  3.972000 1.523000  0.6100000      2.007000  
1 1 1 31 21 46 f 4.194000 1.037000  5.006000 1.470000  3.382000 1.463000  1.625000       2.074000  
1 1 1 31 22 1  o 12.68000 0.4154000 12.96000 0.5353000 12.40000 0.6353000 0.5612000      0.8308000 
1 1 1 31 22 3  o 8.965000 0.4799000 9.571000 0.7076000 8.358000 0.6485000 1.213000       0.9598000 
1 1 1 31 22 5  o 8.435000 0.5949000 7.964000 0.9861000 8.905000 0.6656000 -0.9412000     1.190000  
1 1 1 31 22 7  f 4.744000 0.8801000 4.906000 1.141000  4.583000 1.340000  0.3237000      1.760000  
1 1 1 31 22 9  o 26.03000 0.3755000 25.47000 0.4639000 26.59000 0.5906000 -1.129000      0.7509000 
1 1 1 31 22 11 o 13.72000 0.3391000 13.97000 0.4757000 13.46000 0.4832000 0.5118000      0.6781000 
1 1 1 31 22 13 o 25.94000 0.4218000 26.31000 0.3980000 25.57000 0.7438000 0.7434000      0.8436000 
1 1 1 31 22 15 o 13.11000 0.3423000 13.68000 0.4524000 12.54000 0.5138000 1.132000       0.6846000 
1 1 1 31 22 17 o 8.163000 0.5868000 8.124000 0.9718000 8.202000 0.6578000 -0.7856000E-01 1.174000  
1 1 1 31 22 19 o 15.61000 0.4680000 15.26000 0.4485000 15.96000 0.8217000 -0.6909000     0.9361000 
1 1 1 31 22 21 o 17.78000 0.3499000 17.76000 0.4749000 17.80000 0.5141000 -0.4222000E-01 0.6999000 
1 1 1 31 22 23 o 14.44000 0.3473000 14.13000 0.3726000 14.75000 0.5863000 -0.6192000     0.6946000 
1 1 1 31 22 25 o 12.20000 0.3660000 12.07000 0.4161000 12.32000 0.6021000 -0.2518000     0.7319000 
1 1 1 31 22 27 o 9.329000 0.4525000 9.198000 0.5088000 9.460000 0.7485000 -0.2618000     0.9051000 
1 1 1 31 22 29 o 8.454000 0.5022000 7.585000 0.6827000 9.322000 0.7367000 -1.737000      1.004000  
1 1 1 31 22 31 o 10.02000 0.4483000 9.731000 0.4985000 10.31000 0.7452000 -0.5813000     0.8965000 
1 1 1 31 22 33 o 15.62000 0.3527000 14.91000 0.4202000 16.33000 0.5665000 -1.420000      0.7053000 
1 1 1 31 22 35 o 5.193000 0.8769000 4.412000 1.094000  5.974000 1.371000  -1.562000      1.754000  
1 1 1 31 22 37 o 9.990000 0.4736000 9.339000 0.6084000 10.64000 0.7259000 -1.302000      0.9471000 
1 1 1 31 22 39 o 15.21000 0.4348000 15.12000 0.4354000 15.30000 0.7527000 -0.1804000     0.8696000 
1 1 1 31 22 41 o 10.27000 0.5215000 10.50000 0.6063000 10.04000 0.8486000 0.4573000      1.043000  
1 1 1 31 22 43 o 3.322000 0.8766000 3.906000 1.175000  2.738000 1.301000  1.169000       1.753000  
1 1 1 31 22 45 o 6.325000 1.105000  ?        ?         6.325000 1.105000  ?              ?         
1 1 1 31 23 0  o 7.653000 0.7897000 7.653000 0.7897000 7.653000 0.7897000 0.000000       0.000000  
1 1 1 31 23 2  f 6.280000 0.6858000 7.212000 0.7039000 5.348000 1.177000  1.864000       1.372000  
1 1 1 31 23 4  o 13.89000 0.3530000 14.12000 0.4490000 13.66000 0.5449000 0.4629000      0.7060000 
1 1 1 31 23 6  o 14.84000 0.3330000 14.45000 0.4490000 15.23000 0.4918000 -0.7832000     0.6659000 
1 1 1 31 23 8  o 6.008000 1.187000  4.716000 1.220000  7.300000 2.036000  -2.584000      2.374000  
1 1 1 31 23 10 o 16.17000 0.3095000 16.64000 0.4347000 15.70000 0.4408000 0.9341000      0.6191000 
1 1 1 31 23 12 o 10.58000 0.4587000 11.41000 0.7038000 9.746000 0.5884000 1.667000       0.9174000 
1 1 1 31 23 14 o 17.35000 0.3419000 16.87000 0.5363000 17.83000 0.4243000 -0.9587000     0.6839000 
1 1 1 31 23 16 o 9.644000 0.3726000 10.18000 0.4936000 9.111000 0.5583000 1.066000       0.7452000 
1 1 1 31 23 18 o 7.356000 0.6283000 8.092000 0.5605000 6.621000 1.125000  1.471000       1.257000  
1 1 1 31 23 20 o 12.00000 0.4738000 12.25000 0.3850000 11.75000 0.8659000 0.5048000      0.9476000 
1 1 1 31 23 22 o 8.071000 0.4948000 7.832000 0.5560000 8.310000 0.8187000 -0.4783000     0.9897000 
1 1 1 31 23 24 o 12.02000 0.4106000 11.75000 0.5117000 12.29000 0.6422000 -0.5461000     0.8211000 
1 1 1 31 23 26 o 4.860000 0.8449000 5.386000 1.108000  4.334000 1.276000  1.053000       1.690000  
1 1 1 31 23 28 o 4.109000 0.9130000 4.194000 1.256000  4.024000 1.326000  0.1698000      1.826000  
1 1 1 31 23 30 o 5.829000 0.8188000 5.777000 1.065000  5.881000 1.244000  -0.1047000     1.638000  
1 1 1 31 23 32 o 3.851000 0.9017000 4.289000 1.184000  3.412000 1.360000  0.8765000      1.803000  
1 1 1 31 23 34 o 9.211000 0.5680000 8.997000 0.5032000 9.425000 1.019000  -0.4287000     1.136000  
1 1 1 31 23 36 o 4.634000 0.8730000 4.776000 1.012000  4.492000 1.423000  0.2833000      1.746000  
1 1 1 31 23 38 o 3.722000 0.9373000 3.390000 1.154000  4.054000 1.477000  -0.6642000     1.875000  
1 1 1 31 23 40 o 10.71000 0.5284000 10.22000 0.7344000 11.19000 0.7600000 -0.9675000     1.057000  
1 1 1 31 23 42 o 3.060000 0.9047000 2.648000 1.145000  3.471000 1.401000  -0.8234000     1.809000  
1 1 1 31 23 44 o 10.73000 0.6298000 11.70000 0.8008000 9.764000 0.9723000 1.941000       1.260000  
1 1 1 31 24 1  o 11.80000 0.3605000 12.48000 0.4568000 11.12000 0.5579000 1.356000       0.7211000 
1 1 1 31 24 3  o 13.96000 0.3158000 13.93000 0.4375000 13.99000 0.4556000 -0.6487000E-01 0.6316000 
1 1 1 31 24 5  o 15.70000 0.3236000 15.45000 0.4194000 15.94000 0.4930000 -0.4831000     0.6473000 
1 1 1 31 24 7  o 12.61000 0.3752000 12.44000 0.4684000 12.79000 0.5862000 -0.3534000     0.7503000 
1 1 1 31 24 9  o 12.71000 0.3598000 13.49000 0.5046000 11.92000 0.5131000 1.572000       0.7196000 
1 1 1 31 24 11 o 10.89000 0.8071000 11.64000 1.475000  10.14000 0.6549000 1.494000       1.614000  
1 1 1 31 24 13 o 16.31000 0.3507000 15.89000 0.5559000 16.73000 0.4279000 -0.8364000     0.7015000 
1 1 1 31 24 15 o 13.59000 0.3403000 13.82000 0.4615000 13.37000 0.5002000 0.4473000      0.6805000 
1 1 1 31 24 17 o 9.979000 0.4969000 10.15000 0.4288000 9.811000 0.8965000 0.3345000      0.9937000 
1 1 1 31 24 19 f 17.48000 0.6795000 16.30000 0.4214000 18.66000 1.292000  -2.363000      1.359000  
1 1 1 31 24 21 o 17.28000 0.4466000 16.51000 0.3402000 18.05000 0.8258000 -1.536000      0.8932000 
1 1 1 31 24 23 o 16.31000 0.3114000 16.06000 0.3430000 16.55000 0.5199000 -0.4907000     0.6228000 
1 1 1 31 24 25 f 18.36000 0.3302000 17.91000 0.4157000 18.81000 0.5132000 -0.8991000     0.6605000 
1 1 1 31 24 27 o 6.873000 0.6320000 7.077000 0.7344000 6.668000 1.029000  0.4085000      1.264000  
1 1 1 31 24 29 o 12.19000 0.3842000 11.84000 0.4862000 12.54000 0.5950000 -0.7082000     0.7684000 
1 1 1 31 24 31 o 16.74000 0.3681000 16.82000 0.4808000 16.66000 0.5574000 0.1550000      0.7361000 
1 1 1 31 24 33 o 12.29000 0.4607000 12.30000 0.6552000 12.28000 0.6479000 0.2579000E-01  0.9214000 
1 1 1 31 24 35 o 3.119000 0.8259000 2.629000 1.039000  3.608000 1.284000  -0.9788000     1.652000  
1 1 1 31 24 37 o 5.279000 0.8689000 4.969000 1.047000  5.589000 1.387000  -0.6199000     1.738000  
1 1 1 31 24 39 o 10.24000 0.6922000 9.906000 1.131000  10.58000 0.7981000 -0.6735000     1.384000  
1 1 1 31 24 41 o 2.967000 0.9072000 2.675000 1.226000  3.259000 1.337000  -0.5840000     1.814000  
1 1 1 31 24 43 o 3.312000 1.017000  3.293000 1.394000  3.331000 1.483000  -0.3857000E-01 2.035000  
1 1 1 31 25 0  o 1.968000 0.9270000 1.968000 0.9270000 1.968000 0.9270000 0.000000       0.000000  
1 1 1 31 25 2  o 11.07000 0.3738000 11.39000 0.4922000 10.74000 0.5629000 0.6488000      0.7477000 
1 1 1 31 25 4  o 18.54000 0.2937000 18.75000 0.3932000 18.34000 0.4365000 0.4050000      0.5875000 
1 1 1 31 25 6  o 6.184000 0.6280000 5.727000 0.9072000 6.641000 0.8685000 -0.9138000     1.256000  
1 1 1 31 25 8  o 12.39000 0.3378000 12.28000 0.4655000 12.51000 0.4897000 -0.2309000     0.6756000 
1 1 1 31 25 10 o 10.28000 0.3534000 10.10000 0.5127000 10.47000 0.4864000 -0.3669000     0.7067000 
1 1 1 31 25 12 o 3.573000 0.7826000 4.303000 1.059000  2.844000 1.152000  1.459000       1.565000  
1 1 1 31 25 14 f 6.763000 0.5180000 6.813000 0.6452000 6.712000 0.8105000 0.1005000      1.036000  
1 1 1 31 25 16 o 9.331000 0.5539000 10.38000 0.3780000 8.285000 1.041000  2.092000       1.108000  
1 1 1 31 25 18 o 17.82000 0.4473000 19.14000 0.6307000 16.51000 0.6343000 2.630000       0.8945000 
1 1 1 31 25 20 o 5.951000 0.8950000 6.117000 1.232000  5.785000 1.298000  0.3313000      1.790000  
1 1 1 31 25 22 o 5.956000 0.8256000 5.406000 1.243000  6.506000 1.087000  -1.101000      1.651000  
1 1 1 31 25 24 o 14.15000 0.4638000 13.47000 0.7518000 14.83000 0.5434000 -1.353000      0.9276000 
1 1 1 31 25 26 o 8.048000 0.5011000 6.627000 0.6007000 9.468000 0.8023000 -2.840000      1.002000  
1 1 1 31 25 28 o 2.895000 0.7758000 3.080000 1.016000  2.710000 1.172000  0.3703000      1.552000  
1 1 1 31 25 30 o 7.684000 0.5389000 6.943000 0.7003000 8.426000 0.8192000 -1.482000      1.078000  
1 1 1 31 25 32 o 3.943000 0.9464000 3.484000 1.184000  4.401000 1.477000  -0.9171000     1.893000  
1 1 1 31 25 34 o 6.451000 0.9779000 6.745000 1.286000  6.157000 1.474000  0.5881000      1.956000  
1 1 1 31 25 36 o 4.541000 0.9898000 4.629000 1.390000  4.452000 1.409000  0.1769000      1.980000  
1 1 1 31 25 38 o 4.349000 1.093000  4.469000 1.656000  4.228000 1.428000  0.2407000      2.187000  
1 1 1 31 25 40 o 9.581000 0.6266000 9.308000 0.9009000 9.854000 0.8712000 -0.5460000     1.253000  
1 1 1 31 25 42 o 5.880000 0.9506000 5.439000 1.412000  6.320000 1.273000  -0.8804000     1.901000  
1 1 1 31 26 1  o 11.12000 0.4009000 11.44000 0.5003000 10.81000 0.6266000 0.6324000      0.8019000 
1 1 1 31 26 3  o 3.627000 0.8563000 3.189000 1.182000  4.064000 1.239000  -0.8746000     1.713000  
1 1 1 31 26 5  o 15.95000 0.3051000 16.52000 0.4318000 15.39000 0.4312000 1.126000       0.6102000 
1 1 1 31 26 7  o 5.409000 0.9394000 5.570000 1.489000  5.248000 1.145000  0.3225000      1.879000  
1 1 1 31 26 9  o 6.222000 0.5696000 6.953000 0.7464000 5.491000 0.8606000 1.461000       1.139000  
1 1 1 31 26 11 o 7.682000 0.4749000 8.595000 0.5218000 6.769000 0.7937000 1.825000       0.9499000 
1 1 1 31 26 13 o 5.149000 0.5387000 5.050000 0.7235000 5.247000 0.7982000 -0.1976000     1.077000  
1 1 1 31 26 15 o 15.70000 0.4146000 15.51000 0.5715000 15.90000 0.6008000 -0.3927000     0.8292000 
1 1 1 31 26 17 o 12.01000 0.5358000 11.75000 0.7161000 12.28000 0.7972000 -0.5272000     1.072000  
1 1 1 31 26 19 o 6.929000 1.565000  6.684000 1.889000  7.173000 2.496000  -0.4892000     3.130000  
1 1 1 31 26 21 o 7.756000 0.6985000 8.152000 1.012000  7.360000 0.9634000 0.7921000      1.397000  
1 1 1 31 26 23 o 4.686000 1.009000  4.474000 1.503000  4.899000 1.346000  -0.4246000     2.017000  
1 1 1 31 26 25 o 4.952000 0.9491000 4.845000 1.435000  5.058000 1.242000  -0.2126000     1.898000  
1 1 1 31 26 27 o 3.414000 0.9419000 2.911000 1.283000  3.916000 1.379000  -1.005000      1.884000  
1 1 1 31 26 29 o 3.848000 1.027000  3.903000 1.523000  3.794000 1.378000  0.1093000      2.053000  
1 1 1 31 26 31 o 6.489000 0.7705000 7.128000 0.9810000 5.850000 1.188000  1.279000       1.541000  
1 1 1 31 26 33 o 3.015000 0.8255000 3.328000 1.085000  2.702000 1.244000  0.6259000      1.651000  
1 1 1 31 26 35 o 2.911000 0.9014000 2.847000 1.265000  2.976000 1.284000  -0.1288000     1.803000  
1 1 1 31 26 37 o 7.650000 0.9008000 8.205000 1.426000  7.096000 1.101000  1.109000       1.802000  
1 1 1 31 26 39 o 3.211000 0.9478000 3.164000 1.327000  3.259000 1.353000  -0.9509000E-01 1.896000  
1 1 1 31 26 41 o 4.003000 1.037000  3.583000 1.473000  4.423000 1.462000  -0.8406000     2.075000  
1 1 1 31 27 0  o 7.926000 0.6331000 7.926000 0.6331000 7.926000 0.6331000 0.000000       0.000000  
1 1 1 31 27 2  o 8.543000 0.4406000 9.169000 0.5738000 7.918000 0.6687000 1.252000       0.8812000 
1 1 1 31 27 4  o 21.72000 0.2797000 21.91000 0.3958000 21.53000 0.3953000 0.3826000      0.5594000 
1 1 1 31 27 6  o 18.53000 0.3725000 19.33000 0.5392000 17.73000 0.5141000 1.610000       0.7450000 
1 1 1 31 27 8  o 8.771000 0.4002000 9.130000 0.5394000 8.413000 0.5913000 0.7171000      0.8004000 
1 1 1 31 27 10 f 17.79000 0.3275000 17.54000 0.4183000 18.04000 0.5041000 -0.5037000     0.6550000 
1 1 1 31 27 12 o 14.40000 0.4153000 14.20000 0.6075000 14.59000 0.5666000 -0.3879000     0.8307000 
1 1 1 31 27 14 o 12.00000 0.4797000 11.86000 0.6896000 12.14000 0.6669000 -0.2887000     0.9594000 
1 1 1 31 27 16 o 14.70000 0.4720000 14.28000 0.6394000 15.12000 0.6946000 -0.8375000     0.9440000 
1 1 1 31 27 18 o 17.51000 0.4412000 17.75000 0.5852000 17.27000 0.6605000 0.4808000      0.8824000 
1 1 1 31 27 20 o 8.472000 0.7986000 8.780000 0.9081000 8.164000 1.314000  0.6155000      1.597000  
1 1 1 31 27 22 o 14.25000 0.5762000 13.40000 0.6047000 15.10000 0.9811000 -1.702000      1.152000  
1 1 1 31 27 24 o 13.86000 0.6224000 13.44000 1.105000  14.27000 0.5733000 -0.8309000     1.245000  
1 1 1 31 27 26 o 3.971000 0.9466000 3.336000 1.359000  4.607000 1.318000  -1.271000      1.893000  
1 1 1 31 27 28 o 4.645000 0.9776000 4.009000 1.516000  5.282000 1.234000  -1.273000      1.955000  
1 1 1 31 27 30 o 9.284000 0.5755000 8.827000 0.8192000 9.741000 0.8087000 -0.9133000     1.151000  
1 1 1 31 27 32 o 12.62000 0.7077000 12.90000 0.6536000 12.35000 1.255000  0.5413000      1.415000  
1 1 1 31 27 34 o 4.911000 1.016000  4.323000 1.539000  5.498000 1.326000  -1.175000      2.031000  
1 1 1 31 27 36 o 3.670000 0.9751000 3.758000 1.384000  3.582000 1.374000  0.1758000      1.950000  
1 1 1 31 27 38 o 5.584000 0.9093000 6.394000 1.127000  4.775000 1.427000  1.619000       1.819000  
1 1 1 31 27 40 o 6.712000 0.8932000 6.583000 1.324000  6.840000 1.199000  -0.2563000     1.786000  
1 1 1 31 27 42 o 4.345000 1.243000  3.617000 1.537000  5.073000 1.955000  -1.456000      2.486000  
1 1 1 31 28 1  o 3.178000 0.8032000 3.292000 1.117000  3.064000 1.154000  0.2283000      1.606000  
1 1 1 31 28 3  o 6.491000 0.5955000 5.963000 0.7896000 7.019000 0.8917000 -1.056000      1.191000  
1 1 1 31 28 5  o 13.53000 0.3587000 13.49000 0.5787000 13.57000 0.4239000 -0.8531000E-01 0.7173000 
1 1 1 31 28 7  o 12.65000 0.3497000 12.96000 0.4410000 12.34000 0.5428000 0.6175000      0.6994000 
1 1 1 31 28 9  o 11.29000 0.3063000 10.72000 0.4227000 11.85000 0.4435000 -1.126000      0.6127000 
1 1 1 31 28 11 o 28.15000 0.3636000 28.47000 0.5181000 27.83000 0.5102000 0.6323000      0.7271000 
1 1 1 31 28 13 o 5.815000 0.8377000 6.223000 1.168000  5.408000 1.201000  0.8150000      1.675000  
1 1 1 31 28 15 o 13.34000 0.4190000 13.75000 0.5878000 12.93000 0.5972000 0.8285000      0.8379000 
1 1 1 31 28 17 o 21.72000 0.3883000 22.60000 0.5071000 20.84000 0.5882000 1.759000       0.7766000 
1 1 1 31 28 19 f 13.64000 0.4686000 14.08000 0.5576000 13.19000 0.7533000 0.8839000      0.9372000 
1 1 1 31 28 21 o 10.89000 0.5325000 10.69000 0.6695000 11.09000 0.8282000 -0.4018000     1.065000  
1 1 1 31 28 23 o 7.467000 1.110000  7.001000 1.566000  7.934000 1.574000  -0.9335000     2.221000  
1 1 1 31 28 25 o 4.153000 1.017000  3.918000 1.388000  4.389000 1.487000  -0.4709000     2.034000  
1 1 1 31 28 27 o 9.988000 0.6990000 9.388000 1.143000  10.59000 0.8054000 -1.199000      1.398000  
1 1 1 31 28 29 o 11.11000 0.6842000 11.45000 0.9854000 10.78000 0.9495000 0.6665000      1.368000  
1 1 1 31 28 31 o 12.55000 0.5072000 12.23000 0.6959000 12.88000 0.7382000 -0.6455000     1.014000  
1 1 1 31 28 33 o 4.200000 1.009000  3.756000 1.513000  4.644000 1.334000  -0.8886000     2.017000  
1 1 1 31 28 35 o 4.155000 0.9753000 3.627000 1.335000  4.682000 1.422000  -1.055000      1.951000  
1 1 1 31 28 37 o 4.178000 1.011000  4.383000 1.426000  3.974000 1.433000  0.4082000      2.022000  
1 1 1 31 28 39 o 5.350000 0.9730000 6.703000 1.275000  3.996000 1.470000  2.707000       1.946000  
1 1 1 31 28 41 o 5.526000 1.106000  5.927000 1.654000  5.125000 1.469000  0.8015000      2.212000  
1 1 1 31 29 0  o 33.10000 0.4288000 33.10000 0.4288000 33.10000 0.4288000 0.000000       0.000000  
1 1 1 31 29 2  o 16.48000 0.3068000 16.54000 0.3886000 16.41000 0.4749000 0.1262000      0.6136000 
1 1 1 31 29 4  o 13.08000 0.3476000 13.27000 0.5459000 12.89000 0.4305000 0.3839000      0.6952000 
1 1 1 31 29 6  o 9.629000 0.3881000 10.14000 0.5269000 9.122000 0.5699000 1.015000       0.7761000 
1 1 1 31 29 8  o 6.119000 0.4865000 5.407000 0.7346000 6.830000 0.6380000 -1.424000      0.9730000 
1 1 1 31 29 10 o 12.47000 0.5195000 12.66000 0.8439000 12.29000 0.6062000 0.3625000      1.039000  
1 1 1 31 29 12 o 9.081000 0.5702000 9.074000 0.8383000 9.088000 0.7732000 -0.1398000E-01 1.140000  
1 1 1 31 29 14 o 5.001000 0.9111000 5.473000 1.234000  4.528000 1.341000  0.9443000      1.822000  
1 1 1 31 29 16 o 5.324000 0.8858000 4.739000 1.316000  5.909000 1.186000  -1.171000      1.772000  
1 1 1 31 29 18 o 13.90000 0.6592000 14.87000 0.5690000 12.93000 1.189000  1.932000       1.318000  
1 1 1 31 29 20 o 10.39000 0.6680000 10.91000 0.7447000 9.862000 1.109000  1.047000       1.336000  
1 1 1 31 29 22 o 11.70000 0.5349000 11.12000 0.7470000 12.28000 0.7657000 -1.153000      1.070000  
1 1 1 31 29 24 o 7.611000 0.8469000 6.428000 1.462000  8.795000 0.8554000 -2.367000      1.694000  
1 1 1 31 29 26 o 3.727000 1.004000  3.630000 1.416000  3.824000 1.422000  -0.1941000     2.007000  
1 1 1 31 29 28 o 8.275000 0.7849000 8.586000 1.040000  7.964000 1.176000  0.6221000      1.570000  
1 1 1 31 29 30 o 8.642000 0.6097000 8.252000 0.8882000 9.032000 0.8356000 -0.7797000     1.219000  
1 1 1 31 29 32 o 6.701000 0.9656000 6.713000 1.380000  6.690000 1.351000  0.2309000E-01  1.931000  
1 1 1 31 29 34 f 3.873000 1.046000  4.416000 1.491000  3.330000 1.466000  1.086000       2.091000  
1 1 1 31 29 36 f 5.915000 1.040000  5.546000 1.554000  6.283000 1.383000  -0.7379000     2.080000  
1 1 1 31 29 38 o 8.003000 0.7886000 8.474000 1.017000  7.532000 1.206000  0.9417000      1.577000  
1 1 1 31 29 40 o 2.982000 0.9408000 3.110000 1.368000  2.854000 1.292000  0.2561000      1.882000  
1 1 1 31 30 1  o 8.749000 0.4458000 8.125000 0.6105000 9.373000 0.6498000 -1.248000      0.8916000 
1 1 1 31 30 3  o 5.877000 0.5719000 5.511000 0.8757000 6.242000 0.7357000 -0.7313000     1.144000  
1 1 1 31 30 5  o 5.485000 0.6089000 4.652000 0.9558000 6.318000 0.7548000 -1.666000      1.218000  
1 1 1 31 30 7  o 8.982000 0.3353000 9.377000 0.4555000 8.587000 0.4923000 0.7902000      0.6707000 
1 1 1 31 30 9  f 13.09000 0.4315000 13.08000 0.6157000 13.09000 0.6046000 -0.1232000E-01 0.8629000 
1 1 1 31 30 11 f 8.741000 0.5416000 7.761000 0.7776000 9.720000 0.7540000 -1.959000      1.083000  
1 1 1 31 30 13 o 7.788000 0.6309000 8.739000 0.8504000 6.837000 0.9322000 1.902000       1.262000  
1 1 1 31 30 15 o 10.71000 0.5250000 11.33000 0.6692000 10.09000 0.8091000 1.241000       1.050000  
1 1 1 31 30 17 f 15.40000 0.4283000 15.32000 0.5898000 15.48000 0.6213000 -0.1659000     0.8567000 
1 1 1 31 30 19 o 17.48000 0.4473000 17.33000 0.5587000 17.62000 0.6988000 -0.2890000     0.8946000 
1 1 1 31 30 21 o 16.64000 0.4634000 16.55000 0.6004000 16.73000 0.7060000 -0.1802000     0.9268000 
1 1 1 31 30 23 o 5.793000 1.181000  4.352000 1.774000  7.234000 1.560000  -2.882000      2.363000  
1 1 1 31 30 25 o 5.169000 0.9545000 5.339000 1.449000  4.999000 1.242000  0.3402000      1.909000  
1 1 1 31 30 27 o 3.189000 0.9650000 3.819000 1.510000  2.558000 1.202000  1.261000       1.930000  
1 1 1 31 30 29 o 4.216000 1.009000  4.281000 1.443000  4.150000 1.409000  0.1312000      2.017000  
1 1 1 31 30 31 o 3.223000 0.9734000 3.222000 1.445000  3.225000 1.304000  -0.2210000E-02 1.947000  
1 1 1 31 30 33 o 6.581000 0.8470000 6.566000 1.162000  6.595000 1.232000  -0.2824000E-01 1.694000  
1 1 1 31 30 35 o 4.585000 0.9683000 3.339000 1.355000  5.831000 1.384000  -2.493000      1.937000  
1 1 1 31 30 37 o 3.710000 0.9456000 2.613000 1.197000  4.806000 1.464000  -2.192000      1.891000  
1 1 1 31 30 39 o 6.076000 1.114000  6.573000 1.416000  5.578000 1.719000  0.9953000      2.227000  
1 1 1 31 31 0  o 4.963000 0.9600000 4.963000 0.9600000 4.963000 0.9600000 0.000000       0.000000  
1 1 1 31 31 2  o 15.77000 0.2906000 15.68000 0.4121000 15.86000 0.4098000 -0.1772000     0.5811000 
1 1 1 31 31 4  o 9.554000 0.3527000 10.05000 0.4719000 9.059000 0.5244000 0.9900000      0.7055000 
1 1 1 31 31 6  o 8.403000 0.3600000 8.620000 0.5046000 8.186000 0.5136000 0.4346000      0.7200000 
1 1 1 31 31 8  o 11.92000 0.5331000 11.80000 0.6615000 12.05000 0.8363000 -0.2501000     1.066000  
1 1 1 31 31 10 o 12.15000 0.4600000 12.22000 0.6719000 12.07000 0.6285000 0.1465000      0.9200000 
1 1 1 31 31 12 o 6.277000 0.8201000 6.471000 1.164000  6.083000 1.156000  0.3883000      1.640000  
1 1 1 31 31 14 o 7.634000 0.6823000 8.123000 0.8919000 7.146000 1.033000  0.9771000      1.365000  
1 1 1 31 31 16 o 4.633000 0.9404000 3.559000 1.344000  5.706000 1.316000  -2.147000      1.881000  
1 1 1 31 31 18 o 11.97000 0.4975000 12.49000 0.6527000 11.44000 0.7511000 1.053000       0.9951000 
1 1 1 31 31 20 o 8.739000 0.8163000 8.339000 0.9253000 9.139000 1.345000  -0.7998000     1.633000  
1 1 1 31 31 22 o 9.153000 0.7119000 8.220000 1.124000  10.09000 0.8743000 -1.866000      1.424000  
1 1 1 31 31 24 o 5.332000 1.027000  6.132000 1.204000  4.531000 1.665000  1.601000       2.055000  
1 1 1 31 31 26 o 5.161000 1.044000  5.152000 1.426000  5.169000 1.524000  -0.1700000E-01 2.088000  
1 1 1 31 31 28 o 10.00000 0.6751000 10.31000 1.018000  9.696000 0.8868000 0.6106000      1.350000  
1 1 1 31 31 30 o 6.101000 0.9405000 5.472000 1.387000  6.730000 1.271000  -1.258000      1.881000  
1 1 1 31 31 32 o 5.893000 0.9103000 6.056000 1.232000  5.731000 1.340000  0.3249000      1.821000  
1 1 1 31 31 34 o 5.596000 0.9451000 6.359000 1.300000  4.833000 1.372000  1.526000       1.890000  
1 1 1 31 31 36 o 3.585000 0.9616000 3.458000 1.369000  3.713000 1.351000  -0.2547000     1.923000  
1 1 1 31 31 38 o 3.495000 1.001000  3.693000 1.495000  3.298000 1.333000  0.3955000      2.003000  
1 1 1 31 32 1  o 4.016000 0.7725000 4.681000 0.9626000 3.351000 1.208000  1.329000       1.545000  
1 1 1 31 32 3  o 6.988000 0.4664000 7.046000 0.6712000 6.931000 0.6476000 0.1153000      0.9327000 
1 1 1 31 32 5  o 4.457000 0.8254000 4.518000 1.337000  4.395000 0.9683000 0.1231000      1.651000  
1 1 1 31 32 7  o 13.00000 0.4303000 13.22000 0.6068000 12.79000 0.6103000 0.4337000      0.8606000 
1 1 1 31 32 9  o 7.484000 0.6731000 7.251000 0.9846000 7.716000 0.9180000 -0.4653000     1.346000  
1 1 1 31 32 11 o 3.798000 1.001000  3.541000 1.462000  4.056000 1.368000  -0.5148000     2.002000  
1 1 1 31 32 13 o 3.973000 0.9496000 4.012000 1.364000  3.934000 1.322000  0.7765000E-01  1.899000  
1 1 1 31 32 15 o 10.41000 0.5451000 10.79000 0.6765000 10.03000 0.8549000 0.7668000      1.090000  
1 1 1 31 32 17 o 3.983000 0.8609000 2.385000 1.101000  5.581000 1.323000  -3.196000      1.722000  
1 1 1 31 32 19 o 12.78000 0.5543000 13.29000 0.8189000 12.26000 0.7474000 1.022000       1.109000  
1 1 1 31 32 21 o 6.015000 1.086000  7.071000 1.384000  4.960000 1.674000  2.111000       2.172000  
1 1 1 31 32 23 o 8.082000 0.9522000 7.309000 1.362000  8.855000 1.331000  -1.546000      1.904000  
1 1 1 31 32 25 o 4.589000 1.056000  4.288000 1.485000  4.891000 1.500000  -0.6031000     2.111000  
1 1 1 31 32 27 f 3.700000 1.043000  3.994000 1.582000  3.407000 1.360000  0.5872000      2.086000  
1 1 1 31 32 29 o 3.565000 1.025000  3.478000 1.422000  3.652000 1.476000  -0.1745000     2.050000  
1 1 1 31 32 31 o 4.536000 1.255000  3.106000 1.386000  5.965000 2.093000  -2.859000      2.510000  
1 1 1 31 32 33 o 4.116000 0.9000000 5.395000 1.302000  2.837000 1.243000  2.557000       1.800000  
1 1 1 31 32 35 o 4.035000 0.9977000 5.146000 1.526000  2.923000 1.285000  2.222000       1.995000  
1 1 1 31 32 37 o 4.414000 0.9858000 5.247000 1.380000  3.581000 1.409000  1.667000       1.972000  
1 1 1 31 33 0  o 6.931000 0.6406000 6.931000 0.6406000 6.931000 0.6406000 0.000000       0.000000  
1 1 1 31 33 2  o 11.41000 0.3963000 11.50000 0.6253000 11.32000 0.4869000 0.1860000      0.7925000 
1 1 1 31 33 4  o 13.97000 0.3396000 14.28000 0.5327000 13.66000 0.4213000 0.6116000      0.6791000 
1 1 1 31 33 6  o 5.322000 0.8330000 4.549000 1.292000  6.096000 1.052000  -1.547000      1.666000  
1 1 1 31 33 8  o 2.905000 0.8825000 2.854000 1.177000  2.956000 1.315000  -0.1021000     1.765000  
1 1 1 31 33 10 o 4.379000 0.8883000 5.061000 1.165000  3.698000 1.342000  1.363000       1.777000  
1 1 1 31 33 12 o 3.553000 0.9236000 3.516000 1.253000  3.589000 1.358000  -0.7342000E-01 1.847000  
1 1 1 31 33 14 o 15.67000 0.3999000 15.68000 0.5413000 15.66000 0.5887000 0.1824000E-01  0.7998000 
1 1 1 31 33 16 o 3.707000 0.9922000 3.291000 1.290000  4.124000 1.508000  -0.8331000     1.984000  
1 1 1 31 33 18 o 7.346000 0.7556000 6.567000 1.195000  8.125000 0.9256000 -1.558000      1.511000  
1 1 1 31 33 20 o 5.159000 1.224000  5.805000 1.256000  4.514000 2.102000  1.291000       2.448000  
1 1 1 31 33 22 o 8.138000 0.7228000 6.514000 1.175000  9.762000 0.8427000 -3.247000      1.446000  
1 1 1 31 33 24 o 3.940000 1.055000  3.820000 1.414000  4.061000 1.567000  -0.2409000     2.111000  
1 1 1 31 33 26 o 5.144000 1.108000  5.655000 1.586000  4.632000 1.549000  1.023000       2.217000  
1 1 1 31 33 28 o 7.928000 0.6840000 7.771000 1.005000  8.085000 0.9282000 -0.3142000     1.368000  
1 1 1 31 33 30 o 8.283000 0.7486000 8.178000 1.013000  8.389000 1.103000  -0.2102000     1.497000  
1 1 1 31 33 32 o 3.826000 1.058000  4.246000 1.588000  3.406000 1.398000  0.8399000      2.116000  
1 1 1 31 33 34 o 4.335000 1.051000  4.019000 1.437000  4.650000 1.535000  -0.6312000     2.103000  
1 1 1 31 33 36 o 3.742000 1.041000  3.475000 1.373000  4.009000 1.566000  -0.5335000     2.082000  
1 1 1 31 34 1  o 6.941000 0.8568000 6.659000 1.495000  7.223000 0.8374000 -0.5640000     1.714000  
1 1 1 31 34 3  o 7.381000 0.4691000 7.905000 0.7816000 6.857000 0.5190000 1.048000       0.9383000 
1 1 1 31 34 5  o 8.241000 0.5566000 8.897000 0.7807000 7.584000 0.7936000 1.312000       1.113000  
1 1 1 31 34 7  o 2.584000 0.8017000 2.734000 1.165000  2.434000 1.101000  0.3000000      1.603000  
1 1 1 31 34 9  o 10.56000 0.5013000 10.57000 0.6766000 10.54000 0.7398000 0.2471000E-01  1.003000  
1 1 1 31 34 11 f 12.76000 0.5224000 12.96000 0.8325000 12.57000 0.6313000 0.3823000      1.045000  
1 1 1 31 34 13 o 8.348000 0.6479000 8.502000 0.9217000 8.195000 0.9109000 0.3074000      1.296000  
1 1 1 31 34 15 o 5.515000 0.9961000 5.274000 1.504000  5.757000 1.306000  -0.4833000     1.992000  
1 1 1 31 34 17 o 5.220000 1.017000  5.697000 1.333000  4.743000 1.537000  0.9541000      2.034000  
1 1 1 31 34 19 o 3.831000 0.9611000 4.674000 1.408000  2.988000 1.309000  1.686000       1.922000  
1 1 1 31 34 21 o 6.196000 0.8403000 6.071000 1.211000  6.320000 1.165000  -0.2493000     1.681000  
1 1 1 31 34 23 o 5.757000 1.037000  4.653000 1.538000  6.861000 1.391000  -2.208000      2.074000  
1 1 1 31 34 25 o 4.657000 0.9980000 3.925000 1.400000  5.389000 1.423000  -1.464000      1.996000  
1 1 1 31 34 27 o 4.722000 1.016000  4.948000 1.386000  4.495000 1.486000  0.4536000      2.032000  
1 1 1 31 34 29 o 4.669000 1.022000  5.435000 1.480000  3.903000 1.411000  1.532000       2.045000  
1 1 1 31 34 31 o 7.421000 0.9646000 5.551000 1.558000  9.291000 1.138000  -3.740000      1.929000  
1 1 1 31 34 33 o 9.217000 0.7144000 8.417000 1.143000  10.02000 0.8577000 -1.600000      1.429000  
1 1 1 31 34 35 o 6.386000 1.073000  8.502000 1.355000  4.270000 1.664000  4.232000       2.146000  
1 1 1 31 35 0  o 2.794000 1.166000  2.794000 1.166000  2.794000 1.166000  0.000000       0.000000  
1 1 1 31 35 2  o 10.95000 0.4004000 11.58000 0.6100000 10.32000 0.5188000 1.262000       0.8008000 
1 1 1 31 35 4  o 4.190000 0.8937000 3.358000 1.239000  5.021000 1.288000  -1.663000      1.787000  
1 1 1 31 35 6  o 6.243000 0.7422000 4.970000 1.211000  7.517000 0.8588000 -2.547000      1.484000  
1 1 1 31 35 8  o 6.970000 0.7380000 7.867000 0.9015000 6.074000 1.169000  1.793000       1.476000  
1 1 1 31 35 10 o 11.83000 0.4929000 11.94000 0.6859000 11.73000 0.7080000 0.2137000      0.9857000 
1 1 1 31 35 12 o 5.790000 1.043000  6.131000 1.423000  5.448000 1.526000  0.6831000      2.086000  
1 1 1 31 35 14 o 6.673000 0.9255000 7.854000 1.195000  5.492000 1.413000  2.362000       1.851000  
1 1 1 31 35 16 o 3.803000 1.009000  4.139000 1.439000  3.468000 1.416000  0.6712000      2.018000  
1 1 1 31 35 18 o 8.352000 0.6792000 8.640000 0.9356000 8.063000 0.9850000 0.5772000      1.358000  
1 1 1 31 35 20 o 4.646000 1.298000  4.019000 1.546000  5.272000 2.086000  -1.253000      2.597000  
1 1 1 31 35 22 o 7.463000 0.7686000 6.612000 1.039000  8.314000 1.133000  -1.702000      1.537000  
1 1 1 31 35 24 o 7.262000 0.7418000 6.864000 1.105000  7.660000 0.9906000 -0.7962000     1.484000  
1 1 1 31 35 26 o 3.395000 1.008000  3.178000 1.347000  3.612000 1.499000  -0.4342000     2.015000  
1 1 1 31 35 28 o 4.085000 1.027000  3.231000 1.378000  4.939000 1.523000  -1.708000      2.054000  
1 1 1 31 35 30 o 8.292000 0.8557000 9.823000 1.236000  6.761000 1.184000  3.061000       1.711000  
1 1 1 31 35 32 o 6.807000 0.8363000 6.946000 1.258000  6.668000 1.102000  0.2774000      1.673000  
1 1 1 31 35 34 o 5.690000 0.9261000 6.061000 1.253000  5.319000 1.364000  0.7422000      1.852000  
1 1 1 31 36 1  o 3.712000 0.9690000 2.595000 1.023000  4.829000 1.646000  -2.234000      1.938000  
1 1 1 31 36 3  f 5.111000 0.8233000 5.893000 0.9672000 4.330000 1.333000  1.562000       1.647000  
1 1 1 31 36 5  o 5.853000 0.7300000 5.623000 1.057000  6.083000 1.007000  -0.4594000     1.460000  
1 1 1 31 36 7  o 9.286000 0.6551000 9.048000 0.8927000 9.523000 0.9590000 -0.4748000     1.310000  
1 1 1 31 36 9  o 6.320000 1.093000  6.487000 1.179000  6.153000 1.840000  0.3344000      2.186000  
1 1 1 31 36 11 o 4.410000 1.121000  4.291000 1.636000  4.528000 1.533000  -0.2363000     2.242000  
1 1 1 31 36 13 o 6.136000 0.8767000 7.061000 1.080000  5.211000 1.381000  1.850000       1.753000  
1 1 1 31 36 15 o 6.383000 0.8595000 7.508000 1.063000  5.258000 1.351000  2.249000       1.719000  
1 1 1 31 36 17 o 6.032000 1.039000  5.673000 1.517000  6.392000 1.421000  -0.7196000     2.079000  
1 1 1 31 36 19 o 3.294000 1.006000  2.875000 1.280000  3.712000 1.553000  -0.8365000     2.013000  
1 1 1 31 36 21 o 5.890000 0.9102000 6.447000 1.154000  5.333000 1.408000  1.114000       1.820000  
1 1 1 31 36 23 o 6.004000 0.8948000 5.416000 1.329000  6.591000 1.199000  -1.175000      1.790000  
1 1 1 31 36 25 o 4.130000 1.031000  3.850000 1.461000  4.410000 1.455000  -0.5602000     2.061000  
1 1 1 31 36 27 o 4.403000 1.029000  3.643000 1.395000  5.163000 1.512000  -1.520000      2.057000  
1 1 1 31 36 29 o 6.529000 0.8984000 6.257000 1.342000  6.802000 1.194000  -0.5453000     1.797000  
1 1 1 31 36 31 o 4.934000 1.080000  5.475000 1.471000  4.393000 1.581000  1.083000       2.160000  
1 1 1 31 36 33 o 3.657000 1.033000  3.598000 1.509000  3.717000 1.411000  -0.1187000     2.066000  
1 1 1 31 37 0  o 4.544000 1.512000  4.544000 1.512000  4.544000 1.512000  0.000000       0.000000  
1 1 1 31 37 2  o 7.237000 1.123000  8.717000 0.7403000 5.757000 2.119000  2.960000       2.245000  
1 1 1 31 37 4  o 6.309000 1.185000  7.579000 1.026000  5.038000 2.137000  2.540000       2.371000  
1 1 1 31 37 6  o 11.98000 0.5328000 11.94000 0.7548000 12.02000 0.7523000 -0.7462000E-01 1.066000  
1 1 1 31 37 8  o 6.692000 0.8364000 6.851000 1.098000  6.533000 1.262000  0.3179000      1.673000  
1 1 1 31 37 10 o 3.265000 0.9516000 3.187000 1.330000  3.343000 1.361000  -0.1555000     1.903000  
1 1 1 31 37 12 o 3.273000 0.9258000 3.671000 1.391000  2.875000 1.222000  0.7963000      1.852000  
1 1 1 31 37 14 o 5.805000 1.070000  5.389000 1.558000  6.222000 1.468000  -0.8337000     2.141000  
1 1 1 31 37 16 o 3.681000 1.030000  3.351000 1.387000  4.011000 1.524000  -0.6597000     2.061000  
1 1 1 31 37 18 o 4.970000 0.9481000 3.783000 1.345000  6.157000 1.336000  -2.374000      1.896000  
1 1 1 31 37 20 o 3.508000 1.011000  3.403000 1.400000  3.612000 1.458000  -0.2092000     2.021000  
1 1 1 31 37 22 o 5.027000 1.092000  5.159000 1.621000  4.895000 1.463000  0.2642000      2.184000  
1 1 1 31 37 24 o 7.131000 0.9069000 5.793000 1.477000  8.470000 1.052000  -2.678000      1.814000  
1 1 1 31 37 26 o 4.736000 0.9475000 3.557000 1.427000  5.916000 1.247000  -2.358000      1.895000  
1 1 1 31 37 28 o 4.114000 1.006000  4.654000 1.397000  3.574000 1.447000  1.080000       2.012000  
1 1 1 31 37 30 o 2.987000 0.9020000 2.545000 1.170000  3.429000 1.374000  -0.8837000     1.804000  
1 1 1 31 37 32 o 4.090000 1.108000  3.753000 1.607000  4.426000 1.525000  -0.6736000     2.215000  
1 1 1 31 38 1  o 6.697000 0.4878000 8.098000 0.6406000 5.295000 0.7359000 2.803000       0.9757000 
1 1 1 31 38 3  o 4.545000 0.9723000 4.971000 1.106000  4.119000 1.599000  0.8519000      1.945000  
1 1 1 31 38 5  o 5.372000 0.9127000 5.392000 0.9337000 5.352000 1.568000  0.4038000E-01  1.825000  
1 1 1 31 38 7  o 9.097000 0.5873000 8.544000 0.8379000 9.651000 0.8232000 -1.107000      1.175000  
1 1 1 31 38 9  o 10.53000 0.6607000 10.52000 0.8548000 10.54000 1.008000  -0.2268000E-01 1.321000  
1 1 1 31 38 11 o 5.759000 0.9979000 5.549000 1.499000  5.968000 1.318000  -0.4186000     1.996000  
1 1 1 31 38 13 o 7.987000 0.7468000 8.295000 0.9085000 7.680000 1.186000  0.6150000      1.494000  
1 1 1 31 38 15 o 6.468000 0.8451000 6.428000 1.156000  6.508000 1.234000  -0.7976000E-01 1.690000  
1 1 1 31 38 17 o 2.974000 0.9021000 2.670000 1.175000  3.278000 1.369000  -0.6081000     1.804000  
1 1 1 31 38 19 o 3.197000 0.9427000 3.659000 1.415000  2.734000 1.246000  0.9251000      1.885000  
1 1 1 31 38 21 o 7.697000 0.7182000 7.466000 0.9979000 7.929000 1.033000  -0.4627000     1.436000  
1 1 1 31 38 23 f 7.037000 0.8505000 6.758000 1.224000  7.317000 1.181000  -0.5583000     1.701000  
1 1 1 31 38 25 o 5.142000 1.025000  4.552000 1.499000  5.732000 1.399000  -1.180000      2.050000  
1 1 1 31 38 27 o 3.067000 0.9364000 2.978000 1.285000  3.157000 1.363000  -0.1798000     1.873000  
1 1 1 31 38 29 o 5.362000 1.002000  5.794000 1.340000  4.930000 1.490000  0.8634000      2.004000  
1 1 1 31 38 31 o 4.353000 1.955000  ?        ?         4.353000 1.955000  ?              ?         
1 1 1 31 39 0  o 3.759000 1.651000  3.759000 1.651000  3.759000 1.651000  0.000000       0.000000  
1 1 1 31 39 2  o 8.432000 1.119000  8.874000 1.337000  7.989000 1.795000  0.8852000      2.238000  
1 1 1 31 39 4  o 10.86000 0.6896000 10.88000 0.5562000 10.84000 1.262000  0.4280000E-01  1.379000  
1 1 1 31 39 6  o 10.78000 0.6201000 9.972000 0.5907000 11.59000 1.091000  -1.621000      1.240000  
1 1 1 31 39 8  o 6.573000 1.085000  7.291000 0.8369000 5.854000 2.002000  1.437000       2.170000  
1 1 1 31 39 10 o 12.93000 0.5091000 12.79000 0.6219000 13.07000 0.8063000 -0.2850000     1.018000  
1 1 1 31 39 12 o 14.58000 0.5067000 15.45000 0.7495000 13.71000 0.6822000 1.747000       1.013000  
1 1 1 31 39 14 o 8.200000 0.6756000 8.787000 0.8534000 7.614000 1.048000  1.173000       1.351000  
1 1 1 31 39 16 o 5.949000 0.9240000 5.977000 1.273000  5.921000 1.340000  0.5656000E-01  1.848000  
1 1 1 31 39 18 o 3.707000 1.022000  3.236000 1.366000  4.177000 1.520000  -0.9407000     2.044000  
1 1 1 31 39 20 o 4.758000 1.029000  5.833000 1.323000  3.684000 1.576000  2.149000       2.058000  
1 1 1 31 39 22 o 5.224000 1.018000  5.385000 1.499000  5.064000 1.377000  0.3212000      2.036000  
1 1 1 31 39 24 o 6.477000 0.9243000 6.259000 1.259000  6.694000 1.353000  -0.4343000     1.849000  
1 1 1 31 39 26 o 4.119000 1.025000  3.232000 1.362000  5.006000 1.534000  -1.773000      2.051000  
1 1 1 31 39 28 o 3.710000 1.025000  4.183000 1.530000  3.238000 1.365000  0.9449000      2.051000  
1 1 1 31 40 1  o 3.228000 0.9931000 3.288000 1.378000  3.169000 1.431000  0.1193000      1.986000  
1 1 1 31 40 3  o 10.62000 0.7129000 11.04000 0.9092000 10.21000 1.098000  0.8312000      1.426000  
1 1 1 31 40 5  o 6.658000 0.8342000 6.818000 0.7349000 6.497000 1.498000  0.3205000      1.668000  
1 1 1 31 40 7  o 9.389000 0.6747000 9.025000 0.6197000 9.754000 1.199000  -0.7290000     1.349000  
1 1 1 31 40 9  o 7.645000 0.8388000 7.408000 0.9628000 7.883000 1.374000  -0.4751000     1.678000  
1 1 1 31 40 11 o 6.820000 0.9776000 8.281000 0.8474000 5.359000 1.762000  2.922000       1.955000  
1 1 1 31 40 13 o 9.506000 0.5915000 9.554000 0.8065000 9.457000 0.8653000 0.9714000E-01  1.183000  
1 1 1 31 40 15 o 4.809000 0.9840000 4.374000 1.356000  5.244000 1.426000  -0.8706000     1.968000  
1 1 1 31 40 17 o 8.581000 0.6827000 9.378000 0.8650000 7.784000 1.056000  1.595000       1.365000  
1 1 1 31 40 19 o 4.095000 1.046000  4.557000 1.535000  3.633000 1.422000  0.9239000      2.092000  
1 1 1 31 40 21 o 8.985000 0.6793000 8.578000 0.9779000 9.392000 0.9432000 -0.8145000     1.359000  
1 1 1 31 40 23 o 6.043000 0.9098000 4.714000 1.387000  7.371000 1.177000  -2.657000      1.820000  
1 1 1 31 40 25 o 4.010000 1.021000  3.288000 1.369000  4.733000 1.516000  -1.445000      2.043000  
1 1 1 31 40 27 o 3.981000 1.108000  3.727000 1.499000  4.235000 1.632000  -0.5086000     2.216000  
1 1 1 31 41 0  o 4.006000 1.536000  4.006000 1.536000  4.006000 1.536000  0.000000       0.000000  
1 1 1 31 41 2  o 4.486000 1.081000  5.139000 1.474000  3.832000 1.583000  1.308000       2.163000  
1 1 1 31 41 4  o 9.236000 0.6407000 8.894000 0.7491000 9.578000 1.040000  -0.6840000     1.281000  
1 1 1 31 41 6  o 5.216000 0.9693000 4.809000 1.063000  5.622000 1.621000  -0.8127000     1.939000  
1 1 1 31 41 8  o 7.070000 0.9119000 6.878000 0.9660000 7.263000 1.547000  -0.3850000     1.824000  
1 1 1 31 41 10 o 6.548000 0.8232000 6.627000 0.8602000 6.469000 1.404000  0.1585000      1.646000  
1 1 1 31 41 12 o 5.953000 1.042000  5.746000 1.185000  6.161000 1.715000  -0.4143000     2.085000  
1 1 1 31 41 14 o 5.262000 0.9414000 5.197000 1.397000  5.327000 1.263000  -0.1300000     1.883000  
1 1 1 31 41 16 o 3.484000 0.9849000 3.631000 1.370000  3.338000 1.415000  0.2933000      1.970000  
1 1 1 31 41 18 o 4.205000 0.9980000 4.788000 1.449000  3.622000 1.373000  1.166000       1.996000  
1 1 1 31 41 20 o 5.183000 1.056000  4.611000 1.515000  5.755000 1.472000  -1.144000      2.112000  
1 1 1 31 41 22 o 4.256000 1.073000  4.062000 1.526000  4.451000 1.509000  -0.3891000     2.146000  
1 1 1 31 41 24 o 3.317000 0.9468000 3.064000 1.308000  3.569000 1.369000  -0.5054000     1.894000  
1 1 1 31 42 1  o 3.754000 1.097000  3.708000 1.500000  3.800000 1.603000  -0.9154000E-01 2.195000  
1 1 1 31 42 3  o 3.088000 0.9579000 2.801000 1.276000  3.376000 1.429000  -0.5749000     1.916000  
1 1 1 31 42 5  o 3.147000 0.9775000 3.410000 1.451000  2.883000 1.310000  0.5267000      1.955000  
1 1 1 31 42 7  f 2.757000 0.8984000 2.311000 1.070000  3.204000 1.444000  -0.8931000     1.797000  
1 1 1 31 42 9  o 7.139000 0.9730000 6.599000 1.054000  7.680000 1.635000  -1.081000      1.946000  
1 1 1 31 42 11 o 7.996000 0.7646000 7.305000 0.7639000 8.687000 1.325000  -1.382000      1.529000  
1 1 1 31 42 13 o 7.737000 0.7256000 7.571000 0.7928000 7.903000 1.216000  -0.3324000     1.451000  
1 1 1 31 42 15 o 4.802000 0.9331000 6.077000 1.033000  3.527000 1.554000  2.550000       1.866000  
1 1 1 31 42 17 o 3.569000 1.007000  3.551000 1.446000  3.586000 1.403000  -0.3491000E-01 2.015000  
1 1 1 31 42 19 o 3.674000 0.9287000 4.511000 1.391000  2.837000 1.231000  1.674000       1.857000  
1 1 1 31 42 21 o 4.630000 1.024000  4.536000 1.445000  4.723000 1.452000  -0.1862000     2.049000  
1 1 1 31 42 23 o 4.244000 1.051000  5.039000 1.504000  3.449000 1.470000  1.590000       2.102000  
1 1 1 31 43 0  o 3.413000 1.463000  3.413000 1.463000  3.413000 1.463000  0.000000       0.000000  
1 1 1 31 43 2  f 7.424000 1.000000  8.835000 1.136000  6.012000 1.646000  2.823000       2.000000  
1 1 1 31 43 4  o 6.929000 0.9986000 7.636000 1.407000  6.221000 1.417000  1.415000       1.997000  
1 1 1 31 43 6  o 6.816000 1.194000  8.324000 1.316000  5.308000 1.991000  3.016000       2.387000  
1 1 1 31 43 8  o 7.700000 0.9164000 8.085000 0.8557000 7.316000 1.621000  0.7698000      1.833000  
1 1 1 31 43 10 o 2.958000 0.8909000 3.455000 1.327000  2.461000 1.189000  0.9946000      1.782000  
1 1 1 31 43 12 o 3.129000 0.9756000 2.751000 1.208000  3.507000 1.533000  -0.7558000     1.951000  
1 1 1 31 43 14 o 3.846000 0.9995000 3.777000 1.256000  3.915000 1.555000  -0.1385000     1.999000  
1 1 1 31 43 16 o 3.043000 0.9497000 2.487000 1.112000  3.599000 1.540000  -1.112000      1.899000  
1 1 1 31 43 18 o 4.182000 1.024000  4.424000 1.252000  3.939000 1.620000  0.4851000      2.047000  
1 1 1 31 43 20 o 3.391000 0.9831000 2.704000 1.199000  4.079000 1.558000  -1.375000      1.966000  
1 1 1 31 44 1  o 5.435000 1.121000  6.597000 1.511000  4.273000 1.657000  2.324000       2.243000  
1 1 1 31 44 3  o 4.322000 1.063000  4.854000 1.515000  3.789000 1.491000  1.065000       2.126000  
1 1 1 31 44 5  o 7.968000 1.067000  8.914000 1.364000  7.023000 1.642000  1.892000       2.135000  
1 1 1 31 44 7  o 4.531000 1.203000  4.786000 1.747000  4.275000 1.654000  0.5113000      2.405000  
1 1 1 31 44 9  o 3.064000 0.9764000 2.900000 1.308000  3.228000 1.450000  -0.3273000     1.953000  
1 1 1 31 44 11 o 2.847000 0.9064000 2.923000 1.255000  2.771000 1.308000  0.1521000      1.813000  
1 1 1 31 44 13 o 5.063000 1.032000  3.721000 1.262000  6.405000 1.632000  -2.684000      2.063000  
1 1 1 31 44 15 o 4.052000 1.026000  2.840000 1.169000  5.265000 1.686000  -2.425000      2.051000  
1 1 1 31 44 17 o 4.685000 1.104000  3.543000 1.266000  5.826000 1.810000  -2.282000      2.209000  
1 1 1 31 44 19 o 5.452000 1.203000  6.345000 1.573000  4.560000 1.820000  1.785000       2.406000  
1 1 1 31 45 0  o 10.83000 1.055000  10.83000 1.055000  10.83000 1.055000  0.000000       0.000000  
1 1 1 31 45 2  f 9.186000 0.8268000 9.975000 1.085000  8.397000 1.248000  1.578000       1.654000  
1 1 1 31 45 4  o 3.753000 1.085000  4.218000 1.621000  3.287000 1.444000  0.9305000      2.171000  
1 1 1 31 45 6  o 4.600000 1.132000  5.771000 1.662000  3.428000 1.537000  2.343000       2.264000  
1 1 1 31 45 8  o 7.002000 1.094000  5.832000 1.733000  8.173000 1.337000  -2.341000      2.189000  
1 1 1 31 45 10 o 4.070000 1.159000  3.984000 1.584000  4.155000 1.693000  -0.1714000     2.319000  
1 1 1 31 45 12 o 6.107000 1.139000  6.322000 1.614000  5.892000 1.608000  0.4303000      2.278000  
1 1 1 31 45 14 o 9.449000 0.9604000 9.451000 1.340000  9.447000 1.376000  0.4339000E-02  1.921000  
1 1 1 31 45 16 o 5.677000 1.472000  5.949000 2.127000  5.404000 2.036000  0.5453000      2.944000  
1 1 1 31 46 1  o 7.174000 1.175000  7.871000 1.562000  6.476000 1.755000  1.396000       2.349000  
1 1 1 31 46 3  o 5.157000 1.092000  5.054000 1.552000  5.260000 1.537000  -0.2065000     2.184000  
1 1 1 31 46 5  o 6.708000 1.212000  7.529000 1.625000  5.886000 1.799000  1.643000       2.424000  
1 1 1 31 46 7  o 5.340000 1.169000  5.236000 1.723000  5.445000 1.582000  -0.2090000     2.339000  
1 1 1 31 46 9  o 5.166000 1.230000  5.482000 1.617000  4.851000 1.853000  0.6308000      2.459000  
1 1 1 31 46 11 o 4.036000 1.200000  4.202000 1.651000  3.871000 1.741000  0.3313000      2.400000  
1 1 1 31 47 0  f 3.705000 1.569000  3.705000 1.569000  3.705000 1.569000  0.000000       0.000000  
1 1 1 31 47 2  o 4.118000 1.141000  4.402000 1.674000  3.833000 1.550000  0.5684000      2.282000  
1 1 1 31 47 4  o 4.294000 1.120000  4.756000 1.606000  3.832000 1.562000  0.9241000      2.240000  
1 1 1 31 47 6  o 6.679000 1.535000  8.467000 2.261000  4.890000 2.076000  3.576000       3.069000  
1 1 1 32 0  0  o 19.74000 0.6650000 19.74000 0.6650000 19.74000 0.6650000 0.000000       0.000000  
1 1 1 32 0  2  o 36.27000 0.4782000 36.27000 0.4782000 36.27000 0.4782000 0.000000       0.000000  
1 1 1 32 0  4  o 25.08000 0.4379000 25.08000 0.4379000 25.08000 0.4379000 0.000000       0.000000  
1 1 1 32 0  6  o 11.93000 0.6727000 11.93000 0.6727000 11.93000 0.6727000 0.000000       0.000000  
1 1 1 32 0  8  o 34.89000 0.4666000 34.89000 0.4666000 34.89000 0.4666000 0.000000       0.000000  
1 1 1 32 0  10 o 33.26000 0.4558000 33.26000 0.4558000 33.26000 0.4558000 0.000000       0.000000  
1 1 1 32 0  12 o 31.85000 0.5025000 31.85000 0.5025000 31.85000 0.5025000 0.000000       0.000000  
1 1 1 32 0  14 f 7.817000 0.8254000 7.817000 0.8254000 7.817000 0.8254000 0.000000       0.000000  
1 1 1 32 0  16 o 19.67000 0.4459000 19.67000 0.4459000 19.67000 0.4459000 0.000000       0.000000  
1 1 1 32 0  18 o 7.919000 0.8665000 7.919000 0.8665000 7.919000 0.8665000 0.000000       0.000000  
1 1 1 32 0  20 o 4.563000 1.281000  4.563000 1.281000  4.563000 1.281000  0.000000       0.000000  
1 1 1 32 0  22 o 17.16000 0.4836000 17.16000 0.4836000 17.16000 0.4836000 0.000000       0.000000  
1 1 1 32 0  24 o 3.352000 1.278000  3.352000 1.278000  3.352000 1.278000  0.000000       0.000000  
1 1 1 32 0  26 o 9.170000 0.9423000 9.170000 0.9423000 9.170000 0.9423000 0.000000       0.000000  
1 1 1 32 0  28 o 13.46000 0.5579000 13.46000 0.5579000 13.46000 0.5579000 0.000000       0.000000  
1 1 1 32 0  30 o 3.189000 1.309000  3.189000 1.309000  3.189000 1.309000  0.000000       0.000000  
1 1 1 32 0  32 o 5.384000 1.310000  5.384000 1.310000  5.384000 1.310000  0.000000       0.000000  
1 1 1 32 0  34 o 4.363000 1.223000  4.363000 1.223000  4.363000 1.223000  0.000000       0.000000  
1 1 1 32 0  36 o 2.612000 1.130000  2.612000 1.130000  2.612000 1.130000  0.000000       0.000000  
1 1 1 32 0  38 o 8.201000 1.321000  8.201000 1.321000  8.201000 1.321000  0.000000       0.000000  
1 1 1 32 0  40 o 2.486000 1.149000  2.486000 1.149000  2.486000 1.149000  0.000000       0.000000  
1 1 1 32 0  42 o 17.91000 0.5677000 17.91000 0.5677000 17.91000 0.5677000 0.000000       0.000000  
1 1 1 32 0  44 o 3.234000 1.367000  3.234000 1.367000  3.234000 1.367000  0.000000       0.000000  
1 1 1 32 0  46 o 5.855000 1.483000  5.855000 1.483000  5.855000 1.483000  0.000000       0.000000  
1 1 1 32 0  48 o 2.390000 1.127000  2.390000 1.127000  2.390000 1.127000  0.000000       0.000000  
1 1 1 32 0  50 o 4.159000 1.745000  4.159000 1.745000  4.159000 1.745000  0.000000       0.000000  
1 1 1 32 1  1  o 40.71000 0.3486000 40.27000 0.4898000 41.14000 0.4961000 -0.8664000     0.6971000 
1 1 1 32 1  3  o 9.169000 0.5343000 8.447000 0.7913000 9.892000 0.7183000 -1.445000      1.069000  
1 1 1 32 1  5  o 17.74000 0.3680000 17.17000 0.5408000 18.31000 0.4991000 -1.136000      0.7359000 
1 1 1 32 1  7  o 27.28000 0.3337000 27.08000 0.4332000 27.48000 0.5077000 -0.4017000     0.6674000 
1 1 1 32 1  9  o 18.85000 0.3313000 19.04000 0.4639000 18.66000 0.4731000 0.3828000      0.6626000 
1 1 1 32 1  11 o 24.61000 0.3223000 24.69000 0.4337000 24.54000 0.4769000 0.1481000      0.6446000 
1 1 1 32 1  13 o 13.92000 0.3961000 14.04000 0.5993000 13.80000 0.5182000 0.2442000      0.7923000 
1 1 1 32 1  15 o 9.224000 0.5057000 9.377000 0.6901000 9.071000 0.7394000 0.3065000      1.011000  
1 1 1 32 1  17 o 13.41000 0.3862000 13.64000 0.5398000 13.18000 0.5525000 0.4614000      0.7724000 
1 1 1 32 1  19 o 39.44000 0.3439000 39.60000 0.4893000 39.29000 0.4833000 0.3153000      0.6877000 
1 1 1 32 1  21 o 12.60000 0.4072000 13.53000 0.5595000 11.68000 0.5919000 1.850000       0.8145000 
1 1 1 32 1  23 o 3.846000 0.9778000 3.987000 1.347000  3.705000 1.418000  0.2814000      1.956000  
1 1 1 32 1  25 o 6.026000 0.8876000 6.825000 1.051000  5.227000 1.430000  1.598000       1.775000  
1 1 1 32 1  27 f 8.244000 0.7247000 8.748000 1.104000  7.740000 0.9387000 1.008000       1.449000  
1 1 1 32 1  29 o 16.30000 0.3890000 16.19000 0.6056000 16.42000 0.4883000 -0.2261000     0.7779000 
1 1 1 32 1  31 f 13.00000 0.4749000 12.39000 0.7750000 13.60000 0.5492000 -1.205000      0.9499000 
1 1 1 32 1  33 o 5.183000 0.8696000 5.585000 1.074000  4.782000 1.368000  0.8032000      1.739000  
1 1 1 32 1  35 o 12.76000 0.3941000 13.53000 0.5535000 11.99000 0.5612000 1.535000       0.7882000 
1 1 1 32 1  37 f 12.35000 0.4479000 12.46000 0.6075000 12.25000 0.6582000 0.2122000      0.8958000 
1 1 1 32 1  39 o 11.56000 0.5891000 11.17000 0.6587000 11.95000 0.9769000 -0.7802000     1.178000  
1 1 1 32 1  41 o 4.703000 1.003000  3.695000 1.448000  5.710000 1.387000  -2.015000      2.005000  
1 1 1 32 1  43 o 5.088000 1.061000  5.768000 1.438000  4.407000 1.561000  1.361000       2.123000  
1 1 1 32 1  45 o 10.76000 0.5907000 10.46000 0.7612000 11.06000 0.9035000 -0.6039000     1.181000  
1 1 1 32 1  47 o 4.017000 1.116000  4.278000 1.680000  3.755000 1.470000  0.5230000      2.232000  
1 1 1 32 1  49 o 3.528000 0.9643000 4.190000 1.454000  2.865000 1.266000  1.325000       1.929000  
1 1 1 32 2  0  o 10.70000 0.7005000 10.70000 0.7005000 10.70000 0.7005000 0.000000       0.000000  
1 1 1 32 2  2  f 39.38000 0.3721000 39.70000 0.5698000 39.06000 0.4788000 0.6469000      0.7443000 
1 1 1 32 2  4  o 22.41000 0.3468000 22.51000 0.5249000 22.31000 0.4535000 0.1985000      0.6937000 
1 1 1 32 2  6  o 18.36000 0.3245000 18.72000 0.4460000 18.00000 0.4715000 0.7224000      0.6490000 
1 1 1 32 2  8  o 23.56000 0.3613000 23.24000 0.5091000 23.87000 0.5129000 -0.6307000     0.7227000 
1 1 1 32 2  10 o 6.951000 0.7224000 6.404000 1.094000  7.499000 0.9435000 -1.095000      1.445000  
1 1 1 32 2  12 o 33.24000 0.3177000 32.95000 0.4484000 33.53000 0.4502000 -0.5750000     0.6354000 
1 1 1 32 2  14 o 11.04000 0.4478000 11.50000 0.6376000 10.58000 0.6290000 0.9240000      0.8956000 
1 1 1 32 2  16 o 12.97000 0.3870000 12.93000 0.5410000 13.02000 0.5537000 -0.9248000E-01 0.7741000 
1 1 1 32 2  18 o 31.11000 0.3135000 30.99000 0.4445000 31.24000 0.4421000 -0.2454000     0.6269000 
1 1 1 32 2  20 o 14.55000 0.4142000 14.85000 0.5246000 14.24000 0.6411000 0.6109000      0.8284000 
1 1 1 32 2  22 o 7.130000 0.7356000 7.495000 0.9105000 6.765000 1.156000  0.7299000      1.471000  
1 1 1 32 2  24 o 13.05000 0.4056000 13.25000 0.5633000 12.84000 0.5838000 0.4056000      0.8112000 
1 1 1 32 2  26 o 7.344000 0.6770000 7.108000 1.093000  7.581000 0.7995000 -0.4728000     1.354000  
1 1 1 32 2  28 o 8.990000 0.5877000 10.00000 0.8212000 7.975000 0.8410000 2.029000       1.175000  
1 1 1 32 2  30 o 8.364000 0.8328000 7.691000 1.483000  9.036000 0.7580000 -1.345000      1.666000  
1 1 1 32 2  32 o 3.474000 0.8377000 2.499000 1.136000  4.450000 1.231000  -1.951000      1.675000  
1 1 1 32 2  34 o 6.764000 0.6438000 6.522000 0.9923000 7.006000 0.8203000 -0.4838000     1.288000  
1 1 1 32 2  36 o 2.957000 0.8616000 3.556000 1.322000  2.358000 1.105000  1.198000       1.723000  
1 1 1 32 2  38 f 5.305000 0.8566000 5.099000 1.269000  5.510000 1.151000  -0.4113000     1.713000  
1 1 1 32 2  40 f 3.831000 0.9855000 3.799000 1.457000  3.863000 1.327000  -0.6419000E-01 1.971000  
1 1 1 32 2  42 o 9.602000 0.6155000 10.81000 0.7762000 8.395000 0.9554000 2.414000       1.231000  
1 1 1 32 2  44 o 13.67000 0.5862000 13.03000 0.7372000 14.31000 0.9117000 -1.277000      1.172000  
1 1 1 32 2  46 o 6.271000 0.8672000 6.437000 1.209000  6.105000 1.244000  0.3315000      1.734000  
1 1 1 32 2  48 o 4.170000 1.046000  4.004000 1.546000  4.335000 1.409000  -0.3314000     2.091000  
1 1 1 32 2  50 o 7.789000 1.203000  9.552000 1.497000  6.026000 1.885000  3.526000       2.407000  
1 1 1 32 3  1  o 29.46000 0.3619000 29.49000 0.5196000 29.42000 0.5039000 0.7579000E-01  0.7238000 
1 1 1 32 3  3  o 12.02000 0.4626000 12.54000 0.6089000 11.49000 0.6965000 1.050000       0.9251000 
1 1 1 32 3  5  o 7.441000 0.6228000 7.163000 0.9237000 7.719000 0.8355000 -0.5560000     1.246000  
1 1 1 32 3  7  o 14.99000 0.3675000 15.18000 0.5103000 14.80000 0.5290000 0.3815000      0.7350000 
1 1 1 32 3  9  o 15.19000 0.4302000 15.47000 0.5019000 14.92000 0.6988000 0.5458000      0.8604000 
1 1 1 32 3  11 o 11.72000 0.4028000 11.83000 0.5713000 11.61000 0.5680000 0.2124000      0.8056000 
1 1 1 32 3  13 o 7.121000 0.6382000 6.729000 0.9384000 7.514000 0.8652000 -0.7844000     1.276000  
1 1 1 32 3  15 o 26.10000 0.3241000 25.90000 0.4864000 26.30000 0.4284000 -0.4038000     0.6482000 
1 1 1 32 3  17 o 8.228000 0.6358000 9.029000 0.7242000 7.427000 1.045000  1.602000       1.272000  
1 1 1 32 3  19 o 20.36000 0.3445000 19.71000 0.4513000 21.00000 0.5207000 -1.290000      0.6890000 
1 1 1 32 3  21 o 26.91000 0.3382000 26.66000 0.4423000 27.17000 0.5118000 -0.5101000     0.6764000 
1 1 1 32 3  23 o 25.63000 0.3137000 25.40000 0.4370000 25.85000 0.4503000 -0.4470000     0.6275000 
1 1 1 32 3  25 o 18.98000 0.3578000 18.38000 0.5492000 19.58000 0.4589000 -1.195000      0.7156000 
1 1 1 32 3  27 o 6.694000 0.6819000 6.713000 1.029000  6.675000 0.8946000 0.3818000E-01  1.364000  
1 1 1 32 3  29 o 18.20000 0.3488000 18.72000 0.4771000 17.69000 0.5090000 1.030000       0.6977000 
1 1 1 32 3  31 f 8.288000 0.7112000 8.652000 1.189000  7.924000 0.7812000 0.7280000      1.422000  
1 1 1 32 3  33 o 15.37000 0.4114000 14.93000 0.6108000 15.80000 0.5514000 -0.8617000     0.8229000 
1 1 1 32 3  35 o 11.44000 0.4591000 11.89000 0.5460000 10.98000 0.7381000 0.9099000      0.9181000 
1 1 1 32 3  37 o 3.876000 0.8758000 4.899000 1.247000  2.852000 1.230000  2.047000       1.752000  
1 1 1 32 3  39 o 12.25000 0.4394000 11.99000 0.6446000 12.50000 0.5972000 -0.5100000     0.8787000 
1 1 1 32 3  41 o 7.853000 0.7709000 7.296000 1.092000  8.410000 1.088000  -1.114000      1.542000  
1 1 1 32 3  43 o 3.516000 1.003000  3.137000 1.328000  3.896000 1.504000  -0.7586000     2.007000  
1 1 1 32 3  45 o 6.616000 0.8363000 5.913000 1.250000  7.319000 1.111000  -1.406000      1.673000  
1 1 1 32 3  47 f 9.363000 0.6176000 9.085000 0.8841000 9.641000 0.8627000 -0.5556000     1.235000  
1 1 1 32 3  49 o 4.721000 1.058000  5.147000 1.553000  4.296000 1.439000  0.8509000      2.117000  
1 1 1 32 4  0  o 58.38000 0.6201000 58.38000 0.6201000 58.38000 0.6201000 0.000000       0.000000  
1 1 1 32 4  2  o 31.40000 0.3426000 31.13000 0.4419000 31.67000 0.5237000 -0.5441000     0.6852000 
1 1 1 32 4  4  o 28.70000 0.3342000 28.79000 0.4328000 28.62000 0.5092000 0.1717000      0.6683000 
1 1 1 32 4  6  o 30.46000 0.3798000 30.36000 0.4361000 30.55000 0.6220000 -0.1917000     0.7597000 
1 1 1 32 4  8  o 42.30000 0.5530000 41.77000 0.5018000 42.84000 0.9855000 -1.065000      1.106000  
1 1 1 32 4  10 o 23.30000 0.3908000 23.49000 0.4395000 23.12000 0.6464000 0.3666000      0.7817000 
1 1 1 32 4  12 o 4.678000 0.9578000 4.873000 1.267000  4.483000 1.437000  0.3904000      1.916000  
1 1 1 32 4  14 o 21.85000 0.3409000 21.67000 0.4368000 22.03000 0.5234000 -0.3670000     0.6818000 
1 1 1 32 4  16 f 14.00000 0.4311000 14.12000 0.5672000 13.87000 0.6492000 0.2535000      0.8621000 
1 1 1 32 4  18 o 11.15000 0.4299000 11.62000 0.5957000 10.68000 0.6201000 0.9402000      0.8599000 
1 1 1 32 4  20 o 10.77000 0.4576000 11.29000 0.6253000 10.25000 0.6682000 1.047000       0.9151000 
1 1 1 32 4  22 o 19.01000 0.3258000 18.67000 0.4560000 19.36000 0.4653000 -0.6933000     0.6515000 
1 1 1 32 4  24 o 31.50000 0.3482000 30.66000 0.5270000 32.35000 0.4552000 -1.690000      0.6963000 
1 1 1 32 4  26 o 12.07000 0.4624000 11.71000 0.7346000 12.43000 0.5617000 -0.7171000     0.9248000 
1 1 1 32 4  28 o 16.82000 0.4001000 17.14000 0.4770000 16.50000 0.6425000 0.6414000      0.8002000 
1 1 1 32 4  30 o 8.849000 0.5156000 9.232000 0.7045000 8.466000 0.7530000 0.7662000      1.031000  
1 1 1 32 4  32 o 4.955000 0.9209000 3.962000 1.555000  5.949000 0.9876000 -1.987000      1.842000  
1 1 1 32 4  34 o 9.233000 0.5841000 9.660000 0.8021000 8.805000 0.8492000 0.8549000      1.168000  
1 1 1 32 4  36 o 6.394000 0.7362000 5.854000 1.006000  6.934000 1.076000  -1.080000      1.472000  
1 1 1 32 4  38 o 14.73000 0.4642000 14.38000 0.6009000 15.08000 0.7077000 -0.6920000     0.9285000 
1 1 1 32 4  40 o 2.797000 0.8745000 2.865000 1.282000  2.729000 1.190000  0.1361000      1.749000  
1 1 1 32 4  42 o 3.401000 1.081000  2.771000 1.238000  4.031000 1.772000  -1.260000      2.162000  
1 1 1 32 4  44 o 5.065000 1.083000  4.676000 1.477000  5.453000 1.584000  -0.7775000     2.166000  
1 1 1 32 4  46 o 6.297000 0.8633000 6.244000 1.235000  6.350000 1.207000  -0.1062000     1.727000  
1 1 1 32 4  48 f 5.911000 0.9003000 6.510000 1.238000  5.313000 1.307000  1.198000       1.801000  
1 1 1 32 5  1  o 18.32000 0.3379000 18.00000 0.4805000 18.64000 0.4752000 -0.6352000     0.6758000 
1 1 1 32 5  3  o 27.90000 0.3094000 27.67000 0.4347000 28.12000 0.4404000 -0.4526000     0.6188000 
1 1 1 32 5  5  o 48.55000 0.4692000 48.08000 0.5396000 49.02000 0.7678000 -0.9409000     0.9385000 
1 1 1 32 5  7  o 42.79000 0.4326000 42.88000 0.5040000 42.70000 0.7033000 0.1872000      0.8652000 
1 1 1 32 5  9  o 23.55000 0.3288000 23.27000 0.4292000 23.84000 0.4983000 -0.5759000     0.6577000 
1 1 1 32 5  11 o 10.14000 0.5715000 10.38000 0.6592000 9.887000 0.9336000 0.4976000      1.143000  
1 1 1 32 5  13 o 6.773000 0.6841000 6.923000 0.9099000 6.623000 1.022000  0.2997000      1.368000  
1 1 1 32 5  15 o 28.48000 0.3086000 27.93000 0.4341000 29.04000 0.4387000 -1.104000      0.6171000 
1 1 1 32 5  17 o 17.62000 0.3288000 17.47000 0.4609000 17.78000 0.4692000 -0.3038000     0.6577000 
1 1 1 32 5  19 o 33.40000 0.3207000 33.03000 0.4459000 33.77000 0.4611000 -0.7377000     0.6414000 
1 1 1 32 5  21 o 17.71000 0.3313000 17.87000 0.4568000 17.54000 0.4798000 0.3309000      0.6625000 
1 1 1 32 5  23 o 23.63000 0.3456000 22.90000 0.5153000 24.35000 0.4608000 -1.453000      0.6912000 
1 1 1 32 5  25 o 10.06000 0.5240000 8.890000 0.8714000 11.23000 0.5823000 -2.337000      1.048000  
1 1 1 32 5  27 o 7.598000 0.6157000 7.104000 0.9629000 8.092000 0.7677000 -0.9881000     1.231000  
1 1 1 32 5  29 o 8.668000 0.5462000 8.570000 0.7204000 8.766000 0.8212000 -0.1961000     1.092000  
1 1 1 32 5  31 o 15.15000 0.3602000 14.59000 0.5260000 15.71000 0.4921000 -1.111000      0.7203000 
1 1 1 32 5  33 o 4.092000 0.8961000 4.838000 1.306000  3.347000 1.227000  1.491000       1.792000  
1 1 1 32 5  35 o 3.817000 0.9936000 3.167000 1.323000  4.467000 1.483000  -1.299000      1.987000  
1 1 1 32 5  37 o 5.966000 0.7953000 5.194000 1.110000  6.738000 1.139000  -1.545000      1.591000  
1 1 1 32 5  39 o 4.785000 1.050000  4.887000 1.545000  4.683000 1.423000  0.2039000      2.101000  
1 1 1 32 5  41 o 2.677000 0.8674000 2.461000 1.133000  2.892000 1.313000  -0.4312000     1.735000  
1 1 1 32 5  43 o 9.402000 0.5579000 9.847000 0.7679000 8.958000 0.8095000 0.8890000      1.116000  
1 1 1 32 5  45 o 6.199000 1.017000  7.131000 1.093000  5.268000 1.714000  1.863000       2.033000  
1 1 1 32 5  47 o 9.220000 0.6153000 9.440000 0.8144000 9.001000 0.9225000 0.4393000      1.231000  
1 1 1 32 5  49 o 5.193000 0.9587000 4.805000 1.416000  5.582000 1.293000  -0.7768000     1.917000  
1 1 1 32 6  0  o 7.372000 0.9036000 7.372000 0.9036000 7.372000 0.9036000 0.000000       0.000000  
1 1 1 32 6  2  o 16.95000 0.3462000 16.75000 0.4943000 17.16000 0.4848000 -0.4121000     0.6924000 
1 1 1 32 6  4  o 17.78000 0.3614000 17.29000 0.4686000 18.27000 0.5503000 -0.9817000     0.7228000 
1 1 1 32 6  6  o 20.54000 0.3380000 20.80000 0.4563000 20.27000 0.4987000 0.5231000      0.6760000 
1 1 1 32 6  8  o 15.50000 0.3593000 15.74000 0.5146000 15.27000 0.5016000 0.4658000      0.7187000 
1 1 1 32 6  10 o 15.27000 0.3563000 15.38000 0.4996000 15.16000 0.5082000 0.2159000      0.7127000 
1 1 1 32 6  12 o 25.63000 0.3345000 25.28000 0.4355000 25.99000 0.5079000 -0.7132000     0.6690000 
1 1 1 32 6  14 o 31.03000 0.3130000 31.12000 0.4407000 30.95000 0.4444000 0.1692000      0.6259000 
1 1 1 32 6  16 o 22.70000 0.3293000 23.20000 0.4865000 22.20000 0.4440000 0.9978000      0.6586000 
1 1 1 32 6  18 o 12.66000 0.3798000 13.25000 0.5147000 12.08000 0.5588000 1.167000       0.7597000 
1 1 1 32 6  20 f 16.15000 0.3968000 15.71000 0.5396000 16.60000 0.5819000 -0.8946000     0.7935000 
1 1 1 32 6  22 o 13.62000 0.4145000 14.01000 0.6160000 13.23000 0.5549000 0.7733000      0.8290000 
1 1 1 32 6  24 o 21.81000 0.3835000 21.28000 0.6378000 22.33000 0.4262000 -1.054000      0.7671000 
1 1 1 32 6  26 o 15.45000 0.3895000 15.75000 0.5950000 15.14000 0.5029000 0.6106000      0.7791000 
1 1 1 32 6  28 o 18.32000 0.4154000 18.51000 0.5485000 18.12000 0.6239000 0.3889000      0.8307000 
1 1 1 32 6  30 o 16.68000 0.3385000 16.87000 0.4798000 16.49000 0.4775000 0.3830000      0.6769000 
1 1 1 32 6  32 o 8.460000 0.6084000 8.090000 0.9634000 8.830000 0.7434000 -0.7392000     1.217000  
1 1 1 32 6  34 o 8.736000 0.5420000 8.948000 0.6330000 8.524000 0.8800000 0.4244000      1.084000  
1 1 1 32 6  36 o 13.43000 0.4266000 13.28000 0.6096000 13.58000 0.5970000 -0.3087000     0.8532000 
1 1 1 32 6  38 o 9.450000 0.5298000 9.407000 0.6520000 9.494000 0.8352000 -0.8724000E-01 1.060000  
1 1 1 32 6  40 o 8.938000 0.7360000 8.339000 1.065000  9.537000 1.016000  -1.198000      1.472000  
1 1 1 32 6  42 o 8.125000 0.7833000 8.160000 0.8927000 8.090000 1.287000  0.6940000E-01  1.567000  
1 1 1 32 6  44 o 6.306000 0.8718000 6.133000 1.338000  6.480000 1.118000  -0.3469000     1.744000  
1 1 1 32 6  46 o 8.860000 0.6561000 9.706000 0.7975000 8.014000 1.042000  1.692000       1.312000  
1 1 1 32 6  48 o 5.304000 0.9504000 5.743000 1.302000  4.865000 1.384000  0.8780000      1.901000  
1 1 1 32 7  1  o 21.95000 0.3546000 21.90000 0.5144000 21.99000 0.4882000 -0.9342000E-01 0.7092000 
1 1 1 32 7  3  o 21.02000 0.3367000 20.85000 0.4398000 21.19000 0.5101000 -0.3442000     0.6735000 
1 1 1 32 7  5  f 12.91000 0.4031000 13.07000 0.5854000 12.75000 0.5545000 0.3206000      0.8063000 
1 1 1 32 7  7  o 25.09000 0.3123000 25.47000 0.4439000 24.71000 0.4393000 0.7647000      0.6245000 
1 1 1 32 7  9  o 15.99000 0.3492000 16.08000 0.4856000 15.90000 0.5021000 0.1794000      0.6985000 
1 1 1 32 7  11 o 4.668000 0.9134000 4.314000 1.301000  5.022000 1.283000  -0.7079000     1.827000  
1 1 1 32 7  13 o 29.16000 0.3374000 29.34000 0.4411000 28.98000 0.5106000 0.3650000      0.6748000 
1 1 1 32 7  15 o 21.68000 0.3515000 21.39000 0.4933000 21.97000 0.5008000 -0.5791000     0.7030000 
1 1 1 32 7  17 o 18.17000 0.3735000 18.44000 0.5978000 17.91000 0.4479000 0.5305000      0.7470000 
1 1 1 32 7  19 o 13.94000 0.4044000 13.71000 0.5939000 14.16000 0.5490000 -0.4525000     0.8087000 
1 1 1 32 7  21 o 12.11000 0.4180000 12.20000 0.5654000 12.02000 0.6157000 0.1786000      0.8360000 
1 1 1 32 7  23 f 15.36000 0.4150000 15.11000 0.6677000 15.61000 0.4931000 -0.4966000     0.8301000 
1 1 1 32 7  25 o 9.612000 0.4954000 9.671000 0.7289000 9.553000 0.6711000 0.1175000      0.9908000 
1 1 1 32 7  27 o 17.12000 0.3819000 16.93000 0.5716000 17.32000 0.5065000 -0.3837000     0.7637000 
1 1 1 32 7  29 o 13.73000 0.4421000 13.66000 0.5805000 13.80000 0.6668000 -0.1317000     0.8841000 
1 1 1 32 7  31 o 20.14000 0.3158000 20.06000 0.4496000 20.22000 0.4437000 -0.1536000     0.6317000 
1 1 1 32 7  33 o 6.198000 0.7308000 6.204000 0.9295000 6.193000 1.128000  0.1096000E-01  1.462000  
1 1 1 32 7  35 o 3.935000 0.9033000 4.249000 1.193000  3.621000 1.357000  0.6281000      1.807000  
1 1 1 32 7  37 o 7.717000 0.6979000 7.120000 0.9986000 8.314000 0.9752000 -1.194000      1.396000  
1 1 1 32 7  39 o 11.49000 0.4773000 12.05000 0.6064000 10.92000 0.7373000 1.132000       0.9546000 
1 1 1 32 7  41 o 3.801000 1.040000  3.899000 1.497000  3.703000 1.443000  0.1952000      2.079000  
1 1 1 32 7  43 o 3.553000 0.9661000 3.682000 1.381000  3.424000 1.351000  0.2579000      1.932000  
1 1 1 32 7  45 o 8.131000 0.6749000 8.290000 0.9131000 7.973000 0.9942000 0.3171000      1.350000  
1 1 1 32 7  47 o 2.999000 0.9363000 2.889000 1.264000  3.108000 1.381000  -0.2191000     1.873000  
1 1 1 32 7  49 o 5.204000 0.9138000 5.935000 1.173000  4.473000 1.401000  1.463000       1.828000  
1 1 1 32 8  0  o 8.244000 0.9130000 8.244000 0.9130000 8.244000 0.9130000 0.000000       0.000000  
1 1 1 32 8  2  o 45.08000 0.3971000 45.04000 0.5996000 45.11000 0.5208000 -0.7599000E-01 0.7942000 
1 1 1 32 8  4  o 20.25000 0.3351000 20.63000 0.5031000 19.88000 0.4429000 0.7557000      0.6702000 
1 1 1 32 8  6  o 18.65000 0.3516000 18.70000 0.5175000 18.61000 0.4761000 0.8303000E-01  0.7032000 
1 1 1 32 8  8  o 27.97000 0.3576000 27.96000 0.4910000 27.98000 0.5201000 -0.1963000E-01 0.7153000 
1 1 1 32 8  10 o 18.96000 0.3619000 18.91000 0.5128000 19.01000 0.5107000 -0.1087000     0.7237000 
1 1 1 32 8  12 o 24.99000 0.3521000 25.04000 0.4915000 24.94000 0.5044000 0.9656000E-01  0.7042000 
1 1 1 32 8  14 o 6.894000 0.8261000 6.482000 1.057000  7.306000 1.270000  -0.8241000     1.652000  
1 1 1 32 8  16 o 11.74000 0.4733000 11.77000 0.6444000 11.71000 0.6933000 0.5531000E-01  0.9466000 
1 1 1 32 8  18 o 6.282000 0.8423000 6.326000 1.128000  6.238000 1.251000  0.8867000E-01  1.685000  
1 1 1 32 8  20 f 27.58000 0.3346000 27.35000 0.4918000 27.81000 0.4538000 -0.4661000     0.6692000 
1 1 1 32 8  22 o 23.56000 0.3447000 23.69000 0.5055000 23.43000 0.4687000 0.2623000      0.6893000 
1 1 1 32 8  24 o 29.56000 0.3598000 29.37000 0.5057000 29.75000 0.5119000 -0.3837000     0.7195000 
1 1 1 32 8  26 o 11.97000 0.4730000 11.58000 0.7062000 12.36000 0.6294000 -0.7880000     0.9460000 
1 1 1 32 8  28 o 10.50000 0.4405000 9.977000 0.6568000 11.03000 0.5872000 -1.048000      0.8810000 
1 1 1 32 8  30 o 19.21000 0.3408000 19.45000 0.4455000 18.97000 0.5159000 0.4815000      0.6816000 
1 1 1 32 8  32 o 4.518000 0.8982000 4.759000 1.185000  4.276000 1.350000  0.4828000      1.796000  
1 1 1 32 8  34 o 5.687000 0.7813000 4.373000 1.175000  7.002000 1.031000  -2.629000      1.563000  
1 1 1 32 8  36 o 3.520000 0.8778000 4.050000 1.221000  2.990000 1.262000  1.060000       1.756000  
1 1 1 32 8  38 o 6.342000 0.7284000 6.356000 0.8612000 6.328000 1.175000  0.2811000E-01  1.457000  
1 1 1 32 8  40 o 3.132000 0.8947000 3.195000 1.190000  3.068000 1.337000  0.1271000      1.789000  
1 1 1 32 8  42 o 4.369000 1.012000  4.783000 1.381000  3.956000 1.480000  0.8270000      2.024000  
1 1 1 32 8  44 o 13.37000 0.4832000 12.66000 0.7419000 14.08000 0.6194000 -1.420000      0.9664000 
1 1 1 32 8  46 o 5.900000 0.8987000 5.133000 1.406000  6.668000 1.120000  -1.535000      1.797000  
1 1 1 32 8  48 o 3.563000 0.9458000 3.335000 1.267000  3.791000 1.405000  -0.4561000     1.892000  
1 1 1 32 9  1  o 25.48000 0.3098000 25.64000 0.4400000 25.32000 0.4361000 0.3230000      0.6195000 
1 1 1 32 9  3  f 16.87000 0.3405000 17.39000 0.4787000 16.35000 0.4845000 1.037000       0.6811000 
1 1 1 32 9  5  o 37.83000 0.4178000 38.07000 0.5360000 37.60000 0.6410000 0.4634000      0.8356000 
1 1 1 32 9  7  o 18.08000 0.3878000 17.95000 0.5226000 18.22000 0.5732000 -0.2686000     0.7756000 
1 1 1 32 9  9  o 11.25000 0.5118000 11.30000 0.6576000 11.21000 0.7843000 0.9001000E-01  1.024000  
1 1 1 32 9  11 o 32.45000 0.3613000 32.17000 0.4969000 32.74000 0.5245000 -0.5691000     0.7226000 
1 1 1 32 9  13 o 39.85000 0.3717000 40.43000 0.4902000 39.26000 0.5588000 1.170000       0.7433000 
1 1 1 32 9  15 o 6.411000 0.6767000 6.392000 0.9153000 6.431000 0.9971000 -0.3945000E-01 1.353000  
1 1 1 32 9  17 o 9.950000 0.5144000 10.14000 0.6286000 9.757000 0.8144000 0.3852000      1.029000  
1 1 1 32 9  19 o 22.74000 0.3350000 22.94000 0.4265000 22.55000 0.5168000 0.3914000      0.6701000 
1 1 1 32 9  21 f 11.03000 0.5043000 11.28000 0.6829000 10.78000 0.7422000 0.4949000      1.009000  
1 1 1 32 9  23 o 7.342000 0.9275000 7.372000 1.405000  7.313000 1.211000  0.5904000E-01  1.855000  
1 1 1 32 9  25 o 13.08000 0.3727000 12.78000 0.5474000 13.39000 0.5061000 -0.6062000     0.7455000 
1 1 1 32 9  27 o 10.35000 0.4671000 10.21000 0.6973000 10.49000 0.6217000 -0.2764000     0.9342000 
1 1 1 32 9  29 o 8.685000 0.5429000 9.028000 0.7900000 8.341000 0.7448000 0.6868000      1.086000  
1 1 1 32 9  31 o 11.82000 0.4269000 12.01000 0.4906000 11.63000 0.6988000 0.3805000      0.8538000 
1 1 1 32 9  33 o 8.098000 0.6060000 9.175000 0.6913000 7.020000 0.9955000 2.156000       1.212000  
1 1 1 32 9  35 o 15.97000 0.4187000 16.13000 0.4467000 15.82000 0.7083000 0.3115000      0.8374000 
1 1 1 32 9  37 o 5.067000 0.8808000 5.415000 1.040000  4.718000 1.422000  0.6974000      1.762000  
1 1 1 32 9  39 o 10.59000 0.5262000 10.35000 0.7231000 10.82000 0.7647000 -0.4702000     1.052000  
1 1 1 32 9  41 o 5.647000 0.9048000 6.338000 1.182000  4.956000 1.371000  1.382000       1.810000  
1 1 1 32 9  43 o 3.655000 0.9559000 3.153000 1.306000  4.156000 1.396000  -1.002000      1.912000  
1 1 1 32 9  45 o 7.292000 0.7965000 5.786000 1.342000  8.797000 0.8586000 -3.011000      1.593000  
1 1 1 32 9  47 o 5.088000 0.9230000 5.838000 1.227000  4.337000 1.379000  1.501000       1.846000  
1 1 1 32 9  49 o 3.691000 0.9926000 2.968000 1.322000  4.414000 1.481000  -1.446000      1.985000  
1 1 1 32 10 0  o 4.570000 1.301000  4.570000 1.301000  4.570000 1.301000  0.000000       0.000000  
1 1 1 32 10 2  o 23.40000 0.3133000 23.31000 0.4371000 23.50000 0.4489000 -0.1910000     0.6265000 
1 1 1 32 10 4  o 26.82000 0.3278000 27.09000 0.4308000 26.54000 0.4941000 0.5491000      0.6556000 
1 1 1 32 10 6  o 18.31000 0.3695000 18.71000 0.4609000 17.91000 0.5777000 0.7974000      0.7390000 
1 1 1 32 10 8  f 20.62000 0.3229000 20.66000 0.4382000 20.58000 0.4745000 0.7738000E-01  0.6459000 
1 1 1 32 10 10 o 32.68000 0.3377000 32.46000 0.4419000 32.91000 0.5107000 -0.4542000     0.6753000 
1 1 1 32 10 12 o 17.71000 0.3233000 18.02000 0.4452000 17.40000 0.4689000 0.6139000      0.6466000 
1 1 1 32 10 14 o 15.97000 0.3689000 15.88000 0.5029000 16.07000 0.5399000 -0.1832000     0.7379000 
1 1 1 32 10 16 o 18.42000 0.3186000 18.60000 0.4463000 18.23000 0.4548000 0.3689000      0.6372000 
1 1 1 32 10 18 o 35.03000 0.3495000 35.28000 0.5246000 34.79000 0.4620000 0.4949000      0.6990000 
1 1 1 32 10 20 o 18.16000 0.4126000 17.98000 0.5035000 18.34000 0.6538000 -0.3667000     0.8252000 
1 1 1 32 10 22 o 26.13000 0.3520000 26.69000 0.4955000 25.57000 0.5001000 1.124000       0.7040000 
1 1 1 32 10 24 o 22.74000 0.3533000 23.18000 0.4924000 22.30000 0.5069000 0.8773000      0.7067000 
1 1 1 32 10 26 o 14.48000 0.3512000 13.65000 0.5166000 15.31000 0.4761000 -1.654000      0.7025000 
1 1 1 32 10 28 o 8.544000 0.5478000 8.795000 0.8105000 8.293000 0.7370000 0.5019000      1.096000  
1 1 1 32 10 30 o 15.31000 0.4436000 15.26000 0.5079000 15.36000 0.7275000 -0.9516000E-01 0.8873000 
1 1 1 32 10 32 o 15.17000 0.3599000 15.00000 0.4415000 15.34000 0.5684000 -0.3434000     0.7197000 
1 1 1 32 10 34 o 17.22000 0.4271000 17.00000 0.4373000 17.44000 0.7337000 -0.4396000     0.8541000 
1 1 1 32 10 36 o 4.290000 0.9055000 3.746000 1.210000  4.835000 1.347000  -1.089000      1.811000  
1 1 1 32 10 38 o 8.213000 0.6141000 7.894000 0.8742000 8.531000 0.8626000 -0.6363000     1.228000  
1 1 1 32 10 40 o 13.88000 0.4530000 13.42000 0.5215000 14.35000 0.7409000 -0.9269000     0.9061000 
1 1 1 32 10 42 o 7.677000 0.7429000 7.410000 0.9383000 7.944000 1.152000  -0.5340000     1.486000  
1 1 1 32 10 44 o 2.717000 0.8774000 2.735000 1.248000  2.698000 1.234000  0.3741000E-01  1.755000  
1 1 1 32 10 46 f 4.356000 1.000000  4.078000 1.423000  4.635000 1.407000  -0.5564000     2.001000  
1 1 1 32 10 48 f 6.701000 0.8035000 5.997000 1.188000  7.404000 1.082000  -1.407000      1.607000  
1 1 1 32 11 1  o 25.56000 0.3022000 25.35000 0.4369000 25.78000 0.4175000 -0.4217000     0.6043000 
1 1 1 32 11 3  o 13.61000 0.4219000 13.89000 0.5435000 13.34000 0.6456000 0.5506000      0.8439000 
1 1 1 32 11 5  o 35.33000 0.3216000 35.54000 0.4546000 35.11000 0.4551000 0.4324000      0.6432000 
1 1 1 32 11 7  o 30.85000 0.3156000 30.62000 0.4430000 31.07000 0.4497000 -0.4472000     0.6313000 
1 1 1 32 11 9  o 12.57000 0.4113000 12.30000 0.5583000 12.85000 0.6042000 -0.5524000     0.8227000 
1 1 1 32 11 11 o 20.57000 0.3183000 20.40000 0.4481000 20.74000 0.4521000 -0.3400000     0.6365000 
1 1 1 32 11 13 o 37.59000 0.3350000 37.39000 0.4735000 37.78000 0.4740000 -0.3856000     0.6700000 
1 1 1 32 11 15 o 25.09000 0.3509000 24.95000 0.4927000 25.24000 0.4997000 -0.2903000     0.7018000 
1 1 1 32 11 17 o 10.53000 0.4430000 10.42000 0.6322000 10.65000 0.6207000 -0.2261000     0.8860000 
1 1 1 32 11 19 o 12.47000 0.6613000 12.60000 1.110000  12.35000 0.7191000 0.2508000      1.323000  
1 1 1 32 11 21 o 11.21000 0.4280000 11.08000 0.5882000 11.34000 0.6221000 -0.2645000     0.8561000 
1 1 1 32 11 23 o 3.925000 0.8521000 4.755000 1.204000  3.095000 1.206000  1.660000       1.704000  
1 1 1 32 11 25 o 18.90000 0.3788000 18.46000 0.4488000 19.34000 0.6104000 -0.8771000     0.7576000 
1 1 1 32 11 27 o 9.213000 0.5333000 8.125000 0.8133000 10.30000 0.6901000 -2.177000      1.067000  
1 1 1 32 11 29 o 7.161000 0.6491000 5.906000 1.089000  8.416000 0.7063000 -2.511000      1.298000  
1 1 1 32 11 31 o 5.369000 0.8249000 4.512000 1.101000  6.225000 1.228000  -1.713000      1.650000  
1 1 1 32 11 33 o 9.218000 0.6320000 8.714000 0.6626000 9.722000 1.076000  -1.008000      1.264000  
1 1 1 32 11 35 o 11.86000 0.4266000 11.51000 0.5442000 12.22000 0.6572000 -0.7027000     0.8533000 
1 1 1 32 11 37 o 11.73000 0.4792000 11.61000 0.6684000 11.86000 0.6870000 -0.2458000     0.9585000 
1 1 1 32 11 39 o 5.727000 0.8232000 6.967000 0.8158000 4.488000 1.430000  2.479000       1.646000  
1 1 1 32 11 41 o 9.138000 0.5703000 9.737000 0.6212000 8.540000 0.9565000 1.197000       1.141000  
1 1 1 32 11 43 o 11.62000 0.5404000 11.09000 0.8420000 12.15000 0.6778000 -1.066000      1.081000  
1 1 1 32 11 45 o 8.326000 0.6412000 7.868000 0.9675000 8.783000 0.8417000 -0.9152000     1.282000  
1 1 1 32 11 47 o 5.470000 0.8930000 4.499000 1.394000  6.442000 1.116000  -1.944000      1.786000  
1 1 1 32 12 0  o 16.62000 0.5571000 16.62000 0.5571000 16.62000 0.5571000 0.000000       0.000000  
1 1 1 32 12 2  o 30.58000 0.3299000 30.44000 0.4315000 30.73000 0.4991000 -0.2905000     0.6598000 
1 1 1 32 12 4  o 30.39000 0.3030000 29.93000 0.4222000 30.85000 0.4346000 -0.9206000     0.6059000 
1 1 1 32 12 6  o 18.52000 0.3244000 18.58000 0.4559000 18.47000 0.4616000 0.1131000      0.6488000 
1 1 1 32 12 8  f 9.702000 0.4848000 9.183000 0.6816000 10.22000 0.6895000 -1.038000      0.9695000 
1 1 1 32 12 10 o 39.02000 0.3737000 38.64000 0.5637000 39.41000 0.4906000 -0.7674000     0.7473000 
1 1 1 32 12 12 o 20.74000 0.3502000 20.48000 0.5494000 21.01000 0.4343000 -0.5395000     0.7003000 
1 1 1 32 12 14 o 26.80000 0.3413000 26.45000 0.5279000 27.15000 0.4328000 -0.6967000     0.6826000 
1 1 1 32 12 16 o 32.91000 0.4424000 33.50000 0.6489000 32.31000 0.6014000 1.186000       0.8848000 
1 1 1 32 12 18 o 27.12000 0.4091000 27.09000 0.6383000 27.15000 0.5118000 -0.5791000E-01 0.8182000 
1 1 1 32 12 20 o 26.99000 0.3356000 26.37000 0.5107000 27.61000 0.4355000 -1.241000      0.6712000 
1 1 1 32 12 22 o 34.55000 0.3223000 34.43000 0.4610000 34.66000 0.4504000 -0.2278000     0.6445000 
1 1 1 32 12 24 o 6.126000 0.6802000 6.320000 0.8352000 5.932000 1.074000  0.3875000      1.360000  
1 1 1 32 12 26 o 4.992000 0.7972000 4.250000 1.241000  5.734000 1.001000  -1.485000      1.594000  
1 1 1 32 12 28 o 15.76000 0.3871000 16.20000 0.5232000 15.32000 0.5707000 0.8729000      0.7742000 
1 1 1 32 12 30 o 9.655000 0.5656000 9.317000 0.5958000 9.993000 0.9617000 -0.6755000     1.131000  
1 1 1 32 12 32 o 9.045000 0.6309000 9.163000 0.5900000 8.926000 1.115000  0.2369000      1.262000  
1 1 1 32 12 34 o 3.607000 0.8788000 2.843000 1.124000  4.371000 1.351000  -1.528000      1.758000  
1 1 1 32 12 36 f 4.145000 0.9432000 3.627000 1.306000  4.662000 1.361000  -1.036000      1.886000  
1 1 1 32 12 38 o 13.57000 0.4044000 13.61000 0.4973000 13.52000 0.6377000 0.9554000E-01  0.8087000 
1 1 1 32 12 40 o 4.662000 0.9277000 4.173000 1.247000  5.151000 1.374000  -0.9787000     1.855000  
1 1 1 32 12 42 o 7.867000 0.6873000 8.614000 0.8388000 7.119000 1.089000  1.495000       1.375000  
1 1 1 32 12 44 o 3.166000 0.9786000 3.299000 1.458000  3.032000 1.305000  0.2662000      1.957000  
1 1 1 32 12 46 o 3.936000 1.016000  3.618000 1.402000  4.254000 1.472000  -0.6358000     2.033000  
1 1 1 32 12 48 o 4.106000 1.058000  4.589000 1.516000  3.624000 1.477000  0.9646000      2.116000  
1 1 1 32 13 1  o 14.75000 0.3754000 14.89000 0.5455000 14.61000 0.5160000 0.2816000      0.7509000 
1 1 1 32 13 3  f 4.300000 0.9084000 4.271000 1.266000  4.330000 1.303000  -0.5930000E-01 1.817000  
1 1 1 32 13 5  o 36.32000 0.3234000 35.89000 0.4515000 36.75000 0.4632000 -0.8645000     0.6468000 
1 1 1 32 13 7  o 11.31000 0.4937000 11.15000 0.7690000 11.48000 0.6193000 -0.3357000     0.9874000 
1 1 1 32 13 9  o 9.504000 0.5867000 9.390000 0.9153000 9.619000 0.7344000 -0.2296000     1.173000  
1 1 1 32 13 11 o 23.98000 0.3106000 23.80000 0.4263000 24.16000 0.4517000 -0.3625000     0.6211000 
1 1 1 32 13 13 o 8.628000 0.5879000 8.525000 0.8329000 8.730000 0.8299000 -0.2048000     1.176000  
1 1 1 32 13 15 o 24.30000 0.4035000 24.06000 0.5184000 24.55000 0.6185000 -0.4879000     0.8070000 
1 1 1 32 13 17 o 14.10000 0.3893000 13.88000 0.5956000 14.32000 0.5014000 -0.4375000     0.7785000 
1 1 1 32 13 19 o 15.54000 0.3577000 16.18000 0.5102000 14.90000 0.5014000 1.276000       0.7154000 
1 1 1 32 13 21 o 5.207000 0.8706000 4.316000 1.425000  6.099000 1.001000  -1.783000      1.741000  
1 1 1 32 13 23 f 15.24000 0.3919000 15.10000 0.5877000 15.39000 0.5186000 -0.2942000     0.7838000 
1 1 1 32 13 25 o 10.05000 0.4354000 9.605000 0.6473000 10.49000 0.5825000 -0.8886000     0.8708000 
1 1 1 32 13 27 o 8.695000 0.4845000 8.924000 0.6950000 8.466000 0.6751000 0.4577000      0.9689000 
1 1 1 32 13 29 o 10.71000 0.5269000 10.02000 0.5962000 11.39000 0.8689000 -1.369000      1.054000  
1 1 1 32 13 31 o 5.792000 0.9506000 5.054000 1.243000  6.529000 1.439000  -1.475000      1.901000  
1 1 1 32 13 33 o 4.849000 0.8537000 5.122000 1.117000  4.576000 1.291000  0.5458000      1.707000  
1 1 1 32 13 35 o 4.398000 0.9260000 4.181000 1.287000  4.614000 1.332000  -0.4326000     1.852000  
1 1 1 32 13 37 o 16.34000 0.3575000 16.14000 0.4422000 16.55000 0.5619000 -0.4088000     0.7150000 
1 1 1 32 13 39 o 16.17000 0.4011000 15.99000 0.4473000 16.35000 0.6660000 -0.3523000     0.8022000 
1 1 1 32 13 41 o 11.08000 0.4918000 11.04000 0.5882000 11.11000 0.7885000 -0.7329000E-01 0.9837000 
1 1 1 32 13 43 o 10.89000 0.5421000 11.13000 0.6815000 10.66000 0.8432000 0.4698000      1.084000  
1 1 1 32 13 45 o 3.276000 0.9610000 3.717000 1.463000  2.835000 1.246000  0.8824000      1.922000  
1 1 1 32 13 47 o 3.747000 1.010000  3.200000 1.336000  4.294000 1.515000  -1.094000      2.020000  
1 1 1 32 14 0  o 13.82000 0.5361000 13.82000 0.5361000 13.82000 0.5361000 0.000000       0.000000  
1 1 1 32 14 2  o 21.12000 0.3289000 20.83000 0.4933000 21.41000 0.4350000 -0.5833000     0.6577000 
1 1 1 32 14 4  o 26.71000 0.3356000 26.66000 0.5154000 26.76000 0.4298000 -0.9990000E-01 0.6711000 
1 1 1 32 14 6  o 12.64000 0.4563000 11.84000 0.7387000 13.43000 0.5359000 -1.589000      0.9126000 
1 1 1 32 14 8  o 19.36000 0.3219000 18.91000 0.4392000 19.81000 0.4707000 -0.8995000     0.6438000 
1 1 1 32 14 10 o 33.15000 0.3568000 32.46000 0.5018000 33.83000 0.5073000 -1.373000      0.7136000 
1 1 1 32 14 12 o 11.89000 0.5219000 11.87000 0.7332000 11.92000 0.7429000 -0.5063000E-01 1.044000  
1 1 1 32 14 14 o 19.94000 0.3131000 19.87000 0.4440000 20.00000 0.4415000 -0.1337000     0.6261000 
1 1 1 32 14 16 o 15.24000 0.3816000 14.99000 0.5001000 15.49000 0.5765000 -0.5067000     0.7631000 
1 1 1 32 14 18 o 13.72000 0.3609000 14.19000 0.5012000 13.24000 0.5194000 0.9473000      0.7218000 
1 1 1 32 14 20 o 22.58000 0.3146000 22.54000 0.4664000 22.61000 0.4223000 -0.7299000E-01 0.6292000 
1 1 1 32 14 22 o 21.00000 0.3194000 20.84000 0.4411000 21.16000 0.4621000 -0.3131000     0.6388000 
1 1 1 32 14 24 o 5.447000 0.7022000 5.370000 1.018000  5.524000 0.9673000 -0.1539000     1.404000  
1 1 1 32 14 26 o 5.321000 0.8861000 5.373000 1.421000  5.269000 1.059000  0.1032000      1.772000  
1 1 1 32 14 28 o 16.46000 0.4057000 16.15000 0.4289000 16.77000 0.6889000 -0.6180000     0.8115000 
1 1 1 32 14 30 o 13.89000 0.3765000 13.69000 0.4688000 14.10000 0.5893000 -0.4035000     0.7531000 
1 1 1 32 14 32 o 9.134000 0.5182000 8.619000 0.7224000 9.650000 0.7431000 -1.031000      1.036000  
1 1 1 32 14 34 o 9.151000 0.5091000 8.774000 0.7003000 9.529000 0.7392000 -0.7551000     1.018000  
1 1 1 32 14 36 o 6.322000 0.7326000 6.463000 0.9245000 6.180000 1.137000  0.2822000      1.465000  
1 1 1 32 14 38 o 12.45000 0.4653000 12.79000 0.5068000 12.11000 0.7806000 0.6814000      0.9307000 
1 1 1 32 14 40 f 7.609000 0.6264000 6.860000 0.8027000 8.357000 0.9619000 -1.497000      1.253000  
1 1 1 32 14 42 o 12.53000 0.5279000 12.10000 0.5547000 12.96000 0.8983000 -0.8558000     1.056000  
1 1 1 32 14 44 o 5.045000 0.9965000 5.001000 1.479000  5.089000 1.336000  -0.8791000E-01 1.993000  
1 1 1 32 14 46 o 6.546000 0.9363000 6.577000 1.391000  6.515000 1.254000  0.6211000E-01  1.873000  
1 1 1 32 15 1  o 40.47000 0.3722000 39.99000 0.5552000 40.95000 0.4959000 -0.9587000     0.7444000 
1 1 1 32 15 3  o 60.64000 0.5613000 61.33000 0.9279000 59.94000 0.6320000 1.388000       1.123000  
1 1 1 32 15 5  o 24.60000 0.2938000 24.77000 0.4175000 24.44000 0.4136000 0.3329000      0.5876000 
1 1 1 32 15 7  o 24.56000 0.2961000 24.46000 0.4251000 24.65000 0.4121000 -0.1821000     0.5921000 
1 1 1 32 15 9  o 22.23000 0.3550000 22.52000 0.5464000 21.94000 0.4533000 0.5839000      0.7100000 
1 1 1 32 15 11 o 16.97000 0.3846000 17.33000 0.5812000 16.61000 0.5038000 0.7186000      0.7692000 
1 1 1 32 15 13 o 12.34000 0.3810000 12.62000 0.5292000 12.06000 0.5482000 0.5590000      0.7620000 
1 1 1 32 15 15 o 3.235000 0.8711000 3.235000 1.256000  3.236000 1.207000  -0.1064000E-02 1.742000  
1 1 1 32 15 17 o 10.35000 0.4676000 11.46000 0.5551000 9.247000 0.7525000 2.213000       0.9351000 
1 1 1 32 15 19 f 6.390000 0.6496000 6.198000 0.9211000 6.581000 0.9163000 -0.3825000     1.299000  
1 1 1 32 15 21 o 6.660000 0.6367000 6.990000 0.7775000 6.330000 1.009000  0.6592000      1.273000  
1 1 1 32 15 23 f 16.36000 0.3109000 17.10000 0.4338000 15.62000 0.4453000 1.480000       0.6217000 
1 1 1 32 15 25 o 3.438000 0.8283000 3.330000 1.205000  3.547000 1.137000  -0.2175000     1.657000  
1 1 1 32 15 27 o 6.799000 0.7426000 5.837000 0.8498000 7.762000 1.218000  -1.925000      1.485000  
1 1 1 32 15 29 o 16.06000 0.3734000 16.15000 0.4989000 15.98000 0.5557000 0.1722000      0.7467000 
1 1 1 32 15 31 o 17.60000 0.4096000 17.50000 0.4814000 17.71000 0.6627000 -0.2059000     0.8191000 
1 1 1 32 15 33 o 3.184000 0.8654000 2.986000 1.199000  3.381000 1.249000  -0.3944000     1.731000  
1 1 1 32 15 35 o 11.74000 0.4603000 11.70000 0.6569000 11.79000 0.6449000 -0.9659000E-01 0.9206000 
1 1 1 32 15 37 o 18.56000 0.3698000 17.91000 0.5021000 19.21000 0.5430000 -1.296000      0.7396000 
1 1 1 32 15 39 o 19.23000 0.3511000 18.82000 0.4258000 19.64000 0.5583000 -0.8262000     0.7021000 
1 1 1 32 15 41 o 15.49000 0.3916000 14.98000 0.4752000 15.99000 0.6226000 -1.013000      0.7832000 
1 1 1 32 15 43 o 3.304000 0.9594000 3.747000 1.379000  2.860000 1.334000  0.8863000      1.919000  
1 1 1 32 15 45 o 7.399000 0.7751000 7.162000 0.9469000 7.635000 1.227000  -0.4732000     1.550000  
1 1 1 32 15 47 o 6.166000 0.9701000 6.810000 1.473000  5.522000 1.263000  1.288000       1.940000  
1 1 1 32 16 0  o 17.52000 0.5151000 17.52000 0.5151000 17.52000 0.5151000 0.000000       0.000000  
1 1 1 32 16 2  o 22.43000 0.3374000 22.01000 0.5247000 22.85000 0.4242000 -0.8371000     0.6747000 
1 1 1 32 16 4  o 9.640000 0.5109000 8.981000 0.8047000 10.30000 0.6296000 -1.318000      1.022000  
1 1 1 32 16 6  o 19.42000 0.3390000 19.54000 0.4862000 19.30000 0.4724000 0.2382000      0.6779000 
1 1 1 32 16 8  o 15.01000 0.4127000 15.02000 0.6024000 15.01000 0.5644000 0.1417000E-01  0.8255000 
1 1 1 32 16 10 o 29.63000 0.3116000 29.61000 0.4311000 29.64000 0.4500000 -0.2999000E-01 0.6232000 
1 1 1 32 16 12 o 28.34000 0.3054000 28.65000 0.4274000 28.03000 0.4364000 0.6211000      0.6108000 
1 1 1 32 16 14 o 21.23000 0.3175000 21.68000 0.4460000 20.78000 0.4521000 0.8922000      0.6351000 
1 1 1 32 16 16 o 2.313000 0.7316000 2.589000 1.106000  2.036000 0.9584000 0.5529000      1.463000  
1 1 1 32 16 18 o 18.25000 0.3067000 17.90000 0.4190000 18.61000 0.4479000 -0.7144000     0.6133000 
1 1 1 32 16 20 o 4.374000 0.8955000 4.233000 1.282000  4.516000 1.250000  -0.2833000     1.791000  
1 1 1 32 16 22 o 12.72000 0.3572000 12.60000 0.5016000 12.85000 0.5088000 -0.2538000     0.7145000 
1 1 1 32 16 24 o 16.45000 0.3610000 16.81000 0.5061000 16.09000 0.5149000 0.7221000      0.7220000 
1 1 1 32 16 26 o 5.759000 0.7423000 6.325000 0.7678000 5.193000 1.271000  1.132000       1.485000  
1 1 1 32 16 28 o 6.330000 0.7001000 6.850000 0.7556000 5.811000 1.179000  1.039000       1.400000  
1 1 1 32 16 30 o 11.77000 0.4812000 11.44000 0.7198000 12.11000 0.6388000 -0.6648000     0.9624000 
1 1 1 32 16 32 o 8.523000 0.5494000 7.797000 0.7804000 9.248000 0.7734000 -1.451000      1.099000  
1 1 1 32 16 34 o 4.623000 0.8714000 3.935000 1.224000  5.312000 1.241000  -1.377000      1.743000  
1 1 1 32 16 36 o 12.19000 0.4344000 12.55000 0.5572000 11.84000 0.6664000 0.7075000      0.8687000 
1 1 1 32 16 38 o 10.30000 0.5270000 10.42000 0.5630000 10.17000 0.8910000 0.2585000      1.054000  
1 1 1 32 16 40 o 14.58000 0.4053000 14.46000 0.4840000 14.70000 0.6503000 -0.2429000     0.8107000 
1 1 1 32 16 42 o 2.800000 0.8572000 2.629000 1.122000  2.970000 1.297000  -0.3409000     1.714000  
1 1 1 32 16 44 o 8.042000 0.7287000 8.011000 0.9084000 8.073000 1.140000  -0.6179000E-01 1.457000  
1 1 1 32 16 46 f 4.403000 0.9634000 4.016000 1.388000  4.789000 1.336000  -0.7739000     1.927000  
1 1 1 32 17 1  o 14.94000 0.4041000 14.29000 0.6339000 15.60000 0.5015000 -1.307000      0.8082000 
1 1 1 32 17 3  o 12.51000 0.4309000 12.57000 0.6126000 12.44000 0.6062000 0.1364000      0.8618000 
1 1 1 32 17 5  o 4.119000 0.9862000 4.446000 1.385000  3.791000 1.404000  0.6552000      1.972000  
1 1 1 32 17 7  o 20.92000 0.3007000 20.48000 0.4235000 21.35000 0.4269000 -0.8695000     0.6013000 
1 1 1 32 17 9  o 5.143000 0.8167000 4.882000 1.111000  5.405000 1.197000  -0.5226000     1.633000  
1 1 1 32 17 11 o 6.169000 0.7238000 5.629000 1.151000  6.709000 0.8785000 -1.080000      1.448000  
1 1 1 32 17 13 o 20.74000 0.3118000 20.85000 0.4539000 20.62000 0.4277000 0.2274000      0.6236000 
1 1 1 32 17 15 o 17.43000 0.3019000 17.98000 0.4155000 16.88000 0.4381000 1.102000       0.6038000 
1 1 1 32 17 17 o 2.751000 0.8207000 2.363000 1.038000  3.138000 1.272000  -0.7747000     1.641000  
1 1 1 32 17 19 o 11.83000 0.3864000 11.62000 0.5078000 12.04000 0.5827000 -0.4225000     0.7729000 
1 1 1 32 17 21 o 21.47000 0.3361000 21.28000 0.4743000 21.67000 0.4764000 -0.3876000     0.6722000 
1 1 1 32 17 23 f 6.708000 0.6849000 8.591000 0.6364000 4.824000 1.213000  3.767000       1.370000  
1 1 1 32 17 25 o 14.81000 0.3528000 14.32000 0.4263000 15.30000 0.5624000 -0.9812000     0.7057000 
1 1 1 32 17 27 o 3.376000 0.8657000 3.529000 1.156000  3.223000 1.289000  0.3068000      1.731000  
1 1 1 32 17 29 o 4.219000 0.8620000 3.515000 1.228000  4.922000 1.210000  -1.407000      1.724000  
1 1 1 32 17 31 o 10.62000 0.5235000 10.92000 0.5254000 10.31000 0.9055000 0.6082000      1.047000  
1 1 1 32 17 33 o 9.786000 0.4818000 9.311000 0.6996000 10.26000 0.6627000 -0.9491000     0.9637000 
1 1 1 32 17 35 o 18.95000 0.3391000 18.46000 0.4174000 19.43000 0.5346000 -0.9705000     0.6783000 
1 1 1 32 17 37 o 16.01000 0.4301000 15.62000 0.4988000 16.40000 0.7007000 -0.7828000     0.8601000 
1 1 1 32 17 39 o 3.763000 0.8969000 4.295000 1.159000  3.232000 1.369000  1.063000       1.794000  
1 1 1 32 17 41 o 5.832000 0.8275000 5.366000 0.9715000 6.298000 1.340000  -0.9318000     1.655000  
1 1 1 32 17 43 o 4.064000 1.074000  4.154000 1.184000  3.973000 1.792000  0.1814000      2.148000  
1 1 1 32 17 45 o 4.412000 0.9435000 4.578000 1.296000  4.246000 1.372000  0.3320000      1.887000  
1 1 1 32 18 0  o 12.86000 0.6775000 12.86000 0.6775000 12.86000 0.6775000 0.000000       0.000000  
1 1 1 32 18 2  o 21.74000 0.3134000 22.49000 0.4728000 20.99000 0.4114000 1.502000       0.6267000 
1 1 1 32 18 4  o 15.94000 0.3574000 15.88000 0.5575000 16.00000 0.4472000 -0.1165000     0.7147000 
1 1 1 32 18 6  o 32.71000 0.3109000 32.07000 0.4409000 33.34000 0.4385000 -1.276000      0.6218000 
1 1 1 32 18 8  o 14.24000 0.3454000 14.72000 0.4578000 13.75000 0.5173000 0.9655000      0.6907000 
1 1 1 32 18 10 o 10.44000 0.4441000 9.819000 0.6817000 11.05000 0.5693000 -1.234000      0.8882000 
1 1 1 32 18 12 o 9.486000 0.4395000 10.13000 0.5833000 8.842000 0.6576000 1.288000       0.8790000 
1 1 1 32 18 14 o 11.70000 0.3618000 11.84000 0.4892000 11.57000 0.5332000 0.2752000      0.7236000 
1 1 1 32 18 16 o 8.976000 0.4755000 9.624000 0.5668000 8.327000 0.7636000 1.297000       0.9509000 
1 1 1 32 18 18 o 17.89000 0.4078000 17.50000 0.4149000 18.28000 0.7023000 -0.7845000     0.8157000 
1 1 1 32 18 20 o 9.877000 0.4225000 9.540000 0.5791000 10.21000 0.6154000 -0.6731000     0.8450000 
1 1 1 32 18 22 o 18.94000 0.2948000 18.91000 0.4121000 18.97000 0.4217000 -0.5952000E-01 0.5896000 
1 1 1 32 18 24 o 5.151000 0.7743000 5.293000 0.8544000 5.010000 1.292000  0.2829000      1.549000  
1 1 1 32 18 26 o 10.08000 0.4553000 10.20000 0.5420000 9.966000 0.7317000 0.2361000      0.9106000 
1 1 1 32 18 28 o 9.434000 0.4725000 9.829000 0.5391000 9.038000 0.7762000 0.7912000      0.9450000 
1 1 1 32 18 30 o 10.56000 0.4202000 10.59000 0.5129000 10.53000 0.6657000 0.6068000E-01  0.8403000 
1 1 1 32 18 32 o 13.65000 0.3836000 13.30000 0.4721000 14.00000 0.6048000 -0.7008000     0.7672000 
1 1 1 32 18 34 o 13.48000 0.4498000 12.66000 0.6649000 14.30000 0.6059000 -1.641000      0.8996000 
1 1 1 32 18 36 o 10.21000 0.5259000 9.940000 0.6246000 10.47000 0.8463000 -0.5319000     1.052000  
1 1 1 32 18 38 o 4.353000 0.9466000 4.183000 1.237000  4.524000 1.433000  -0.3403000     1.893000  
1 1 1 32 18 40 o 8.754000 0.5659000 8.328000 0.6722000 9.180000 0.9104000 -0.8512000     1.132000  
1 1 1 32 18 42 o 3.579000 0.9635000 3.220000 1.195000  3.938000 1.512000  -0.7184000     1.927000  
1 1 1 32 18 44 o 4.687000 0.9458000 4.747000 1.349000  4.627000 1.326000  0.1200000      1.892000  
1 1 1 32 18 46 o 4.553000 1.044000  5.133000 1.466000  3.973000 1.487000  1.159000       2.088000  
1 1 1 32 19 1  o 17.28000 0.5480000 16.73000 0.7878000 17.83000 0.7621000 -1.101000      1.096000  
1 1 1 32 19 3  o 15.09000 0.3345000 15.01000 0.4698000 15.17000 0.4762000 -0.1654000     0.6690000 
1 1 1 32 19 5  f 31.79000 0.3382000 31.63000 0.5218000 31.96000 0.4305000 -0.3385000     0.6764000 
1 1 1 32 19 7  o 15.43000 0.3550000 15.31000 0.5195000 15.55000 0.4839000 -0.2409000     0.7099000 
1 1 1 32 19 9  o 5.304000 0.8058000 5.571000 1.132000  5.036000 1.148000  0.5346000      1.612000  
1 1 1 32 19 11 o 12.92000 0.3517000 13.64000 0.4823000 12.20000 0.5120000 1.441000       0.7033000 
1 1 1 32 19 13 o 10.41000 0.3935000 10.77000 0.5410000 10.05000 0.5714000 0.7203000      0.7869000 
1 1 1 32 19 15 o 8.481000 0.5420000 9.362000 0.5649000 7.599000 0.9252000 1.763000       1.084000  
1 1 1 32 19 17 o 4.096000 0.8372000 4.601000 1.051000  3.591000 1.303000  1.010000       1.674000  
1 1 1 32 19 19 o 9.497000 0.4154000 9.336000 0.5629000 9.659000 0.6111000 -0.3222000     0.8308000 
1 1 1 32 19 21 o 8.902000 0.4598000 9.003000 0.6788000 8.802000 0.6203000 0.2015000      0.9195000 
1 1 1 32 19 23 o 3.204000 0.8482000 2.915000 1.077000  3.492000 1.311000  -0.5770000     1.696000  
1 1 1 32 19 25 o 4.637000 0.8176000 3.925000 1.115000  5.349000 1.196000  -1.424000      1.635000  
1 1 1 32 19 27 o 14.19000 0.3606000 13.91000 0.4157000 14.46000 0.5893000 -0.5553000     0.7212000 
1 1 1 32 19 29 o 5.911000 0.6540000 5.701000 0.8330000 6.121000 1.008000  -0.4208000     1.308000  
1 1 1 32 19 31 o 15.32000 0.3993000 15.06000 0.4221000 15.58000 0.6779000 -0.5246000     0.7985000 
1 1 1 32 19 33 f 8.590000 0.5115000 8.314000 0.6481000 8.865000 0.7915000 -0.5510000     1.023000  
1 1 1 32 19 35 o 10.88000 0.5130000 10.85000 0.5722000 10.91000 0.8516000 -0.5844000E-01 1.026000  
1 1 1 32 19 37 o 13.96000 0.4255000 13.29000 0.5945000 14.62000 0.6088000 -1.325000      0.8509000 
1 1 1 32 19 39 f 17.40000 0.3795000 17.64000 0.4333000 17.16000 0.6231000 0.4770000      0.7589000 
1 1 1 32 19 41 o 5.466000 1.011000  4.666000 1.344000  6.265000 1.511000  -1.599000      2.023000  
1 1 1 32 19 43 o 3.655000 0.9428000 3.841000 1.214000  3.468000 1.443000  0.3731000      1.886000  
1 1 1 32 19 45 o 4.251000 1.058000  4.423000 1.542000  4.079000 1.448000  0.3440000      2.115000  
1 1 1 32 20 0  f 40.01000 0.4964000 40.01000 0.4964000 40.01000 0.4964000 0.000000       0.000000  
1 1 1 32 20 2  o 15.84000 0.4317000 15.62000 0.6442000 16.06000 0.5749000 -0.4423000     0.8635000 
1 1 1 32 20 4  o 13.92000 0.4946000 14.44000 0.8298000 13.40000 0.5384000 1.044000       0.9892000 
1 1 1 32 20 6  f 13.87000 0.3999000 13.92000 0.6466000 13.82000 0.4708000 0.1044000      0.7998000 
1 1 1 32 20 8  o 12.59000 0.3721000 13.10000 0.5134000 12.08000 0.5388000 1.023000       0.7442000 
1 1 1 32 20 10 o 8.521000 0.4798000 9.250000 0.6156000 7.792000 0.7360000 1.458000       0.9596000 
1 1 1 32 20 12 o 4.915000 0.7995000 4.899000 1.088000  4.931000 1.172000  -0.3136000E-01 1.599000  
1 1 1 32 20 14 o 13.16000 0.3834000 13.82000 0.4559000 12.51000 0.6166000 1.308000       0.7668000 
1 1 1 32 20 16 o 7.161000 0.5620000 6.451000 0.8067000 7.872000 0.7826000 -1.421000      1.124000  
1 1 1 32 20 18 o 7.130000 0.5801000 7.913000 0.6662000 6.346000 0.9499000 1.567000       1.160000  
1 1 1 32 20 20 f 4.207000 0.7764000 4.356000 1.065000  4.057000 1.130000  0.2986000      1.553000  
1 1 1 32 20 22 o 20.71000 0.3176000 20.77000 0.3811000 20.64000 0.5083000 0.1280000      0.6353000 
1 1 1 32 20 24 o 20.42000 0.3086000 19.90000 0.3782000 20.94000 0.4877000 -1.035000      0.6171000 
1 1 1 32 20 26 o 6.533000 0.6281000 6.357000 0.7145000 6.709000 1.033000  -0.3516000     1.256000  
1 1 1 32 20 28 o 11.06000 0.4060000 10.62000 0.4653000 11.50000 0.6653000 -0.8807000     0.8119000 
1 1 1 32 20 30 o 9.789000 0.4454000 9.443000 0.5121000 10.14000 0.7288000 -0.6931000     0.8907000 
1 1 1 32 20 32 o 5.283000 0.7498000 5.802000 0.8481000 4.765000 1.237000  1.037000       1.500000  
1 1 1 32 20 34 o 13.36000 0.3948000 12.65000 0.5135000 14.08000 0.5998000 -1.431000      0.7896000 
1 1 1 32 20 36 o 8.237000 0.5697000 7.467000 0.7760000 9.007000 0.8343000 -1.540000      1.139000  
1 1 1 32 20 38 o 11.24000 0.4902000 11.16000 0.6575000 11.32000 0.7271000 -0.1548000     0.9803000 
1 1 1 32 20 40 o 3.569000 0.9891000 2.911000 1.167000  4.226000 1.597000  -1.316000      1.978000  
1 1 1 32 20 42 o 11.46000 0.6352000 12.00000 0.7352000 10.92000 1.036000  1.086000       1.270000  
1 1 1 32 20 44 o 6.661000 0.8811000 6.841000 0.9667000 6.482000 1.473000  0.3595000      1.762000  
1 1 1 32 21 1  o 5.207000 0.8773000 4.144000 1.312000  6.269000 1.165000  -2.125000      1.755000  
1 1 1 32 21 3  o 8.256000 0.6401000 8.624000 0.7270000 7.889000 1.054000  0.7352000      1.280000  
1 1 1 32 21 5  o 15.68000 0.4062000 15.47000 0.5330000 15.90000 0.6132000 -0.4245000     0.8125000 
1 1 1 32 21 7  o 19.40000 0.3893000 19.63000 0.4853000 19.16000 0.6089000 0.4765000      0.7786000 
1 1 1 32 21 9  o 21.92000 0.3107000 21.66000 0.4134000 22.18000 0.4640000 -0.5180000     0.6214000 
1 1 1 32 21 11 o 9.723000 0.4549000 9.913000 0.5909000 9.534000 0.6917000 0.3798000      0.9098000 
1 1 1 32 21 13 o 6.700000 0.6145000 7.320000 0.7309000 6.079000 0.9881000 1.241000       1.229000  
1 1 1 32 21 15 o 8.931000 0.5779000 9.633000 0.5624000 8.230000 1.010000  1.404000       1.156000  
1 1 1 32 21 17 o 4.038000 0.9149000 3.728000 1.159000  4.348000 1.416000  -0.6192000     1.830000  
1 1 1 32 21 19 o 10.85000 0.4572000 11.49000 0.5048000 10.21000 0.7626000 1.279000       0.9145000 
1 1 1 32 21 21 o 11.46000 0.4144000 11.41000 0.5548000 11.50000 0.6158000 -0.8855000E-01 0.8288000 
1 1 1 32 21 23 o 11.90000 0.4059000 12.27000 0.4735000 11.53000 0.6593000 0.7434000      0.8117000 
1 1 1 32 21 25 o 9.014000 0.4359000 8.669000 0.5319000 9.359000 0.6907000 -0.6894000     0.8718000 
1 1 1 32 21 27 o 8.283000 0.5163000 8.182000 0.5902000 8.384000 0.8473000 -0.2018000     1.033000  
1 1 1 32 21 29 o 3.208000 0.8277000 3.303000 1.117000  3.113000 1.222000  0.1900000      1.655000  
1 1 1 32 21 31 o 5.416000 0.8532000 5.034000 0.9502000 5.798000 1.417000  -0.7635000     1.706000  
1 1 1 32 21 33 o 6.702000 0.6437000 6.555000 0.7265000 6.850000 1.063000  -0.2952000     1.287000  
1 1 1 32 21 35 o 2.418000 0.7579000 1.753000 0.8478000 3.083000 1.257000  -1.329000      1.516000  
1 1 1 32 21 37 o 7.557000 0.6153000 6.976000 0.7648000 8.139000 0.9640000 -1.163000      1.231000  
1 1 1 32 21 39 o 3.857000 0.9489000 3.272000 1.179000  4.442000 1.487000  -1.171000      1.898000  
1 1 1 32 21 41 o 5.575000 0.8771000 5.313000 1.093000  5.836000 1.372000  -0.5237000     1.754000  
1 1 1 32 21 43 o 3.887000 1.002000  4.500000 1.429000  3.273000 1.405000  1.226000       2.004000  
1 1 1 32 22 0  o 41.33000 0.5665000 41.33000 0.5665000 41.33000 0.5665000 0.000000       0.000000  
1 1 1 32 22 2  o 24.28000 0.2809000 24.05000 0.3919000 24.51000 0.4025000 -0.4583000     0.5617000 
1 1 1 32 22 4  o 22.12000 0.3131000 22.01000 0.4057000 22.23000 0.4769000 -0.2224000     0.6261000 
1 1 1 32 22 6  o 3.595000 0.8416000 3.460000 1.195000  3.729000 1.185000  -0.2688000     1.683000  
1 1 1 32 22 8  o 11.01000 0.4804000 12.31000 0.5603000 9.704000 0.7805000 2.604000       0.9608000 
1 1 1 32 22 10 o 19.00000 0.3303000 19.65000 0.4848000 18.34000 0.4488000 1.305000       0.6606000 
1 1 1 32 22 12 o 7.922000 0.6072000 7.978000 0.6936000 7.865000 0.9968000 0.1126000      1.214000  
1 1 1 32 22 14 o 12.00000 0.3788000 12.48000 0.4818000 11.53000 0.5847000 0.9522000      0.7577000 
1 1 1 32 22 16 o 7.663000 0.5223000 7.604000 0.7346000 7.722000 0.7426000 -0.1180000     1.045000  
1 1 1 32 22 18 o 14.69000 0.3543000 14.77000 0.4733000 14.61000 0.5275000 0.1606000      0.7087000 
1 1 1 32 22 20 o 16.96000 0.3284000 16.92000 0.3463000 17.01000 0.5581000 -0.9179000E-01 0.6568000 
1 1 1 32 22 22 o 10.84000 0.3873000 10.79000 0.4398000 10.89000 0.6376000 -0.1011000     0.7746000 
1 1 1 32 22 24 o 18.62000 0.3608000 18.57000 0.4954000 18.68000 0.5245000 -0.1106000     0.7215000 
1 1 1 32 22 26 o 16.44000 0.3329000 15.62000 0.4010000 17.26000 0.5314000 -1.634000      0.6657000 
1 1 1 32 22 28 o 4.683000 0.8701000 4.733000 1.111000  4.634000 1.339000  0.9944000E-01  1.740000  
1 1 1 32 22 30 o 4.753000 0.8223000 5.295000 0.8301000 4.212000 1.420000  1.083000       1.645000  
1 1 1 32 22 32 o 8.174000 0.5296000 8.080000 0.5835000 8.267000 0.8839000 -0.1868000     1.059000  
1 1 1 32 22 34 o 5.402000 0.8507000 5.916000 0.8119000 4.889000 1.495000  1.026000       1.701000  
1 1 1 32 22 36 o 3.524000 0.8829000 2.574000 1.067000  4.473000 1.407000  -1.899000      1.766000  
1 1 1 32 22 38 o 10.71000 0.4745000 9.928000 0.5300000 11.49000 0.7873000 -1.562000      0.9491000 
1 1 1 32 22 40 o 4.201000 0.9395000 4.344000 1.186000  4.059000 1.457000  0.2844000      1.879000  
1 1 1 32 22 42 o 4.231000 1.069000  3.234000 1.250000  5.229000 1.735000  -1.995000      2.139000  
1 1 1 32 22 44 o 4.682000 1.912000  ?        ?         4.682000 1.912000  ?              ?         
1 1 1 32 23 1  o 4.628000 0.8117000 4.726000 1.056000  4.530000 1.233000  0.1959000      1.623000  
1 1 1 32 23 3  o 9.055000 0.4482000 9.395000 0.5908000 8.714000 0.6742000 0.6815000      0.8965000 
1 1 1 32 23 5  f 13.76000 0.3440000 13.53000 0.4634000 14.00000 0.5087000 -0.4653000     0.6881000 
1 1 1 32 23 7  o 8.099000 0.5439000 7.583000 0.7862000 8.615000 0.7517000 -1.032000      1.088000  
1 1 1 32 23 9  o 3.212000 0.8818000 3.347000 1.177000  3.078000 1.313000  0.2691000      1.764000  
1 1 1 32 23 11 o 4.803000 0.7570000 4.349000 0.9883000 5.256000 1.147000  -0.9073000     1.514000  
1 1 1 32 23 13 o 9.452000 0.4857000 10.59000 0.6314000 8.317000 0.7381000 2.270000       0.9713000 
1 1 1 32 23 15 o 34.94000 0.3957000 34.63000 0.6404000 35.25000 0.4649000 -0.6183000     0.7914000 
1 1 1 32 23 17 o 24.94000 0.3360000 25.47000 0.5176000 24.41000 0.4286000 1.067000       0.6720000 
1 1 1 32 23 19 o 7.343000 0.7575000 8.070000 0.6681000 6.615000 1.360000  1.455000       1.515000  
1 1 1 32 23 21 o 5.185000 0.8296000 5.289000 1.102000  5.082000 1.240000  0.2073000      1.659000  
1 1 1 32 23 23 f 2.968000 0.8158000 3.534000 1.209000  2.401000 1.096000  1.133000       1.632000  
1 1 1 32 23 25 o 10.07000 0.4715000 9.454000 0.6514000 10.69000 0.6819000 -1.237000      0.9430000 
1 1 1 32 23 27 o 16.37000 0.3611000 16.44000 0.4789000 16.30000 0.5405000 0.1346000      0.7222000 
1 1 1 32 23 29 o 2.824000 0.8605000 3.154000 1.289000  2.493000 1.140000  0.6615000      1.721000  
1 1 1 32 23 31 o 13.30000 0.5088000 12.31000 0.6972000 14.29000 0.7412000 -1.981000      1.018000  
1 1 1 32 23 33 o 9.975000 0.5266000 9.637000 0.4738000 10.31000 0.9407000 -0.6769000     1.053000  
1 1 1 32 23 35 o 4.207000 0.8704000 5.239000 1.009000  3.176000 1.418000  2.063000       1.741000  
1 1 1 32 23 37 o 5.120000 0.8568000 6.003000 0.9102000 4.236000 1.452000  1.767000       1.714000  
1 1 1 32 23 39 o 7.142000 0.9138000 7.809000 1.388000  6.474000 1.189000  1.335000       1.828000  
1 1 1 32 23 41 o 4.275000 1.066000  4.227000 1.540000  4.324000 1.474000  -0.9711000E-01 2.132000  
1 1 1 32 23 43 o 4.718000 1.092000  5.566000 1.634000  3.870000 1.451000  1.696000       2.185000  
1 1 1 32 24 0  o 20.04000 0.4738000 20.04000 0.4738000 20.04000 0.4738000 0.000000       0.000000  
1 1 1 32 24 2  o 8.977000 0.4781000 9.203000 0.6424000 8.751000 0.7082000 0.4511000      0.9562000 
1 1 1 32 24 4  o 11.86000 0.4156000 11.69000 0.5014000 12.02000 0.6630000 -0.3335000     0.8313000 
1 1 1 32 24 6  o 14.84000 0.3105000 15.27000 0.4454000 14.40000 0.4329000 0.8628000      0.6211000 
1 1 1 32 24 8  o 12.18000 0.4456000 13.37000 0.5741000 10.99000 0.6818000 2.374000       0.8913000 
1 1 1 32 24 10 o 7.726000 0.4903000 7.549000 0.7126000 7.902000 0.6736000 -0.3536000     0.9806000 
1 1 1 32 24 12 o 3.838000 0.9218000 3.884000 1.441000  3.792000 1.150000  0.9216000E-01  1.844000  
1 1 1 32 24 14 o 6.625000 0.5142000 7.051000 0.6844000 6.199000 0.7676000 0.8513000      1.028000  
1 1 1 32 24 16 o 11.17000 0.4087000 11.31000 0.5432000 11.02000 0.6107000 0.2897000      0.8173000 
1 1 1 32 24 18 o 2.977000 0.8081000 3.205000 1.009000  2.749000 1.263000  0.4556000      1.616000  
1 1 1 32 24 20 o 13.82000 0.4005000 13.33000 0.3520000 14.31000 0.7196000 -0.9778000     0.8011000 
1 1 1 32 24 22 o 6.088000 0.7342000 6.233000 0.8851000 5.943000 1.172000  0.2898000      1.468000  
1 1 1 32 24 24 o 10.13000 0.4578000 10.44000 0.5727000 9.817000 0.7144000 0.6271000      0.9156000 
1 1 1 32 24 26 o 4.421000 0.8761000 3.991000 1.109000  4.851000 1.357000  -0.8601000     1.752000  
1 1 1 32 24 28 o 3.368000 0.8746000 3.924000 1.279000  2.812000 1.193000  1.112000       1.749000  
1 1 1 32 24 30 o 7.809000 0.5987000 8.231000 0.6980000 7.386000 0.9729000 0.8449000      1.197000  
1 1 1 32 24 32 o 6.698000 0.6902000 6.107000 0.5976000 7.289000 1.244000  -1.181000      1.380000  
1 1 1 32 24 34 o 5.149000 0.9227000 3.752000 1.162000  6.546000 1.434000  -2.794000      1.845000  
1 1 1 32 24 36 o 6.132000 0.7719000 5.313000 1.047000  6.951000 1.135000  -1.638000      1.544000  
1 1 1 32 24 38 o 4.740000 1.058000  4.362000 1.608000  5.118000 1.376000  -0.7558000     2.117000  
1 1 1 32 24 40 o 6.116000 0.9699000 6.530000 1.426000  5.703000 1.315000  0.8272000      1.940000  
1 1 1 32 24 42 o 4.555000 1.097000  3.465000 1.492000  5.645000 1.609000  -2.180000      2.194000  
1 1 1 32 25 1  o 19.42000 0.2975000 19.58000 0.3911000 19.25000 0.4484000 0.3294000      0.5950000 
1 1 1 32 25 3  o 18.65000 0.2961000 18.64000 0.4255000 18.66000 0.4118000 -0.2435000E-01 0.5921000 
1 1 1 32 25 5  o 11.79000 0.4466000 11.23000 0.6731000 12.35000 0.5871000 -1.123000      0.8932000 
1 1 1 32 25 7  o 9.146000 0.4752000 8.900000 0.6137000 9.393000 0.7256000 -0.4933000     0.9504000 
1 1 1 32 25 9  o 10.20000 0.3753000 10.06000 0.5398000 10.33000 0.5217000 -0.2704000     0.7507000 
1 1 1 32 25 11 o 14.29000 0.3596000 14.74000 0.5841000 13.84000 0.4197000 0.9048000      0.7192000 
1 1 1 32 25 13 o 8.432000 0.4187000 9.534000 0.5230000 7.329000 0.6540000 2.205000       0.8374000 
1 1 1 32 25 15 o 12.44000 0.3259000 12.90000 0.4697000 11.98000 0.4519000 0.9278000      0.6517000 
1 1 1 32 25 17 o 13.02000 0.4387000 13.47000 0.4542000 12.58000 0.7507000 0.8947000      0.8774000 
1 1 1 32 25 19 o 6.629000 0.9607000 7.712000 0.5475000 5.547000 1.842000  2.165000       1.921000  
1 1 1 32 25 21 o 4.330000 1.020000  4.205000 1.582000  4.454000 1.287000  -0.2488000     2.039000  
1 1 1 32 25 23 o 12.07000 0.4918000 10.92000 0.7584000 13.22000 0.6264000 -2.300000      0.9836000 
1 1 1 32 25 25 o 10.44000 0.5467000 9.613000 0.8685000 11.26000 0.6642000 -1.645000      1.093000  
1 1 1 32 25 27 o 3.435000 0.8724000 2.532000 1.018000  4.339000 1.417000  -1.807000      1.745000  
1 1 1 32 25 29 o 12.89000 0.3911000 12.35000 0.4556000 13.43000 0.6359000 -1.082000      0.7823000 
1 1 1 32 25 31 o 9.831000 0.6862000 11.16000 0.5209000 8.498000 1.270000  2.666000       1.372000  
1 1 1 32 25 33 o 4.345000 1.012000  3.661000 1.383000  5.029000 1.478000  -1.368000      2.024000  
1 1 1 32 25 35 o 2.633000 0.8525000 2.747000 1.244000  2.520000 1.166000  0.2269000      1.705000  
1 1 1 32 25 37 o 3.576000 0.9941000 3.396000 1.416000  3.756000 1.396000  -0.3597000     1.988000  
1 1 1 32 25 39 o 4.732000 1.041000  4.171000 1.557000  5.292000 1.384000  -1.121000      2.083000  
1 1 1 32 25 41 o 7.873000 0.8381000 6.539000 1.417000  9.207000 0.8960000 -2.668000      1.676000  
1 1 1 32 26 0  o 5.502000 0.9960000 5.502000 0.9960000 5.502000 0.9960000 0.000000       0.000000  
1 1 1 32 26 2  o 7.142000 0.4905000 7.265000 0.6699000 7.019000 0.7167000 0.2454000      0.9810000 
1 1 1 32 26 4  o 8.913000 0.4071000 8.796000 0.5658000 9.030000 0.5854000 -0.2335000     0.8141000 
1 1 1 32 26 6  o 5.978000 0.7110000 6.891000 0.6364000 5.065000 1.272000  1.826000       1.422000  
1 1 1 32 26 8  o 3.626000 0.8751000 3.944000 1.327000  3.308000 1.141000  0.6357000      1.750000  
1 1 1 32 26 10 o 8.799000 0.3901000 9.543000 0.5261000 8.056000 0.5763000 1.487000       0.7803000 
1 1 1 32 26 12 o 10.06000 0.3418000 10.97000 0.4441000 9.138000 0.5198000 1.834000       0.6836000 
1 1 1 32 26 14 o 2.169000 0.6453000 1.806000 0.8301000 2.532000 0.9883000 -0.7257000     1.291000  
1 1 1 32 26 16 o 15.68000 0.5299000 15.07000 0.6712000 16.29000 0.8201000 -1.214000      1.060000  
1 1 1 32 26 18 o 20.49000 0.4007000 20.64000 0.5141000 20.33000 0.6149000 0.3122000      0.8015000 
1 1 1 32 26 20 o 10.89000 0.5510000 11.80000 0.6739000 9.994000 0.8719000 1.801000       1.102000  
1 1 1 32 26 22 o 4.088000 1.041000  5.202000 1.642000  2.974000 1.280000  2.228000       2.082000  
1 1 1 32 26 24 o 10.18000 0.6944000 8.614000 1.135000  11.75000 0.8003000 -3.138000      1.389000  
1 1 1 32 26 26 o 9.913000 0.9960000 7.947000 1.868000  11.88000 0.6926000 -3.931000      1.992000  
1 1 1 32 26 28 o 10.56000 0.6000000 9.027000 0.9993000 12.09000 0.6643000 -3.058000      1.200000  
1 1 1 32 26 30 o 12.58000 0.6776000 12.08000 0.7537000 13.08000 1.126000  -1.001000      1.355000  
1 1 1 32 26 32 o 3.843000 0.9707000 3.354000 1.316000  4.332000 1.427000  -0.9780000     1.941000  
1 1 1 32 26 34 o 3.436000 0.9817000 4.136000 1.544000  2.737000 1.213000  1.399000       1.963000  
1 1 1 32 26 36 o 3.525000 0.9275000 2.820000 1.305000  4.230000 1.318000  -1.410000      1.855000  
1 1 1 32 26 38 o 4.489000 1.005000  3.975000 1.488000  5.003000 1.352000  -1.027000      2.010000  
1 1 1 32 26 40 o 4.175000 1.029000  3.750000 1.478000  4.599000 1.431000  -0.8489000     2.057000  
1 1 1 32 27 1  o 3.457000 0.8338000 3.553000 1.145000  3.362000 1.212000  0.1913000      1.668000  
1 1 1 32 27 3  o 10.95000 0.3443000 11.05000 0.4861000 10.84000 0.4878000 0.2112000      0.6886000 
1 1 1 32 27 5  o 6.470000 0.5324000 6.964000 0.6778000 5.976000 0.8212000 0.9886000      1.065000  
1 1 1 32 27 7  o 8.667000 0.5106000 8.767000 0.8298000 8.568000 0.5952000 0.1988000      1.021000  
1 1 1 32 27 9  o 5.630000 0.6173000 5.034000 1.007000  6.227000 0.7149000 -1.193000      1.235000  
1 1 1 32 27 11 o 14.78000 0.2894000 14.85000 0.3821000 14.70000 0.4347000 0.1446000      0.5788000 
1 1 1 32 27 13 o 8.109000 0.6177000 8.670000 0.8378000 7.549000 0.9079000 1.122000       1.235000  
1 1 1 32 27 15 o 5.472000 0.8891000 4.754000 1.379000  6.190000 1.123000  -1.436000      1.778000  
1 1 1 32 27 17 o 12.06000 0.5308000 11.66000 0.7113000 12.46000 0.7881000 -0.8030000     1.062000  
1 1 1 32 27 19 o 11.22000 1.209000  12.06000 0.8638000 10.38000 2.258000  1.679000       2.418000  
1 1 1 32 27 21 o 15.57000 0.4601000 15.64000 0.6566000 15.50000 0.6448000 0.1453000      0.9202000 
1 1 1 32 27 23 f 5.485000 0.9470000 4.453000 1.485000  6.518000 1.175000  -2.065000      1.894000  
1 1 1 32 27 25 o 7.151000 0.9027000 6.887000 1.457000  7.415000 1.066000  -0.5282000     1.805000  
1 1 1 32 27 27 o 3.467000 0.9596000 3.548000 1.398000  3.385000 1.315000  0.1630000      1.919000  
1 1 1 32 27 29 o 4.088000 1.535000  4.088000 1.535000  ?        ?         ?              ?         
1 1 1 32 27 31 o 3.662000 0.9966000 4.468000 1.495000  2.857000 1.318000  1.611000       1.993000  
1 1 1 32 27 33 o 4.120000 1.207000  4.696000 1.998000  3.544000 1.356000  1.152000       2.414000  
1 1 1 32 27 35 o 3.127000 0.9578000 3.215000 1.407000  3.038000 1.300000  0.1769000      1.916000  
1 1 1 32 27 37 o 3.959000 1.042000  4.481000 1.541000  3.437000 1.404000  1.044000       2.084000  
1 1 1 32 27 39 o 4.293000 1.038000  3.591000 1.475000  4.996000 1.462000  -1.405000      2.077000  
1 1 1 32 28 0  o 5.444000 1.021000  5.444000 1.021000  5.444000 1.021000  0.000000       0.000000  
1 1 1 32 28 2  o 3.644000 0.8038000 3.577000 1.128000  3.712000 1.146000  -0.1352000     1.608000  
1 1 1 32 28 4  o 23.58000 0.4080000 23.51000 0.5147000 23.64000 0.6331000 -0.1274000     0.8159000 
1 1 1 32 28 6  o 16.18000 0.3753000 16.41000 0.5570000 15.95000 0.5030000 0.4550000      0.7505000 
1 1 1 32 28 8  o 11.24000 0.3209000 11.38000 0.4484000 11.10000 0.4592000 0.2868000      0.6418000 
1 1 1 32 28 10 o 22.56000 0.3113000 22.73000 0.3685000 22.39000 0.5018000 0.3388000      0.6226000 
1 1 1 32 28 12 o 21.12000 0.3630000 21.12000 0.5271000 21.13000 0.4991000 -0.1005000E-01 0.7259000 
1 1 1 32 28 14 o 8.835000 0.5674000 9.576000 0.7635000 8.094000 0.8396000 1.482000       1.135000  
1 1 1 32 28 16 o 3.907000 0.9682000 3.126000 1.305000  4.688000 1.430000  -1.561000      1.936000  
1 1 1 32 28 18 o 7.215000 0.7929000 6.602000 1.148000  7.827000 1.094000  -1.224000      1.586000  
1 1 1 32 28 20 o 7.981000 0.8204000 9.148000 0.8322000 6.815000 1.414000  2.332000       1.641000  
1 1 1 32 28 22 o 19.32000 0.5933000 19.85000 1.016000  18.79000 0.6136000 1.060000       1.187000  
1 1 1 32 28 24 o 16.89000 0.6210000 16.68000 1.053000  17.11000 0.6592000 -0.4309000     1.242000  
1 1 1 32 28 26 o 7.646000 0.7405000 6.944000 1.127000  8.348000 0.9605000 -1.404000      1.481000  
1 1 1 32 28 28 o 8.844000 0.9156000 6.588000 1.330000  11.10000 1.259000  -4.512000      1.831000  
1 1 1 32 28 30 o 6.159000 0.9006000 5.420000 1.428000  6.897000 1.098000  -1.476000      1.801000  
1 1 1 32 28 32 o 5.883000 1.042000  6.640000 1.548000  5.126000 1.395000  1.514000       2.084000  
1 1 1 32 28 34 o 4.524000 1.131000  4.283000 1.488000  4.766000 1.704000  -0.4826000     2.262000  
1 1 1 32 28 36 o 4.108000 1.161000  4.018000 1.639000  4.199000 1.645000  -0.1809000     2.322000  
1 1 1 32 28 38 o 5.609000 1.123000  5.205000 1.717000  6.014000 1.447000  -0.8097000     2.246000  
1 1 1 32 29 1  o 5.891000 0.6424000 5.993000 0.8266000 5.788000 0.9836000 0.2055000      1.285000  
1 1 1 32 29 3  o 6.024000 0.7022000 6.512000 0.7404000 5.536000 1.193000  0.9754000      1.404000  
1 1 1 32 29 5  o 4.665000 0.8293000 4.521000 1.299000  4.808000 1.031000  -0.2867000     1.659000  
1 1 1 32 29 7  o 5.549000 0.6143000 6.600000 0.6943000 4.497000 1.014000  2.103000       1.229000  
1 1 1 32 29 9  o 12.08000 0.4604000 11.39000 0.7056000 12.77000 0.5917000 -1.375000      0.9209000 
1 1 1 32 29 11 o 5.739000 0.8689000 7.142000 1.073000  4.336000 1.367000  2.806000       1.738000  
1 1 1 32 29 13 o 12.49000 0.4487000 12.23000 0.6458000 12.76000 0.6230000 -0.5355000     0.8973000 
1 1 1 32 29 15 o 15.39000 0.4016000 15.66000 0.5702000 15.13000 0.5658000 0.5358000      0.8033000 
1 1 1 32 29 17 o 8.195000 0.6641000 9.169000 0.7967000 7.221000 1.063000  1.948000       1.328000  
1 1 1 32 29 19 o 8.827000 0.9205000 9.542000 0.7229000 8.113000 1.693000  1.429000       1.841000  
1 1 1 32 29 21 o 12.77000 0.5713000 12.76000 0.8390000 12.78000 0.7757000 -0.1640000E-01 1.143000  
1 1 1 32 29 23 o 9.992000 0.8807000 9.504000 1.416000  10.48000 1.047000  -0.9754000     1.761000  
1 1 1 32 29 25 o 3.854000 1.074000  3.592000 1.429000  4.116000 1.604000  -0.5237000     2.148000  
1 1 1 32 29 27 o 8.988000 0.7094000 8.771000 0.9633000 9.206000 1.042000  -0.4348000     1.419000  
1 1 1 32 29 29 o 15.05000 0.4698000 14.29000 0.7158000 15.81000 0.6087000 -1.519000      0.9397000 
1 1 1 32 29 31 o 10.29000 0.6472000 10.66000 0.7461000 9.919000 1.058000  0.7440000      1.294000  
1 1 1 32 29 33 f 10.53000 0.6411000 9.982000 0.9479000 11.08000 0.8635000 -1.099000      1.282000  
1 1 1 32 29 35 o 9.194000 0.7707000 7.809000 1.265000  10.58000 0.8806000 -2.770000      1.541000  
1 1 1 32 29 37 o 4.813000 1.033000  5.136000 1.475000  4.489000 1.445000  0.6463000      2.065000  
1 1 1 32 29 39 o 4.336000 1.931000  4.336000 1.931000  ?        ?         ?              ?         
1 1 1 32 30 0  o 2.469000 1.083000  2.469000 1.083000  2.469000 1.083000  0.000000       0.000000  
1 1 1 32 30 2  o 4.974000 0.7661000 5.503000 0.8309000 4.444000 1.287000  1.059000       1.532000  
1 1 1 32 30 4  o 21.22000 0.3208000 21.32000 0.5052000 21.13000 0.3956000 0.1925000      0.6416000 
1 1 1 32 30 6  o 9.196000 0.3696000 9.043000 0.5205000 9.350000 0.5250000 -0.3071000     0.7393000 
1 1 1 32 30 8  o 10.37000 0.4779000 10.28000 0.7055000 10.46000 0.6449000 -0.1802000     0.9559000 
1 1 1 32 30 10 o 11.14000 0.5198000 11.42000 0.7830000 10.87000 0.6839000 0.5441000      1.040000  
1 1 1 32 30 12 o 3.936000 0.9294000 4.102000 1.270000  3.770000 1.357000  0.3327000      1.859000  
1 1 1 32 30 14 o 6.989000 0.7176000 8.153000 0.7690000 5.824000 1.212000  2.329000       1.435000  
1 1 1 32 30 16 o 6.989000 0.7648000 7.654000 0.8732000 6.323000 1.256000  1.331000       1.530000  
1 1 1 32 30 18 o 19.13000 0.4169000 18.65000 0.5241000 19.61000 0.6485000 -0.9586000     0.8338000 
1 1 1 32 30 20 o 22.42000 0.4479000 23.48000 0.6300000 21.37000 0.6369000 2.110000       0.8958000 
1 1 1 32 30 22 o 5.068000 1.081000  5.501000 1.590000  4.634000 1.466000  0.8675000      2.163000  
1 1 1 32 30 24 o 5.156000 1.005000  4.962000 1.202000  5.351000 1.611000  -0.3898000     2.010000  
1 1 1 32 30 26 o 6.201000 0.9280000 4.538000 1.441000  7.864000 1.170000  -3.325000      1.856000  
1 1 1 32 30 28 o 4.641000 1.112000  3.620000 1.469000  5.662000 1.669000  -2.042000      2.224000  
1 1 1 32 30 30 o 8.449000 0.6862000 8.793000 0.8781000 8.105000 1.055000  0.6883000      1.372000  
1 1 1 32 30 32 o 3.462000 0.9777000 4.352000 1.565000  2.571000 1.172000  1.781000       1.955000  
1 1 1 32 30 34 o 5.892000 0.9673000 4.792000 1.565000  6.992000 1.138000  -2.199000      1.935000  
1 1 1 32 30 36 o 3.434000 0.9769000 4.070000 1.509000  2.799000 1.241000  1.272000       1.954000  
1 1 1 32 30 38 o 3.715000 1.165000  3.978000 1.822000  3.452000 1.452000  0.5259000      2.329000  
1 1 1 32 31 1  o 6.564000 0.6594000 7.004000 0.6923000 6.125000 1.123000  0.8784000      1.319000  
1 1 1 32 31 3  f 7.604000 0.5101000 8.089000 0.7424000 7.118000 0.6999000 0.9712000      1.020000  
1 1 1 32 31 5  o 12.55000 0.3670000 13.01000 0.5458000 12.09000 0.4908000 0.9235000      0.7341000 
1 1 1 32 31 7  o 4.108000 0.9634000 3.424000 1.287000  4.793000 1.434000  -1.369000      1.927000  
1 1 1 32 31 9  f 8.025000 0.6164000 7.909000 0.8921000 8.141000 0.8510000 -0.2323000     1.233000  
1 1 1 32 31 11 o 18.08000 0.3835000 18.91000 0.5224000 17.26000 0.5615000 1.645000       0.7670000 
1 1 1 32 31 13 o 11.56000 0.4696000 11.95000 0.6585000 11.16000 0.6697000 0.7820000      0.9392000 
1 1 1 32 31 15 o 19.66000 0.3934000 20.06000 0.5379000 19.25000 0.5741000 0.8146000      0.7867000 
1 1 1 32 31 17 o 5.174000 0.9335000 3.683000 1.355000  6.665000 1.285000  -2.982000      1.867000  
1 1 1 32 31 19 o 5.578000 1.188000  4.579000 1.556000  6.578000 1.796000  -2.000000      2.376000  
1 1 1 32 31 21 o 7.954000 0.9418000 9.224000 0.9255000 6.684000 1.641000  2.539000       1.884000  
1 1 1 32 31 23 o 3.409000 0.9872000 3.486000 1.358000  3.332000 1.433000  0.1539000      1.974000  
1 1 1 32 31 25 o 4.719000 0.9871000 5.515000 1.305000  3.922000 1.481000  1.592000       1.974000  
1 1 1 32 31 27 o 6.166000 0.9741000 6.136000 1.458000  6.195000 1.293000  -0.5909000E-01 1.948000  
1 1 1 32 31 29 o 6.684000 0.9004000 6.766000 1.252000  6.602000 1.294000  0.1640000      1.801000  
1 1 1 32 31 31 o 6.919000 0.8821000 7.471000 1.077000  6.367000 1.397000  1.104000       1.764000  
1 1 1 32 31 33 o 3.495000 1.001000  3.905000 1.522000  3.085000 1.301000  0.8198000      2.002000  
1 1 1 32 31 35 o 5.836000 0.9577000 5.385000 1.437000  6.287000 1.267000  -0.9022000     1.915000  
1 1 1 32 31 37 o 4.415000 1.150000  4.487000 1.619000  4.343000 1.634000  0.1436000      2.301000  
1 1 1 32 32 0  o 6.980000 0.7949000 6.980000 0.7949000 6.980000 0.7949000 0.000000       0.000000  
1 1 1 32 32 2  o 5.518000 0.6484000 5.739000 0.9647000 5.297000 0.8668000 0.4418000      1.297000  
1 1 1 32 32 4  o 3.093000 0.8012000 3.431000 1.182000  2.755000 1.082000  0.6763000      1.602000  
1 1 1 32 32 6  o 3.617000 0.9061000 2.916000 1.229000  4.317000 1.332000  -1.401000      1.812000  
1 1 1 32 32 8  o 6.754000 0.8255000 6.887000 1.041000  6.621000 1.281000  0.2660000      1.651000  
1 1 1 32 32 10 o 5.404000 1.012000  6.019000 1.562000  4.788000 1.287000  1.231000       2.024000  
1 1 1 32 32 12 o 9.930000 0.5732000 9.472000 0.8217000 10.39000 0.7993000 -0.9163000     1.146000  
1 1 1 32 32 14 o 11.80000 0.4828000 12.15000 0.6806000 11.45000 0.6851000 0.6960000      0.9657000 
1 1 1 32 32 16 o 14.47000 0.4948000 14.73000 0.7321000 14.20000 0.6659000 0.5261000      0.9897000 
1 1 1 32 32 18 o 12.27000 0.5548000 11.65000 0.7242000 12.88000 0.8407000 -1.235000      1.110000  
1 1 1 32 32 20 o 7.829000 0.9177000 8.773000 0.9164000 6.886000 1.590000  1.887000       1.835000  
1 1 1 32 32 22 o 11.17000 0.5977000 10.67000 0.8959000 11.66000 0.7912000 -0.9886000     1.195000  
1 1 1 32 32 24 o 9.278000 0.7019000 10.13000 0.9302000 8.431000 1.051000  1.694000       1.404000  
1 1 1 32 32 26 o 6.978000 0.8818000 8.117000 1.079000  5.839000 1.395000  2.278000       1.764000  
1 1 1 32 32 28 o 5.784000 1.159000  5.869000 1.619000  5.698000 1.659000  0.1715000      2.318000  
1 1 1 32 32 30 o 3.458000 0.9551000 4.077000 1.420000  2.839000 1.277000  1.238000       1.910000  
1 1 1 32 32 32 f 3.796000 1.048000  3.367000 1.345000  4.225000 1.609000  -0.8576000     2.097000  
1 1 1 32 32 34 o 2.902000 0.9036000 2.352000 1.123000  3.451000 1.416000  -1.098000      1.807000  
1 1 1 32 32 36 o 4.029000 1.069000  4.515000 1.609000  3.543000 1.407000  0.9713000      2.138000  
1 1 1 32 33 1  o 6.218000 0.6310000 6.526000 0.9203000 5.909000 0.8637000 0.6167000      1.262000  
1 1 1 32 33 3  o 2.832000 0.7869000 2.504000 1.114000  3.161000 1.112000  -0.6568000     1.574000  
1 1 1 32 33 5  o 11.17000 0.4474000 11.53000 0.6078000 10.82000 0.6568000 0.7132000      0.8949000 
1 1 1 32 33 7  o 6.111000 0.7916000 6.672000 1.072000  5.550000 1.165000  1.122000       1.583000  
1 1 1 32 33 9  o 7.735000 0.6522000 7.408000 0.9156000 8.063000 0.9289000 -0.6554000     1.304000  
1 1 1 32 33 11 f 21.46000 0.3921000 20.69000 0.5759000 22.23000 0.5322000 -1.534000      0.7842000 
1 1 1 32 33 13 o 10.54000 0.5581000 10.53000 0.8559000 10.55000 0.7165000 -0.1639000E-01 1.116000  
1 1 1 32 33 15 f 4.295000 0.9924000 5.725000 1.489000  2.865000 1.312000  2.861000       1.985000  
1 1 1 32 33 17 o 12.71000 0.5105000 12.89000 0.6320000 12.54000 0.8019000 0.3546000      1.021000  
1 1 1 32 33 19 o 6.461000 0.9986000 6.913000 1.132000  6.008000 1.646000  0.9056000      1.997000  
1 1 1 32 33 21 o 18.67000 0.5371000 18.85000 0.6845000 18.48000 0.8279000 0.3752000      1.074000  
1 1 1 32 33 23 o 13.37000 0.5698000 13.64000 0.8290000 13.11000 0.7820000 0.5310000      1.140000  
1 1 1 32 33 25 o 5.080000 1.033000  5.198000 1.478000  4.962000 1.444000  0.2362000      2.066000  
1 1 1 32 33 27 o 9.210000 0.7144000 8.539000 0.9744000 9.881000 1.045000  -1.342000      1.429000  
1 1 1 32 33 29 o 2.898000 0.8856000 2.489000 1.154000  3.307000 1.344000  -0.8177000     1.771000  
1 1 1 32 33 31 o 4.075000 1.008000  3.875000 1.359000  4.276000 1.490000  -0.4007000     2.017000  
1 1 1 32 33 33 o 5.084000 0.9979000 3.974000 1.525000  6.195000 1.288000  -2.222000      1.996000  
1 1 1 32 33 35 o 9.327000 1.786000  9.327000 1.786000  ?        ?         ?              ?         
1 1 1 32 34 0  o 9.820000 0.8098000 9.820000 0.8098000 9.820000 0.8098000 0.000000       0.000000  
1 1 1 32 34 2  o 8.825000 0.4565000 9.058000 0.7060000 8.592000 0.5790000 0.4666000      0.9131000 
1 1 1 32 34 4  o 12.77000 0.4261000 13.40000 0.5646000 12.15000 0.6383000 1.254000       0.8522000 
1 1 1 32 34 6  o 3.709000 0.9476000 3.111000 1.324000  4.308000 1.356000  -1.197000      1.895000  
1 1 1 32 34 8  o 4.957000 1.059000  5.302000 1.505000  4.612000 1.488000  0.6900000      2.117000  
1 1 1 32 34 10 o 3.389000 0.9802000 3.619000 1.435000  3.160000 1.336000  0.4590000      1.960000  
1 1 1 32 34 12 o 6.148000 0.9959000 5.977000 1.354000  6.320000 1.461000  -0.3427000     1.992000  
1 1 1 32 34 14 o 6.886000 0.7393000 6.688000 0.9971000 7.083000 1.092000  -0.3950000     1.479000  
1 1 1 32 34 16 o 11.21000 0.5106000 11.58000 0.6389000 10.83000 0.7967000 0.7499000      1.021000  
1 1 1 32 34 18 o 6.846000 0.8564000 7.007000 0.9910000 6.684000 1.397000  0.3230000      1.713000  
1 1 1 32 34 20 o 3.735000 1.074000  3.766000 1.539000  3.703000 1.498000  0.6314000E-01  2.148000  
1 1 1 32 34 22 o 8.807000 0.7807000 7.356000 1.346000  10.26000 0.7921000 -2.902000      1.561000  
1 1 1 32 34 24 o 5.348000 1.035000  5.440000 1.473000  5.257000 1.454000  0.1839000      2.070000  
1 1 1 32 34 26 o 3.809000 1.030000  3.722000 1.435000  3.897000 1.479000  -0.1749000     2.061000  
1 1 1 32 34 28 o 3.238000 0.9526000 3.108000 1.339000  3.368000 1.355000  -0.2597000     1.905000  
1 1 1 32 34 30 o 4.629000 1.062000  4.642000 1.518000  4.616000 1.485000  0.2623000E-01  2.123000  
1 1 1 32 34 32 o 4.735000 1.198000  5.032000 1.797000  4.439000 1.586000  0.5929000      2.397000  
1 1 1 32 35 1  o 4.431000 0.9894000 3.532000 1.646000  5.331000 1.099000  -1.799000      1.979000  
1 1 1 32 35 3  o 5.372000 0.6582000 5.924000 1.121000  4.820000 0.6904000 1.103000       1.316000  
1 1 1 32 35 5  o 9.850000 0.5973000 10.99000 0.7765000 8.712000 0.9078000 2.276000       1.195000  
1 1 1 32 35 7  o 3.060000 0.9315000 3.075000 1.309000  3.044000 1.325000  0.3053000E-01  1.863000  
1 1 1 32 35 9  o 9.956000 0.6922000 10.38000 0.8809000 9.532000 1.068000  0.8478000      1.384000  
1 1 1 32 35 11 o 9.023000 0.6873000 9.012000 1.102000  9.034000 0.8217000 -0.2190000E-01 1.375000  
1 1 1 32 35 13 o 5.622000 0.8544000 6.818000 1.015000  4.425000 1.374000  2.393000       1.709000  
1 1 1 32 35 15 o 4.884000 1.044000  4.461000 1.342000  5.308000 1.600000  -0.8471000     2.089000  
1 1 1 32 35 17 o 6.233000 1.083000  6.077000 1.552000  6.388000 1.510000  -0.3108000     2.165000  
1 1 1 32 35 19 o 12.10000 0.6694000 12.59000 0.6943000 11.61000 1.145000  0.9819000      1.339000  
1 1 1 32 35 21 o 5.755000 0.9232000 5.780000 1.291000  5.731000 1.320000  0.4864000E-01  1.846000  
1 1 1 32 35 23 o 5.192000 0.9432000 4.402000 1.384000  5.982000 1.282000  -1.580000      1.886000  
1 1 1 32 35 25 o 3.103000 0.9271000 3.373000 1.344000  2.833000 1.278000  0.5404000      1.854000  
1 1 1 32 35 27 o 4.052000 1.012000  4.567000 1.477000  3.538000 1.384000  1.028000       2.024000  
1 1 1 32 35 29 o 3.893000 1.062000  4.026000 1.558000  3.760000 1.443000  0.2661000      2.123000  
1 1 1 32 35 31 o 4.735000 1.001000  5.562000 1.389000  3.907000 1.442000  1.655000       2.003000  
1 1 1 32 36 0  o 3.488000 1.341000  3.488000 1.341000  3.488000 1.341000  0.000000       0.000000  
1 1 1 32 36 2  o 3.611000 0.7767000 4.095000 1.226000  3.127000 0.9540000 0.9684000      1.553000  
1 1 1 32 36 4  o 6.760000 0.7128000 6.813000 0.9867000 6.707000 1.029000  0.1059000      1.426000  
1 1 1 32 36 6  o 5.805000 0.8643000 6.963000 1.076000  4.647000 1.353000  2.316000       1.729000  
1 1 1 32 36 8  o 7.395000 0.6211000 7.228000 0.9440000 7.562000 0.8073000 -0.3340000     1.242000  
1 1 1 32 36 10 o 11.97000 0.4880000 12.28000 0.6314000 11.66000 0.7443000 0.6120000      0.9760000 
1 1 1 32 36 12 o 8.270000 0.7401000 8.678000 0.9823000 7.863000 1.107000  0.8144000      1.480000  
1 1 1 32 36 14 o 3.914000 1.020000  4.932000 1.561000  2.895000 1.313000  2.037000       2.040000  
1 1 1 32 36 16 o 7.498000 0.8159000 7.031000 1.173000  7.965000 1.135000  -0.9342000     1.632000  
1 1 1 32 36 18 o 10.45000 0.5538000 10.57000 0.7924000 10.32000 0.7739000 0.2510000      1.108000  
1 1 1 32 36 20 o 3.405000 0.9808000 3.538000 1.388000  3.272000 1.387000  0.2653000      1.962000  
1 1 1 32 36 22 o 3.107000 0.9439000 2.786000 1.244000  3.428000 1.420000  -0.6422000     1.888000  
1 1 1 32 36 24 o 3.971000 0.9660000 4.673000 1.393000  3.269000 1.339000  1.404000       1.932000  
1 1 1 32 36 26 o 3.938000 1.049000  4.315000 1.531000  3.561000 1.436000  0.7542000      2.099000  
1 1 1 32 36 28 o 4.185000 1.075000  4.296000 1.532000  4.075000 1.508000  0.2211000      2.150000  
1 1 1 32 36 30 o 4.182000 1.100000  4.686000 1.503000  3.678000 1.606000  1.008000       2.200000  
1 1 1 32 37 1  o 5.319000 1.101000  4.841000 1.629000  5.797000 1.481000  -0.9552000     2.202000  
1 1 1 32 37 3  o 3.863000 1.049000  3.658000 1.270000  4.068000 1.670000  -0.4095000     2.098000  
1 1 1 32 37 5  o 3.244000 0.9190000 3.427000 1.339000  3.061000 1.259000  0.3658000      1.838000  
1 1 1 32 37 7  o 10.28000 0.5875000 9.819000 0.8507000 10.74000 0.8105000 -0.9160000     1.175000  
1 1 1 32 37 9  o 5.980000 1.178000  5.983000 1.326000  5.976000 1.948000  0.7004000E-02  2.357000  
1 1 1 32 37 11 o 12.34000 0.7090000 12.81000 1.150000  11.88000 0.8290000 0.9315000      1.418000  
1 1 1 32 37 13 o 7.409000 0.7191000 7.280000 1.041000  7.538000 0.9924000 -0.2579000     1.438000  
1 1 1 32 37 15 o 9.251000 0.5733000 9.780000 0.8041000 8.722000 0.8172000 1.058000       1.147000  
1 1 1 32 37 17 o 3.498000 0.9685000 3.275000 1.345000  3.720000 1.394000  -0.4442000     1.937000  
1 1 1 32 37 19 o 4.689000 1.083000  4.368000 1.430000  5.010000 1.627000  -0.6414000     2.166000  
1 1 1 32 37 21 f 5.939000 0.9351000 6.174000 1.210000  5.703000 1.426000  0.4713000      1.870000  
1 1 1 32 37 23 o 5.115000 0.9779000 3.617000 1.431000  6.613000 1.333000  -2.996000      1.956000  
1 1 1 32 37 25 o 3.611000 0.8872000 2.140000 1.038000  5.082000 1.439000  -2.942000      1.774000  
1 1 1 32 37 27 o 4.078000 1.026000  4.640000 1.476000  3.516000 1.425000  1.124000       2.052000  
1 1 1 32 37 29 o 4.342000 1.054000  4.163000 1.497000  4.520000 1.484000  -0.3570000     2.108000  
1 1 1 32 38 0  o 5.544000 1.684000  5.544000 1.684000  5.544000 1.684000  0.000000       0.000000  
1 1 1 32 38 2  o 7.313000 1.180000  7.502000 1.770000  7.123000 1.561000  0.3792000      2.360000  
1 1 1 32 38 4  o 7.686000 1.019000  8.793000 0.5959000 6.580000 1.950000  2.213000       2.039000  
1 1 1 32 38 6  o 4.836000 0.9158000 5.253000 1.155000  4.418000 1.421000  0.8355000      1.832000  
1 1 1 32 38 8  o 4.019000 0.9196000 3.646000 1.293000  4.392000 1.308000  -0.7459000     1.839000  
1 1 1 32 38 10 o 12.04000 0.4907000 11.86000 0.6574000 12.23000 0.7286000 -0.3671000     0.9814000 
1 1 1 32 38 12 o 4.894000 0.9951000 4.781000 1.495000  5.006000 1.314000  -0.2249000     1.990000  
1 1 1 32 38 14 o 8.933000 0.6666000 9.521000 0.8829000 8.344000 0.9989000 1.177000       1.333000  
1 1 1 32 38 16 o 3.478000 0.9497000 3.544000 1.311000  3.412000 1.375000  0.1325000      1.899000  
1 1 1 32 38 18 o 3.897000 0.9861000 4.170000 1.331000  3.624000 1.455000  0.5464000      1.972000  
1 1 1 32 38 20 o 6.645000 0.9331000 6.798000 1.201000  6.492000 1.429000  0.3055000      1.866000  
1 1 1 32 38 22 o 3.981000 1.050000  3.315000 1.469000  4.648000 1.501000  -1.333000      2.100000  
1 1 1 32 38 24 o 5.307000 1.018000  4.434000 1.489000  6.181000 1.387000  -1.747000      2.035000  
1 1 1 32 38 26 o 5.275000 0.9840000 5.501000 1.361000  5.050000 1.422000  0.4508000      1.968000  
1 1 1 32 38 28 o 3.256000 0.9507000 3.579000 1.404000  2.934000 1.282000  0.6452000      1.901000  
1 1 1 32 39 1  o 5.630000 0.9506000 7.608000 1.215000  3.652000 1.463000  3.957000       1.901000  
1 1 1 32 39 3  o 6.456000 0.9969000 8.879000 1.158000  4.032000 1.623000  4.847000       1.994000  
1 1 1 32 39 5  o 8.562000 0.6717000 7.957000 0.6494000 9.166000 1.176000  -1.209000      1.343000  
1 1 1 32 39 7  o 4.057000 0.9878000 4.289000 1.292000  3.825000 1.495000  0.4637000      1.976000  
1 1 1 32 39 9  o 16.52000 0.5238000 16.85000 0.5347000 16.19000 0.9010000 0.6587000      1.048000  
1 1 1 32 39 11 o 12.78000 0.5699000 13.09000 0.8638000 12.47000 0.7436000 0.6199000      1.140000  
1 1 1 32 39 13 o 7.763000 0.7500000 7.844000 1.043000  7.682000 1.078000  0.1616000      1.500000  
1 1 1 32 39 15 o 3.274000 0.9053000 4.080000 1.402000  2.469000 1.145000  1.612000       1.811000  
1 1 1 32 39 17 o 11.45000 0.5750000 12.87000 0.6621000 10.03000 0.9403000 2.844000       1.150000  
1 1 1 32 39 19 o 3.944000 1.059000  3.389000 1.369000  4.499000 1.615000  -1.109000      2.117000  
1 1 1 32 39 21 o 3.793000 1.005000  3.414000 1.381000  4.173000 1.462000  -0.7588000     2.011000  
1 1 1 32 39 23 o 4.949000 1.067000  4.773000 1.536000  5.126000 1.481000  -0.3528000     2.133000  
1 1 1 32 39 25 o 3.338000 0.9700000 3.489000 1.415000  3.187000 1.328000  0.3018000      1.940000  
1 1 1 32 39 27 o 3.728000 1.694000  ?        ?         3.728000 1.694000  ?              ?         
1 1 1 32 40 0  o 5.439000 1.511000  5.439000 1.511000  5.439000 1.511000  0.000000       0.000000  
1 1 1 32 40 2  o 4.707000 1.094000  3.884000 1.625000  5.529000 1.464000  -1.645000      2.187000  
1 1 1 32 40 4  o 6.375000 1.117000  6.155000 1.596000  6.595000 1.564000  -0.4395000     2.234000  
1 1 1 32 40 6  f 3.776000 1.011000  3.307000 1.253000  4.244000 1.586000  -0.9377000     2.021000  
1 1 1 32 40 8  o 7.091000 0.8926000 7.906000 0.9254000 6.276000 1.527000  1.630000       1.785000  
1 1 1 32 40 10 o 5.603000 0.9516000 4.620000 1.369000  6.586000 1.322000  -1.966000      1.903000  
1 1 1 32 40 12 o 2.590000 0.8340000 2.586000 1.176000  2.595000 1.183000  -0.8512000E-02 1.668000  
1 1 1 32 40 14 o 3.539000 0.9776000 3.679000 1.366000  3.399000 1.399000  0.2795000      1.955000  
1 1 1 32 40 16 o 9.475000 0.6149000 10.13000 0.7928000 8.824000 0.9401000 1.302000       1.230000  
1 1 1 32 40 18 o 3.604000 1.019000  3.867000 1.473000  3.341000 1.408000  0.5267000      2.038000  
1 1 1 32 40 20 o 5.090000 0.9777000 6.431000 1.302000  3.749000 1.459000  2.682000       1.955000  
1 1 1 32 40 22 o 6.210000 0.9206000 5.289000 1.499000  7.131000 1.068000  -1.842000      1.841000  
1 1 1 32 40 24 o 6.768000 0.8638000 6.416000 1.289000  7.119000 1.150000  -0.7026000     1.728000  
1 1 1 32 41 1  o 3.859000 1.063000  3.895000 1.524000  3.822000 1.482000  0.7305000E-01  2.126000  
1 1 1 32 41 3  o 5.018000 1.180000  5.967000 1.722000  4.068000 1.614000  1.899000       2.361000  
1 1 1 32 41 5  o 4.918000 1.128000  5.614000 1.628000  4.222000 1.562000  1.392000       2.256000  
1 1 1 32 41 7  o 3.346000 0.9527000 3.091000 1.214000  3.602000 1.469000  -0.5110000     1.905000  
1 1 1 32 41 9  f 4.418000 1.040000  4.263000 1.330000  4.574000 1.598000  -0.3115000     2.080000  
1 1 1 32 41 11 o 4.120000 0.9944000 3.873000 1.221000  4.366000 1.570000  -0.4932000     1.989000  
1 1 1 32 41 13 o 5.013000 1.000000  4.103000 1.428000  5.923000 1.401000  -1.820000      2.000000  
1 1 1 32 41 15 o 7.289000 0.7411000 7.429000 0.9718000 7.149000 1.119000  0.2797000      1.482000  
1 1 1 32 41 17 o 3.881000 0.9859000 3.165000 1.322000  4.596000 1.463000  -1.431000      1.972000  
1 1 1 32 41 19 o 5.692000 1.109000  6.560000 1.351000  4.823000 1.760000  1.737000       2.219000  
1 1 1 32 41 21 o 3.644000 0.9992000 3.811000 1.461000  3.478000 1.363000  0.3326000      1.998000  
1 1 1 32 41 23 o 2.709000 0.8798000 2.963000 1.315000  2.456000 1.169000  0.5075000      1.760000  
1 1 1 32 42 0  o 3.499000 1.439000  3.499000 1.439000  3.499000 1.439000  0.000000       0.000000  
1 1 1 32 42 2  o 4.352000 1.143000  4.621000 1.682000  4.084000 1.548000  0.5369000      2.286000  
1 1 1 32 42 4  o 4.514000 1.170000  4.818000 1.645000  4.210000 1.665000  0.6085000      2.341000  
1 1 1 32 42 6  o 11.62000 0.6887000 11.54000 0.9715000 11.70000 0.9764000 -0.1571000     1.377000  
1 1 1 32 42 8  o 5.184000 1.225000  5.610000 1.764000  4.758000 1.701000  0.8517000      2.451000  
1 1 1 32 42 10 o 4.530000 1.008000  3.118000 1.289000  5.942000 1.549000  -2.823000      2.015000  
1 1 1 32 42 12 o 3.415000 0.9994000 3.237000 1.294000  3.593000 1.523000  -0.3556000     1.999000  
1 1 1 32 42 14 o 3.663000 0.9936000 3.193000 1.196000  4.132000 1.587000  -0.9395000     1.987000  
1 1 1 32 42 16 o 7.015000 0.8103000 7.184000 1.153000  6.846000 1.139000  0.3388000      1.621000  
1 1 1 32 42 18 o 3.902000 1.001000  3.839000 1.434000  3.966000 1.397000  -0.1274000     2.002000  
1 1 1 32 42 20 o 3.383000 1.022000  3.340000 1.417000  3.427000 1.473000  -0.8676000E-01 2.044000  
1 1 1 32 43 1  o 3.887000 1.080000  3.977000 1.563000  3.798000 1.490000  0.1797000      2.160000  
1 1 1 32 43 3  o 3.658000 1.090000  4.480000 1.705000  2.836000 1.358000  1.645000       2.179000  
1 1 1 32 43 5  o 7.180000 0.9611000 8.238000 1.200000  6.122000 1.502000  2.117000       1.922000  
1 1 1 32 43 7  o 7.644000 1.036000  7.351000 1.335000  7.936000 1.585000  -0.5857000     2.072000  
1 1 1 32 43 9  o 7.328000 1.058000  8.961000 1.331000  5.695000 1.646000  3.266000       2.117000  
1 1 1 32 43 11 o 5.320000 1.081000  6.140000 1.294000  4.500000 1.732000  1.640000       2.162000  
1 1 1 32 43 13 o 8.065000 0.7459000 7.312000 0.7826000 8.818000 1.270000  -1.507000      1.492000  
1 1 1 32 43 15 o 6.451000 1.015000  7.655000 0.8144000 5.247000 1.859000  2.408000       2.030000  
1 1 1 32 43 17 o 4.516000 1.036000  4.247000 1.272000  4.785000 1.635000  -0.5385000     2.072000  
1 1 1 32 44 0  o 5.770000 1.525000  5.770000 1.525000  5.770000 1.525000  0.000000       0.000000  
1 1 1 32 44 2  o 6.714000 1.100000  6.647000 1.610000  6.782000 1.500000  -0.1353000     2.200000  
1 1 1 32 44 4  o 5.381000 1.168000  6.315000 1.627000  4.447000 1.676000  1.868000       2.335000  
1 1 1 32 44 6  f 10.52000 0.7791000 10.31000 1.138000  10.73000 1.064000  -0.4162000     1.558000  
1 1 1 32 44 8  o 4.202000 1.187000  4.338000 1.633000  4.065000 1.725000  0.2734000      2.375000  
1 1 1 32 44 10 o 4.461000 1.179000  4.166000 1.670000  4.755000 1.666000  -0.5894000     2.359000  
1 1 1 32 44 12 o 5.683000 1.235000  6.078000 1.653000  5.287000 1.835000  0.7916000      2.470000  
1 1 1 32 44 14 o 3.469000 1.115000  2.704000 1.262000  4.234000 1.838000  -1.530000      2.230000  
1 1 1 32 45 1  o 4.405000 1.114000  5.002000 1.618000  3.808000 1.533000  1.193000       2.229000  
1 1 1 32 45 3  o 3.478000 1.097000  3.732000 1.624000  3.225000 1.475000  0.5064000      2.194000  
1 1 1 32 45 5  o 3.817000 1.086000  3.987000 1.568000  3.647000 1.504000  0.3397000      2.173000  
1 1 1 32 45 7  o 5.362000 1.268000  5.568000 1.750000  5.155000 1.836000  0.4136000      2.537000  
1 1 1 32 45 9  o 4.686000 1.335000  4.609000 1.765000  4.763000 2.003000  -0.1540000     2.670000  
1 1 1 32 45 11 o 6.641000 1.557000  5.183000 2.039000  8.099000 2.353000  -2.916000      3.114000  
1 1 1 32 46 0  o 6.526000 2.245000  6.526000 2.245000  6.526000 2.245000  0.000000       0.000000  
1 1 1 32 46 2  o 3.326000 1.070000  3.230000 1.457000  3.423000 1.567000  -0.1930000     2.140000  
1 1 1 32 46 4  o 6.002000 2.212000  ?        ?         6.002000 2.212000  ?              ?         
1 1 1 33 0  1  o 22.56000 0.5363000 22.56000 0.5363000 22.56000 0.5363000 0.000000       0.000000  
1 1 1 33 0  3  o 10.72000 0.7969000 10.72000 0.7969000 10.72000 0.7969000 0.000000       0.000000  
1 1 1 33 0  5  o 6.770000 1.007000  6.770000 1.007000  6.770000 1.007000  0.000000       0.000000  
1 1 1 33 0  7  o 41.41000 0.4979000 41.41000 0.4979000 41.41000 0.4979000 0.000000       0.000000  
1 1 1 33 0  9  o 4.268000 1.436000  4.268000 1.436000  4.268000 1.436000  0.000000       0.000000  
1 1 1 33 0  11 o 7.642000 0.8016000 7.642000 0.8016000 7.642000 0.8016000 0.000000       0.000000  
1 1 1 33 0  13 o 37.99000 0.4736000 37.99000 0.4736000 37.99000 0.4736000 0.000000       0.000000  
1 1 1 33 0  15 o 11.14000 0.6341000 11.14000 0.6341000 11.14000 0.6341000 0.000000       0.000000  
1 1 1 33 0  17 o 8.683000 0.7284000 8.683000 0.7284000 8.683000 0.7284000 0.000000       0.000000  
1 1 1 33 0  19 o 14.86000 0.4817000 14.86000 0.4817000 14.86000 0.4817000 0.000000       0.000000  
1 1 1 33 0  21 o 13.85000 0.5096000 13.85000 0.5096000 13.85000 0.5096000 0.000000       0.000000  
1 1 1 33 0  23 o 23.66000 0.5229000 23.66000 0.5229000 23.66000 0.5229000 0.000000       0.000000  
1 1 1 33 0  25 o 21.74000 0.7207000 21.74000 0.7207000 21.74000 0.7207000 0.000000       0.000000  
1 1 1 33 0  27 o 7.483000 0.8417000 7.483000 0.8417000 7.483000 0.8417000 0.000000       0.000000  
1 1 1 33 0  29 o 13.35000 0.5984000 13.35000 0.5984000 13.35000 0.5984000 0.000000       0.000000  
1 1 1 33 0  31 o 11.21000 0.7177000 11.21000 0.7177000 11.21000 0.7177000 0.000000       0.000000  
1 1 1 33 0  33 o 3.002000 1.228000  3.002000 1.228000  3.002000 1.228000  0.000000       0.000000  
1 1 1 33 0  35 o 5.513000 1.218000  5.513000 1.218000  5.513000 1.218000  0.000000       0.000000  
1 1 1 33 0  37 o 2.508000 1.132000  2.508000 1.132000  2.508000 1.132000  0.000000       0.000000  
1 1 1 33 0  39 o 4.701000 1.360000  4.701000 1.360000  4.701000 1.360000  0.000000       0.000000  
1 1 1 33 0  41 o 2.527000 1.166000  2.527000 1.166000  2.527000 1.166000  0.000000       0.000000  
1 1 1 33 0  43 o 2.458000 1.155000  2.458000 1.155000  2.458000 1.155000  0.000000       0.000000  
1 1 1 33 0  45 o 6.567000 1.414000  6.567000 1.414000  6.567000 1.414000  0.000000       0.000000  
1 1 1 33 0  47 o 6.945000 1.173000  6.945000 1.173000  6.945000 1.173000  0.000000       0.000000  
1 1 1 33 1  0  o 31.43000 0.5195000 31.43000 0.5195000 31.43000 0.5195000 0.000000       0.000000  
1 1 1 33 1  2  o 47.74000 0.4466000 47.51000 0.6318000 47.97000 0.6313000 -0.4599000     0.8931000 
1 1 1 33 1  4  o 19.76000 0.3515000 20.06000 0.4605000 19.47000 0.5312000 0.5863000      0.7030000 
1 1 1 33 1  6  o 20.11000 0.3198000 20.29000 0.4441000 19.93000 0.4602000 0.3637000      0.6395000 
1 1 1 33 1  8  o 44.15000 0.4526000 43.37000 0.5156000 44.92000 0.7441000 -1.553000      0.9053000 
1 1 1 33 1  10 f 26.82000 0.3259000 27.11000 0.4882000 26.53000 0.4319000 0.5730000      0.6518000 
1 1 1 33 1  12 o 24.00000 0.3067000 24.44000 0.4328000 23.57000 0.4346000 0.8725000      0.6134000 
1 1 1 33 1  14 o 17.43000 0.3290000 17.80000 0.4695000 17.05000 0.4610000 0.7534000      0.6580000 
1 1 1 33 1  16 o 20.83000 0.3082000 20.44000 0.4330000 21.23000 0.4386000 -0.7955000     0.6163000 
1 1 1 33 1  18 o 21.36000 0.3080000 21.85000 0.4386000 20.86000 0.4324000 0.9899000      0.6159000 
1 1 1 33 1  20 o 4.737000 0.8918000 5.373000 1.148000  4.100000 1.365000  1.273000       1.784000  
1 1 1 33 1  22 o 15.72000 0.3897000 15.90000 0.5533000 15.53000 0.5488000 0.3672000      0.7793000 
1 1 1 33 1  24 o 14.52000 0.4303000 14.09000 0.6713000 14.94000 0.5386000 -0.8522000     0.8606000 
1 1 1 33 1  26 o 14.02000 0.4568000 14.70000 0.6607000 13.35000 0.6309000 1.348000       0.9135000 
1 1 1 33 1  28 o 9.183000 0.5766000 8.968000 0.8923000 9.398000 0.7306000 -0.4301000     1.153000  
1 1 1 33 1  30 o 8.964000 0.5096000 8.722000 0.7667000 9.205000 0.6715000 -0.4838000     1.019000  
1 1 1 33 1  32 o 8.079000 0.5966000 7.819000 0.8019000 8.340000 0.8835000 -0.5209000     1.193000  
1 1 1 33 1  34 f 3.574000 0.9637000 3.256000 1.358000  3.893000 1.367000  -0.6377000     1.927000  
1 1 1 33 1  36 o 5.034000 0.8547000 4.954000 1.213000  5.113000 1.204000  -0.1589000     1.709000  
1 1 1 33 1  38 o 11.04000 0.4896000 10.31000 0.7390000 11.77000 0.6424000 -1.453000      0.9792000 
1 1 1 33 1  40 o 7.770000 0.7320000 6.649000 1.077000  8.892000 0.9918000 -2.243000      1.464000  
1 1 1 33 1  42 o 5.080000 1.079000  5.354000 1.494000  4.807000 1.556000  0.5469000      2.157000  
1 1 1 33 1  44 f 7.821000 0.8328000 8.404000 0.9951000 7.238000 1.336000  1.166000       1.666000  
1 1 1 33 1  46 o 3.090000 0.9293000 2.529000 1.205000  3.651000 1.415000  -1.122000      1.859000  
1 1 1 33 1  48 o 3.237000 0.9356000 3.033000 1.304000  3.442000 1.342000  -0.4083000     1.871000  
1 1 1 33 2  1  o 26.33000 0.3388000 26.28000 0.4442000 26.38000 0.5117000 -0.1031000     0.6776000 
1 1 1 33 2  3  o 23.22000 0.3524000 23.11000 0.4439000 23.33000 0.5475000 -0.2270000     0.7049000 
1 1 1 33 2  5  o 4.150000 1.027000  4.620000 1.332000  3.681000 1.563000  0.9387000      2.054000  
1 1 1 33 2  7  o 21.36000 0.3711000 21.62000 0.4521000 21.10000 0.5886000 0.5252000      0.7422000 
1 1 1 33 2  9  o 8.987000 0.5381000 8.717000 0.7602000 9.257000 0.7618000 -0.5399000     1.076000  
1 1 1 33 2  11 o 12.21000 0.4220000 12.13000 0.6404000 12.28000 0.5497000 -0.1496000     0.8440000 
1 1 1 33 2  13 o 30.14000 0.3856000 30.11000 0.4391000 30.18000 0.6339000 -0.7387000E-01 0.7711000 
1 1 1 33 2  15 o 3.916000 0.9446000 3.338000 1.243000  4.494000 1.422000  -1.156000      1.889000  
1 1 1 33 2  17 o 21.45000 0.3345000 21.37000 0.4361000 21.53000 0.5073000 -0.1580000     0.6690000 
1 1 1 33 2  19 o 29.63000 0.3326000 29.84000 0.4427000 29.43000 0.4965000 0.4076000      0.6652000 
1 1 1 33 2  21 o 17.76000 0.3212000 18.20000 0.4587000 17.32000 0.4496000 0.8794000      0.6423000 
1 1 1 33 2  23 o 3.825000 0.8895000 2.906000 1.230000  4.743000 1.285000  -1.836000      1.779000  
1 1 1 33 2  25 o 20.10000 0.3764000 19.34000 0.5622000 20.86000 0.5007000 -1.515000      0.7529000 
1 1 1 33 2  27 o 9.250000 0.6841000 9.100000 1.195000  9.400000 0.6653000 -0.3002000     1.368000  
1 1 1 33 2  29 o 18.81000 0.4097000 19.01000 0.6781000 18.61000 0.4601000 0.4091000      0.8195000 
1 1 1 33 2  31 f 2.666000 0.8043000 2.261000 1.051000  3.071000 1.218000  -0.8099000     1.609000  
1 1 1 33 2  33 o 3.102000 0.8535000 3.692000 1.266000  2.511000 1.145000  1.181000       1.707000  
1 1 1 33 2  35 o 2.812000 0.8415000 3.071000 1.244000  2.552000 1.133000  0.5188000      1.683000  
1 1 1 33 2  37 o 11.42000 0.4628000 11.39000 0.5710000 11.44000 0.7284000 -0.4845000E-01 0.9255000 
1 1 1 33 2  39 o 4.385000 0.9839000 3.932000 1.446000  4.837000 1.334000  -0.9046000     1.968000  
1 1 1 33 2  41 o 7.766000 0.7335000 8.458000 0.9201000 7.074000 1.143000  1.384000       1.467000  
1 1 1 33 2  43 o 11.44000 0.5538000 11.89000 0.6691000 10.99000 0.8825000 0.9030000      1.108000  
1 1 1 33 2  45 o 5.684000 0.9607000 5.727000 1.329000  5.640000 1.388000  0.8776000E-01  1.921000  
1 1 1 33 2  47 o 4.093000 1.055000  4.638000 1.579000  3.548000 1.399000  1.090000       2.110000  
1 1 1 33 3  0  o 25.92000 0.4363000 25.92000 0.4363000 25.92000 0.4363000 0.000000       0.000000  
1 1 1 33 3  2  o 33.60000 0.3267000 33.20000 0.4611000 34.01000 0.4629000 -0.8191000     0.6534000 
1 1 1 33 3  4  o 40.81000 0.4241000 40.39000 0.4927000 41.22000 0.6904000 -0.8263000     0.8481000 
1 1 1 33 3  6  o 20.93000 0.4724000 20.30000 0.4366000 21.55000 0.8378000 -1.252000      0.9448000 
1 1 1 33 3  8  o 16.45000 0.4593000 16.04000 0.5179000 16.85000 0.7587000 -0.8087000     0.9186000 
1 1 1 33 3  10 o 15.83000 0.3770000 15.90000 0.4989000 15.77000 0.5652000 0.1286000      0.7539000 
1 1 1 33 3  12 o 30.55000 0.3585000 29.99000 0.4987000 31.10000 0.5152000 -1.104000      0.7170000 
1 1 1 33 3  14 o 3.593000 0.9449000 3.313000 1.246000  3.874000 1.421000  -0.5610000     1.890000  
1 1 1 33 3  16 o 22.11000 0.3023000 22.08000 0.4295000 22.15000 0.4255000 -0.7872000E-01 0.6046000 
1 1 1 33 3  18 o 3.693000 0.8902000 4.018000 1.268000  3.367000 1.250000  0.6505000      1.780000  
1 1 1 33 3  20 o 11.58000 0.4076000 11.27000 0.6039000 11.89000 0.5476000 -0.6136000     0.8152000 
1 1 1 33 3  22 o 13.37000 0.3812000 13.87000 0.5280000 12.88000 0.5500000 0.9810000      0.7625000 
1 1 1 33 3  24 o 27.24000 0.3968000 27.74000 0.6413000 26.75000 0.4675000 0.9899000      0.7936000 
1 1 1 33 3  26 o 4.946000 0.8788000 3.978000 1.435000  5.913000 1.014000  -1.935000      1.758000  
1 1 1 33 3  28 o 8.126000 0.5853000 7.494000 0.8977000 8.759000 0.7512000 -1.265000      1.171000  
1 1 1 33 3  30 o 10.04000 0.6314000 9.778000 1.007000  10.30000 0.7621000 -0.5266000     1.263000  
1 1 1 33 3  32 o 15.12000 0.3554000 15.56000 0.5090000 14.67000 0.4960000 0.8909000      0.7107000 
1 1 1 33 3  34 o 20.90000 0.3210000 20.90000 0.4590000 20.90000 0.4490000 0.3868000E-02  0.6421000 
1 1 1 33 3  36 o 20.32000 0.3533000 20.20000 0.4721000 20.43000 0.5258000 -0.2303000     0.7067000 
1 1 1 33 3  38 o 13.04000 0.4295000 13.32000 0.5100000 12.75000 0.6912000 0.5665000      0.8590000 
1 1 1 33 3  40 o 3.511000 1.029000  3.271000 1.324000  3.751000 1.575000  -0.4806000     2.058000  
1 1 1 33 3  42 o 4.593000 1.028000  5.342000 1.403000  3.844000 1.503000  1.498000       2.057000  
1 1 1 33 3  44 o 4.873000 1.017000  3.953000 1.406000  5.793000 1.469000  -1.840000      2.034000  
1 1 1 33 3  46 o 4.834000 1.054000  4.737000 1.573000  4.930000 1.403000  -0.1931000     2.107000  
1 1 1 33 3  48 o 5.404000 1.026000  4.927000 1.591000  5.881000 1.295000  -0.9538000     2.051000  
1 1 1 33 4  1  o 30.19000 0.3151000 29.63000 0.4432000 30.76000 0.4480000 -1.127000      0.6302000 
1 1 1 33 4  3  o 24.95000 0.3328000 24.38000 0.4447000 25.53000 0.4953000 -1.143000      0.6657000 
1 1 1 33 4  5  o 14.58000 0.3918000 14.59000 0.5186000 14.57000 0.5874000 0.1680000E-01  0.7836000 
1 1 1 33 4  7  o 26.01000 0.3401000 25.92000 0.4330000 26.09000 0.5247000 -0.1711000     0.6803000 
1 1 1 33 4  9  o 25.24000 0.3342000 25.33000 0.4320000 25.16000 0.5101000 0.1703000      0.6684000 
1 1 1 33 4  11 f 15.91000 0.3402000 16.16000 0.4788000 15.67000 0.4833000 0.4840000      0.6803000 
1 1 1 33 4  13 f 12.27000 0.4349000 12.37000 0.6459000 12.17000 0.5824000 0.2015000      0.8697000 
1 1 1 33 4  15 o 11.96000 0.4105000 11.74000 0.5836000 12.18000 0.5775000 -0.4357000     0.8210000 
1 1 1 33 4  17 o 9.105000 0.4797000 9.035000 0.6615000 9.174000 0.6949000 -0.1393000     0.9594000 
1 1 1 33 4  19 o 23.76000 0.3023000 23.29000 0.4341000 24.23000 0.4207000 -0.9386000     0.6045000 
1 1 1 33 4  21 o 4.860000 0.8861000 4.953000 1.386000  4.768000 1.105000  0.1848000      1.772000  
1 1 1 33 4  23 o 7.494000 0.7054000 7.848000 1.051000  7.140000 0.9406000 0.7083000      1.411000  
1 1 1 33 4  25 o 10.84000 0.4613000 10.13000 0.6896000 11.54000 0.6130000 -1.416000      0.9226000 
1 1 1 33 4  27 o 15.51000 0.4080000 15.89000 0.5270000 15.12000 0.6231000 0.7674000      0.8161000 
1 1 1 33 4  29 o 10.09000 0.5506000 10.61000 0.7560000 9.570000 0.8007000 1.043000       1.101000  
1 1 1 33 4  31 o 3.516000 0.9280000 3.304000 1.375000  3.728000 1.246000  -0.4242000     1.856000  
1 1 1 33 4  33 o 10.97000 0.4207000 11.63000 0.5820000 10.30000 0.6075000 1.332000       0.8413000 
1 1 1 33 4  35 o 13.11000 0.4052000 13.29000 0.4950000 12.94000 0.6417000 0.3474000      0.8104000 
1 1 1 33 4  37 o 7.684000 0.6707000 7.787000 0.8313000 7.580000 1.053000  0.2069000      1.341000  
1 1 1 33 4  39 o 11.48000 0.5278000 12.36000 0.7141000 10.61000 0.7776000 1.750000       1.056000  
1 1 1 33 4  41 o 11.37000 0.7108000 11.37000 0.7108000 ?        ?         ?              ?         
1 1 1 33 4  43 o 13.79000 0.5005000 13.82000 0.7839000 13.75000 0.6224000 0.7483000E-01  1.001000  
1 1 1 33 4  45 o 6.953000 0.7965000 6.689000 1.177000  7.217000 1.073000  -0.5285000     1.593000  
1 1 1 33 4  47 o 7.484000 0.7322000 7.139000 1.125000  7.828000 0.9378000 -0.6895000     1.464000  
1 1 1 33 5  0  o 18.52000 0.5523000 18.52000 0.5523000 18.52000 0.5523000 0.000000       0.000000  
1 1 1 33 5  2  o 23.37000 0.3300000 22.83000 0.4446000 23.91000 0.4878000 -1.079000      0.6600000 
1 1 1 33 5  4  o 25.95000 0.3362000 26.43000 0.4934000 25.46000 0.4568000 0.9732000      0.6724000 
1 1 1 33 5  6  o 8.691000 0.5589000 8.889000 0.7572000 8.492000 0.8223000 0.3975000      1.118000  
1 1 1 33 5  8  o 36.72000 0.4100000 36.15000 0.4700000 37.30000 0.6719000 -1.153000      0.8200000 
1 1 1 33 5  10 o 12.67000 0.4285000 13.08000 0.5687000 12.27000 0.6412000 0.8107000      0.8571000 
1 1 1 33 5  12 o 31.92000 0.3199000 31.51000 0.4529000 32.33000 0.4518000 -0.8254000     0.6397000 
1 1 1 33 5  14 o 17.05000 0.3580000 17.53000 0.5201000 16.57000 0.4920000 0.9541000      0.7159000 
1 1 1 33 5  16 o 16.20000 0.3337000 16.40000 0.4624000 15.99000 0.4812000 0.4074000      0.6673000 
1 1 1 33 5  18 o 3.338000 0.8828000 3.773000 1.328000  2.904000 1.163000  0.8698000      1.766000  
1 1 1 33 5  20 f 14.18000 0.3794000 14.94000 0.5418000 13.42000 0.5313000 1.520000       0.7588000 
1 1 1 33 5  22 o 17.45000 0.3629000 17.74000 0.5478000 17.16000 0.4762000 0.5825000      0.7259000 
1 1 1 33 5  24 o 14.83000 0.4047000 14.02000 0.6056000 15.64000 0.5369000 -1.620000      0.8093000 
1 1 1 33 5  26 o 4.633000 0.9052000 4.016000 1.313000  5.251000 1.246000  -1.235000      1.810000  
1 1 1 33 5  28 o 13.09000 0.4273000 12.79000 0.5781000 13.40000 0.6294000 -0.6082000     0.8546000 
1 1 1 33 5  30 o 7.373000 0.6193000 7.767000 0.8779000 6.980000 0.8736000 0.7873000      1.239000  
1 1 1 33 5  32 o 10.01000 0.4653000 9.777000 0.7009000 10.24000 0.6122000 -0.4643000     0.9306000 
1 1 1 33 5  34 o 3.525000 0.9393000 3.431000 1.331000  3.618000 1.326000  -0.1867000     1.879000  
1 1 1 33 5  36 o 13.25000 0.4121000 13.59000 0.5136000 12.90000 0.6447000 0.6981000      0.8242000 
1 1 1 33 5  38 o 10.67000 0.5945000 9.871000 0.7836000 11.46000 0.8941000 -1.591000      1.189000  
1 1 1 33 5  40 o 3.314000 0.9958000 3.448000 1.367000  3.179000 1.448000  0.2685000      1.992000  
1 1 1 33 5  42 o 10.44000 0.5711000 10.67000 0.7450000 10.22000 0.8658000 0.4514000      1.142000  
1 1 1 33 5  44 o 4.045000 0.9810000 3.382000 1.344000  4.708000 1.429000  -1.326000      1.962000  
1 1 1 33 5  46 o 4.126000 1.027000  4.730000 1.484000  3.521000 1.420000  1.209000       2.054000  
1 1 1 33 5  48 o 7.541000 0.8015000 8.837000 0.9417000 6.244000 1.297000  2.593000       1.603000  
1 1 1 33 6  1  o 27.82000 0.3550000 27.15000 0.5090000 28.49000 0.4950000 -1.342000      0.7100000 
1 1 1 33 6  3  o 42.81000 0.3866000 43.02000 0.5848000 42.60000 0.5059000 0.4228000      0.7732000 
1 1 1 33 6  5  o 15.44000 0.3723000 16.01000 0.5334000 14.86000 0.5195000 1.153000       0.7445000 
1 1 1 33 6  7  o 6.362000 0.7218000 6.500000 0.9816000 6.223000 1.059000  0.2768000      1.444000  
1 1 1 33 6  9  f 15.40000 0.3913000 15.49000 0.5065000 15.30000 0.5967000 0.1893000      0.7827000 
1 1 1 33 6  11 o 19.78000 0.3403000 20.19000 0.5113000 19.36000 0.4491000 0.8328000      0.6805000 
1 1 1 33 6  13 o 16.64000 0.3604000 16.88000 0.5353000 16.41000 0.4826000 0.4682000      0.7207000 
1 1 1 33 6  15 o 29.37000 0.3665000 29.37000 0.5889000 29.38000 0.4364000 -0.8986000E-02 0.7330000 
1 1 1 33 6  17 o 23.73000 0.3210000 23.41000 0.4769000 24.06000 0.4298000 -0.6496000     0.6420000 
1 1 1 33 6  19 o 26.12000 0.3019000 26.14000 0.4227000 26.11000 0.4312000 0.3746000E-01  0.6038000 
1 1 1 33 6  21 o 11.79000 0.4406000 12.16000 0.6430000 11.42000 0.6027000 0.7352000      0.8813000 
1 1 1 33 6  23 o 34.60000 0.3531000 34.10000 0.5250000 35.11000 0.4723000 -1.010000      0.7062000 
1 1 1 33 6  25 o 13.67000 0.4139000 12.84000 0.5927000 14.49000 0.5778000 -1.655000      0.8277000 
1 1 1 33 6  27 o 16.23000 0.3584000 16.45000 0.5216000 16.00000 0.4918000 0.4465000      0.7169000 
1 1 1 33 6  29 o 12.22000 0.4085000 12.34000 0.5663000 12.10000 0.5888000 0.2399000      0.8170000 
1 1 1 33 6  31 o 3.910000 0.8897000 4.422000 1.265000  3.398000 1.251000  1.023000       1.779000  
1 1 1 33 6  33 o 10.63000 0.4517000 10.34000 0.6854000 10.93000 0.5885000 -0.5950000     0.9034000 
1 1 1 33 6  35 f 7.938000 0.6978000 7.871000 0.9697000 8.004000 1.004000  -0.1334000     1.396000  
1 1 1 33 6  37 o 7.061000 0.6934000 7.185000 0.8513000 6.937000 1.095000  0.2481000      1.387000  
1 1 1 33 6  39 o 4.337000 0.9922000 4.522000 1.304000  4.152000 1.495000  0.3698000      1.984000  
1 1 1 33 6  41 o 12.05000 0.4974000 12.35000 0.6346000 11.76000 0.7661000 0.5902000      0.9949000 
1 1 1 33 6  43 o 8.322000 0.6769000 7.944000 0.9950000 8.699000 0.9181000 -0.7552000     1.354000  
1 1 1 33 6  45 o 5.322000 0.9668000 5.663000 1.341000  4.982000 1.393000  0.6810000      1.934000  
1 1 1 33 6  47 o 8.287000 0.6763000 8.359000 0.9786000 8.216000 0.9339000 0.1421000      1.353000  
1 1 1 33 7  0  o 52.24000 0.5747000 52.24000 0.5747000 52.24000 0.5747000 0.000000       0.000000  
1 1 1 33 7  2  f 19.23000 0.3385000 19.05000 0.4936000 19.42000 0.4633000 -0.3648000     0.6769000 
1 1 1 33 7  4  o 30.95000 0.3750000 30.94000 0.6056000 30.96000 0.4426000 -0.2160000E-01 0.7501000 
1 1 1 33 7  6  o 23.84000 0.3248000 24.06000 0.4761000 23.62000 0.4420000 0.4416000      0.6496000 
1 1 1 33 7  8  o 30.76000 0.3400000 30.81000 0.4944000 30.71000 0.4668000 0.9660000E-01  0.6799000 
1 1 1 33 7  10 o 20.89000 0.3590000 20.47000 0.5016000 21.31000 0.5137000 -0.8387000     0.7180000 
1 1 1 33 7  12 o 33.99000 0.3640000 34.09000 0.5112000 33.88000 0.5182000 0.2109000      0.7279000 
1 1 1 33 7  14 f 22.68000 0.3020000 22.62000 0.4261000 22.73000 0.4282000 -0.1011000     0.6041000 
1 1 1 33 7  16 o 19.57000 0.3313000 19.29000 0.4958000 19.86000 0.4395000 -0.5724000     0.6626000 
1 1 1 33 7  18 o 7.010000 0.6226000 7.015000 0.8873000 7.005000 0.8738000 0.9730000E-02  1.245000  
1 1 1 33 7  20 o 15.67000 0.3726000 15.30000 0.4698000 16.05000 0.5786000 -0.7540000     0.7453000 
1 1 1 33 7  22 o 11.29000 0.4156000 11.04000 0.5774000 11.54000 0.5978000 -0.4992000     0.8312000 
1 1 1 33 7  24 o 11.79000 0.4664000 10.90000 0.7404000 12.68000 0.5672000 -1.781000      0.9327000 
1 1 1 33 7  26 o 5.233000 0.8292000 5.146000 1.231000  5.319000 1.111000  -0.1731000     1.658000  
1 1 1 33 7  28 o 4.438000 0.8920000 3.643000 1.306000  5.233000 1.216000  -1.590000      1.784000  
1 1 1 33 7  30 o 4.802000 0.8463000 4.396000 1.274000  5.208000 1.115000  -0.8111000     1.693000  
1 1 1 33 7  32 o 2.739000 0.8345000 2.642000 1.165000  2.837000 1.195000  -0.1954000     1.669000  
1 1 1 33 7  34 o 2.963000 0.8580000 3.217000 1.241000  2.709000 1.185000  0.5075000      1.716000  
1 1 1 33 7  36 o 4.906000 0.9089000 5.180000 1.340000  4.632000 1.229000  0.5474000      1.818000  
1 1 1 33 7  38 o 13.96000 0.4228000 13.84000 0.5514000 14.07000 0.6410000 -0.2306000     0.8456000 
1 1 1 33 7  40 o 13.05000 0.5409000 13.51000 0.7150000 12.59000 0.8118000 0.9263000      1.082000  
1 1 1 33 7  42 o 6.537000 0.7838000 6.294000 1.102000  6.780000 1.115000  -0.4860000     1.568000  
1 1 1 33 7  44 o 8.854000 0.6472000 8.797000 0.9285000 8.911000 0.9017000 -0.1142000     1.294000  
1 1 1 33 7  46 o 5.766000 0.8693000 7.775000 0.9878000 3.758000 1.431000  4.018000       1.739000  
1 1 1 33 7  48 o 6.232000 1.195000  5.358000 1.854000  7.105000 1.508000  -1.747000      2.390000  
1 1 1 33 8  1  o 23.35000 0.3150000 23.45000 0.4482000 23.25000 0.4427000 0.1963000      0.6300000 
1 1 1 33 8  3  o 44.83000 0.3989000 44.21000 0.5187000 45.45000 0.6062000 -1.243000      0.7978000 
1 1 1 33 8  5  o 15.96000 0.3550000 16.79000 0.4771000 15.13000 0.5257000 1.660000       0.7099000 
1 1 1 33 8  7  o 13.77000 0.3777000 14.40000 0.5161000 13.15000 0.5516000 1.247000       0.7555000 
1 1 1 33 8  9  o 21.85000 0.3145000 21.95000 0.4292000 21.74000 0.4598000 0.2134000      0.6290000 
1 1 1 33 8  11 o 28.44000 0.3368000 27.70000 0.4319000 29.18000 0.5170000 -1.480000      0.6736000 
1 1 1 33 8  13 o 2.940000 0.8570000 3.145000 1.245000  2.735000 1.178000  0.4096000      1.714000  
1 1 1 33 8  15 o 4.151000 0.8236000 3.202000 1.185000  5.100000 1.144000  -1.898000      1.647000  
1 1 1 33 8  17 o 13.06000 0.3645000 12.93000 0.5092000 13.19000 0.5216000 -0.2596000     0.7289000 
1 1 1 33 8  19 o 10.53000 0.4316000 10.14000 0.6058000 10.93000 0.6150000 -0.7876000     0.8633000 
1 1 1 33 8  21 o 9.101000 0.5390000 9.365000 0.7779000 8.837000 0.7464000 0.5272000      1.078000  
1 1 1 33 8  23 o 22.80000 0.3338000 22.68000 0.5011000 22.92000 0.4409000 -0.2375000     0.6675000 
1 1 1 33 8  25 o 17.92000 0.3607000 17.99000 0.5188000 17.84000 0.5012000 0.1483000      0.7213000 
1 1 1 33 8  27 o 8.849000 0.5235000 8.168000 0.8242000 9.530000 0.6457000 -1.362000      1.047000  
1 1 1 33 8  29 o 5.829000 0.7875000 6.262000 1.049000  5.397000 1.175000  0.8654000      1.575000  
1 1 1 33 8  31 o 8.234000 0.5654000 9.055000 0.7970000 7.413000 0.8022000 1.643000       1.131000  
1 1 1 33 8  33 o 8.458000 0.5651000 8.587000 0.6887000 8.330000 0.8961000 0.2574000      1.130000  
1 1 1 33 8  35 o 8.016000 0.7102000 7.671000 0.7213000 8.361000 1.224000  -0.6905000     1.420000  
1 1 1 33 8  37 o 3.485000 0.9712000 3.571000 1.395000  3.399000 1.351000  0.1715000      1.942000  
1 1 1 33 8  39 o 3.663000 0.9943000 3.131000 1.266000  4.195000 1.533000  -1.063000      1.989000  
1 1 1 33 8  41 o 6.575000 0.7981000 6.346000 1.099000  6.805000 1.157000  -0.4588000     1.596000  
1 1 1 33 8  43 o 6.416000 0.8761000 6.075000 1.360000  6.756000 1.105000  -0.6815000     1.752000  
1 1 1 33 8  45 o 2.828000 0.8803000 2.637000 1.199000  3.018000 1.289000  -0.3809000     1.761000  
1 1 1 33 8  47 o 4.845000 1.023000  5.012000 1.387000  4.678000 1.506000  0.3340000      2.047000  
1 1 1 33 9  0  o 3.722000 1.302000  3.722000 1.302000  3.722000 1.302000  0.000000       0.000000  
1 1 1 33 9  2  o 30.24000 0.3133000 30.42000 0.4443000 30.06000 0.4417000 0.3618000      0.6266000 
1 1 1 33 9  4  o 51.21000 0.3993000 51.41000 0.5677000 51.01000 0.5616000 0.3952000      0.7986000 
1 1 1 33 9  6  o 29.61000 0.3093000 29.36000 0.4295000 29.85000 0.4451000 -0.4916000     0.6185000 
1 1 1 33 9  8  o 15.85000 0.3751000 15.68000 0.5358000 16.03000 0.5250000 -0.3435000     0.7502000 
1 1 1 33 9  10 o 5.819000 0.7646000 5.961000 1.009000  5.677000 1.149000  0.2847000      1.529000  
1 1 1 33 9  12 o 10.30000 0.4769000 10.25000 0.6093000 10.35000 0.7339000 -0.1045000     0.9539000 
1 1 1 33 9  14 o 16.59000 0.3610000 16.73000 0.4655000 16.45000 0.5518000 0.2812000      0.7219000 
1 1 1 33 9  16 o 29.57000 0.3269000 29.63000 0.4931000 29.51000 0.4294000 0.1109000      0.6538000 
1 1 1 33 9  18 o 12.25000 0.3930000 12.94000 0.5225000 11.56000 0.5870000 1.371000       0.7859000 
1 1 1 33 9  20 o 5.147000 1.008000  5.023000 1.523000  5.270000 1.321000  -0.2470000     2.016000  
1 1 1 33 9  22 o 18.86000 0.3176000 18.86000 0.4296000 18.86000 0.4678000 -0.4074000E-02 0.6351000 
1 1 1 33 9  24 o 30.62000 0.3549000 31.01000 0.5111000 30.24000 0.4925000 0.7727000      0.7098000 
1 1 1 33 9  26 o 4.840000 0.8687000 4.447000 1.227000  5.233000 1.230000  -0.7860000     1.737000  
1 1 1 33 9  28 o 11.88000 0.4785000 12.23000 0.7171000 11.54000 0.6336000 0.6934000      0.9569000 
1 1 1 33 9  30 f 8.424000 0.5358000 9.213000 0.7299000 7.635000 0.7845000 1.578000       1.072000  
1 1 1 33 9  32 o 11.65000 0.4280000 11.72000 0.4940000 11.58000 0.6991000 0.1477000      0.8560000 
1 1 1 33 9  34 o 11.81000 0.5663000 13.03000 0.5272000 10.58000 1.002000  2.457000       1.133000  
1 1 1 33 9  36 f 5.912000 0.8258000 5.015000 1.252000  6.809000 1.077000  -1.794000      1.652000  
1 1 1 33 9  38 o 8.696000 0.6087000 7.968000 0.8708000 9.424000 0.8507000 -1.456000      1.217000  
1 1 1 33 9  40 o 9.361000 0.5460000 9.171000 0.6778000 9.550000 0.8562000 -0.3793000     1.092000  
1 1 1 33 9  42 o 9.542000 0.5604000 9.714000 0.7814000 9.371000 0.8037000 0.3429000      1.121000  
1 1 1 33 9  44 o 6.443000 0.8347000 6.628000 1.148000  6.258000 1.212000  0.3701000      1.669000  
1 1 1 33 9  46 o 3.740000 0.9717000 3.361000 1.338000  4.120000 1.409000  -0.7590000     1.943000  
1 1 1 33 10 1  o 31.72000 0.3159000 32.22000 0.4513000 31.23000 0.4422000 0.9901000      0.6319000 
1 1 1 33 10 3  o 3.586000 0.9208000 3.694000 1.323000  3.478000 1.282000  0.2154000      1.842000  
1 1 1 33 10 5  o 11.12000 0.4304000 10.81000 0.6127000 11.44000 0.6048000 -0.6327000     0.8609000 
1 1 1 33 10 7  o 7.442000 0.6835000 6.815000 0.9059000 8.068000 1.024000  -1.254000      1.367000  
1 1 1 33 10 9  o 7.911000 0.6463000 7.002000 0.9070000 8.819000 0.9208000 -1.818000      1.293000  
1 1 1 33 10 11 o 7.503000 0.6446000 7.211000 0.8762000 7.796000 0.9458000 -0.5851000     1.289000  
1 1 1 33 10 13 o 12.05000 0.4846000 11.59000 0.5444000 12.51000 0.8018000 -0.9192000     0.9692000 
1 1 1 33 10 15 f 18.20000 0.3515000 18.09000 0.4509000 18.32000 0.5394000 -0.2288000     0.7031000 
1 1 1 33 10 17 o 20.28000 0.3516000 20.08000 0.4878000 20.47000 0.5066000 -0.3917000     0.7032000 
1 1 1 33 10 19 o 11.50000 0.4662000 11.55000 0.6220000 11.45000 0.6946000 0.1090000      0.9324000 
1 1 1 33 10 21 o 15.89000 0.3764000 16.21000 0.4580000 15.56000 0.5974000 0.6515000      0.7527000 
1 1 1 33 10 23 o 11.31000 0.4592000 11.49000 0.5651000 11.14000 0.7239000 0.3480000      0.9183000 
1 1 1 33 10 25 o 4.892000 0.8552000 4.591000 1.322000  5.193000 1.085000  -0.6018000     1.710000  
1 1 1 33 10 27 o 13.29000 0.3714000 12.83000 0.5432000 13.75000 0.5068000 -0.9151000     0.7429000 
1 1 1 33 10 29 o 12.00000 0.4306000 12.18000 0.5931000 11.82000 0.6245000 0.3608000      0.8612000 
1 1 1 33 10 31 o 2.445000 0.7848000 2.352000 1.056000  2.539000 1.161000  -0.1871000     1.570000  
1 1 1 33 10 33 o 15.93000 0.4459000 16.14000 0.4302000 15.71000 0.7812000 0.4289000      0.8918000 
1 1 1 33 10 35 o 8.561000 0.5419000 8.780000 0.6611000 8.342000 0.8589000 0.4376000      1.084000  
1 1 1 33 10 37 o 9.879000 0.5435000 10.20000 0.7022000 9.561000 0.8296000 0.6357000      1.087000  
1 1 1 33 10 39 o 11.82000 0.4980000 11.48000 0.5571000 12.17000 0.8256000 -0.6896000     0.9959000 
1 1 1 33 10 41 o 5.322000 1.036000  5.907000 1.260000  4.736000 1.644000  1.171000       2.071000  
1 1 1 33 10 43 o 5.191000 0.9346000 4.660000 1.393000  5.722000 1.246000  -1.062000      1.869000  
1 1 1 33 10 45 o 3.791000 1.033000  4.261000 1.568000  3.321000 1.345000  0.9406000      2.066000  
1 1 1 33 10 47 o 3.234000 0.9368000 3.032000 1.285000  3.435000 1.364000  -0.4024000     1.874000  
1 1 1 33 11 0  o 5.218000 1.253000  5.218000 1.253000  5.218000 1.253000  0.000000       0.000000  
1 1 1 33 11 2  o 20.15000 0.3153000 19.76000 0.4479000 20.54000 0.4440000 -0.7736000     0.6307000 
1 1 1 33 11 4  o 4.297000 0.9020000 4.687000 1.253000  3.907000 1.298000  0.7794000      1.804000  
1 1 1 33 11 6  o 17.56000 0.3564000 17.25000 0.4902000 17.88000 0.5175000 -0.6271000     0.7129000 
1 1 1 33 11 8  o 11.76000 0.4363000 12.05000 0.5193000 11.47000 0.7014000 0.5777000      0.8727000 
1 1 1 33 11 10 o 12.47000 0.3966000 12.65000 0.5306000 12.28000 0.5895000 0.3698000      0.7932000 
1 1 1 33 11 12 o 19.59000 0.3418000 19.43000 0.4418000 19.74000 0.5217000 -0.3104000     0.6836000 
1 1 1 33 11 14 o 3.837000 0.8176000 2.290000 1.047000  5.384000 1.256000  -3.094000      1.635000  
1 1 1 33 11 16 o 15.60000 0.4150000 15.39000 0.6160000 15.80000 0.5563000 -0.4056000     0.8300000 
1 1 1 33 11 18 o 14.74000 0.3984000 15.01000 0.6062000 14.47000 0.5170000 0.5425000      0.7967000 
1 1 1 33 11 20 o 10.27000 0.4347000 10.04000 0.5912000 10.51000 0.6375000 -0.4707000     0.8694000 
1 1 1 33 11 22 o 8.436000 0.6533000 8.231000 0.7839000 8.640000 1.045000  -0.4090000     1.307000  
1 1 1 33 11 24 o 17.52000 0.3628000 17.43000 0.4982000 17.60000 0.5275000 -0.1713000     0.7256000 
1 1 1 33 11 26 o 11.94000 0.3992000 11.43000 0.5867000 12.46000 0.5414000 -1.030000      0.7983000 
1 1 1 33 11 28 o 11.55000 0.4067000 11.07000 0.6024000 12.03000 0.5466000 -0.9585000     0.8134000 
1 1 1 33 11 30 o 12.39000 0.4980000 11.82000 0.4973000 12.96000 0.8630000 -1.142000      0.9961000 
1 1 1 33 11 32 f 4.869000 0.8754000 4.551000 1.252000  5.188000 1.224000  -0.6374000     1.751000  
1 1 1 33 11 34 f 5.072000 0.8587000 4.810000 1.118000  5.335000 1.304000  -0.5249000     1.717000  
1 1 1 33 11 36 o 8.595000 0.5988000 8.115000 0.8595000 9.075000 0.8341000 -0.9602000     1.198000  
1 1 1 33 11 38 o 11.10000 0.5372000 11.01000 0.6124000 11.19000 0.8828000 -0.1841000     1.074000  
1 1 1 33 11 40 o 9.513000 0.5682000 9.542000 0.6825000 9.485000 0.9087000 0.5741000E-01  1.136000  
1 1 1 33 11 42 o 5.575000 1.002000  5.022000 1.488000  6.128000 1.342000  -1.106000      2.004000  
1 1 1 33 11 44 o 6.902000 0.7568000 6.516000 1.114000  7.289000 1.025000  -0.7736000     1.514000  
1 1 1 33 11 46 o 4.658000 1.072000  4.794000 1.618000  4.522000 1.407000  0.2721000      2.144000  
1 1 1 33 12 1  o 22.96000 0.3028000 22.59000 0.4370000 23.32000 0.4193000 -0.7272000     0.6056000 
1 1 1 33 12 3  o 20.97000 0.3268000 20.85000 0.4173000 21.08000 0.5031000 -0.2312000     0.6536000 
1 1 1 33 12 5  o 14.30000 0.3832000 14.48000 0.4774000 14.11000 0.5996000 0.3741000      0.7665000 
1 1 1 33 12 7  o 7.121000 0.6150000 6.803000 0.8373000 7.438000 0.9009000 -0.6356000     1.230000  
1 1 1 33 12 9  o 4.729000 0.8894000 4.478000 1.246000  4.981000 1.270000  -0.5029000     1.779000  
1 1 1 33 12 11 o 12.01000 0.4061000 11.37000 0.5726000 12.66000 0.5759000 -1.289000      0.8122000 
1 1 1 33 12 13 o 17.59000 0.3873000 16.92000 0.4335000 18.26000 0.6420000 -1.338000      0.7746000 
1 1 1 33 12 15 o 10.26000 0.4329000 10.20000 0.6304000 10.33000 0.5936000 -0.1251000     0.8659000 
1 1 1 33 12 17 o 11.97000 0.4068000 11.64000 0.6121000 12.29000 0.5361000 -0.6500000     0.8137000 
1 1 1 33 12 19 o 7.735000 0.6379000 8.407000 0.7444000 7.063000 1.036000  1.344000       1.276000  
1 1 1 33 12 21 o 3.419000 0.8674000 3.552000 1.170000  3.286000 1.281000  0.2668000      1.735000  
1 1 1 33 12 23 o 9.347000 0.4417000 9.298000 0.6055000 9.396000 0.6432000 -0.9763000E-01 0.8834000 
1 1 1 33 12 25 o 3.268000 0.8813000 3.347000 1.206000  3.190000 1.285000  0.1566000      1.763000  
1 1 1 33 12 27 o 4.815000 0.9276000 4.533000 1.245000  5.097000 1.375000  -0.5644000     1.855000  
1 1 1 33 12 29 o 14.58000 0.5821000 14.84000 0.4656000 14.32000 1.067000  0.5188000      1.164000  
1 1 1 33 12 31 o 16.87000 0.3462000 16.21000 0.4384000 17.52000 0.5360000 -1.310000      0.6924000 
1 1 1 33 12 33 o 6.270000 0.7401000 5.870000 1.009000  6.670000 1.083000  -0.8000000     1.480000  
1 1 1 33 12 35 f 15.61000 0.3788000 15.23000 0.4840000 15.99000 0.5829000 -0.7567000     0.7576000 
1 1 1 33 12 37 o 12.26000 0.4427000 12.07000 0.5338000 12.46000 0.7065000 -0.3850000     0.8855000 
1 1 1 33 12 39 o 14.13000 0.4029000 13.85000 0.5140000 14.40000 0.6206000 -0.5483000     0.8058000 
1 1 1 33 12 41 o 9.067000 0.6591000 8.498000 0.7061000 9.637000 1.113000  -1.139000      1.318000  
1 1 1 33 12 43 o 8.905000 0.7199000 8.186000 1.204000  9.624000 0.7889000 -1.438000      1.440000  
1 1 1 33 12 45 o 7.655000 0.6685000 7.535000 0.9226000 7.776000 0.9676000 -0.2409000     1.337000  
1 1 1 33 13 0  o 3.590000 1.280000  3.590000 1.280000  3.590000 1.280000  0.000000       0.000000  
1 1 1 33 13 2  o 7.452000 0.6388000 7.527000 0.8361000 7.377000 0.9659000 0.1500000      1.278000  
1 1 1 33 13 4  o 19.47000 0.3034000 19.79000 0.4277000 19.15000 0.4306000 0.6406000      0.6069000 
1 1 1 33 13 6  o 26.72000 0.2987000 26.75000 0.4200000 26.68000 0.4247000 0.7619000E-01  0.5973000 
1 1 1 33 13 8  o 8.003000 0.5608000 8.020000 0.7096000 7.986000 0.8686000 0.3441000E-01  1.122000  
1 1 1 33 13 10 o 27.35000 0.3371000 27.22000 0.5061000 27.48000 0.4453000 -0.2684000     0.6741000 
1 1 1 33 13 12 o 21.72000 0.3753000 22.37000 0.5219000 21.07000 0.5394000 1.308000       0.7505000 
1 1 1 33 13 14 o 31.23000 0.4106000 30.37000 0.6345000 32.10000 0.5212000 -1.723000      0.8211000 
1 1 1 33 13 16 f 28.32000 0.3872000 27.97000 0.6143000 28.67000 0.4715000 -0.7037000     0.7744000 
1 1 1 33 13 18 o 20.58000 0.5201000 20.38000 0.8978000 20.78000 0.5252000 -0.3983000     1.040000  
1 1 1 33 13 20 o 8.107000 0.6324000 9.075000 0.7918000 7.139000 0.9862000 1.936000       1.265000  
1 1 1 33 13 22 f 11.00000 0.4169000 11.28000 0.5926000 10.72000 0.5867000 0.5641000      0.8339000 
1 1 1 33 13 24 o 4.876000 0.7729000 4.602000 1.100000  5.149000 1.086000  -0.5479000     1.546000  
1 1 1 33 13 26 o 5.458000 0.7335000 4.205000 1.210000  6.710000 0.8294000 -2.505000      1.467000  
1 1 1 33 13 28 o 12.91000 0.4845000 12.98000 0.5367000 12.84000 0.8068000 0.1426000      0.9690000 
1 1 1 33 13 30 o 5.038000 0.8866000 5.471000 1.172000  4.605000 1.330000  0.8654000      1.773000  
1 1 1 33 13 32 o 14.85000 0.4308000 14.69000 0.6581000 15.00000 0.5562000 -0.3155000     0.8617000 
1 1 1 33 13 34 o 7.342000 0.6258000 7.385000 0.8198000 7.299000 0.9457000 0.8608000E-01  1.252000  
1 1 1 33 13 36 o 10.97000 0.4567000 10.98000 0.5747000 10.96000 0.7100000 0.1996000E-01  0.9134000 
1 1 1 33 13 38 o 11.17000 0.4704000 11.18000 0.5805000 11.16000 0.7404000 0.1886000E-01  0.9408000 
1 1 1 33 13 40 o 9.904000 0.5319000 9.820000 0.6495000 9.989000 0.8424000 -0.1688000     1.064000  
1 1 1 33 13 42 o 4.806000 0.9683000 5.339000 1.089000  4.272000 1.601000  1.067000       1.937000  
1 1 1 33 13 44 o 4.233000 1.049000  4.176000 1.536000  4.289000 1.428000  -0.1130000     2.097000  
1 1 1 33 13 46 o 3.582000 0.9947000 3.461000 1.359000  3.704000 1.453000  -0.2432000     1.989000  
1 1 1 33 14 1  o 17.96000 0.3478000 17.81000 0.4640000 18.11000 0.5183000 -0.2979000     0.6957000 
1 1 1 33 14 3  o 25.38000 0.2930000 25.69000 0.4114000 25.06000 0.4172000 0.6340000      0.5860000 
1 1 1 33 14 5  o 7.582000 0.5477000 7.176000 0.8168000 7.988000 0.7299000 -0.8116000     1.095000  
1 1 1 33 14 7  o 27.63000 0.3340000 26.92000 0.5198000 28.34000 0.4196000 -1.419000      0.6680000 
1 1 1 33 14 9  o 10.09000 0.5403000 9.779000 0.7657000 10.39000 0.7624000 -0.6137000     1.081000  
1 1 1 33 14 11 o 18.50000 0.3559000 18.54000 0.5371000 18.47000 0.4670000 0.6556000E-01  0.7117000 
1 1 1 33 14 13 o 8.124000 0.5563000 7.931000 0.8597000 8.316000 0.7062000 -0.3852000     1.113000  
1 1 1 33 14 15 o 6.915000 0.6776000 6.737000 0.9858000 7.093000 0.9300000 -0.3560000     1.355000  
1 1 1 33 14 17 o 15.89000 0.3325000 15.71000 0.4761000 16.06000 0.4642000 -0.3472000     0.6649000 
1 1 1 33 14 19 o 6.106000 0.7842000 6.248000 1.068000  5.965000 1.149000  0.2828000      1.568000  
1 1 1 33 14 21 o 7.626000 0.6388000 7.853000 1.023000  7.399000 0.7657000 0.4534000      1.278000  
1 1 1 33 14 23 o 5.602000 0.7958000 5.421000 1.280000  5.782000 0.9456000 -0.3615000     1.592000  
1 1 1 33 14 25 o 14.40000 0.4846000 14.20000 0.8003000 14.59000 0.5467000 -0.3935000     0.9692000 
1 1 1 33 14 27 o 6.521000 0.5961000 6.485000 0.8445000 6.556000 0.8415000 -0.7130000E-01 1.192000  
1 1 1 33 14 29 o 6.441000 0.6572000 6.686000 0.7839000 6.196000 1.055000  0.4899000      1.314000  
1 1 1 33 14 31 o 18.96000 0.3812000 18.92000 0.5599000 19.00000 0.5175000 -0.7144000E-01 0.7625000 
1 1 1 33 14 33 o 12.39000 0.4321000 12.25000 0.5713000 12.52000 0.6485000 -0.2631000     0.8643000 
1 1 1 33 14 35 o 19.00000 0.3362000 18.44000 0.4199000 19.56000 0.5250000 -1.125000      0.6723000 
1 1 1 33 14 37 o 3.524000 0.9031000 2.132000 0.9804000 4.916000 1.517000  -2.783000      1.806000  
1 1 1 33 14 39 o 3.132000 0.8981000 3.305000 1.240000  2.959000 1.299000  0.3467000      1.796000  
1 1 1 33 14 41 o 6.540000 0.7469000 6.763000 0.8840000 6.318000 1.204000  0.4449000      1.494000  
1 1 1 33 14 43 o 14.17000 0.4520000 13.47000 0.5805000 14.86000 0.6928000 -1.393000      0.9039000 
1 1 1 33 14 45 o 4.346000 1.074000  4.301000 1.539000  4.390000 1.498000  -0.8910000E-01 2.148000  
1 1 1 33 15 0  o 10.23000 0.6969000 10.23000 0.6969000 10.23000 0.6969000 0.000000       0.000000  
1 1 1 33 15 2  o 13.50000 0.3616000 13.25000 0.5167000 13.75000 0.5060000 -0.4941000     0.7232000 
1 1 1 33 15 4  o 15.18000 0.3268000 14.76000 0.4594000 15.60000 0.4649000 -0.8483000     0.6536000 
1 1 1 33 15 6  o 22.31000 0.3367000 22.97000 0.5346000 21.65000 0.4096000 1.316000       0.6735000 
1 1 1 33 15 8  o 16.24000 0.3679000 16.19000 0.5603000 16.30000 0.4769000 -0.1099000     0.7357000 
1 1 1 33 15 10 o 14.09000 0.3615000 14.48000 0.4778000 13.70000 0.5425000 0.7807000      0.7230000 
1 1 1 33 15 12 o 17.72000 0.3456000 17.76000 0.4901000 17.68000 0.4873000 0.7887000E-01  0.6911000 
1 1 1 33 15 14 o 15.83000 0.3401000 15.90000 0.4682000 15.76000 0.4935000 0.1350000      0.6803000 
1 1 1 33 15 16 o 3.388000 0.7924000 4.291000 1.178000  2.485000 1.060000  1.806000       1.585000  
1 1 1 33 15 18 o 11.01000 0.4391000 11.65000 0.5349000 10.37000 0.6965000 1.283000       0.8782000 
1 1 1 33 15 20 o 8.570000 0.4755000 8.267000 0.6737000 8.872000 0.6714000 -0.6048000     0.9511000 
1 1 1 33 15 22 o 18.62000 0.3230000 18.89000 0.4266000 18.36000 0.4850000 0.5353000      0.6459000 
1 1 1 33 15 24 f 8.990000 0.4811000 8.880000 0.6211000 9.100000 0.7349000 -0.2197000     0.9622000 
1 1 1 33 15 26 o 4.162000 0.8870000 4.822000 1.321000  3.502000 1.184000  1.320000       1.774000  
1 1 1 33 15 28 o 6.878000 0.6930000 6.418000 1.001000  7.339000 0.9588000 -0.9211000     1.386000  
1 1 1 33 15 30 o 11.67000 0.5066000 11.92000 0.5498000 11.42000 0.8511000 0.4939000      1.013000  
1 1 1 33 15 32 o 12.04000 0.4335000 11.90000 0.6343000 12.18000 0.5911000 -0.2707000     0.8670000 
1 1 1 33 15 34 o 16.65000 0.4126000 16.48000 0.6176000 16.82000 0.5473000 -0.3357000     0.8252000 
1 1 1 33 15 36 o 9.526000 0.5478000 9.922000 0.5610000 9.131000 0.9411000 0.7917000      1.096000  
1 1 1 33 15 38 o 11.41000 0.4409000 10.72000 0.5456000 12.11000 0.6928000 -1.382000      0.8819000 
1 1 1 33 15 40 o 10.79000 0.5123000 11.09000 0.5499000 10.49000 0.8645000 0.5978000      1.025000  
1 1 1 33 15 42 o 8.466000 0.7187000 7.969000 0.7504000 8.963000 1.226000  -0.9942000     1.437000  
1 1 1 33 15 44 o 5.014000 0.9729000 5.490000 1.275000  4.537000 1.470000  0.9534000      1.946000  
1 1 1 33 16 1  o 12.83000 0.4043000 12.11000 0.6345000 13.54000 0.5013000 -1.429000      0.8087000 
1 1 1 33 16 3  o 23.16000 0.2929000 22.95000 0.4078000 23.37000 0.4206000 -0.4207000     0.5858000 
1 1 1 33 16 5  o 11.41000 0.4368000 12.36000 0.6594000 10.46000 0.5731000 1.899000       0.8737000 
1 1 1 33 16 7  o 9.418000 0.4672000 9.045000 0.7024000 9.791000 0.6162000 -0.7469000     0.9344000 
1 1 1 33 16 9  o 10.70000 0.4464000 10.36000 0.6291000 11.04000 0.6336000 -0.6735000     0.8929000 
1 1 1 33 16 11 o 6.056000 0.7129000 6.484000 0.9700000 5.629000 1.045000  0.8545000      1.426000  
1 1 1 33 16 13 f 14.13000 0.3451000 14.00000 0.4804000 14.25000 0.4957000 -0.2488000     0.6903000 
1 1 1 33 16 15 o 13.52000 0.3672000 13.54000 0.4782000 13.50000 0.5574000 0.4005000E-01  0.7344000 
1 1 1 33 16 17 o 9.941000 0.4722000 10.55000 0.5729000 9.337000 0.7508000 1.208000       0.9444000 
1 1 1 33 16 19 o 6.303000 0.6398000 6.766000 0.8698000 5.839000 0.9384000 0.9271000      1.280000  
1 1 1 33 16 21 o 12.85000 0.3801000 12.28000 0.5245000 13.42000 0.5502000 -1.140000      0.7602000 
1 1 1 33 16 23 o 8.852000 0.4536000 8.899000 0.6451000 8.806000 0.6379000 0.9360000E-01  0.9073000 
1 1 1 33 16 25 o 12.72000 0.3522000 12.05000 0.5218000 13.38000 0.4731000 -1.332000      0.7044000 
1 1 1 33 16 27 o 15.09000 0.3661000 14.58000 0.4702000 15.59000 0.5613000 -1.002000      0.7322000 
1 1 1 33 16 29 o 2.799000 0.8502000 2.781000 1.200000  2.816000 1.205000  -0.3478000E-01 1.700000  
1 1 1 33 16 31 o 6.754000 0.6504000 6.004000 0.8924000 7.503000 0.9464000 -1.499000      1.301000  
1 1 1 33 16 33 o 10.27000 0.4894000 9.944000 0.6763000 10.60000 0.7074000 -0.6561000     0.9787000 
1 1 1 33 16 35 f 7.636000 0.6824000 7.838000 0.9094000 7.435000 1.018000  0.4023000      1.365000  
1 1 1 33 16 37 o 10.44000 0.4716000 9.972000 0.5684000 10.90000 0.7527000 -0.9254000     0.9432000 
1 1 1 33 16 39 o 14.19000 0.4060000 14.06000 0.4878000 14.32000 0.6492000 -0.2639000     0.8121000 
1 1 1 33 16 41 o 3.513000 0.9355000 2.915000 1.182000  4.110000 1.450000  -1.195000      1.871000  
1 1 1 33 16 43 o 5.433000 0.9792000 5.552000 1.016000  5.315000 1.674000  0.2365000      1.958000  
1 1 1 33 16 45 o 3.552000 0.9642000 3.346000 1.345000  3.757000 1.382000  -0.4110000     1.928000  
1 1 1 33 17 0  o 2.516000 1.140000  2.516000 1.140000  2.516000 1.140000  0.000000       0.000000  
1 1 1 33 17 2  o 5.318000 1.063000  5.744000 1.632000  4.892000 1.363000  0.8518000      2.126000  
1 1 1 33 17 4  o 19.13000 0.3479000 19.32000 0.5486000 18.93000 0.4280000 0.3844000      0.6958000 
1 1 1 33 17 6  o 16.72000 0.3464000 16.20000 0.5133000 17.25000 0.4655000 -1.050000      0.6929000 
1 1 1 33 17 8  f 18.22000 0.3224000 17.73000 0.4762000 18.72000 0.4347000 -0.9803000     0.6448000 
1 1 1 33 17 10 o 12.81000 0.3535000 12.97000 0.4867000 12.65000 0.5129000 0.3196000      0.7071000 
1 1 1 33 17 12 o 8.468000 0.4819000 8.954000 0.6331000 7.981000 0.7267000 0.9733000      0.9638000 
1 1 1 33 17 14 o 2.971000 0.8148000 3.094000 1.155000  2.849000 1.149000  0.2443000      1.630000  
1 1 1 33 17 16 o 13.23000 0.4178000 14.40000 0.4422000 12.06000 0.7089000 2.345000       0.8355000 
1 1 1 33 17 18 o 17.24000 0.3291000 17.20000 0.4189000 17.28000 0.5077000 -0.7621000E-01 0.6582000 
1 1 1 33 17 20 o 10.60000 0.3974000 10.49000 0.5334000 10.71000 0.5893000 -0.2196000     0.7948000 
1 1 1 33 17 22 o 4.553000 0.8037000 4.851000 1.077000  4.255000 1.193000  0.5956000      1.607000  
1 1 1 33 17 24 o 6.274000 0.5861000 6.047000 0.8573000 6.501000 0.7995000 -0.4534000     1.172000  
1 1 1 33 17 26 o 10.31000 0.4577000 10.56000 0.5342000 10.06000 0.7433000 0.5020000      0.9154000 
1 1 1 33 17 28 o 3.704000 0.8518000 2.983000 1.145000  4.425000 1.261000  -1.442000      1.704000  
1 1 1 33 17 30 o 11.74000 0.4669000 11.59000 0.4986000 11.89000 0.7896000 -0.2996000     0.9339000 
1 1 1 33 17 32 o 3.428000 0.8838000 2.925000 1.227000  3.932000 1.272000  -1.007000      1.768000  
1 1 1 33 17 34 o 18.33000 0.3439000 18.46000 0.4192000 18.20000 0.5454000 0.2550000      0.6879000 
1 1 1 33 17 36 o 6.562000 0.7513000 5.789000 1.063000  7.335000 1.062000  -1.547000      1.503000  
1 1 1 33 17 38 o 12.56000 0.4239000 12.29000 0.5058000 12.83000 0.6804000 -0.5361000     0.8478000 
1 1 1 33 17 40 o 7.793000 0.6674000 8.101000 0.7195000 7.485000 1.124000  0.6159000      1.335000  
1 1 1 33 17 42 o 5.557000 1.124000  5.613000 1.055000  5.500000 1.985000  0.1134000      2.247000  
1 1 1 33 17 44 o 3.954000 0.9931000 3.183000 1.280000  4.726000 1.519000  -1.544000      1.986000  
1 1 1 33 18 1  o 3.466000 0.9807000 3.841000 1.474000  3.091000 1.294000  0.7501000      1.961000  
1 1 1 33 18 3  o 14.60000 0.4181000 14.56000 0.6894000 14.64000 0.4733000 -0.7332000E-01 0.8362000 
1 1 1 33 18 5  o 15.26000 0.3631000 15.90000 0.5451000 14.61000 0.4797000 1.284000       0.7262000 
1 1 1 33 18 7  o 21.89000 0.3177000 22.02000 0.4817000 21.75000 0.4143000 0.2781000      0.6354000 
1 1 1 33 18 9  o 3.014000 0.8241000 3.376000 1.206000  2.652000 1.124000  0.7240000      1.648000  
1 1 1 33 18 11 o 5.945000 0.6554000 6.090000 0.8794000 5.800000 0.9719000 0.2901000      1.311000  
1 1 1 33 18 13 o 5.014000 0.8128000 4.645000 1.117000  5.383000 1.181000  -0.7377000     1.626000  
1 1 1 33 18 15 o 6.882000 0.6766000 7.575000 0.7182000 6.189000 1.147000  1.386000       1.353000  
1 1 1 33 18 17 o 5.415000 0.7285000 7.398000 0.7174000 3.433000 1.268000  3.964000       1.457000  
1 1 1 33 18 19 o 5.587000 0.6908000 5.287000 1.042000  5.888000 0.9075000 -0.6004000     1.382000  
1 1 1 33 18 21 o 11.97000 0.3763000 11.93000 0.5233000 12.01000 0.5410000 -0.7866000E-01 0.7527000 
1 1 1 33 18 23 o 10.09000 0.4358000 10.08000 0.6694000 10.10000 0.5584000 -0.2015000E-01 0.8717000 
1 1 1 33 18 25 o 12.25000 0.3889000 11.64000 0.4871000 12.86000 0.6064000 -1.221000      0.7778000 
1 1 1 33 18 27 o 6.313000 0.6673000 6.456000 0.7585000 6.171000 1.098000  0.2853000      1.335000  
1 1 1 33 18 29 o 12.29000 0.3864000 12.24000 0.4733000 12.35000 0.6109000 -0.1072000     0.7728000 
1 1 1 33 18 31 o 11.55000 0.4236000 12.24000 0.5138000 10.86000 0.6736000 1.386000       0.8472000 
1 1 1 33 18 33 o 4.961000 0.9182000 4.688000 1.313000  5.235000 1.284000  -0.5463000     1.836000  
1 1 1 33 18 35 o 4.457000 0.8810000 4.037000 1.252000  4.878000 1.240000  -0.8411000     1.762000  
1 1 1 33 18 37 o 8.906000 0.5549000 8.190000 0.7294000 9.622000 0.8364000 -1.433000      1.110000  
1 1 1 33 18 39 o 6.625000 0.7792000 6.256000 1.056000  6.995000 1.146000  -0.7391000     1.558000  
1 1 1 33 18 41 o 4.039000 0.9835000 3.771000 1.205000  4.307000 1.555000  -0.5360000     1.967000  
1 1 1 33 18 43 o 3.642000 1.006000  3.305000 1.345000  3.980000 1.495000  -0.6749000     2.011000  
1 1 1 33 19 0  o 17.46000 0.7884000 17.46000 0.7884000 17.46000 0.7884000 0.000000       0.000000  
1 1 1 33 19 2  o 4.907000 0.9487000 5.011000 1.255000  4.803000 1.423000  0.2080000      1.897000  
1 1 1 33 19 4  o 3.735000 1.001000  3.193000 1.382000  4.278000 1.449000  -1.085000      2.002000  
1 1 1 33 19 6  o 11.54000 0.4037000 12.36000 0.5383000 10.71000 0.6018000 1.654000       0.8074000 
1 1 1 33 19 8  o 3.939000 0.8753000 4.026000 1.150000  3.851000 1.320000  0.1748000      1.751000  
1 1 1 33 19 10 o 8.956000 0.4766000 9.126000 0.6013000 8.786000 0.7395000 0.3397000      0.9531000 
1 1 1 33 19 12 o 5.982000 0.7244000 5.513000 1.017000  6.451000 1.032000  -0.9386000     1.449000  
1 1 1 33 19 14 o 7.303000 0.5366000 7.369000 0.7006000 7.237000 0.8130000 0.1317000      1.073000  
1 1 1 33 19 16 o 6.063000 0.6312000 6.051000 0.8468000 6.074000 0.9363000 -0.2365000E-01 1.262000  
1 1 1 33 19 18 o 5.053000 0.7154000 5.170000 0.9897000 4.935000 1.033000  0.2341000      1.431000  
1 1 1 33 19 20 o 14.52000 0.3559000 14.50000 0.5444000 14.55000 0.4587000 -0.5260000E-01 0.7119000 
1 1 1 33 19 22 o 19.35000 0.3103000 19.94000 0.4518000 18.75000 0.4254000 1.192000       0.6206000 
1 1 1 33 19 24 o 10.81000 0.3966000 10.73000 0.4674000 10.89000 0.6409000 -0.1636000     0.7932000 
1 1 1 33 19 26 o 12.57000 0.3794000 12.41000 0.4392000 12.73000 0.6187000 -0.3274000     0.7588000 
1 1 1 33 19 28 o 3.878000 0.8800000 3.334000 1.148000  4.422000 1.335000  -1.089000      1.760000  
1 1 1 33 19 30 o 9.112000 0.5823000 9.107000 0.6058000 9.117000 0.9946000 -0.1020000E-01 1.165000  
1 1 1 33 19 32 o 5.946000 0.6723000 5.935000 0.8321000 5.958000 1.056000  -0.2305000E-01 1.345000  
1 1 1 33 19 34 o 6.480000 0.8072000 7.130000 0.6864000 5.830000 1.461000  1.300000       1.614000  
1 1 1 33 19 36 o 7.410000 0.6704000 7.426000 0.8417000 7.393000 1.044000  0.3395000E-01  1.341000  
1 1 1 33 19 38 f 7.799000 0.6407000 7.861000 0.7234000 7.738000 1.058000  0.1225000      1.281000  
1 1 1 33 19 40 o 9.176000 0.6775000 9.530000 0.6872000 8.822000 1.168000  0.7081000      1.355000  
1 1 1 33 19 42 o 6.870000 0.9027000 5.490000 1.083000  8.249000 1.445000  -2.759000      1.805000  
1 1 1 33 19 44 o 4.088000 1.166000  3.569000 1.323000  4.608000 1.920000  -1.039000      2.332000  
1 1 1 33 20 1  o 18.22000 0.3928000 18.50000 0.5304000 17.94000 0.5796000 0.5589000      0.7857000 
1 1 1 33 20 3  o 21.26000 0.2879000 21.05000 0.4105000 21.47000 0.4037000 -0.4250000     0.5757000 
1 1 1 33 20 5  o 7.069000 0.6085000 7.612000 0.9014000 6.526000 0.8176000 1.086000       1.217000  
1 1 1 33 20 7  o 22.78000 0.4132000 23.07000 0.4722000 22.48000 0.6783000 0.5887000      0.8264000 
1 1 1 33 20 9  o 20.82000 0.3133000 20.61000 0.4155000 21.03000 0.4689000 -0.4194000     0.6266000 
1 1 1 33 20 11 o 14.98000 0.3325000 15.17000 0.4581000 14.79000 0.4820000 0.3780000      0.6650000 
1 1 1 33 20 13 o 11.70000 0.3714000 11.95000 0.5153000 11.45000 0.5350000 0.5031000      0.7428000 
1 1 1 33 20 15 f 14.85000 0.3356000 14.93000 0.4536000 14.76000 0.4948000 0.1719000      0.6712000 
1 1 1 33 20 17 o 17.78000 0.3674000 17.14000 0.4453000 18.42000 0.5844000 -1.277000      0.7347000 
1 1 1 33 20 19 o 6.278000 0.6250000 6.394000 0.8513000 6.162000 0.9152000 0.2322000      1.250000  
1 1 1 33 20 21 o 9.236000 0.4197000 8.647000 0.6236000 9.825000 0.5618000 -1.178000      0.8394000 
1 1 1 33 20 23 o 14.66000 0.3449000 14.49000 0.3959000 14.83000 0.5650000 -0.3421000     0.6899000 
1 1 1 33 20 25 o 18.48000 0.3174000 17.74000 0.4037000 19.22000 0.4898000 -1.480000      0.6347000 
1 1 1 33 20 27 f 16.50000 0.3316000 16.18000 0.4013000 16.82000 0.5279000 -0.6363000     0.6631000 
1 1 1 33 20 29 o 3.175000 0.8493000 3.394000 1.150000  2.955000 1.250000  0.4386000      1.699000  
1 1 1 33 20 31 o 14.26000 0.3748000 14.03000 0.4301000 14.49000 0.6139000 -0.4563000     0.7496000 
1 1 1 33 20 33 o 15.98000 0.4028000 16.47000 0.4445000 15.49000 0.6719000 0.9782000      0.8056000 
1 1 1 33 20 35 o 8.264000 0.5459000 8.024000 0.6512000 8.505000 0.8763000 -0.4812000     1.092000  
1 1 1 33 20 37 o 7.101000 0.5852000 5.683000 0.8112000 8.519000 0.8436000 -2.836000      1.170000  
1 1 1 33 20 39 o 6.096000 0.7480000 5.616000 0.9850000 6.576000 1.126000  -0.9601000     1.496000  
1 1 1 33 20 41 o 7.789000 0.7675000 7.242000 0.8414000 8.336000 1.284000  -1.095000      1.535000  
1 1 1 33 20 43 o 8.061000 0.7554000 7.370000 1.043000  8.751000 1.093000  -1.382000      1.511000  
1 1 1 33 21 0  o 12.46000 0.6695000 12.46000 0.6695000 12.46000 0.6695000 0.000000       0.000000  
1 1 1 33 21 2  o 15.53000 0.3889000 14.88000 0.4476000 16.19000 0.6360000 -1.309000      0.7777000 
1 1 1 33 21 4  f 6.693000 0.5372000 6.719000 0.7967000 6.666000 0.7209000 0.5350000E-01  1.074000  
1 1 1 33 21 6  o 9.934000 0.4014000 9.507000 0.5721000 10.36000 0.5632000 -0.8534000     0.8028000 
1 1 1 33 21 8  o 14.97000 0.3312000 14.79000 0.4521000 15.15000 0.4840000 -0.3576000     0.6623000 
1 1 1 33 21 10 o 24.65000 0.3337000 24.46000 0.4694000 24.85000 0.4744000 -0.3945000     0.6674000 
1 1 1 33 21 12 f 13.63000 0.3436000 13.91000 0.4677000 13.34000 0.5036000 0.5708000      0.6873000 
1 1 1 33 21 14 o 8.171000 0.5083000 9.207000 0.6604000 7.136000 0.7727000 2.071000       1.017000  
1 1 1 33 21 16 o 8.802000 0.4774000 9.192000 0.6497000 8.413000 0.6995000 0.7791000      0.9547000 
1 1 1 33 21 18 o 18.73000 0.3130000 18.76000 0.4078000 18.69000 0.4749000 0.6464000E-01  0.6260000 
1 1 1 33 21 20 o 9.884000 0.4135000 10.35000 0.5859000 9.420000 0.5837000 0.9285000      0.8270000 
1 1 1 33 21 22 f 8.677000 0.5040000 9.261000 0.5135000 8.092000 0.8673000 1.169000       1.008000  
1 1 1 33 21 24 o 5.243000 0.7215000 4.673000 0.8792000 5.812000 1.144000  -1.139000      1.443000  
1 1 1 33 21 26 o 11.10000 0.3922000 11.13000 0.4626000 11.08000 0.6335000 0.5347000E-01  0.7844000 
1 1 1 33 21 28 o 3.256000 0.7980000 1.959000 0.9191000 4.554000 1.305000  -2.596000      1.596000  
1 1 1 33 21 30 o 9.242000 0.5900000 9.294000 0.5327000 9.190000 1.053000  0.1041000      1.180000  
1 1 1 33 21 32 o 4.323000 0.8751000 3.072000 1.115000  5.574000 1.349000  -2.501000      1.750000  
1 1 1 33 21 34 o 10.88000 0.4457000 10.96000 0.5008000 10.80000 0.7375000 0.1615000      0.8915000 
1 1 1 33 21 36 f 7.798000 0.7679000 7.913000 0.6774000 7.683000 1.378000  0.2300000      1.536000  
1 1 1 33 21 38 o 4.421000 0.8729000 4.992000 0.9660000 3.851000 1.454000  1.140000       1.746000  
1 1 1 33 21 40 o 8.099000 0.6790000 8.397000 0.8434000 7.802000 1.064000  0.5942000      1.358000  
1 1 1 33 21 42 o 3.263000 0.9696000 2.859000 1.227000  3.668000 1.502000  -0.8090000     1.939000  
1 1 1 33 22 1  o 13.20000 0.4579000 13.24000 0.6678000 13.17000 0.6266000 0.6996000E-01  0.9157000 
1 1 1 33 22 3  o 6.628000 0.6070000 6.308000 0.8734000 6.948000 0.8433000 -0.6398000     1.214000  
1 1 1 33 22 5  o 15.12000 0.3598000 15.41000 0.4911000 14.82000 0.5258000 0.5904000      0.7195000 
1 1 1 33 22 7  o 15.74000 0.3310000 16.42000 0.4568000 15.05000 0.4791000 1.374000       0.6620000 
1 1 1 33 22 9  o 9.721000 0.4515000 9.512000 0.6711000 9.931000 0.6042000 -0.4189000     0.9030000 
1 1 1 33 22 11 o 7.403000 0.5512000 8.286000 0.7253000 6.520000 0.8302000 1.766000       1.102000  
1 1 1 33 22 13 o 11.69000 0.4194000 11.51000 0.5912000 11.87000 0.5952000 -0.3581000     0.8389000 
1 1 1 33 22 15 o 10.76000 0.4787000 11.42000 0.4824000 10.10000 0.8271000 1.320000       0.9575000 
1 1 1 33 22 17 o 10.03000 0.8466000 11.64000 0.4902000 8.410000 1.621000  3.234000       1.693000  
1 1 1 33 22 19 o 7.522000 0.4825000 7.629000 0.6691000 7.416000 0.6953000 0.2129000      0.9649000 
1 1 1 33 22 21 o 6.330000 0.6732000 6.493000 0.6440000 6.168000 1.182000  0.3244000      1.346000  
1 1 1 33 22 23 o 14.06000 0.3401000 13.97000 0.3992000 14.16000 0.5507000 -0.1895000     0.6802000 
1 1 1 33 22 25 o 12.55000 0.4089000 12.82000 0.5166000 12.28000 0.6339000 0.5358000      0.8177000 
1 1 1 33 22 27 o 20.14000 0.3625000 19.47000 0.5074000 20.81000 0.5180000 -1.349000      0.7251000 
1 1 1 33 22 29 o 6.912000 0.6109000 6.258000 0.7641000 7.567000 0.9534000 -1.309000      1.222000  
1 1 1 33 22 31 o 3.482000 0.8464000 3.741000 1.051000  3.224000 1.327000  0.5175000      1.693000  
1 1 1 33 22 33 o 8.600000 0.5482000 8.234000 0.6386000 8.966000 0.8912000 -0.7318000     1.096000  
1 1 1 33 22 35 o 6.338000 0.9079000 6.053000 0.9793000 6.622000 1.529000  -0.5685000     1.816000  
1 1 1 33 22 37 o 4.561000 0.9364000 4.188000 1.259000  4.934000 1.386000  -0.7454000     1.873000  
1 1 1 33 22 39 o 6.834000 1.056000  6.863000 1.787000  6.805000 1.126000  0.5728000E-01  2.112000  
1 1 1 33 22 41 o 6.214000 1.121000  5.800000 1.582000  6.628000 1.589000  -0.8284000     2.242000  
1 1 1 33 23 0  o 26.86000 0.6308000 26.86000 0.6308000 26.86000 0.6308000 0.000000       0.000000  
1 1 1 33 23 2  f 17.58000 0.3418000 18.40000 0.4512000 16.75000 0.5134000 1.653000       0.6835000 
1 1 1 33 23 4  o 8.359000 0.4629000 8.187000 0.6846000 8.531000 0.6233000 -0.3443000     0.9258000 
1 1 1 33 23 6  o 11.20000 0.4203000 11.39000 0.6753000 11.01000 0.5005000 0.3734000      0.8405000 
1 1 1 33 23 8  o 6.772000 0.6011000 7.490000 0.7900000 6.053000 0.9062000 1.436000       1.202000  
1 1 1 33 23 10 o 20.61000 0.2836000 20.91000 0.4119000 20.31000 0.3900000 0.5962000      0.5673000 
1 1 1 33 23 12 o 4.083000 0.8799000 4.454000 1.093000  3.712000 1.379000  0.7419000      1.760000  
1 1 1 33 23 14 o 10.76000 0.4113000 11.86000 0.4932000 9.653000 0.6582000 2.208000       0.8225000 
1 1 1 33 23 16 f 12.93000 0.3927000 12.91000 0.4785000 12.96000 0.6228000 -0.4688000E-01 0.7854000 
1 1 1 33 23 18 o 16.92000 0.3648000 16.46000 0.4678000 17.38000 0.5600000 -0.9174000     0.7297000 
1 1 1 33 23 20 o 6.304000 0.7436000 5.570000 1.112000  7.038000 0.9872000 -1.468000      1.487000  
1 1 1 33 23 22 o 8.063000 0.6193000 7.439000 0.8932000 8.687000 0.8579000 -1.248000      1.239000  
1 1 1 33 23 24 o 7.961000 0.5572000 7.780000 0.7375000 8.141000 0.8355000 -0.3611000     1.114000  
1 1 1 33 23 26 o 6.453000 0.7770000 5.711000 1.147000  7.196000 1.049000  -1.485000      1.554000  
1 1 1 33 23 28 f 7.565000 0.5981000 7.280000 0.8158000 7.851000 0.8749000 -0.5719000     1.196000  
1 1 1 33 23 30 o 10.13000 0.7581000 9.589000 0.6101000 10.68000 1.388000  -1.092000      1.516000  
1 1 1 33 23 32 o 8.672000 0.5235000 8.560000 0.5335000 8.783000 0.9008000 -0.2227000     1.047000  
1 1 1 33 23 34 o 11.21000 0.5687000 11.28000 0.6005000 11.14000 0.9660000 0.1375000      1.137000  
1 1 1 33 23 36 o 4.006000 1.035000  4.419000 1.539000  3.593000 1.384000  0.8261000      2.070000  
1 1 1 33 23 38 o 4.663000 1.009000  3.625000 1.494000  5.701000 1.356000  -2.076000      2.018000  
1 1 1 33 23 40 o 5.718000 1.016000  6.638000 1.371000  4.797000 1.499000  1.841000       2.032000  
1 1 1 33 24 1  o 4.051000 0.8678000 3.384000 1.175000  4.718000 1.277000  -1.334000      1.736000  
1 1 1 33 24 3  o 4.824000 0.8004000 4.951000 0.9770000 4.698000 1.268000  0.2529000      1.601000  
1 1 1 33 24 5  o 4.957000 0.7306000 4.234000 1.144000  5.680000 0.9092000 -1.446000      1.461000  
1 1 1 33 24 7  o 12.43000 0.3691000 13.25000 0.5217000 11.61000 0.5224000 1.640000       0.7382000 
1 1 1 33 24 9  o 11.54000 0.4680000 11.57000 0.5340000 11.52000 0.7687000 0.5181000E-01  0.9360000 
1 1 1 33 24 11 o 16.11000 0.2947000 16.41000 0.4190000 15.82000 0.4144000 0.5940000      0.5893000 
1 1 1 33 24 13 o 4.729000 0.7507000 5.088000 0.9969000 4.370000 1.123000  0.7180000      1.501000  
1 1 1 33 24 15 o 13.04000 0.3909000 13.45000 0.6076000 12.63000 0.4921000 0.8206000      0.7818000 
1 1 1 33 24 17 o 10.24000 0.3699000 10.82000 0.4586000 9.665000 0.5806000 1.153000       0.7398000 
1 1 1 33 24 19 o 10.16000 0.5386000 10.26000 0.5201000 10.05000 0.9434000 0.2078000      1.077000  
1 1 1 33 24 21 o 3.185000 0.9003000 3.449000 1.201000  2.921000 1.342000  0.5279000      1.801000  
1 1 1 33 24 23 o 7.525000 0.6009000 7.601000 0.7144000 7.448000 0.9665000 0.1529000      1.202000  
1 1 1 33 24 25 o 9.057000 0.5302000 8.393000 0.7322000 9.720000 0.7669000 -1.327000      1.060000  
1 1 1 33 24 27 o 2.854000 0.8603000 2.760000 1.151000  2.947000 1.279000  -0.1871000     1.721000  
1 1 1 33 24 29 o 3.449000 0.9155000 2.841000 1.022000  4.057000 1.519000  -1.215000      1.831000  
1 1 1 33 24 31 o 11.36000 0.5112000 10.94000 0.7893000 11.78000 0.6499000 -0.8421000     1.022000  
1 1 1 33 24 33 o 15.13000 0.5500000 14.52000 0.8341000 15.74000 0.7172000 -1.218000      1.100000  
1 1 1 33 24 35 o 4.450000 1.024000  4.092000 1.444000  4.808000 1.452000  -0.7156000     2.048000  
1 1 1 33 24 37 f 3.067000 0.9463000 3.365000 1.428000  2.769000 1.242000  0.5957000      1.893000  
1 1 1 33 24 39 o 5.541000 1.043000  5.661000 1.498000  5.421000 1.452000  0.2397000      2.086000  
1 1 1 33 24 41 o 6.742000 1.299000  5.746000 1.679000  7.737000 1.982000  -1.991000      2.598000  
1 1 1 33 25 0  o 27.99000 0.4711000 27.99000 0.4711000 27.99000 0.4711000 0.000000       0.000000  
1 1 1 33 25 2  o 14.99000 0.2972000 15.73000 0.4020000 14.25000 0.4378000 1.485000       0.5943000 
1 1 1 33 25 4  o 17.86000 0.3101000 17.43000 0.4090000 18.29000 0.4663000 -0.8604000     0.6202000 
1 1 1 33 25 6  o 12.49000 0.3372000 12.14000 0.4684000 12.84000 0.4851000 -0.6976000     0.6743000 
1 1 1 33 25 8  o 10.10000 0.4340000 10.18000 0.5086000 10.02000 0.7034000 0.1536000      0.8681000 
1 1 1 33 25 10 o 9.631000 0.3914000 9.691000 0.5534000 9.570000 0.5536000 0.1210000      0.7828000 
1 1 1 33 25 12 o 7.035000 0.6831000 7.627000 1.107000  6.442000 0.8012000 1.185000       1.366000  
1 1 1 33 25 14 o 18.13000 0.2755000 18.14000 0.3891000 18.11000 0.3900000 0.2771000E-01  0.5509000 
1 1 1 33 25 16 o 3.453000 0.9006000 4.021000 1.430000  2.886000 1.096000  1.135000       1.801000  
1 1 1 33 25 18 o 15.55000 0.5370000 16.04000 0.3977000 15.06000 0.9976000 0.9796000      1.074000  
1 1 1 33 25 20 o 8.979000 0.5381000 9.011000 0.5100000 8.947000 0.9477000 0.6404000E-01  1.076000  
1 1 1 33 25 22 o 8.499000 0.5271000 8.101000 0.5634000 8.896000 0.8910000 -0.7951000     1.054000  
1 1 1 33 25 24 f 3.620000 0.8487000 3.193000 1.071000  4.047000 1.317000  -0.8541000     1.697000  
1 1 1 33 25 26 o 7.723000 0.6637000 6.913000 0.7418000 8.532000 1.101000  -1.619000      1.327000  
1 1 1 33 25 28 o 8.103000 0.6618000 7.878000 0.6426000 8.329000 1.157000  -0.4507000     1.324000  
1 1 1 33 25 30 o 7.959000 0.8439000 6.485000 0.6705000 9.433000 1.549000  -2.949000      1.688000  
1 1 1 33 25 32 o 4.832000 1.003000  4.007000 1.522000  5.656000 1.306000  -1.649000      2.005000  
1 1 1 33 25 34 o 6.606000 0.9996000 6.189000 1.682000  7.023000 1.080000  -0.8342000     1.999000  
1 1 1 33 25 36 o 4.697000 0.9779000 4.041000 1.495000  5.354000 1.261000  -1.313000      1.956000  
1 1 1 33 25 38 o 4.726000 1.029000  5.134000 1.519000  4.319000 1.388000  0.8149000      2.057000  
1 1 1 33 25 40 o 4.044000 1.050000  3.969000 1.549000  4.119000 1.417000  -0.1501000     2.100000  
1 1 1 33 26 1  o 25.47000 0.3473000 25.64000 0.3973000 25.30000 0.5696000 0.3368000      0.6945000 
1 1 1 33 26 3  o 20.18000 0.2790000 20.26000 0.3912000 20.10000 0.3979000 0.1585000      0.5579000 
1 1 1 33 26 5  o 13.84000 0.3408000 13.73000 0.4371000 13.95000 0.5229000 -0.2270000     0.6815000 
1 1 1 33 26 7  o 6.616000 0.6058000 6.778000 0.6667000 6.454000 1.012000  0.3243000      1.212000  
1 1 1 33 26 9  f 9.973000 0.3829000 9.669000 0.5625000 10.28000 0.5197000 -0.6090000     0.7659000 
1 1 1 33 26 11 o 12.17000 0.3844000 12.14000 0.4486000 12.20000 0.6244000 -0.5874000E-01 0.7689000 
1 1 1 33 26 13 o 16.83000 0.2856000 16.91000 0.3785000 16.75000 0.4278000 0.1594000      0.5712000 
1 1 1 33 26 15 o 11.20000 0.4739000 11.82000 0.6297000 10.59000 0.7085000 1.224000       0.9478000 
1 1 1 33 26 17 o 9.396000 0.6134000 10.13000 0.7535000 8.662000 0.9682000 1.468000       1.227000  
1 1 1 33 26 19 o 3.660000 1.007000  3.376000 1.347000  3.943000 1.496000  -0.5664000     2.013000  
1 1 1 33 26 21 o 6.651000 0.9962000 7.083000 1.462000  6.219000 1.353000  0.8647000      1.992000  
1 1 1 33 26 23 o 12.18000 0.5821000 12.10000 0.9266000 12.26000 0.7050000 -0.1628000     1.164000  
1 1 1 33 26 25 o 9.221000 0.6155000 8.516000 0.9141000 9.927000 0.8244000 -1.410000      1.231000  
1 1 1 33 26 27 f 4.044000 1.082000  4.030000 1.520000  4.059000 1.539000  -0.2884000E-01 2.163000  
1 1 1 33 26 29 o 11.84000 0.6148000 12.08000 0.8168000 11.60000 0.9191000 0.4816000      1.230000  
1 1 1 33 26 31 o 5.370000 1.290000  5.312000 1.644000  5.428000 1.987000  -0.1163000     2.579000  
1 1 1 33 26 33 o 7.244000 1.007000  8.427000 1.607000  6.061000 1.213000  2.366000       2.014000  
1 1 1 33 26 35 o 3.906000 1.040000  4.138000 1.562000  3.673000 1.374000  0.4655000      2.080000  
1 1 1 33 26 37 o 3.593000 0.9742000 2.841000 1.305000  4.345000 1.447000  -1.503000      1.948000  
1 1 1 33 26 39 o 3.971000 1.023000  3.639000 1.405000  4.304000 1.489000  -0.6652000     2.047000  
1 1 1 33 27 0  o 14.41000 0.4946000 14.41000 0.4946000 14.41000 0.4946000 0.000000       0.000000  
1 1 1 33 27 2  o 11.63000 0.3621000 12.79000 0.4775000 10.47000 0.5444000 2.326000       0.7242000 
1 1 1 33 27 4  o 27.54000 0.2866000 27.15000 0.4061000 27.93000 0.4046000 -0.7830000     0.5732000 
1 1 1 33 27 6  f 19.45000 0.3080000 19.30000 0.3834000 19.60000 0.4822000 -0.2957000     0.6161000 
1 1 1 33 27 8  o 14.26000 0.4362000 14.51000 0.7566000 14.01000 0.4341000 0.5026000      0.8723000 
1 1 1 33 27 10 o 17.04000 0.2726000 17.29000 0.3736000 16.80000 0.3972000 0.4910000      0.5452000 
1 1 1 33 27 12 o 14.88000 0.3528000 15.14000 0.5804000 14.61000 0.4013000 0.5326000      0.7056000 
1 1 1 33 27 14 o 7.231000 0.6476000 7.263000 0.9161000 7.199000 0.9156000 0.6338000E-01  1.295000  
1 1 1 33 27 16 o 8.041000 0.7996000 7.295000 1.107000  8.787000 1.154000  -1.492000      1.599000  
1 1 1 33 27 18 o 3.332000 1.017000  3.218000 1.281000  3.446000 1.579000  -0.2278000     2.033000  
1 1 1 33 27 20 o 16.41000 0.4517000 17.35000 0.5761000 15.46000 0.6959000 1.897000       0.9034000 
1 1 1 33 27 22 o 4.091000 1.095000  3.821000 1.556000  4.360000 1.541000  -0.5392000     2.190000  
1 1 1 33 27 24 o 4.615000 1.008000  4.424000 1.454000  4.806000 1.396000  -0.3822000     2.016000  
1 1 1 33 27 26 o 8.550000 0.9847000 8.073000 1.086000  9.028000 1.643000  -0.9553000     1.969000  
1 1 1 33 27 28 o 6.038000 1.002000  5.503000 1.434000  6.573000 1.400000  -1.070000      2.004000  
1 1 1 33 27 30 o 4.716000 1.043000  5.356000 1.412000  4.076000 1.537000  1.280000       2.087000  
1 1 1 33 27 32 o 4.867000 1.061000  5.137000 1.574000  4.596000 1.421000  0.5415000      2.121000  
1 1 1 33 27 34 o 8.311000 0.7726000 9.144000 1.051000  7.478000 1.132000  1.666000       1.545000  
1 1 1 33 27 36 o 4.317000 1.119000  3.463000 1.439000  5.171000 1.714000  -1.708000      2.238000  
1 1 1 33 27 38 o 4.210000 1.140000  4.165000 1.545000  4.254000 1.676000  -0.8878000E-01 2.280000  
1 1 1 33 28 1  f 4.623000 0.7363000 5.562000 0.8873000 3.684000 1.175000  1.878000       1.473000  
1 1 1 33 28 3  o 4.309000 0.7721000 4.015000 1.108000  4.603000 1.076000  -0.5871000     1.544000  
1 1 1 33 28 5  o 3.664000 0.8131000 3.221000 1.126000  4.106000 1.173000  -0.8851000     1.626000  
1 1 1 33 28 7  o 3.062000 0.8518000 3.252000 1.302000  2.871000 1.099000  0.3811000      1.704000  
1 1 1 33 28 9  o 4.239000 0.8616000 4.026000 1.476000  4.453000 0.8892000 -0.4271000     1.723000  
1 1 1 33 28 11 o 7.342000 0.4961000 8.177000 0.8471000 6.507000 0.5167000 1.670000       0.9922000 
1 1 1 33 28 13 o 10.10000 0.5240000 9.683000 0.7454000 10.51000 0.7368000 -0.8285000     1.048000  
1 1 1 33 28 15 o 14.09000 0.4373000 14.19000 0.6271000 13.99000 0.6097000 0.2056000      0.8746000 
1 1 1 33 28 17 o 3.503000 0.9160000 2.204000 1.054000  4.802000 1.498000  -2.598000      1.832000  
1 1 1 33 28 19 o 3.095000 0.9587000 2.637000 1.188000  3.552000 1.505000  -0.9155000     1.917000  
1 1 1 33 28 21 o 7.669000 1.167000  8.460000 1.887000  6.877000 1.375000  1.583000       2.335000  
1 1 1 33 28 23 o 8.907000 0.6823000 8.258000 1.058000  9.555000 0.8618000 -1.297000      1.365000  
1 1 1 33 28 25 o 9.157000 0.8757000 8.297000 0.9928000 10.02000 1.443000  -1.719000      1.751000  
1 1 1 33 28 27 o 12.14000 0.5064000 11.36000 0.7708000 12.92000 0.6571000 -1.568000      1.013000  
1 1 1 33 28 29 o 5.591000 1.068000  5.294000 1.689000  5.889000 1.309000  -0.5946000     2.137000  
1 1 1 33 28 31 o 5.698000 1.008000  4.900000 1.493000  6.496000 1.354000  -1.596000      2.015000  
1 1 1 33 28 33 o 6.386000 0.9497000 6.497000 1.243000  6.274000 1.436000  0.2231000      1.899000  
1 1 1 33 28 35 o 7.222000 0.8613000 7.099000 1.259000  7.345000 1.176000  -0.2457000     1.723000  
1 1 1 33 28 37 o 4.181000 0.9983000 4.418000 1.402000  3.944000 1.421000  0.4742000      1.997000  
1 1 1 33 29 0  o 2.573000 1.115000  2.573000 1.115000  2.573000 1.115000  0.000000       0.000000  
1 1 1 33 29 2  o 3.748000 0.7993000 3.760000 1.092000  3.735000 1.167000  0.2528000E-01  1.599000  
1 1 1 33 29 4  o 7.130000 0.4545000 7.167000 0.6464000 7.093000 0.6391000 0.7372000E-01  0.9091000 
1 1 1 33 29 6  o 4.987000 0.8243000 4.623000 1.248000  5.351000 1.077000  -0.7277000     1.649000  
1 1 1 33 29 8  o 5.868000 0.7180000 6.840000 1.090000  4.896000 0.9351000 1.943000       1.436000  
1 1 1 33 29 10 o 10.36000 0.5278000 9.790000 0.7692000 10.92000 0.7229000 -1.135000      1.056000  
1 1 1 33 29 12 o 11.55000 0.4971000 12.10000 0.7169000 11.01000 0.6887000 1.093000       0.9941000 
1 1 1 33 29 14 o 20.94000 0.3709000 20.63000 0.5345000 21.26000 0.5145000 -0.6338000     0.7418000 
1 1 1 33 29 16 o 14.42000 0.4717000 14.75000 0.6509000 14.09000 0.6830000 0.6644000      0.9435000 
1 1 1 33 29 18 o 6.144000 1.126000  7.086000 1.195000  5.203000 1.908000  1.883000       2.252000  
1 1 1 33 29 20 o 13.99000 0.6195000 14.23000 0.8303000 13.74000 0.9195000 0.4912000      1.239000  
1 1 1 33 29 22 o 9.227000 0.7619000 9.271000 0.8938000 9.183000 1.234000  0.8791000E-01  1.524000  
1 1 1 33 29 24 o 5.539000 1.086000  6.129000 1.132000  4.948000 1.854000  1.181000       2.172000  
1 1 1 33 29 26 o 3.606000 0.9978000 4.171000 1.503000  3.042000 1.313000  1.129000       1.996000  
1 1 1 33 29 28 o 8.126000 0.8923000 8.076000 1.432000  8.177000 1.065000  -0.1003000     1.785000  
1 1 1 33 29 30 o 7.416000 0.9036000 6.058000 1.384000  8.774000 1.163000  -2.715000      1.807000  
1 1 1 33 29 32 o 3.611000 1.018000  3.998000 1.532000  3.225000 1.340000  0.7733000      2.036000  
1 1 1 33 29 34 o 7.624000 0.8172000 7.322000 1.231000  7.927000 1.075000  -0.6048000     1.634000  
1 1 1 33 29 36 o 3.130000 0.9388000 2.924000 1.284000  3.336000 1.370000  -0.4112000     1.878000  
1 1 1 33 30 1  o 5.511000 0.6305000 4.835000 0.9852000 6.187000 0.7871000 -1.352000      1.261000  
1 1 1 33 30 3  o 17.70000 0.3577000 18.56000 0.4800000 16.84000 0.5304000 1.719000       0.7153000 
1 1 1 33 30 5  o 11.85000 0.3972000 12.05000 0.5816000 11.65000 0.5412000 0.3977000      0.7944000 
1 1 1 33 30 7  o 11.71000 0.4048000 11.52000 0.6687000 11.89000 0.4563000 -0.3711000     0.8096000 
1 1 1 33 30 9  o 3.697000 0.9291000 3.168000 1.401000  4.227000 1.221000  -1.058000      1.858000  
1 1 1 33 30 11 o 12.03000 0.4801000 12.22000 0.6771000 11.84000 0.6808000 0.3716000      0.9602000 
1 1 1 33 30 13 o 15.82000 0.4086000 15.81000 0.5765000 15.83000 0.5791000 -0.1905000E-01 0.8171000 
1 1 1 33 30 15 o 19.47000 0.4484000 19.47000 0.6316000 19.47000 0.6365000 -0.3588000E-02 0.8967000 
1 1 1 33 30 17 o 7.187000 0.8726000 8.169000 1.070000  6.204000 1.379000  1.965000       1.745000  
1 1 1 33 30 19 o 9.411000 0.7555000 11.02000 0.6451000 7.803000 1.366000  3.214000       1.511000  
1 1 1 33 30 21 o 7.607000 0.9586000 8.142000 1.034000  7.072000 1.614000  1.070000       1.917000  
1 1 1 33 30 23 o 9.242000 0.6594000 7.867000 0.9668000 10.62000 0.8970000 -2.749000      1.319000  
1 1 1 33 30 25 o 3.462000 1.029000  3.254000 1.436000  3.670000 1.473000  -0.4157000     2.057000  
1 1 1 33 30 27 o 3.984000 1.049000  3.994000 1.470000  3.973000 1.496000  0.2076000E-01  2.098000  
1 1 1 33 30 29 o 10.53000 0.5739000 10.73000 0.7997000 10.33000 0.8234000 0.3916000      1.148000  
1 1 1 33 30 31 o 3.111000 0.9193000 3.980000 1.489000  2.243000 1.079000  1.737000       1.839000  
1 1 1 33 30 33 f 8.651000 0.7573000 7.833000 1.203000  9.469000 0.9202000 -1.636000      1.515000  
1 1 1 33 30 35 o 3.463000 0.9622000 2.819000 1.274000  4.107000 1.442000  -1.287000      1.924000  
1 1 1 33 31 0  o 4.510000 1.191000  4.510000 1.191000  4.510000 1.191000  0.000000       0.000000  
1 1 1 33 31 2  o 5.784000 0.6818000 5.671000 0.9026000 5.897000 1.022000  -0.2260000     1.364000  
1 1 1 33 31 4  o 10.20000 0.4178000 10.99000 0.6329000 9.406000 0.5457000 1.585000       0.8357000 
1 1 1 33 31 6  o 3.764000 0.8620000 4.301000 1.316000  3.228000 1.114000  1.073000       1.724000  
1 1 1 33 31 8  o 7.261000 0.7313000 7.332000 1.077000  7.191000 0.9894000 0.1405000      1.463000  
1 1 1 33 31 10 o 4.122000 0.9720000 3.736000 1.344000  4.508000 1.404000  -0.7716000     1.944000  
1 1 1 33 31 12 o 8.425000 0.6311000 8.642000 0.9079000 8.208000 0.8769000 0.4339000      1.262000  
1 1 1 33 31 14 o 5.868000 0.9418000 5.727000 1.422000  6.009000 1.235000  -0.2817000     1.884000  
1 1 1 33 31 16 o 6.850000 0.7562000 7.643000 0.9520000 6.056000 1.175000  1.587000       1.512000  
1 1 1 33 31 18 o 4.211000 0.9963000 4.504000 1.352000  3.918000 1.464000  0.5864000      1.993000  
1 1 1 33 31 20 o 7.986000 0.9171000 9.428000 0.8694000 6.544000 1.615000  2.883000       1.834000  
1 1 1 33 31 22 o 6.474000 0.9822000 7.496000 1.109000  5.452000 1.621000  2.044000       1.964000  
1 1 1 33 31 24 o 6.777000 1.032000  7.748000 1.280000  5.807000 1.619000  1.941000       2.064000  
1 1 1 33 31 26 o 8.496000 0.6842000 8.630000 0.8843000 8.363000 1.044000  0.2667000      1.368000  
1 1 1 33 31 28 o 6.423000 0.9082000 6.613000 1.159000  6.233000 1.399000  0.3801000      1.816000  
1 1 1 33 31 30 o 5.685000 1.186000  5.553000 1.656000  5.818000 1.697000  -0.2645000     2.371000  
1 1 1 33 31 32 o 5.060000 1.153000  5.979000 1.747000  4.140000 1.506000  1.839000       2.306000  
1 1 1 33 31 34 o 4.009000 0.9809000 5.036000 1.478000  2.981000 1.290000  2.054000       1.962000  
1 1 1 33 32 1  o 6.484000 0.6174000 6.882000 0.7024000 6.086000 1.016000  0.7963000      1.235000  
1 1 1 33 32 3  o 8.536000 0.4716000 9.011000 0.7146000 8.061000 0.6155000 0.9501000      0.9431000 
1 1 1 33 32 5  o 4.483000 0.8546000 4.870000 1.255000  4.095000 1.160000  0.7743000      1.709000  
1 1 1 33 32 7  o 4.192000 1.049000  4.617000 1.432000  3.767000 1.533000  0.8502000      2.098000  
1 1 1 33 32 9  o 5.646000 0.8092000 5.692000 1.170000  5.600000 1.118000  0.9199000E-01  1.618000  
1 1 1 33 32 11 o 20.74000 0.4552000 21.01000 0.6375000 20.47000 0.6500000 0.5374000      0.9105000 
1 1 1 33 32 13 o 8.633000 0.7502000 9.307000 1.001000  7.959000 1.118000  1.348000       1.500000  
1 1 1 33 32 15 o 12.11000 0.5590000 13.24000 0.6494000 10.98000 0.9102000 2.265000       1.118000  
1 1 1 33 32 17 o 12.15000 0.5421000 12.53000 0.7496000 11.77000 0.7834000 0.7664000      1.084000  
1 1 1 33 32 19 o 17.31000 0.6434000 18.26000 0.5802000 16.35000 1.148000  1.908000       1.287000  
1 1 1 33 32 21 o 8.110000 1.072000  8.309000 1.777000  7.910000 1.200000  0.3989000      2.144000  
1 1 1 33 32 23 o 6.852000 0.8215000 5.953000 1.216000  7.750000 1.105000  -1.797000      1.643000  
1 1 1 33 32 25 o 4.869000 1.041000  4.145000 1.339000  5.594000 1.594000  -1.449000      2.081000  
1 1 1 33 32 27 o 3.636000 0.9966000 3.483000 1.368000  3.789000 1.450000  -0.3062000     1.993000  
1 1 1 33 32 29 o 7.789000 0.8009000 7.283000 1.210000  8.294000 1.049000  -1.011000      1.602000  
1 1 1 33 32 31 o 4.302000 0.9847000 3.093000 1.355000  5.512000 1.429000  -2.420000      1.969000  
1 1 1 33 32 33 o 3.097000 0.9324000 3.556000 1.427000  2.638000 1.200000  0.9179000      1.865000  
1 1 1 33 33 0  o 11.39000 0.6332000 11.39000 0.6332000 11.39000 0.6332000 0.000000       0.000000  
1 1 1 33 33 2  o 9.631000 0.6729000 8.291000 1.248000  10.97000 0.5049000 -2.681000      1.346000  
1 1 1 33 33 4  o 7.874000 0.9981000 6.444000 1.867000  9.303000 0.7063000 -2.859000      1.996000  
1 1 1 33 33 6  o 6.568000 0.8271000 6.663000 1.074000  6.474000 1.258000  0.1891000      1.654000  
1 1 1 33 33 8  o 8.973000 0.7189000 9.549000 0.8998000 8.397000 1.121000  1.152000       1.438000  
1 1 1 33 33 10 o 17.40000 0.5815000 18.24000 0.9448000 16.56000 0.6780000 1.676000       1.163000  
1 1 1 33 33 12 o 3.980000 1.005000  4.169000 1.380000  3.792000 1.463000  0.3775000      2.011000  
1 1 1 33 33 14 o 5.273000 0.9570000 5.611000 1.349000  4.935000 1.357000  0.6757000      1.914000  
1 1 1 33 33 16 o 6.184000 1.013000  6.226000 1.342000  6.141000 1.517000  0.8429000E-01  2.026000  
1 1 1 33 33 18 o 3.751000 1.041000  4.566000 1.612000  2.935000 1.318000  1.631000       2.082000  
1 1 1 33 33 20 o 8.329000 0.7123000 8.913000 0.9258000 7.745000 1.083000  1.167000       1.425000  
1 1 1 33 33 22 o 3.872000 0.9501000 4.759000 1.382000  2.984000 1.304000  1.775000       1.900000  
1 1 1 33 33 24 o 3.906000 1.014000  3.878000 1.402000  3.934000 1.466000  -0.5549000E-01 2.029000  
1 1 1 33 33 26 o 8.254000 0.7071000 8.997000 0.9024000 7.511000 1.089000  1.486000       1.414000  
1 1 1 33 33 28 o 10.97000 0.8596000 10.84000 1.111000  11.11000 1.312000  -0.2750000     1.719000  
1 1 1 33 33 30 f 4.279000 1.158000  3.932000 1.407000  4.625000 1.841000  -0.6935000     2.317000  
1 1 1 33 33 32 o 4.443000 1.064000  3.654000 1.521000  5.231000 1.489000  -1.576000      2.128000  
1 1 1 33 34 1  f 7.764000 0.5785000 7.351000 0.9590000 8.177000 0.6473000 -0.8258000     1.157000  
1 1 1 33 34 3  o 5.557000 0.6738000 6.853000 1.007000  4.261000 0.8952000 2.592000       1.348000  
1 1 1 33 34 5  o 9.858000 0.5978000 10.05000 0.7586000 9.667000 0.9242000 0.3821000      1.196000  
1 1 1 33 34 7  o 5.049000 0.8843000 6.509000 1.156000  3.588000 1.338000  2.921000       1.769000  
1 1 1 33 34 9  o 9.948000 0.5325000 9.887000 0.7911000 10.01000 0.7129000 -0.1232000     1.065000  
1 1 1 33 34 11 o 9.291000 0.6188000 9.930000 0.8276000 8.653000 0.9201000 1.276000       1.238000  
1 1 1 33 34 13 o 5.002000 0.9599000 5.690000 1.212000  4.315000 1.489000  1.375000       1.920000  
1 1 1 33 34 15 f 10.19000 0.6979000 10.61000 0.9836000 9.765000 0.9904000 0.8399000      1.396000  
1 1 1 33 34 17 o 11.04000 0.5833000 11.51000 0.8445000 10.57000 0.8047000 0.9416000      1.167000  
1 1 1 33 34 19 o 8.962000 0.7717000 9.258000 0.8576000 8.665000 1.283000  0.5925000      1.543000  
1 1 1 33 34 21 o 10.48000 0.6592000 10.60000 1.040000  10.37000 0.8104000 0.2373000      1.318000  
1 1 1 33 34 23 o 3.848000 1.043000  3.646000 1.416000  4.050000 1.532000  -0.4034000     2.086000  
1 1 1 33 34 25 o 3.685000 1.028000  3.992000 1.512000  3.378000 1.394000  0.6145000      2.056000  
1 1 1 33 34 27 o 3.584000 0.9836000 3.942000 1.434000  3.226000 1.347000  0.7159000      1.967000  
1 1 1 33 34 29 o 3.309000 1.011000  3.742000 1.536000  2.876000 1.316000  0.8658000      2.022000  
1 1 1 33 34 31 o 2.761000 0.8920000 2.686000 1.252000  2.835000 1.271000  -0.1496000     1.784000  
1 1 1 33 35 0  o 3.351000 1.408000  3.351000 1.408000  3.351000 1.408000  0.000000       0.000000  
1 1 1 33 35 2  o 4.255000 0.9121000 3.974000 1.298000  4.535000 1.282000  -0.5605000     1.824000  
1 1 1 33 35 4  o 4.489000 0.8682000 4.082000 1.272000  4.896000 1.182000  -0.8139000     1.736000  
1 1 1 33 35 6  o 8.340000 0.6273000 9.391000 0.7739000 7.290000 0.9875000 2.100000       1.255000  
1 1 1 33 35 8  o 5.084000 1.201000  4.815000 1.448000  5.353000 1.915000  -0.5379000     2.401000  
1 1 1 33 35 10 o 7.194000 1.128000  5.571000 2.014000  8.818000 1.019000  -3.247000      2.257000  
1 1 1 33 35 12 o 10.20000 0.6432000 11.05000 0.8473000 9.351000 0.9678000 1.694000       1.286000  
1 1 1 33 35 14 o 3.307000 0.9266000 3.802000 1.399000  2.812000 1.215000  0.9902000      1.853000  
1 1 1 33 35 16 o 4.168000 0.9908000 3.865000 1.339000  4.471000 1.461000  -0.6063000     1.982000  
1 1 1 33 35 18 f 5.886000 0.8741000 6.189000 1.121000  5.582000 1.341000  0.6065000      1.748000  
1 1 1 33 35 20 o 3.845000 1.012000  4.279000 1.453000  3.410000 1.410000  0.8688000      2.025000  
1 1 1 33 35 22 o 3.861000 0.9924000 3.737000 1.412000  3.985000 1.395000  -0.2481000     1.985000  
1 1 1 33 35 24 o 3.533000 0.9910000 3.600000 1.435000  3.467000 1.368000  0.1333000      1.982000  
1 1 1 33 35 26 o 5.592000 0.9220000 7.311000 1.099000  3.873000 1.481000  3.438000       1.844000  
1 1 1 33 35 28 f 3.903000 0.9890000 3.156000 1.326000  4.649000 1.468000  -1.493000      1.978000  
1 1 1 33 35 30 o 4.788000 1.148000  4.553000 1.527000  5.023000 1.714000  -0.4697000     2.296000  
1 1 1 33 36 1  o 8.345000 0.9679000 8.288000 1.749000  8.401000 0.8297000 -0.1133000     1.936000  
1 1 1 33 36 3  o 5.958000 0.7872000 6.456000 1.020000  5.460000 1.200000  0.9964000      1.574000  
1 1 1 33 36 5  o 6.763000 0.7943000 8.069000 0.7821000 5.458000 1.383000  2.611000       1.589000  
1 1 1 33 36 7  o 4.708000 0.9960000 3.629000 1.422000  5.787000 1.395000  -2.158000      1.992000  
1 1 1 33 36 9  o 3.541000 0.9794000 3.461000 1.446000  3.621000 1.321000  -0.1602000     1.959000  
1 1 1 33 36 11 f 4.431000 0.9678000 4.804000 1.313000  4.059000 1.422000  0.7447000      1.936000  
1 1 1 33 36 13 o 4.595000 0.9187000 3.645000 1.374000  5.546000 1.220000  -1.901000      1.837000  
1 1 1 33 36 15 f 2.782000 0.8700000 3.006000 1.280000  2.557000 1.178000  0.4490000      1.740000  
1 1 1 33 36 17 o 6.029000 0.8904000 5.001000 1.388000  7.057000 1.115000  -2.056000      1.781000  
1 1 1 33 36 19 o 6.161000 1.071000  6.134000 1.291000  6.189000 1.710000  -0.5515000E-01 2.143000  
1 1 1 33 36 21 o 7.075000 0.9087000 7.263000 1.394000  6.886000 1.166000  0.3768000      1.817000  
1 1 1 33 36 23 o 5.782000 0.9597000 6.329000 1.246000  5.235000 1.460000  1.094000       1.919000  
1 1 1 33 36 25 o 6.785000 0.9378000 7.281000 1.164000  6.289000 1.471000  0.9919000      1.876000  
1 1 1 33 36 27 o 4.212000 1.072000  4.257000 1.530000  4.168000 1.502000  0.8868000E-01  2.143000  
1 1 1 33 36 29 o 3.949000 0.9958000 3.270000 1.424000  4.628000 1.392000  -1.358000      1.992000  
1 1 1 33 37 0  o 2.491000 1.217000  2.491000 1.217000  2.491000 1.217000  0.000000       0.000000  
1 1 1 33 37 2  o 4.847000 0.9319000 5.450000 1.005000  4.245000 1.570000  1.205000       1.864000  
1 1 1 33 37 4  o 5.532000 0.7747000 5.496000 1.021000  5.568000 1.165000  -0.7201000E-01 1.549000  
1 1 1 33 37 6  o 8.793000 0.5905000 8.425000 0.8263000 9.161000 0.8439000 -0.7366000     1.181000  
1 1 1 33 37 8  o 3.014000 0.9486000 2.521000 1.157000  3.507000 1.503000  -0.9858000     1.897000  
1 1 1 33 37 10 o 4.043000 0.9882000 4.168000 1.387000  3.917000 1.408000  0.2512000      1.976000  
1 1 1 33 37 12 o 5.566000 0.9000000 5.164000 1.233000  5.968000 1.311000  -0.8035000     1.800000  
1 1 1 33 37 14 o 3.003000 0.8890000 2.718000 1.208000  3.289000 1.305000  -0.5707000     1.778000  
1 1 1 33 37 16 o 5.506000 0.9655000 6.271000 1.242000  4.741000 1.479000  1.530000       1.931000  
1 1 1 33 37 18 o 7.773000 0.7695000 8.112000 1.108000  7.434000 1.069000  0.6785000      1.539000  
1 1 1 33 37 20 o 12.49000 0.5660000 14.02000 0.7167000 10.97000 0.8762000 3.057000       1.132000  
1 1 1 33 37 22 o 12.32000 0.5915000 13.40000 0.8200000 11.24000 0.8527000 2.160000       1.183000  
1 1 1 33 37 24 o 5.084000 0.9429000 4.104000 1.409000  6.065000 1.253000  -1.961000      1.886000  
1 1 1 33 37 26 o 3.680000 1.024000  3.669000 1.487000  3.691000 1.407000  -0.2255000E-01 2.047000  
1 1 1 33 37 28 o 6.954000 2.366000  ?        ?         6.954000 2.366000  ?              ?         
1 1 1 33 38 1  o 4.384000 1.120000  5.245000 1.678000  3.522000 1.484000  1.723000       2.241000  
1 1 1 33 38 3  o 3.242000 0.9380000 2.982000 1.212000  3.503000 1.432000  -0.5209000     1.876000  
1 1 1 33 38 5  o 6.214000 0.7537000 5.819000 1.017000  6.610000 1.113000  -0.7910000     1.507000  
1 1 1 33 38 7  o 5.620000 0.8985000 5.363000 1.286000  5.877000 1.255000  -0.5140000     1.797000  
1 1 1 33 38 9  o 5.116000 0.9344000 5.691000 1.273000  4.541000 1.368000  1.150000       1.869000  
1 1 1 33 38 11 o 7.788000 0.8241000 8.543000 1.178000  7.033000 1.153000  1.510000       1.648000  
1 1 1 33 38 13 o 8.509000 0.6338000 8.117000 0.9334000 8.900000 0.8576000 -0.7833000     1.268000  
1 1 1 33 38 15 o 7.594000 0.7511000 7.129000 1.059000  8.058000 1.065000  -0.9291000     1.502000  
1 1 1 33 38 17 o 3.527000 0.9857000 3.548000 1.394000  3.506000 1.395000  0.4158000E-01  1.971000  
1 1 1 33 38 19 o 5.176000 1.087000  6.070000 1.451000  4.282000 1.618000  1.788000       2.173000  
1 1 1 33 38 21 o 3.723000 1.032000  3.245000 1.415000  4.201000 1.504000  -0.9559000     2.065000  
1 1 1 33 38 23 o 2.869000 0.8842000 2.718000 1.210000  3.020000 1.289000  -0.3018000     1.768000  
1 1 1 33 38 25 o 4.274000 0.9978000 3.543000 1.411000  5.005000 1.412000  -1.462000      1.996000  
1 1 1 33 39 0  o 5.801000 1.660000  5.801000 1.660000  5.801000 1.660000  0.000000       0.000000  
1 1 1 33 39 2  f 7.823000 0.9115000 8.644000 1.099000  7.001000 1.455000  1.643000       1.823000  
1 1 1 33 39 4  o 4.824000 1.096000  5.230000 1.584000  4.417000 1.515000  0.8133000      2.192000  
1 1 1 33 39 6  o 8.085000 0.8174000 7.692000 0.9273000 8.479000 1.346000  -0.7875000     1.635000  
1 1 1 33 39 8  f 3.880000 0.9578000 4.094000 1.368000  3.666000 1.341000  0.4275000      1.916000  
1 1 1 33 39 10 o 5.754000 0.8844000 5.427000 1.183000  6.081000 1.315000  -0.6540000     1.769000  
1 1 1 33 39 12 o 4.345000 0.9915000 4.714000 1.385000  3.976000 1.419000  0.7377000      1.983000  
1 1 1 33 39 14 o 3.680000 0.9856000 4.442000 1.489000  2.918000 1.291000  1.525000       1.971000  
1 1 1 33 39 16 o 4.044000 1.007000  3.706000 1.394000  4.381000 1.455000  -0.6749000     2.015000  
1 1 1 33 39 18 o 7.317000 0.8278000 8.235000 0.9736000 6.400000 1.339000  1.835000       1.656000  
1 1 1 33 39 20 o 6.808000 0.8144000 6.276000 1.284000  7.340000 1.002000  -1.064000      1.629000  
1 1 1 33 39 22 o 6.435000 0.9092000 5.952000 1.388000  6.918000 1.175000  -0.9664000     1.818000  
1 1 1 33 39 24 f 3.669000 1.070000  3.369000 1.450000  3.969000 1.575000  -0.6003000     2.141000  
1 1 1 33 40 1  o 3.177000 1.008000  3.347000 1.484000  3.007000 1.366000  0.3396000      2.017000  
1 1 1 33 40 3  o 5.857000 0.9968000 4.267000 1.554000  7.448000 1.249000  -3.181000      1.994000  
1 1 1 33 40 5  o 8.311000 0.9904000 8.266000 1.316000  8.356000 1.480000  -0.9025000E-01 1.981000  
1 1 1 33 40 7  o 5.027000 1.008000  5.220000 1.269000  4.835000 1.565000  0.3854000      2.015000  
1 1 1 33 40 9  o 6.666000 0.9700000 6.606000 1.065000  6.726000 1.622000  -0.1201000     1.940000  
1 1 1 33 40 11 o 12.32000 0.5494000 12.97000 0.8054000 11.66000 0.7474000 1.311000       1.099000  
1 1 1 33 40 13 o 12.28000 0.5145000 12.58000 0.7068000 11.99000 0.7479000 0.5855000      1.029000  
1 1 1 33 40 15 o 14.24000 0.4670000 14.33000 0.6593000 14.14000 0.6616000 0.1886000      0.9340000 
1 1 1 33 40 17 o 3.150000 0.9388000 2.641000 1.227000  3.659000 1.421000  -1.018000      1.878000  
1 1 1 33 40 19 o 4.053000 1.054000  3.180000 1.334000  4.926000 1.634000  -1.746000      2.109000  
1 1 1 33 40 21 o 4.156000 1.072000  4.513000 1.580000  3.800000 1.450000  0.7136000      2.144000  
1 1 1 33 41 0  o 4.634000 1.598000  4.634000 1.598000  4.634000 1.598000  0.000000       0.000000  
1 1 1 33 41 2  o 3.823000 1.020000  4.695000 1.541000  2.951000 1.336000  1.744000       2.039000  
1 1 1 33 41 4  o 4.175000 1.118000  4.377000 1.606000  3.973000 1.555000  0.4036000      2.236000  
1 1 1 33 41 6  o 5.846000 1.178000  6.884000 1.510000  4.807000 1.810000  2.077000       2.357000  
1 1 1 33 41 8  o 3.530000 1.033000  3.151000 1.394000  3.908000 1.525000  -0.7570000     2.067000  
1 1 1 33 41 10 o 3.932000 1.066000  3.002000 1.260000  4.863000 1.719000  -1.861000      2.131000  
1 1 1 33 41 12 o 2.658000 0.8292000 2.187000 1.061000  3.129000 1.275000  -0.9421000     1.658000  
1 1 1 33 41 14 o 4.171000 0.9857000 4.833000 1.430000  3.508000 1.357000  1.325000       1.971000  
1 1 1 33 41 16 o 3.267000 0.9098000 2.523000 1.180000  4.010000 1.385000  -1.486000      1.820000  
1 1 1 33 41 18 o 3.472000 0.9816000 4.134000 1.492000  2.810000 1.276000  1.325000       1.963000  
1 1 1 33 42 1  o 6.342000 1.140000  7.015000 1.608000  5.669000 1.615000  1.346000       2.279000  
1 1 1 33 42 3  o 7.108000 0.9396000 7.764000 1.229000  6.453000 1.422000  1.311000       1.879000  
1 1 1 33 42 5  o 5.045000 1.250000  4.567000 1.746000  5.523000 1.791000  -0.9562000     2.501000  
1 1 1 33 42 7  o 9.560000 0.8760000 10.00000 1.271000  9.117000 1.206000  0.8851000      1.752000  
1 1 1 33 42 9  o 5.874000 1.188000  5.240000 1.515000  6.507000 1.830000  -1.266000      2.376000  
1 1 1 33 42 11 o 4.580000 1.089000  4.435000 1.432000  4.726000 1.641000  -0.2907000     2.179000  
1 1 1 33 42 13 o 8.283000 0.9380000 8.694000 0.7054000 7.872000 1.738000  0.8223000      1.876000  
1 1 1 33 42 15 o 4.309000 0.9917000 4.524000 1.490000  4.094000 1.309000  0.4299000      1.983000  
1 1 1 33 42 17 f 4.954000 1.186000  4.427000 1.793000  5.481000 1.554000  -1.054000      2.372000  
1 1 1 33 43 0  o 7.408000 1.437000  7.408000 1.437000  7.408000 1.437000  0.000000       0.000000  
1 1 1 33 43 2  o 4.383000 1.126000  3.815000 1.576000  4.952000 1.609000  -1.136000      2.253000  
1 1 1 33 43 4  o 4.809000 1.210000  4.594000 1.692000  5.024000 1.731000  -0.4298000     2.421000  
1 1 1 33 43 6  o 5.115000 1.221000  5.342000 1.708000  4.888000 1.746000  0.4543000      2.443000  
1 1 1 33 43 8  o 5.584000 1.193000  6.245000 1.676000  4.923000 1.697000  1.322000       2.386000  
1 1 1 33 43 10 o 7.406000 1.132000  8.057000 1.376000  6.756000 1.797000  1.301000       2.264000  
1 1 1 33 43 12 o 5.547000 1.308000  5.608000 1.652000  5.486000 2.029000  0.1230000      2.616000  
1 1 1 33 44 1  o 4.459000 1.223000  4.668000 1.815000  4.250000 1.640000  0.4183000      2.446000  
1 1 1 33 44 3  o 4.905000 1.116000  3.747000 1.524000  6.063000 1.630000  -2.316000      2.232000  
1 1 1 33 44 5  o 5.725000 1.314000  5.609000 1.879000  5.840000 1.837000  -0.2307000     2.628000  
1 1 1 33 44 7  o 4.416000 1.286000  3.576000 1.569000  5.257000 2.038000  -1.682000      2.572000  
1 1 1 33 44 9  o 7.414000 2.549000  ?        ?         7.414000 2.549000  ?              ?         
1 1 1 34 0  0  f 18.06000 1.035000  18.06000 1.035000  18.06000 1.035000  0.000000       0.000000  
1 1 1 34 0  2  o 29.71000 0.5115000 29.71000 0.5115000 29.71000 0.5115000 0.000000       0.000000  
1 1 1 34 0  4  o 3.729000 1.429000  3.729000 1.429000  3.729000 1.429000  0.000000       0.000000  
1 1 1 34 0  6  o 5.173000 1.117000  5.173000 1.117000  5.173000 1.117000  0.000000       0.000000  
1 1 1 34 0  8  o 48.21000 0.6273000 48.21000 0.6273000 48.21000 0.6273000 0.000000       0.000000  
1 1 1 34 0  10 o 6.466000 0.9376000 6.466000 0.9376000 6.466000 0.9376000 0.000000       0.000000  
1 1 1 34 0  12 o 8.253000 0.7454000 8.253000 0.7454000 8.253000 0.7454000 0.000000       0.000000  
1 1 1 34 0  14 o 6.002000 0.9819000 6.002000 0.9819000 6.002000 0.9819000 0.000000       0.000000  
1 1 1 34 0  16 o 4.166000 1.218000  4.166000 1.218000  4.166000 1.218000  0.000000       0.000000  
1 1 1 34 0  18 o 3.053000 1.269000  3.053000 1.269000  3.053000 1.269000  0.000000       0.000000  
1 1 1 34 0  20 o 24.72000 0.5045000 24.72000 0.5045000 24.72000 0.5045000 0.000000       0.000000  
1 1 1 34 0  22 f 2.520000 1.126000  2.520000 1.126000  2.520000 1.126000  0.000000       0.000000  
1 1 1 34 0  24 o 4.018000 1.409000  4.018000 1.409000  4.018000 1.409000  0.000000       0.000000  
1 1 1 34 0  26 o 9.380000 0.7867000 9.380000 0.7867000 9.380000 0.7867000 0.000000       0.000000  
1 1 1 34 0  28 o 3.260000 1.337000  3.260000 1.337000  3.260000 1.337000  0.000000       0.000000  
1 1 1 34 0  30 o 8.558000 0.7060000 8.558000 0.7060000 8.558000 0.7060000 0.000000       0.000000  
1 1 1 34 0  32 o 3.109000 1.233000  3.109000 1.233000  3.109000 1.233000  0.000000       0.000000  
1 1 1 34 0  34 o 4.435000 1.295000  4.435000 1.295000  4.435000 1.295000  0.000000       0.000000  
1 1 1 34 0  36 o 4.759000 1.316000  4.759000 1.316000  4.759000 1.316000  0.000000       0.000000  
1 1 1 34 0  38 o 11.56000 0.7369000 11.56000 0.7369000 11.56000 0.7369000 0.000000       0.000000  
1 1 1 34 0  40 o 3.491000 1.336000  3.491000 1.336000  3.491000 1.336000  0.000000       0.000000  
1 1 1 34 0  42 o 6.287000 1.162000  6.287000 1.162000  6.287000 1.162000  0.000000       0.000000  
1 1 1 34 0  44 o 4.879000 1.611000  4.879000 1.611000  4.879000 1.611000  0.000000       0.000000  
1 1 1 34 0  46 o 3.562000 1.406000  3.562000 1.406000  3.562000 1.406000  0.000000       0.000000  
1 1 1 34 1  1  o 4.623000 0.9985000 4.146000 1.429000  5.100000 1.395000  -0.9543000     1.997000  
1 1 1 34 1  3  o 15.03000 0.3907000 15.40000 0.5135000 14.65000 0.5889000 0.7546000      0.7814000 
1 1 1 34 1  5  o 14.08000 0.4613000 13.55000 0.5559000 14.60000 0.7363000 -1.052000      0.9225000 
1 1 1 34 1  7  o 15.95000 0.4458000 15.97000 0.4936000 15.93000 0.7426000 0.4540000E-01  0.8917000 
1 1 1 34 1  9  o 20.69000 0.3626000 20.42000 0.5003000 20.96000 0.5250000 -0.5374000     0.7252000 
1 1 1 34 1  11 o 12.96000 0.4101000 13.36000 0.5216000 12.56000 0.6330000 0.8005000      0.8203000 
1 1 1 34 1  13 o 7.880000 0.6051000 7.820000 0.7837000 7.940000 0.9223000 -0.1199000     1.210000  
1 1 1 34 1  15 o 12.93000 0.4189000 12.98000 0.5262000 12.89000 0.6521000 0.8672000E-01  0.8379000 
1 1 1 34 1  17 o 4.609000 0.8991000 4.831000 1.177000  4.386000 1.359000  0.4454000      1.798000  
1 1 1 34 1  19 o 13.26000 0.3554000 13.58000 0.5189000 12.94000 0.4859000 0.6412000      0.7109000 
1 1 1 34 1  21 o 25.80000 0.3304000 26.46000 0.5070000 25.14000 0.4237000 1.322000       0.6607000 
1 1 1 34 1  23 o 10.00000 0.5950000 8.708000 0.9960000 11.29000 0.6513000 -2.585000      1.190000  
1 1 1 34 1  25 o 16.70000 0.4021000 17.65000 0.5981000 15.75000 0.5376000 1.904000       0.8042000 
1 1 1 34 1  27 o 10.75000 0.5486000 9.998000 0.8362000 11.51000 0.7102000 -1.513000      1.097000  
1 1 1 34 1  29 o 3.211000 0.8671000 3.297000 1.234000  3.125000 1.218000  0.1726000      1.734000  
1 1 1 34 1  31 o 4.014000 0.9533000 3.095000 1.318000  4.933000 1.378000  -1.838000      1.907000  
1 1 1 34 1  33 o 7.660000 0.6172000 7.705000 0.9014000 7.615000 0.8433000 0.8993000E-01  1.234000  
1 1 1 34 1  35 o 16.92000 0.3956000 17.33000 0.4920000 16.50000 0.6197000 0.8313000      0.7913000 
1 1 1 34 1  37 o 13.58000 0.4310000 13.96000 0.5140000 13.20000 0.6920000 0.7572000      0.8620000 
1 1 1 34 1  39 o 6.554000 0.8202000 4.518000 1.328000  8.589000 0.9630000 -4.071000      1.640000  
1 1 1 34 1  41 o 6.582000 0.8887000 7.079000 1.224000  6.086000 1.288000  0.9931000      1.777000  
1 1 1 34 1  43 o 11.76000 0.5693000 12.00000 0.7185000 11.52000 0.8834000 0.4857000      1.139000  
1 1 1 34 1  45 o 4.613000 1.045000  4.477000 1.536000  4.750000 1.416000  -0.2734000     2.089000  
1 1 1 34 1  47 o 5.534000 0.8865000 7.619000 1.114000  3.449000 1.380000  4.171000       1.773000  
1 1 1 34 2  0  o 10.20000 0.7039000 10.20000 0.7039000 10.20000 0.7039000 0.000000       0.000000  
1 1 1 34 2  2  o 14.94000 0.3847000 14.97000 0.4973000 14.92000 0.5870000 0.4443000E-01  0.7693000 
1 1 1 34 2  4  o 27.62000 0.3257000 27.74000 0.4447000 27.50000 0.4759000 0.2395000      0.6513000 
1 1 1 34 2  6  o 17.69000 0.3468000 17.86000 0.4671000 17.51000 0.5128000 0.3489000      0.6936000 
1 1 1 34 2  8  o 22.62000 0.3112000 23.01000 0.4455000 22.23000 0.4346000 0.7819000      0.6224000 
1 1 1 34 2  10 o 9.003000 0.5423000 9.233000 0.8386000 8.774000 0.6877000 0.4594000      1.085000  
1 1 1 34 2  12 o 28.02000 0.3008000 28.71000 0.4305000 27.32000 0.4202000 1.393000       0.6016000 
1 1 1 34 2  14 o 8.274000 0.5237000 7.825000 0.7895000 8.724000 0.6882000 -0.8992000     1.047000  
1 1 1 34 2  16 o 8.050000 0.5082000 8.307000 0.6922000 7.793000 0.7444000 0.5148000      1.016000  
1 1 1 34 2  18 o 17.35000 0.3153000 17.33000 0.4624000 17.37000 0.4288000 -0.4226000E-01 0.6306000 
1 1 1 34 2  20 o 5.165000 0.7753000 6.011000 0.9464000 4.319000 1.228000  1.692000       1.551000  
1 1 1 34 2  22 f 4.983000 0.8467000 4.936000 1.306000  5.029000 1.077000  -0.9364000E-01 1.693000  
1 1 1 34 2  24 o 3.895000 0.9107000 3.470000 1.250000  4.320000 1.325000  -0.8506000     1.821000  
1 1 1 34 2  26 o 24.32000 0.3749000 23.88000 0.5540000 24.76000 0.5054000 -0.8880000     0.7499000 
1 1 1 34 2  28 o 9.307000 0.5379000 8.969000 0.8671000 9.646000 0.6369000 -0.6767000     1.076000  
1 1 1 34 2  30 o 3.694000 0.9506000 4.009000 1.413000  3.379000 1.272000  0.6296000      1.901000  
1 1 1 34 2  32 o 9.004000 0.5606000 8.975000 0.7509000 9.032000 0.8325000 -0.5694000E-01 1.121000  
1 1 1 34 2  34 o 12.26000 0.4194000 12.50000 0.5822000 12.03000 0.6039000 0.4681000      0.8388000 
1 1 1 34 2  36 o 6.203000 0.8587000 5.707000 1.298000  6.699000 1.125000  -0.9917000     1.717000  
1 1 1 34 2  38 o 2.695000 0.8456000 2.752000 1.180000  2.638000 1.212000  0.1139000      1.691000  
1 1 1 34 2  40 o 11.39000 0.5274000 11.30000 0.7046000 11.47000 0.7849000 -0.1749000     1.055000  
1 1 1 34 2  42 o 5.378000 0.9969000 6.066000 1.210000  4.689000 1.585000  1.377000       1.994000  
1 1 1 34 2  44 o 4.357000 0.9989000 5.029000 1.416000  3.684000 1.410000  1.346000       1.998000  
1 1 1 34 2  46 o 2.826000 0.8990000 2.811000 1.299000  2.841000 1.244000  -0.3008000E-01 1.798000  
1 1 1 34 3  1  o 34.67000 0.3475000 34.30000 0.4554000 35.03000 0.5251000 -0.7297000     0.6951000 
1 1 1 34 3  3  o 20.43000 0.3861000 20.41000 0.4527000 20.44000 0.6257000 -0.2978000E-01 0.7723000 
1 1 1 34 3  5  o 20.79000 0.3890000 20.57000 0.4537000 21.02000 0.6321000 -0.4442000     0.7781000 
1 1 1 34 3  7  o 29.89000 0.3162000 30.21000 0.4440000 29.57000 0.4504000 0.6403000      0.6324000 
1 1 1 34 3  9  o 27.89000 0.3076000 27.71000 0.4362000 28.07000 0.4340000 -0.3581000     0.6153000 
1 1 1 34 3  11 o 16.01000 0.3607000 16.40000 0.5451000 15.63000 0.4724000 0.7718000      0.7213000 
1 1 1 34 3  13 o 11.96000 0.4051000 12.34000 0.5673000 11.59000 0.5783000 0.7479000      0.8101000 
1 1 1 34 3  15 o 11.71000 0.3825000 11.38000 0.5448000 12.04000 0.5371000 -0.6666000     0.7650000 
1 1 1 34 3  17 o 9.481000 0.4446000 9.366000 0.6381000 9.596000 0.6192000 -0.2301000     0.8891000 
1 1 1 34 3  19 o 11.97000 0.3636000 11.85000 0.5098000 12.10000 0.5184000 -0.2419000     0.7271000 
1 1 1 34 3  21 o 15.83000 0.4607000 16.64000 0.7524000 15.02000 0.5320000 1.617000       0.9214000 
1 1 1 34 3  23 o 4.516000 0.9021000 3.518000 1.330000  5.514000 1.219000  -1.996000      1.804000  
1 1 1 34 3  25 o 30.05000 0.4316000 28.88000 0.5423000 31.22000 0.6715000 -2.341000      0.8631000 
1 1 1 34 3  27 o 20.17000 0.3524000 20.74000 0.5418000 19.61000 0.4509000 1.128000       0.7049000 
1 1 1 34 3  29 o 11.27000 0.5150000 11.98000 0.8258000 10.56000 0.6157000 1.418000       1.030000  
1 1 1 34 3  31 o 6.610000 0.6549000 6.462000 0.9703000 6.758000 0.8798000 -0.2961000     1.310000  
1 1 1 34 3  33 o 4.537000 0.8835000 5.554000 1.115000  3.519000 1.371000  2.035000       1.767000  
1 1 1 34 3  35 o 3.750000 0.9302000 3.755000 1.355000  3.744000 1.275000  0.1016000E-01  1.860000  
1 1 1 34 3  37 o 6.583000 0.8113000 6.415000 1.158000  6.752000 1.136000  -0.3369000     1.623000  
1 1 1 34 3  39 o 5.531000 1.030000  5.534000 1.236000  5.527000 1.649000  0.7127000E-02  2.061000  
1 1 1 34 3  41 o 5.201000 1.058000  4.573000 1.485000  5.830000 1.508000  -1.257000      2.117000  
1 1 1 34 3  43 o 6.745000 0.7965000 6.520000 1.168000  6.971000 1.083000  -0.4515000     1.593000  
1 1 1 34 3  45 o 4.451000 0.9802000 5.153000 1.402000  3.748000 1.371000  1.404000       1.960000  
1 1 1 34 3  47 o 6.058000 1.220000  4.785000 1.683000  7.332000 1.766000  -2.546000      2.440000  
1 1 1 34 4  0  o 15.49000 0.5932000 15.49000 0.5932000 15.49000 0.5932000 0.000000       0.000000  
1 1 1 34 4  2  o 13.72000 0.4155000 13.73000 0.6090000 13.70000 0.5655000 0.2382000E-01  0.8311000 
1 1 1 34 4  4  o 16.54000 0.3904000 17.07000 0.5650000 16.02000 0.5388000 1.052000       0.7807000 
1 1 1 34 4  6  o 36.89000 0.3652000 37.27000 0.4728000 36.52000 0.5566000 0.7546000      0.7303000 
1 1 1 34 4  8  o 47.09000 0.3869000 46.90000 0.5421000 47.27000 0.5522000 -0.3686000     0.7738000 
1 1 1 34 4  10 o 25.97000 0.3056000 25.70000 0.4373000 26.23000 0.4270000 -0.5318000     0.6112000 
1 1 1 34 4  12 o 11.73000 0.4346000 11.93000 0.6654000 11.53000 0.5594000 0.3972000      0.8693000 
1 1 1 34 4  14 o 18.21000 0.3105000 18.27000 0.4388000 18.15000 0.4394000 0.1203000      0.6209000 
1 1 1 34 4  16 o 9.447000 0.4700000 9.212000 0.7167000 9.683000 0.6081000 -0.4705000     0.9399000 
1 1 1 34 4  18 o 21.82000 0.3158000 21.63000 0.4739000 22.02000 0.4175000 -0.3906000     0.6316000 
1 1 1 34 4  20 o 19.76000 0.3349000 19.89000 0.5138000 19.64000 0.4297000 0.2491000      0.6698000 
1 1 1 34 4  22 o 18.82000 0.3550000 19.21000 0.5270000 18.42000 0.4758000 0.7869000      0.7100000 
1 1 1 34 4  24 o 17.01000 0.3779000 17.28000 0.5448000 16.75000 0.5238000 0.5284000      0.7558000 
1 1 1 34 4  26 o 8.186000 0.7476000 7.300000 0.8101000 9.072000 1.257000  -1.773000      1.495000  
1 1 1 34 4  28 o 11.69000 0.4259000 11.57000 0.6208000 11.80000 0.5834000 -0.2253000     0.8519000 
1 1 1 34 4  30 o 5.920000 0.8424000 6.561000 1.248000  5.279000 1.132000  1.283000       1.685000  
1 1 1 34 4  32 o 8.905000 0.5038000 8.618000 0.7701000 9.192000 0.6498000 -0.5737000     1.008000  
1 1 1 34 4  34 o 13.04000 0.3872000 13.10000 0.5425000 12.98000 0.5526000 0.1173000      0.7744000 
1 1 1 34 4  36 o 10.88000 0.5097000 10.92000 0.6735000 10.85000 0.7652000 0.6575000E-01  1.019000  
1 1 1 34 4  38 o 3.675000 0.9469000 2.977000 1.197000  4.373000 1.468000  -1.396000      1.894000  
1 1 1 34 4  40 o 5.179000 1.015000  5.006000 1.344000  5.352000 1.521000  -0.3453000     2.030000  
1 1 1 34 4  42 o 8.740000 0.6316000 8.519000 0.8903000 8.961000 0.8962000 -0.4420000     1.263000  
1 1 1 34 4  44 o 6.206000 0.8806000 5.941000 1.298000  6.472000 1.191000  -0.5312000     1.761000  
1 1 1 34 4  46 o 3.318000 0.9898000 3.545000 1.445000  3.091000 1.353000  0.4543000      1.980000  
1 1 1 34 5  1  o 6.444000 0.7172000 6.658000 1.007000  6.231000 1.021000  0.4269000      1.434000  
1 1 1 34 5  3  o 4.654000 0.9349000 5.031000 1.324000  4.276000 1.321000  0.7547000      1.870000  
1 1 1 34 5  5  o 11.24000 0.4773000 10.84000 0.7353000 11.64000 0.6088000 -0.7965000     0.9546000 
1 1 1 34 5  7  o 21.65000 0.3646000 21.82000 0.5011000 21.47000 0.5298000 0.3531000      0.7292000 
1 1 1 34 5  9  o 23.52000 0.3488000 24.07000 0.4867000 22.97000 0.4997000 1.102000       0.6976000 
1 1 1 34 5  11 o 7.590000 0.6425000 7.537000 0.9793000 7.643000 0.8321000 -0.1061000     1.285000  
1 1 1 34 5  13 o 23.23000 0.3210000 22.99000 0.4740000 23.48000 0.4328000 -0.4922000     0.6419000 
1 1 1 34 5  15 o 12.94000 0.3802000 12.69000 0.5569000 13.19000 0.5179000 -0.4998000     0.7605000 
1 1 1 34 5  17 o 12.34000 0.3659000 12.76000 0.5009000 11.92000 0.5335000 0.8427000      0.7318000 
1 1 1 34 5  19 o 22.25000 0.2999000 22.23000 0.4295000 22.26000 0.4188000 -0.2493000E-01 0.5999000 
1 1 1 34 5  21 o 31.54000 0.3712000 31.37000 0.5246000 31.71000 0.5253000 -0.3342000     0.7424000 
1 1 1 34 5  23 o 21.79000 0.3466000 22.72000 0.5091000 20.86000 0.4704000 1.852000       0.6932000 
1 1 1 34 5  25 o 4.690000 0.9443000 3.751000 1.443000  5.628000 1.218000  -1.876000      1.889000  
1 1 1 34 5  27 o 3.930000 0.9106000 3.781000 1.342000  4.079000 1.231000  -0.2975000     1.821000  
1 1 1 34 5  29 o 11.27000 0.4561000 10.95000 0.7088000 11.60000 0.5743000 -0.6467000     0.9123000 
1 1 1 34 5  31 o 4.905000 0.9013000 4.328000 1.434000  5.482000 1.092000  -1.154000      1.803000  
1 1 1 34 5  33 o 8.016000 0.5629000 8.240000 0.7868000 7.792000 0.8051000 0.4480000      1.126000  
1 1 1 34 5  35 o 3.132000 0.8516000 3.748000 1.263000  2.515000 1.142000  1.233000       1.703000  
1 1 1 34 5  37 o 13.63000 0.4570000 14.02000 0.6414000 13.23000 0.6512000 0.7963000      0.9140000 
1 1 1 34 5  39 o 3.176000 0.9865000 2.786000 1.181000  3.565000 1.580000  -0.7797000     1.973000  
1 1 1 34 5  41 o 6.553000 0.7709000 6.755000 1.051000  6.351000 1.129000  0.4038000      1.542000  
1 1 1 34 5  43 o 7.272000 0.8009000 7.407000 1.124000  7.138000 1.141000  0.2688000      1.602000  
1 1 1 34 5  45 o 4.801000 0.9838000 5.083000 1.399000  4.520000 1.384000  0.5631000      1.968000  
1 1 1 34 6  0  o 13.07000 0.5497000 13.07000 0.5497000 13.07000 0.5497000 0.000000       0.000000  
1 1 1 34 6  2  o 4.020000 0.9353000 4.164000 1.344000  3.876000 1.301000  0.2882000      1.871000  
1 1 1 34 6  4  o 28.31000 0.3113000 28.48000 0.4457000 28.15000 0.4347000 0.3377000      0.6226000 
1 1 1 34 6  6  o 20.57000 0.3163000 20.94000 0.4438000 20.21000 0.4507000 0.7271000      0.6325000 
1 1 1 34 6  8  o 16.93000 0.4186000 16.55000 0.4843000 17.32000 0.6828000 -0.7765000     0.8372000 
1 1 1 34 6  10 o 15.84000 0.3428000 15.60000 0.4808000 16.08000 0.4888000 -0.4872000     0.6856000 
1 1 1 34 6  12 o 13.14000 0.3991000 13.33000 0.5733000 12.95000 0.5555000 0.3720000      0.7983000 
1 1 1 34 6  14 o 9.156000 0.4753000 9.368000 0.6638000 8.945000 0.6804000 0.4229000      0.9506000 
1 1 1 34 6  16 o 4.254000 0.8380000 5.123000 1.123000  3.385000 1.244000  1.739000       1.676000  
1 1 1 34 6  18 o 18.35000 0.3112000 18.60000 0.4483000 18.10000 0.4317000 0.4980000      0.6223000 
1 1 1 34 6  20 o 19.71000 0.3261000 20.41000 0.4869000 19.01000 0.4338000 1.405000       0.6522000 
1 1 1 34 6  22 o 10.21000 0.4997000 10.22000 0.6156000 10.21000 0.7872000 0.1318000E-01  0.9993000 
1 1 1 34 6  24 o 3.463000 0.9319000 3.036000 1.194000  3.890000 1.431000  -0.8534000     1.864000  
1 1 1 34 6  26 f 9.684000 0.5047000 9.620000 0.6822000 9.747000 0.7441000 -0.1269000     1.009000  
1 1 1 34 6  28 o 2.688000 0.8219000 2.615000 1.150000  2.761000 1.174000  -0.1450000     1.644000  
1 1 1 34 6  30 o 10.06000 0.4575000 9.951000 0.6764000 10.18000 0.6161000 -0.2278000     0.9149000 
1 1 1 34 6  32 o 5.978000 0.7409000 5.172000 1.181000  6.785000 0.8945000 -1.613000      1.482000  
1 1 1 34 6  34 o 4.140000 0.9040000 5.055000 1.255000  3.224000 1.301000  1.831000       1.808000  
1 1 1 34 6  36 o 11.30000 0.5778000 10.65000 0.6581000 11.94000 0.9499000 -1.290000      1.156000  
1 1 1 34 6  38 o 10.21000 0.5595000 10.36000 0.6996000 10.05000 0.8733000 0.3163000      1.119000  
1 1 1 34 6  40 o 10.52000 0.7328000 11.10000 0.7363000 9.940000 1.267000  1.158000       1.466000  
1 1 1 34 6  42 o 4.157000 0.9951000 5.198000 1.429000  3.117000 1.385000  2.081000       1.990000  
1 1 1 34 6  44 o 4.195000 1.001000  3.769000 1.397000  4.622000 1.434000  -0.8525000     2.002000  
1 1 1 34 6  46 o 4.759000 0.9831000 4.088000 1.444000  5.431000 1.335000  -1.343000      1.966000  
1 1 1 34 7  1  o 17.40000 0.3399000 17.58000 0.4805000 17.23000 0.4808000 0.3479000      0.6798000 
1 1 1 34 7  3  o 14.39000 0.3724000 13.96000 0.5461000 14.82000 0.5064000 -0.8532000     0.7447000 
1 1 1 34 7  5  o 11.82000 0.4065000 12.04000 0.5633000 11.60000 0.5863000 0.4345000      0.8131000 
1 1 1 34 7  7  o 13.80000 0.3750000 14.48000 0.4968000 13.11000 0.5620000 1.374000       0.7501000 
1 1 1 34 7  9  o 33.06000 0.3539000 32.19000 0.4437000 33.92000 0.5514000 -1.734000      0.7078000 
1 1 1 34 7  11 o 21.54000 0.3064000 21.40000 0.4343000 21.67000 0.4322000 -0.2683000     0.6127000 
1 1 1 34 7  13 o 10.22000 0.4677000 10.15000 0.7157000 10.30000 0.6023000 -0.1468000     0.9354000 
1 1 1 34 7  15 o 8.456000 0.4832000 8.812000 0.6328000 8.100000 0.7305000 0.7126000      0.9665000 
1 1 1 34 7  17 f 14.99000 0.3393000 15.27000 0.4698000 14.71000 0.4897000 0.5558000      0.6786000 
1 1 1 34 7  19 o 7.806000 0.5810000 7.815000 0.8624000 7.796000 0.7787000 0.1917000E-01  1.162000  
1 1 1 34 7  21 o 19.95000 0.3814000 19.65000 0.5485000 20.25000 0.5302000 -0.5929000     0.7629000 
1 1 1 34 7  23 o 19.93000 0.3602000 20.16000 0.4981000 19.70000 0.5205000 0.4603000      0.7205000 
1 1 1 34 7  25 o 9.939000 0.4741000 8.990000 0.7067000 10.89000 0.6322000 -1.899000      0.9482000 
1 1 1 34 7  27 o 9.540000 0.5252000 9.768000 0.6990000 9.311000 0.7841000 0.4562000      1.050000  
1 1 1 34 7  29 o 11.13000 0.4312000 11.16000 0.6432000 11.11000 0.5746000 0.5210000E-01  0.8625000 
1 1 1 34 7  31 o 5.197000 0.7959000 5.107000 1.176000  5.287000 1.072000  -0.1802000     1.592000  
1 1 1 34 7  33 o 4.629000 0.8138000 2.715000 1.167000  6.543000 1.134000  -3.828000      1.628000  
1 1 1 34 7  35 o 5.235000 1.025000  3.700000 1.313000  6.771000 1.575000  -3.071000      2.050000  
1 1 1 34 7  37 o 10.42000 0.5372000 10.38000 0.6943000 10.45000 0.8200000 -0.7264000E-01 1.074000  
1 1 1 34 7  39 f 4.808000 0.9649000 6.038000 1.336000  3.579000 1.392000  2.459000       1.930000  
1 1 1 34 7  41 o 15.68000 0.3963000 15.60000 0.5501000 15.77000 0.5706000 -0.1694000     0.7926000 
1 1 1 34 7  43 o 9.368000 0.8258000 10.18000 0.7811000 8.558000 1.455000  1.620000       1.652000  
1 1 1 34 7  45 o 3.115000 0.9085000 3.596000 1.382000  2.634000 1.180000  0.9616000      1.817000  
1 1 1 34 8  0  o 29.92000 0.4364000 29.92000 0.4364000 29.92000 0.4364000 0.000000       0.000000  
1 1 1 34 8  2  o 10.97000 0.4420000 11.64000 0.6067000 10.30000 0.6428000 1.342000       0.8839000 
1 1 1 34 8  4  o 31.60000 0.3115000 31.21000 0.4357000 31.99000 0.4454000 -0.7796000     0.6231000 
1 1 1 34 8  6  o 13.99000 0.3552000 14.07000 0.4847000 13.91000 0.5195000 0.1680000      0.7105000 
1 1 1 34 8  8  o 21.72000 0.3104000 21.10000 0.4228000 22.34000 0.4545000 -1.244000      0.6207000 
1 1 1 34 8  10 o 20.95000 0.3823000 21.22000 0.4709000 20.67000 0.6025000 0.5553000      0.7646000 
1 1 1 34 8  12 o 35.81000 0.3250000 35.40000 0.4587000 36.22000 0.4604000 -0.8271000     0.6499000 
1 1 1 34 8  14 o 27.36000 0.3248000 26.82000 0.4940000 27.90000 0.4218000 -1.084000      0.6496000 
1 1 1 34 8  16 o 4.726000 0.8084000 4.980000 1.127000  4.473000 1.159000  0.5066000      1.617000  
1 1 1 34 8  18 o 3.285000 0.8095000 2.395000 1.087000  4.176000 1.200000  -1.781000      1.619000  
1 1 1 34 8  20 o 21.80000 0.3376000 21.65000 0.4245000 21.96000 0.5251000 -0.3121000     0.6752000 
1 1 1 34 8  22 o 3.248000 0.8936000 3.067000 1.205000  3.428000 1.320000  -0.3607000     1.787000  
1 1 1 34 8  24 o 4.042000 0.8921000 3.948000 1.250000  4.136000 1.273000  -0.1878000     1.784000  
1 1 1 34 8  26 o 10.33000 0.4314000 9.948000 0.6388000 10.71000 0.5800000 -0.7612000     0.8629000 
1 1 1 34 8  28 o 12.47000 0.4085000 12.75000 0.5912000 12.18000 0.5640000 0.5684000      0.8171000 
1 1 1 34 8  30 o 4.907000 0.8772000 5.871000 1.219000  3.943000 1.262000  1.927000       1.754000  
1 1 1 34 8  32 o 4.341000 0.8821000 4.738000 1.235000  3.943000 1.260000  0.7949000      1.764000  
1 1 1 34 8  34 o 17.83000 0.5191000 17.26000 0.4902000 18.40000 0.9151000 -1.137000      1.038000  
1 1 1 34 8  36 o 14.49000 0.4396000 15.33000 0.6080000 13.66000 0.6351000 1.672000       0.8792000 
1 1 1 34 8  38 o 9.084000 0.6623000 8.710000 0.8434000 9.459000 1.021000  -0.7489000     1.325000  
1 1 1 34 8  40 o 8.117000 0.7067000 8.121000 0.7617000 8.114000 1.190000  0.6968000E-02  1.413000  
1 1 1 34 8  42 o 3.875000 1.008000  3.915000 1.469000  3.835000 1.382000  0.7978000E-01  2.017000  
1 1 1 34 8  44 o 4.908000 1.010000  4.798000 1.418000  5.017000 1.438000  -0.2190000     2.019000  
1 1 1 34 8  46 o 6.278000 0.8450000 6.076000 1.209000  6.481000 1.180000  -0.4054000     1.690000  
1 1 1 34 9  1  o 32.71000 0.3215000 32.58000 0.4575000 32.85000 0.4518000 -0.2664000     0.6430000 
1 1 1 34 9  3  o 12.55000 0.3900000 12.61000 0.5424000 12.48000 0.5605000 0.1269000      0.7800000 
1 1 1 34 9  5  o 12.47000 0.3781000 12.46000 0.5382000 12.48000 0.5311000 -0.1970000E-01 0.7562000 
1 1 1 34 9  7  o 3.520000 0.8926000 3.256000 1.216000  3.784000 1.307000  -0.5277000     1.785000  
1 1 1 34 9  9  o 6.486000 0.7125000 7.257000 0.8013000 5.716000 1.178000  1.541000       1.425000  
1 1 1 34 9  11 o 12.72000 0.4085000 13.00000 0.5255000 12.44000 0.6256000 0.5617000      0.8170000 
1 1 1 34 9  13 o 20.31000 0.3008000 20.32000 0.4218000 20.31000 0.4291000 0.1305000E-01  0.6017000 
1 1 1 34 9  15 o 9.523000 0.4721000 9.397000 0.7320000 9.650000 0.5964000 -0.2533000     0.9442000 
1 1 1 34 9  17 o 9.119000 0.6235000 9.245000 1.004000  8.994000 0.7395000 0.2508000      1.247000  
1 1 1 34 9  19 o 12.43000 0.3734000 13.18000 0.5061000 11.67000 0.5493000 1.509000       0.7469000 
1 1 1 34 9  21 o 12.52000 0.4189000 13.28000 0.4890000 11.76000 0.6802000 1.520000       0.8378000 
1 1 1 34 9  23 o 8.766000 0.4836000 9.436000 0.5812000 8.096000 0.7732000 1.341000       0.9673000 
1 1 1 34 9  25 o 10.57000 0.4360000 10.64000 0.6236000 10.51000 0.6094000 0.1355000      0.8719000 
1 1 1 34 9  27 o 9.046000 0.5162000 8.966000 0.7061000 9.126000 0.7532000 -0.1609000     1.032000  
1 1 1 34 9  29 o 9.218000 0.4844000 9.128000 0.6896000 9.309000 0.6804000 -0.1810000     0.9688000 
1 1 1 34 9  31 o 4.862000 0.9017000 4.697000 1.382000  5.027000 1.158000  -0.3294000     1.803000  
1 1 1 34 9  33 o 9.520000 0.6127000 8.922000 0.6656000 10.12000 1.029000  -1.196000      1.225000  
1 1 1 34 9  35 o 10.72000 0.4937000 10.28000 0.6527000 11.15000 0.7409000 -0.8755000     0.9874000 
1 1 1 34 9  37 o 6.977000 0.6996000 6.297000 1.062000  7.656000 0.9116000 -1.359000      1.399000  
1 1 1 34 9  39 o 10.34000 0.5107000 9.527000 0.7002000 11.15000 0.7436000 -1.623000      1.021000  
1 1 1 34 9  41 o 4.506000 0.9669000 4.618000 1.257000  4.393000 1.469000  0.2254000      1.934000  
1 1 1 34 9  43 o 3.493000 0.9271000 3.825000 1.321000  3.161000 1.301000  0.6648000      1.854000  
1 1 1 34 9  45 o 4.619000 1.043000  4.568000 1.326000  4.669000 1.610000  -0.1013000     2.086000  
1 1 1 34 10 0  o 4.520000 1.266000  4.520000 1.266000  4.520000 1.266000  0.000000       0.000000  
1 1 1 34 10 2  o 9.474000 0.4662000 9.035000 0.6945000 9.914000 0.6222000 -0.8785000     0.9325000 
1 1 1 34 10 4  o 22.95000 0.2939000 22.82000 0.4128000 23.08000 0.4183000 -0.2623000     0.5877000 
1 1 1 34 10 6  o 25.27000 0.3105000 24.76000 0.4548000 25.77000 0.4228000 -1.011000      0.6209000 
1 1 1 34 10 8  o 19.24000 0.4124000 19.82000 0.4247000 18.66000 0.7071000 1.165000       0.8248000 
1 1 1 34 10 10 o 12.85000 0.3839000 12.84000 0.5010000 12.85000 0.5818000 -0.8402000E-02 0.7678000 
1 1 1 34 10 12 o 15.08000 0.3390000 15.40000 0.4785000 14.77000 0.4804000 0.6337000      0.6781000 
1 1 1 34 10 14 o 20.46000 0.3047000 20.15000 0.4252000 20.76000 0.4366000 -0.6063000     0.6095000 
1 1 1 34 10 16 o 17.39000 0.3743000 16.97000 0.5990000 17.81000 0.4489000 -0.8451000     0.7485000 
1 1 1 34 10 18 o 8.673000 0.4701000 8.413000 0.6694000 8.933000 0.6601000 -0.5199000     0.9401000 
1 1 1 34 10 20 o 23.44000 0.3747000 23.39000 0.4194000 23.49000 0.6211000 -0.9664000E-01 0.7494000 
1 1 1 34 10 22 o 9.491000 0.4808000 9.145000 0.6625000 9.837000 0.6969000 -0.6927000     0.9615000 
1 1 1 34 10 24 o 5.815000 0.6737000 5.376000 0.9845000 6.254000 0.9200000 -0.8773000     1.347000  
1 1 1 34 10 26 o 3.264000 0.8514000 2.774000 1.167000  3.755000 1.240000  -0.9812000     1.703000  
1 1 1 34 10 28 o 26.98000 0.3918000 26.70000 0.5106000 27.26000 0.5943000 -0.5599000     0.7835000 
1 1 1 34 10 30 o 4.432000 0.9323000 3.836000 1.320000  5.029000 1.317000  -1.193000      1.865000  
1 1 1 34 10 32 o 18.72000 0.3542000 18.22000 0.4499000 19.22000 0.5472000 -0.9959000     0.7084000 
1 1 1 34 10 34 o 12.96000 0.4153000 12.67000 0.5557000 13.24000 0.6173000 -0.5740000     0.8306000 
1 1 1 34 10 36 o 3.544000 0.9089000 4.247000 1.330000  2.841000 1.239000  1.407000       1.818000  
1 1 1 34 10 38 o 8.540000 0.5754000 7.518000 0.7624000 9.562000 0.8620000 -2.044000      1.151000  
1 1 1 34 10 40 o 9.226000 0.6742000 8.262000 0.9615000 10.19000 0.9453000 -1.927000      1.348000  
1 1 1 34 10 42 o 3.694000 1.010000  3.329000 1.358000  4.059000 1.494000  -0.7303000     2.019000  
1 1 1 34 10 44 o 4.333000 1.024000  5.383000 1.555000  3.282000 1.334000  2.101000       2.049000  
1 1 1 34 11 1  o 18.60000 0.3070000 18.78000 0.4420000 18.42000 0.4261000 0.3593000      0.6139000 
1 1 1 34 11 3  o 11.71000 0.4044000 12.17000 0.5582000 11.26000 0.5854000 0.9109000      0.8089000 
1 1 1 34 11 5  o 13.67000 0.3515000 13.56000 0.4896000 13.77000 0.5044000 -0.2023000     0.7029000 
1 1 1 34 11 7  o 20.57000 0.3383000 20.25000 0.4235000 20.89000 0.5276000 -0.6408000     0.6765000 
1 1 1 34 11 9  o 18.15000 0.3462000 17.90000 0.4390000 18.39000 0.5354000 -0.4902000     0.6924000 
1 1 1 34 11 11 o 23.07000 0.3952000 22.12000 0.4249000 24.02000 0.6666000 -1.905000      0.7905000 
1 1 1 34 11 13 o 3.898000 0.9436000 3.514000 1.369000  4.281000 1.299000  -0.7664000     1.887000  
1 1 1 34 11 15 o 14.95000 0.3790000 14.54000 0.5160000 15.36000 0.5551000 -0.8198000     0.7579000 
1 1 1 34 11 17 o 3.874000 0.9149000 3.502000 1.208000  4.247000 1.374000  -0.7455000     1.830000  
1 1 1 34 11 19 o 6.721000 0.6929000 7.598000 0.7356000 5.844000 1.174000  1.754000       1.386000  
1 1 1 34 11 21 o 9.204000 0.5349000 9.381000 0.6265000 9.028000 0.8672000 0.3533000      1.070000  
1 1 1 34 11 23 o 3.818000 0.8256000 4.667000 1.124000  2.968000 1.210000  1.699000       1.651000  
1 1 1 34 11 25 o 3.935000 0.9113000 3.801000 1.290000  4.069000 1.288000  -0.2681000     1.823000  
1 1 1 34 11 27 o 4.847000 0.8511000 4.538000 1.288000  5.155000 1.113000  -0.6174000     1.702000  
1 1 1 34 11 29 o 8.382000 0.5540000 7.906000 0.7602000 8.858000 0.8061000 -0.9521000     1.108000  
1 1 1 34 11 31 o 5.482000 0.8793000 5.236000 1.227000  5.728000 1.260000  -0.4921000     1.759000  
1 1 1 34 11 33 o 9.369000 0.5803000 8.323000 0.8960000 10.41000 0.7377000 -2.091000      1.161000  
1 1 1 34 11 35 o 15.81000 0.3786000 15.64000 0.4617000 15.98000 0.6000000 -0.3407000     0.7571000 
1 1 1 34 11 37 o 10.59000 0.5365000 10.57000 0.5951000 10.61000 0.8929000 -0.3328000E-01 1.073000  
1 1 1 34 11 39 o 5.353000 0.9286000 4.811000 1.251000  5.894000 1.373000  -1.083000      1.857000  
1 1 1 34 11 41 o 9.873000 0.5641000 9.983000 0.6989000 9.763000 0.8856000 0.2200000      1.128000  
1 1 1 34 11 43 o 10.56000 0.5124000 10.44000 0.7248000 10.67000 0.7244000 -0.2350000     1.025000  
1 1 1 34 11 45 o 3.982000 1.024000  3.794000 1.509000  4.171000 1.384000  -0.3777000     2.048000  
1 1 1 34 12 0  o 19.71000 0.4160000 19.71000 0.4160000 19.71000 0.4160000 0.000000       0.000000  
1 1 1 34 12 2  o 8.674000 0.4932000 8.429000 0.7441000 8.919000 0.6475000 -0.4909000     0.9864000 
1 1 1 34 12 4  o 10.20000 0.4257000 9.973000 0.6044000 10.43000 0.5996000 -0.4616000     0.8514000 
1 1 1 34 12 6  o 27.95000 0.3260000 27.72000 0.4186000 28.18000 0.4999000 -0.4623000     0.6520000 
1 1 1 34 12 8  o 5.084000 0.8951000 5.345000 1.030000  4.822000 1.464000  0.5233000      1.790000  
1 1 1 34 12 10 o 10.48000 0.5209000 10.04000 0.7194000 10.92000 0.7534000 -0.8792000     1.042000  
1 1 1 34 12 12 o 15.52000 0.3771000 15.44000 0.4527000 15.61000 0.6031000 -0.1715000     0.7541000 
1 1 1 34 12 14 o 5.862000 0.7203000 6.027000 1.026000  5.697000 1.012000  0.3298000      1.441000  
1 1 1 34 12 16 o 12.72000 0.3711000 12.55000 0.5486000 12.88000 0.4998000 -0.3275000     0.7421000 
1 1 1 34 12 18 f 8.191000 0.5160000 8.499000 0.6500000 7.882000 0.8016000 0.6169000      1.032000  
1 1 1 34 12 20 o 7.456000 0.5582000 8.112000 0.6498000 6.801000 0.9078000 1.310000       1.116000  
1 1 1 34 12 22 o 9.274000 0.6389000 9.747000 0.6919000 8.801000 1.074000  0.9458000      1.278000  
1 1 1 34 12 24 o 19.33000 0.4099000 19.57000 0.5843000 19.10000 0.5750000 0.4747000      0.8198000 
1 1 1 34 12 26 o 3.813000 0.8795000 4.621000 1.237000  3.005000 1.250000  1.616000       1.759000  
1 1 1 34 12 28 o 10.63000 0.5197000 10.45000 0.6413000 10.82000 0.8181000 -0.3676000     1.039000  
1 1 1 34 12 30 o 3.811000 0.9010000 3.362000 1.188000  4.260000 1.355000  -0.8984000     1.802000  
1 1 1 34 12 32 o 7.385000 0.7047000 6.788000 1.025000  7.982000 0.9676000 -1.194000      1.409000  
1 1 1 34 12 34 o 14.37000 0.4048000 14.07000 0.5523000 14.68000 0.5920000 -0.6072000     0.8097000 
1 1 1 34 12 36 o 9.983000 0.5524000 10.14000 0.6027000 9.827000 0.9258000 0.3121000      1.105000  
1 1 1 34 12 38 o 12.15000 0.4615000 11.73000 0.5817000 12.57000 0.7166000 -0.8484000     0.9229000 
1 1 1 34 12 40 o 11.37000 0.5690000 11.93000 0.5990000 10.81000 0.9676000 1.119000       1.138000  
1 1 1 34 12 42 o 3.459000 0.9687000 2.644000 1.205000  4.274000 1.517000  -1.630000      1.937000  
1 1 1 34 12 44 f 7.094000 0.7257000 6.896000 1.033000  7.292000 1.020000  -0.3956000     1.451000  
1 1 1 34 13 1  o 8.885000 0.4912000 9.310000 0.6852000 8.459000 0.7041000 0.8513000      0.9825000 
1 1 1 34 13 3  o 19.22000 0.3265000 19.35000 0.4887000 19.10000 0.4331000 0.2536000      0.6530000 
1 1 1 34 13 5  o 15.36000 0.3471000 15.52000 0.4394000 15.20000 0.5375000 0.3195000      0.6942000 
1 1 1 34 13 7  o 20.72000 0.3248000 20.31000 0.4237000 21.12000 0.4924000 -0.8115000     0.6496000 
1 1 1 34 13 9  o 13.57000 0.3651000 13.47000 0.4927000 13.68000 0.5390000 -0.2111000     0.7303000 
1 1 1 34 13 11 o 27.68000 0.3210000 27.44000 0.4714000 27.92000 0.4358000 -0.4821000     0.6420000 
1 1 1 34 13 13 o 15.56000 0.3692000 16.01000 0.4971000 15.11000 0.5461000 0.8941000      0.7385000 
1 1 1 34 13 15 o 20.31000 0.3052000 20.52000 0.4252000 20.10000 0.4378000 0.4259000      0.6103000 
1 1 1 34 13 17 o 7.412000 0.5879000 7.954000 0.7323000 6.871000 0.9201000 1.084000       1.176000  
1 1 1 34 13 19 o 8.426000 0.5594000 9.307000 0.6264000 7.544000 0.9271000 1.764000       1.119000  
1 1 1 34 13 21 o 9.648000 0.4657000 9.870000 0.6590000 9.426000 0.6582000 0.4441000      0.9314000 
1 1 1 34 13 23 f 15.02000 0.3498000 15.49000 0.4691000 14.56000 0.5189000 0.9344000      0.6996000 
1 1 1 34 13 25 o 11.73000 0.4348000 11.94000 0.6022000 11.52000 0.6273000 0.4190000      0.8696000 
1 1 1 34 13 27 o 3.146000 0.8846000 2.969000 1.176000  3.323000 1.322000  -0.3539000     1.769000  
1 1 1 34 13 29 o 17.32000 0.3496000 17.28000 0.4328000 17.36000 0.5492000 -0.8483000E-01 0.6992000 
1 1 1 34 13 31 o 6.416000 0.8312000 5.454000 1.385000  7.378000 0.9191000 -1.924000      1.662000  
1 1 1 34 13 33 o 7.128000 0.7260000 8.248000 0.7962000 6.009000 1.214000  2.239000       1.452000  
1 1 1 34 13 35 o 12.08000 0.4686000 11.52000 0.5306000 12.64000 0.7727000 -1.122000      0.9373000 
1 1 1 34 13 37 o 13.61000 0.3989000 13.52000 0.4841000 13.71000 0.6340000 -0.1988000     0.7977000 
1 1 1 34 13 39 o 9.924000 0.5549000 10.06000 0.6242000 9.788000 0.9175000 0.2710000      1.110000  
1 1 1 34 13 41 o 7.737000 0.6742000 6.955000 0.8752000 8.519000 1.026000  -1.565000      1.348000  
1 1 1 34 13 43 o 4.335000 1.016000  4.025000 1.313000  4.645000 1.552000  -0.6204000     2.032000  
1 1 1 34 13 45 o 4.761000 1.253000  4.114000 1.668000  5.408000 1.872000  -1.294000      2.507000  
1 1 1 34 14 0  o 29.46000 0.4899000 29.46000 0.4899000 29.46000 0.4899000 0.000000       0.000000  
1 1 1 34 14 2  o 13.56000 0.3578000 13.63000 0.5116000 13.49000 0.5004000 0.1363000      0.7157000 
1 1 1 34 14 4  o 31.86000 0.3279000 31.81000 0.4287000 31.91000 0.4964000 -0.1028000     0.6558000 
1 1 1 34 14 6  o 14.60000 0.4058000 14.30000 0.6141000 14.90000 0.5307000 -0.6019000     0.8117000 
1 1 1 34 14 8  o 3.223000 0.8559000 3.093000 1.177000  3.354000 1.243000  -0.2618000     1.712000  
1 1 1 34 14 10 o 9.911000 0.4644000 10.25000 0.6294000 9.573000 0.6831000 0.6766000      0.9288000 
1 1 1 34 14 12 o 3.453000 0.9275000 3.431000 1.338000  3.475000 1.285000  -0.4424000E-01 1.855000  
1 1 1 34 14 14 o 16.04000 0.3817000 16.11000 0.5616000 15.97000 0.5170000 0.1399000      0.7633000 
1 1 1 34 14 16 o 22.24000 0.3439000 21.91000 0.5097000 22.57000 0.4618000 -0.6573000     0.6878000 
1 1 1 34 14 18 o 14.31000 0.5974000 14.37000 1.092000  14.25000 0.4852000 0.1170000      1.195000  
1 1 1 34 14 20 o 12.79000 0.4091000 12.66000 0.6188000 12.91000 0.5351000 -0.2524000     0.8181000 
1 1 1 34 14 22 o 11.13000 0.4281000 11.50000 0.5594000 10.77000 0.6482000 0.7279000      0.8562000 
1 1 1 34 14 24 f 16.59000 0.3676000 16.67000 0.5037000 16.51000 0.5355000 0.1640000      0.7351000 
1 1 1 34 14 26 o 11.03000 0.4011000 10.59000 0.5968000 11.46000 0.5361000 -0.8720000     0.8022000 
1 1 1 34 14 28 o 7.545000 0.6407000 7.770000 0.6505000 7.321000 1.104000  0.4484000      1.281000  
1 1 1 34 14 30 o 10.96000 0.4635000 9.784000 0.6469000 12.13000 0.6640000 -2.345000      0.9270000 
1 1 1 34 14 32 o 3.256000 0.8847000 2.235000 1.056000  4.277000 1.420000  -2.042000      1.769000  
1 1 1 34 14 34 o 8.920000 0.5447000 8.359000 0.7519000 9.481000 0.7883000 -1.121000      1.089000  
1 1 1 34 14 36 o 6.558000 0.7539000 7.493000 0.7519000 5.624000 1.307000  1.869000       1.508000  
1 1 1 34 14 38 o 14.67000 0.3989000 14.90000 0.4494000 14.44000 0.6593000 0.4636000      0.7979000 
1 1 1 34 14 40 o 9.073000 0.5463000 9.312000 0.6508000 8.834000 0.8778000 0.4777000      1.093000  
1 1 1 34 14 42 o 4.651000 0.9680000 3.736000 1.240000  5.566000 1.487000  -1.830000      1.936000  
1 1 1 34 14 44 f 3.795000 0.9198000 4.631000 1.316000  2.960000 1.285000  1.671000       1.840000  
1 1 1 34 15 1  o 22.50000 0.3255000 22.71000 0.4326000 22.29000 0.4864000 0.4185000      0.6509000 
1 1 1 34 15 3  o 19.03000 0.3581000 18.93000 0.5076000 19.12000 0.5053000 -0.1932000     0.7162000 
1 1 1 34 15 5  o 22.93000 0.2953000 23.09000 0.4178000 22.77000 0.4173000 0.3128000      0.5905000 
1 1 1 34 15 7  o 6.798000 0.6473000 6.338000 1.014000  7.258000 0.8042000 -0.9194000     1.295000  
1 1 1 34 15 9  o 15.89000 0.4877000 16.76000 0.8348000 15.03000 0.5044000 1.725000       0.9754000 
1 1 1 34 15 11 o 21.18000 0.3693000 21.52000 0.5136000 20.83000 0.5307000 0.6875000      0.7385000 
1 1 1 34 15 13 o 14.66000 0.4244000 14.46000 0.6208000 14.86000 0.5789000 -0.3972000     0.8489000 
1 1 1 34 15 15 o 10.09000 0.4693000 10.11000 0.6873000 10.08000 0.6393000 0.3182000E-01  0.9387000 
1 1 1 34 15 17 o 6.411000 0.6706000 5.696000 1.119000  7.126000 0.7399000 -1.431000      1.341000  
1 1 1 34 15 19 o 6.784000 0.6517000 6.905000 0.8124000 6.662000 1.019000  0.2426000      1.303000  
1 1 1 34 15 21 o 17.21000 0.3796000 17.30000 0.5670000 17.13000 0.5050000 0.1698000      0.7593000 
1 1 1 34 15 23 o 4.255000 0.9155000 4.946000 1.369000  3.564000 1.215000  1.382000       1.831000  
1 1 1 34 15 25 o 4.615000 0.8906000 4.366000 1.366000  4.864000 1.144000  -0.4985000     1.781000  
1 1 1 34 15 27 o 10.84000 0.4327000 10.40000 0.5508000 11.28000 0.6675000 -0.8791000     0.8654000 
1 1 1 34 15 29 o 6.097000 0.7953000 5.846000 0.9401000 6.349000 1.283000  -0.5027000     1.591000  
1 1 1 34 15 31 o 11.20000 0.4677000 11.26000 0.6882000 11.14000 0.6334000 0.1191000      0.9353000 
1 1 1 34 15 33 o 10.39000 0.4954000 10.20000 0.6797000 10.58000 0.7210000 -0.3855000     0.9908000 
1 1 1 34 15 35 o 10.20000 0.5260000 9.146000 0.6961000 11.26000 0.7887000 -2.112000      1.052000  
1 1 1 34 15 37 o 8.014000 0.5794000 7.565000 0.7487000 8.462000 0.8844000 -0.8968000     1.159000  
1 1 1 34 15 39 o 3.545000 0.9438000 3.629000 1.225000  3.461000 1.436000  0.1676000      1.888000  
1 1 1 34 15 41 o 10.00000 0.6176000 9.251000 0.6621000 10.76000 1.043000  -1.507000      1.235000  
1 1 1 34 15 43 o 6.624000 0.9818000 7.316000 0.8394000 5.933000 1.775000  1.383000       1.964000  
1 1 1 34 16 0  o 20.80000 0.6765000 20.80000 0.6765000 20.80000 0.6765000 0.000000       0.000000  
1 1 1 34 16 2  o 16.56000 0.3295000 15.97000 0.4905000 17.15000 0.4400000 -1.175000      0.6589000 
1 1 1 34 16 4  f 8.580000 0.4915000 8.859000 0.7078000 8.301000 0.6822000 0.5581000      0.9830000 
1 1 1 34 16 6  f 12.49000 0.4391000 12.64000 0.7176000 12.34000 0.5062000 0.3088000      0.8782000 
1 1 1 34 16 8  o 12.41000 0.4189000 12.54000 0.6399000 12.28000 0.5406000 0.2655000      0.8377000 
1 1 1 34 16 10 o 20.47000 0.2997000 19.97000 0.4103000 20.97000 0.4371000 -0.9980000     0.5995000 
1 1 1 34 16 12 o 17.69000 0.3463000 18.12000 0.4936000 17.25000 0.4860000 0.8754000      0.6927000 
1 1 1 34 16 14 o 22.02000 0.3567000 22.66000 0.4611000 21.38000 0.5445000 1.284000       0.7135000 
1 1 1 34 16 16 o 16.96000 0.3333000 16.54000 0.4401000 17.39000 0.5008000 -0.8471000     0.6666000 
1 1 1 34 16 18 o 19.38000 0.3436000 19.82000 0.4698000 18.94000 0.5015000 0.8819000      0.6872000 
1 1 1 34 16 20 o 10.16000 0.4135000 10.04000 0.5784000 10.29000 0.5912000 -0.2542000     0.8270000 
1 1 1 34 16 22 o 10.23000 0.4282000 9.636000 0.6284000 10.83000 0.5817000 -1.192000      0.8564000 
1 1 1 34 16 24 o 12.92000 0.3891000 12.87000 0.6046000 12.96000 0.4900000 -0.8379000E-01 0.7782000 
1 1 1 34 16 26 f 17.79000 0.4420000 17.48000 0.7057000 18.11000 0.5326000 -0.6383000     0.8841000 
1 1 1 34 16 28 o 11.49000 0.4738000 10.89000 0.6672000 12.09000 0.6730000 -1.196000      0.9477000 
1 1 1 34 16 30 o 12.71000 0.4046000 13.11000 0.5036000 12.30000 0.6333000 0.8100000      0.8091000 
1 1 1 34 16 32 o 5.475000 0.8066000 6.169000 0.8574000 4.781000 1.367000  1.388000       1.613000  
1 1 1 34 16 34 o 6.595000 0.7522000 6.507000 1.014000  6.682000 1.112000  -0.1749000     1.504000  
1 1 1 34 16 36 o 4.530000 0.8504000 3.013000 1.173000  6.048000 1.232000  -3.035000      1.701000  
1 1 1 34 16 38 o 7.038000 0.6791000 7.091000 0.7849000 6.984000 1.109000  0.1069000      1.358000  
1 1 1 34 16 40 o 4.802000 0.9446000 4.686000 1.237000  4.918000 1.428000  -0.2317000     1.889000  
1 1 1 34 16 42 o 6.020000 0.9225000 5.691000 0.9652000 6.349000 1.573000  -0.6581000     1.845000  
1 1 1 34 17 1  o 5.274000 0.9300000 4.882000 1.424000  5.667000 1.197000  -0.7852000     1.860000  
1 1 1 34 17 3  o 6.234000 0.8100000 5.760000 1.282000  6.708000 0.9910000 -0.9482000     1.620000  
1 1 1 34 17 5  o 4.713000 0.8671000 4.274000 1.399000  5.153000 1.025000  -0.8790000     1.734000  
1 1 1 34 17 7  o 8.319000 0.4733000 8.911000 0.6398000 7.726000 0.6977000 1.184000       0.9466000 
1 1 1 34 17 9  o 7.493000 0.5927000 8.603000 0.6236000 6.383000 1.008000  2.220000       1.185000  
1 1 1 34 17 11 f 16.70000 0.3630000 17.40000 0.4758000 16.00000 0.5483000 1.402000       0.7259000 
1 1 1 34 17 13 o 14.38000 0.3800000 14.82000 0.4752000 13.93000 0.5931000 0.8838000      0.7600000 
1 1 1 34 17 15 o 5.300000 0.8907000 5.185000 1.044000  5.414000 1.443000  -0.2293000     1.781000  
1 1 1 34 17 17 o 4.580000 0.7879000 5.433000 0.9809000 3.726000 1.233000  1.707000       1.576000  
1 1 1 34 17 19 o 12.23000 0.3641000 12.24000 0.5067000 12.21000 0.5229000 0.2985000E-01  0.7281000 
1 1 1 34 17 21 o 3.761000 0.8317000 3.165000 1.183000  4.357000 1.169000  -1.192000      1.663000  
1 1 1 34 17 23 o 16.86000 0.3373000 16.83000 0.5092000 16.90000 0.4426000 -0.6710000E-01 0.6747000 
1 1 1 34 17 25 o 5.944000 0.6307000 5.655000 0.9238000 6.234000 0.8590000 -0.5785000     1.261000  
1 1 1 34 17 27 o 8.512000 0.5161000 8.617000 0.6110000 8.408000 0.8321000 0.2096000      1.032000  
1 1 1 34 17 29 o 7.834000 0.6213000 6.867000 0.6998000 8.802000 1.027000  -1.936000      1.243000  
1 1 1 34 17 31 o 7.721000 0.6845000 6.196000 1.175000  9.246000 0.7031000 -3.049000      1.369000  
1 1 1 34 17 33 o 5.699000 0.8310000 4.579000 1.092000  6.819000 1.253000  -2.240000      1.662000  
1 1 1 34 17 35 o 6.926000 0.6645000 5.882000 0.9194000 7.970000 0.9597000 -2.089000      1.329000  
1 1 1 34 17 37 o 6.943000 0.6137000 6.523000 0.7332000 7.364000 0.9845000 -0.8407000     1.227000  
1 1 1 34 17 39 f 5.341000 0.8685000 4.809000 1.139000  5.873000 1.311000  -1.064000      1.737000  
1 1 1 34 17 41 o 6.795000 1.074000  5.985000 0.9973000 7.605000 1.902000  -1.621000      2.147000  
1 1 1 34 17 43 o 5.848000 0.9349000 6.235000 1.098000  5.460000 1.514000  0.7743000      1.870000  
1 1 1 34 18 0  o 2.715000 1.198000  2.715000 1.198000  2.715000 1.198000  0.000000       0.000000  
1 1 1 34 18 2  o 7.930000 0.6149000 7.594000 0.9297000 8.265000 0.8050000 -0.6711000     1.230000  
1 1 1 34 18 4  o 8.185000 0.6114000 8.555000 0.8734000 7.816000 0.8559000 0.7393000      1.223000  
1 1 1 34 18 6  f 13.18000 0.4149000 12.92000 0.6021000 13.44000 0.5710000 -0.5252000     0.8298000 
1 1 1 34 18 8  o 2.995000 0.8384000 3.497000 1.240000  2.494000 1.129000  1.003000       1.677000  
1 1 1 34 18 10 o 8.029000 0.5893000 8.399000 0.6555000 7.658000 0.9794000 0.7412000      1.179000  
1 1 1 34 18 12 o 15.64000 0.3248000 15.69000 0.4576000 15.58000 0.4610000 0.1037000      0.6495000 
1 1 1 34 18 14 f 17.42000 0.3042000 17.32000 0.4202000 17.51000 0.4398000 -0.1920000     0.6083000 
1 1 1 34 18 16 o 20.35000 0.3532000 20.42000 0.4026000 20.28000 0.5805000 0.1379000      0.7065000 
1 1 1 34 18 18 o 5.605000 0.6992000 5.806000 1.019000  5.403000 0.9578000 0.4030000      1.398000  
1 1 1 34 18 20 o 5.149000 0.7492000 5.700000 0.9897000 4.598000 1.125000  1.103000       1.498000  
1 1 1 34 18 22 o 5.648000 0.6979000 5.758000 0.9521000 5.538000 1.021000  0.2197000      1.396000  
1 1 1 34 18 24 o 5.503000 0.6739000 5.887000 0.9651000 5.119000 0.9410000 0.7676000      1.348000  
1 1 1 34 18 26 o 6.624000 0.6405000 6.900000 0.6982000 6.348000 1.074000  0.5525000      1.281000  
1 1 1 34 18 28 o 10.97000 0.4521000 11.38000 0.5405000 10.56000 0.7249000 0.8180000      0.9042000 
1 1 1 34 18 30 f 2.690000 0.8194000 2.348000 1.034000  3.032000 1.272000  -0.6841000     1.639000  
1 1 1 34 18 32 o 9.356000 0.5781000 9.668000 0.6825000 9.044000 0.9332000 0.6241000      1.156000  
1 1 1 34 18 34 o 8.600000 0.4991000 8.162000 0.6447000 9.038000 0.7622000 -0.8760000     0.9983000 
1 1 1 34 18 36 o 4.855000 0.8696000 4.370000 1.125000  5.341000 1.326000  -0.9713000     1.739000  
1 1 1 34 18 38 o 7.334000 0.6792000 7.210000 0.8603000 7.458000 1.051000  -0.2480000     1.358000  
1 1 1 34 18 40 o 4.618000 0.9084000 4.316000 1.115000  4.919000 1.434000  -0.6028000     1.817000  
1 1 1 34 18 42 o 5.671000 0.9920000 5.239000 1.418000  6.102000 1.387000  -0.8630000     1.984000  
1 1 1 34 19 1  o 11.84000 0.3863000 11.60000 0.5785000 12.08000 0.5121000 -0.4783000     0.7726000 
1 1 1 34 19 3  f 12.28000 0.4971000 12.30000 0.8493000 12.25000 0.5170000 0.4891000E-01  0.9943000 
1 1 1 34 19 5  o 26.61000 0.3267000 26.54000 0.4720000 26.67000 0.4518000 -0.1310000     0.6534000 
1 1 1 34 19 7  o 24.85000 0.3569000 24.68000 0.4195000 25.02000 0.5775000 -0.3463000     0.7138000 
1 1 1 34 19 9  o 6.841000 0.7661000 7.126000 0.9376000 6.556000 1.212000  0.5697000      1.532000  
1 1 1 34 19 11 o 21.00000 0.3175000 21.12000 0.4783000 20.87000 0.4177000 0.2439000      0.6350000 
1 1 1 34 19 13 o 26.44000 0.3005000 26.43000 0.4198000 26.45000 0.4301000 -0.2043000E-01 0.6010000 
1 1 1 34 19 15 o 7.961000 0.5442000 8.224000 0.6519000 7.699000 0.8717000 0.5246000      1.088000  
1 1 1 34 19 17 o 16.18000 0.3537000 16.65000 0.4762000 15.71000 0.5230000 0.9374000      0.7073000 
1 1 1 34 19 19 o 6.836000 0.6195000 6.578000 0.9850000 7.094000 0.7515000 -0.5162000     1.239000  
1 1 1 34 19 21 o 3.065000 0.8158000 2.809000 1.121000  3.321000 1.185000  -0.5114000     1.632000  
1 1 1 34 19 23 o 12.43000 0.3532000 12.40000 0.4871000 12.46000 0.5115000 -0.5810000E-01 0.7064000 
1 1 1 34 19 25 o 15.24000 0.3349000 14.86000 0.3927000 15.63000 0.5427000 -0.7665000     0.6699000 
1 1 1 34 19 27 o 17.97000 0.3405000 17.92000 0.4240000 18.02000 0.5328000 -0.1081000     0.6809000 
1 1 1 34 19 29 o 12.60000 0.4708000 12.09000 0.5138000 13.11000 0.7890000 -1.022000      0.9415000 
1 1 1 34 19 31 o 3.891000 0.8907000 3.439000 1.149000  4.342000 1.361000  -0.9024000     1.781000  
1 1 1 34 19 33 o 3.636000 0.9019000 3.443000 1.157000  3.829000 1.384000  -0.3855000     1.804000  
1 1 1 34 19 35 o 3.833000 0.9922000 3.599000 1.330000  4.067000 1.473000  -0.4680000     1.984000  
1 1 1 34 19 37 o 7.199000 0.7502000 5.967000 0.9138000 8.432000 1.190000  -2.466000      1.500000  
1 1 1 34 19 39 f 3.503000 0.9241000 3.016000 1.216000  3.990000 1.392000  -0.9738000     1.848000  
1 1 1 34 19 41 o 4.097000 1.034000  3.079000 1.248000  5.114000 1.648000  -2.036000      2.067000  
1 1 1 34 20 0  o 5.816000 0.9321000 5.816000 0.9321000 5.816000 0.9321000 0.000000       0.000000  
1 1 1 34 20 2  o 15.16000 0.3534000 14.78000 0.5293000 15.55000 0.4685000 -0.7711000     0.7069000 
1 1 1 34 20 4  o 11.79000 0.3591000 11.43000 0.5066000 12.14000 0.5092000 -0.7158000     0.7183000 
1 1 1 34 20 6  o 14.63000 0.3285000 14.55000 0.4582000 14.70000 0.4709000 -0.1471000     0.6570000 
1 1 1 34 20 8  o 3.977000 0.8172000 4.584000 1.089000  3.369000 1.218000  1.215000       1.634000  
1 1 1 34 20 10 o 28.77000 0.3480000 28.90000 0.5541000 28.64000 0.4211000 0.2568000      0.6960000 
1 1 1 34 20 12 o 4.568000 0.9320000 4.965000 1.276000  4.171000 1.359000  0.7941000      1.864000  
1 1 1 34 20 14 o 12.12000 0.3916000 12.28000 0.5471000 11.96000 0.5604000 0.3116000      0.7832000 
1 1 1 34 20 16 f 16.35000 0.3621000 16.51000 0.4149000 16.19000 0.5936000 0.3180000      0.7243000 
1 1 1 34 20 18 o 15.78000 0.3202000 15.98000 0.4198000 15.59000 0.4838000 0.3883000      0.6405000 
1 1 1 34 20 20 o 25.72000 0.2943000 26.02000 0.4104000 25.41000 0.4220000 0.6014000      0.5887000 
1 1 1 34 20 22 f 10.60000 0.3801000 11.25000 0.5184000 9.940000 0.5559000 1.312000       0.7601000 
1 1 1 34 20 24 o 16.49000 0.3348000 16.26000 0.4243000 16.71000 0.5181000 -0.4460000     0.6696000 
1 1 1 34 20 26 o 2.735000 0.8085000 2.396000 1.019000  3.074000 1.255000  -0.6780000     1.617000  
1 1 1 34 20 28 o 7.345000 0.5814000 7.073000 0.7455000 7.617000 0.8924000 -0.5446000     1.163000  
1 1 1 34 20 30 o 4.302000 0.8195000 5.060000 0.9038000 3.544000 1.367000  1.515000       1.639000  
1 1 1 34 20 32 o 2.946000 0.8761000 2.555000 1.100000  3.337000 1.364000  -0.7827000     1.752000  
1 1 1 34 20 34 o 4.630000 0.8687000 4.567000 1.104000  4.693000 1.341000  -0.1265000     1.737000  
1 1 1 34 20 36 o 14.84000 0.4535000 14.48000 0.4487000 15.20000 0.7882000 -0.7143000     0.9070000 
1 1 1 34 20 38 o 3.968000 0.9909000 3.741000 1.328000  4.195000 1.471000  -0.4541000     1.982000  
1 1 1 34 20 40 o 4.627000 0.9219000 3.083000 1.359000  6.172000 1.246000  -3.089000      1.844000  
1 1 1 34 21 1  o 7.317000 0.7628000 5.517000 1.364000  9.116000 0.6826000 -3.599000      1.526000  
1 1 1 34 21 3  o 7.766000 0.5137000 8.005000 0.7414000 7.526000 0.7111000 0.4798000      1.027000  
1 1 1 34 21 5  o 8.320000 0.4951000 8.289000 0.7297000 8.351000 0.6695000 -0.6231000E-01 0.9903000 
1 1 1 34 21 7  o 13.10000 0.3667000 13.43000 0.5195000 12.78000 0.5177000 0.6472000      0.7334000 
1 1 1 34 21 9  o 4.463000 0.8117000 4.020000 1.248000  4.906000 1.039000  -0.8860000     1.623000  
1 1 1 34 21 11 o 28.22000 0.3156000 28.44000 0.4751000 28.00000 0.4156000 0.4403000      0.6312000 
1 1 1 34 21 13 o 23.45000 0.3006000 23.52000 0.4188000 23.39000 0.4314000 0.1382000      0.6012000 
1 1 1 34 21 15 o 3.381000 0.9072000 3.069000 1.202000  3.693000 1.359000  -0.6247000     1.814000  
1 1 1 34 21 17 o 8.470000 0.4636000 9.038000 0.5871000 7.903000 0.7177000 1.134000       0.9272000 
1 1 1 34 21 19 o 16.26000 0.3404000 15.95000 0.4763000 16.57000 0.4865000 -0.6230000     0.6809000 
1 1 1 34 21 21 o 4.056000 0.9224000 4.146000 1.422000  3.965000 1.175000  0.1813000      1.845000  
1 1 1 34 21 23 o 3.917000 0.8656000 3.411000 1.087000  4.422000 1.348000  -1.011000      1.731000  
1 1 1 34 21 25 o 12.65000 0.3732000 11.89000 0.4223000 13.42000 0.6155000 -1.527000      0.7464000 
1 1 1 34 21 27 o 14.13000 0.3680000 14.09000 0.4697000 14.17000 0.5666000 -0.8757000E-01 0.7360000 
1 1 1 34 21 29 o 7.115000 0.6917000 6.327000 0.7773000 7.904000 1.144000  -1.577000      1.383000  
1 1 1 34 21 31 o 8.092000 0.5460000 8.099000 0.6104000 8.085000 0.9054000 0.1393000E-01  1.092000  
1 1 1 34 21 33 o 11.54000 0.4496000 11.79000 0.4889000 11.30000 0.7546000 0.4947000      0.8991000 
1 1 1 34 21 35 o 10.19000 0.5963000 10.06000 0.5442000 10.32000 1.061000  -0.2606000     1.193000  
1 1 1 34 21 37 o 7.110000 0.7127000 7.391000 0.6850000 6.829000 1.250000  0.5620000      1.425000  
1 1 1 34 21 39 o 3.851000 1.038000  3.849000 1.481000  3.854000 1.454000  -0.4408000E-02 2.076000  
1 1 1 34 21 41 o 5.047000 1.194000  5.150000 1.711000  4.944000 1.667000  0.2053000      2.389000  
1 1 1 34 22 0  o 3.468000 1.384000  3.468000 1.384000  3.468000 1.384000  0.000000       0.000000  
1 1 1 34 22 2  o 8.189000 0.5150000 8.215000 0.7313000 8.162000 0.7252000 0.5317000E-01  1.030000  
1 1 1 34 22 4  o 15.04000 0.3494000 14.99000 0.5465000 15.09000 0.4356000 -0.9690000E-01 0.6989000 
1 1 1 34 22 6  o 17.08000 0.2963000 17.47000 0.4309000 16.69000 0.4067000 0.7809000      0.5925000 
1 1 1 34 22 8  o 8.392000 0.4553000 8.892000 0.6094000 7.893000 0.6765000 0.9996000      0.9105000 
1 1 1 34 22 10 f 10.58000 0.3879000 11.11000 0.5417000 10.05000 0.5553000 1.065000       0.7758000 
1 1 1 34 22 12 o 9.247000 0.4267000 9.483000 0.6014000 9.010000 0.6055000 0.4729000      0.8534000 
1 1 1 34 22 14 o 8.606000 0.4785000 9.127000 0.5746000 8.085000 0.7654000 1.042000       0.9571000 
1 1 1 34 22 16 o 9.602000 0.4505000 10.25000 0.5283000 8.950000 0.7298000 1.304000       0.9010000 
1 1 1 34 22 18 o 10.39000 0.6622000 9.847000 0.5732000 10.93000 1.194000  -1.079000      1.324000  
1 1 1 34 22 20 o 6.982000 0.6980000 8.049000 0.7100000 5.915000 1.202000  2.134000       1.396000  
1 1 1 34 22 22 o 3.044000 0.8599000 2.998000 1.143000  3.089000 1.285000  -0.9104000E-01 1.720000  
1 1 1 34 22 24 o 3.892000 0.8183000 2.980000 1.093000  4.803000 1.219000  -1.823000      1.637000  
1 1 1 34 22 26 o 14.25000 0.3801000 13.71000 0.4580000 14.79000 0.6068000 -1.084000      0.7602000 
1 1 1 34 22 28 o 4.043000 0.8481000 3.937000 1.070000  4.148000 1.316000  -0.2113000     1.696000  
1 1 1 34 22 30 o 2.769000 0.8282000 2.517000 1.046000  3.020000 1.284000  -0.5031000     1.656000  
1 1 1 34 22 32 o 6.915000 0.7415000 7.160000 0.8655000 6.671000 1.204000  0.4896000      1.483000  
1 1 1 34 22 34 o 7.851000 0.7834000 8.267000 0.7660000 7.434000 1.367000  0.8329000      1.567000  
1 1 1 34 22 36 o 5.282000 1.014000  5.584000 1.475000  4.979000 1.392000  0.6045000      2.028000  
1 1 1 34 22 38 o 9.086000 0.6658000 9.223000 0.9981000 8.949000 0.8814000 0.2747000      1.332000  
1 1 1 34 22 40 o 5.490000 1.070000  5.558000 1.661000  5.421000 1.350000  0.1365000      2.141000  
1 1 1 34 23 1  o 23.61000 0.3246000 23.40000 0.4280000 23.82000 0.4883000 -0.4148000     0.6493000 
1 1 1 34 23 3  o 24.14000 0.3034000 24.58000 0.4117000 23.69000 0.4458000 0.8948000      0.6068000 
1 1 1 34 23 5  o 5.068000 0.7709000 4.989000 1.166000  5.147000 1.009000  -0.1583000     1.542000  
1 1 1 34 23 7  o 3.690000 0.7725000 4.707000 1.051000  2.673000 1.133000  2.034000       1.545000  
1 1 1 34 23 9  o 3.006000 0.8040000 3.129000 1.122000  2.882000 1.151000  0.2476000      1.608000  
1 1 1 34 23 11 o 14.44000 0.3056000 14.50000 0.4250000 14.39000 0.4392000 0.1140000      0.6112000 
1 1 1 34 23 13 o 4.998000 0.7753000 5.630000 0.8511000 4.365000 1.296000  1.265000       1.551000  
1 1 1 34 23 15 o 7.937000 0.6514000 9.005000 0.5906000 6.868000 1.161000  2.137000       1.303000  
1 1 1 34 23 17 o 13.20000 0.4341000 13.29000 0.6423000 13.11000 0.5840000 0.1834000      0.8681000 
1 1 1 34 23 19 o 5.396000 0.9362000 4.457000 1.661000  6.336000 0.8650000 -1.879000      1.872000  
1 1 1 34 23 21 o 7.797000 0.6538000 8.353000 0.7463000 7.241000 1.074000  1.111000       1.308000  
1 1 1 34 23 23 o 3.763000 1.005000  3.044000 1.227000  4.481000 1.592000  -1.437000      2.010000  
1 1 1 34 23 25 o 9.620000 0.5618000 9.055000 0.7796000 10.18000 0.8092000 -1.129000      1.124000  
1 1 1 34 23 27 o 5.433000 0.8202000 4.281000 1.163000  6.584000 1.157000  -2.303000      1.640000  
1 1 1 34 23 29 o 6.453000 0.7982000 6.685000 0.7567000 6.220000 1.406000  0.4657000      1.596000  
1 1 1 34 23 31 o 4.205000 0.9767000 4.337000 1.263000  4.072000 1.490000  0.2647000      1.953000  
1 1 1 34 23 33 o 7.518000 0.7682000 7.911000 1.144000  7.124000 1.025000  0.7871000      1.536000  
1 1 1 34 23 35 o 5.942000 1.061000  5.475000 1.719000  6.409000 1.242000  -0.9341000     2.121000  
1 1 1 34 23 37 o 4.560000 1.057000  4.609000 1.514000  4.510000 1.476000  0.9826000E-01  2.115000  
1 1 1 34 23 39 o 6.121000 0.9664000 6.013000 1.358000  6.228000 1.375000  -0.2149000     1.933000  
1 1 1 34 24 0  o 5.763000 1.022000  5.763000 1.022000  5.763000 1.022000  0.000000       0.000000  
1 1 1 34 24 2  o 4.227000 0.8444000 4.590000 1.104000  3.863000 1.278000  0.7269000      1.689000  
1 1 1 34 24 4  o 9.566000 0.3984000 9.300000 0.5903000 9.832000 0.5352000 -0.5326000     0.7968000 
1 1 1 34 24 6  o 12.76000 0.4182000 12.34000 0.6241000 13.18000 0.5569000 -0.8311000     0.8364000 
1 1 1 34 24 8  o 13.15000 0.3203000 13.21000 0.4411000 13.09000 0.4645000 0.1200000      0.6405000 
1 1 1 34 24 10 o 16.52000 0.2999000 16.45000 0.4340000 16.58000 0.4141000 -0.1272000     0.5999000 
1 1 1 34 24 12 o 5.738000 0.7610000 6.070000 0.8605000 5.406000 1.255000  0.6640000      1.522000  
1 1 1 34 24 14 o 9.526000 0.5086000 8.892000 0.8508000 10.16000 0.5574000 -1.267000      1.017000  
1 1 1 34 24 16 o 2.848000 0.8515000 3.332000 1.349000  2.364000 1.039000  0.9685000      1.703000  
1 1 1 34 24 18 o 9.569000 0.6497000 10.95000 0.7574000 8.189000 1.056000  2.760000       1.299000  
1 1 1 34 24 20 f 6.527000 0.7514000 6.320000 0.9155000 6.735000 1.192000  -0.4154000     1.503000  
1 1 1 34 24 22 o 3.708000 0.9618000 3.593000 1.253000  3.823000 1.460000  -0.2304000     1.924000  
1 1 1 34 24 24 o 5.331000 0.7594000 4.911000 1.050000  5.752000 1.098000  -0.8405000     1.519000  
1 1 1 34 24 26 o 8.801000 0.5719000 7.938000 0.7522000 9.665000 0.8615000 -1.727000      1.144000  
1 1 1 34 24 28 o 3.694000 1.047000  4.684000 1.663000  2.703000 1.273000  1.981000       2.094000  
1 1 1 34 24 30 o 6.169000 1.051000  7.334000 1.357000  5.005000 1.606000  2.329000       2.102000  
1 1 1 34 24 32 o 7.312000 0.8251000 7.018000 1.289000  7.606000 1.031000  -0.5876000     1.650000  
1 1 1 34 24 34 o 4.599000 1.157000  4.796000 1.826000  4.403000 1.421000  0.3926000      2.314000  
1 1 1 34 24 36 o 2.853000 0.8944000 2.997000 1.314000  2.708000 1.213000  0.2894000      1.789000  
1 1 1 34 24 38 o 6.608000 0.8369000 5.787000 1.302000  7.430000 1.052000  -1.643000      1.674000  
1 1 1 34 25 1  o 15.49000 0.3236000 15.53000 0.4868000 15.44000 0.4266000 0.9762000E-01  0.6473000 
1 1 1 34 25 3  o 11.72000 0.3960000 11.89000 0.4943000 11.54000 0.6188000 0.3470000      0.7920000 
1 1 1 34 25 5  o 4.485000 0.7328000 4.959000 0.9841000 4.011000 1.086000  0.9481000      1.466000  
1 1 1 34 25 7  o 13.32000 0.3574000 12.87000 0.4485000 13.77000 0.5565000 -0.9007000     0.7147000 
1 1 1 34 25 9  f 7.056000 0.6201000 7.448000 0.7363000 6.663000 0.9979000 0.7853000      1.240000  
1 1 1 34 25 11 f 7.074000 0.7134000 5.565000 1.299000  8.582000 0.5897000 -3.017000      1.427000  
1 1 1 34 25 13 o 3.423000 0.8963000 3.326000 1.314000  3.520000 1.219000  -0.1932000     1.793000  
1 1 1 34 25 15 o 8.571000 0.5094000 8.491000 0.8357000 8.650000 0.5828000 -0.1591000     1.019000  
1 1 1 34 25 17 o 4.042000 1.022000  3.730000 1.090000  4.354000 1.729000  -0.6245000     2.043000  
1 1 1 34 25 19 o 7.497000 0.6898000 7.743000 0.5663000 7.250000 1.258000  0.4927000      1.380000  
1 1 1 34 25 21 o 4.355000 0.9212000 3.576000 1.070000  5.134000 1.500000  -1.559000      1.842000  
1 1 1 34 25 23 o 4.146000 0.9429000 3.930000 1.126000  4.363000 1.513000  -0.4324000     1.886000  
1 1 1 34 25 25 o 5.191000 0.7872000 5.649000 0.8431000 4.733000 1.330000  0.9157000      1.574000  
1 1 1 34 25 27 o 6.686000 0.5653000 6.006000 0.7215000 7.366000 0.8704000 -1.360000      1.131000  
1 1 1 34 25 29 o 4.831000 1.152000  5.572000 1.388000  4.090000 1.840000  1.482000       2.305000  
1 1 1 34 25 31 o 3.652000 1.015000  3.545000 1.404000  3.759000 1.467000  -0.2142000     2.030000  
1 1 1 34 25 33 o 7.879000 1.053000  8.837000 1.541000  6.921000 1.436000  1.916000       2.106000  
1 1 1 34 25 35 o 8.838000 0.7052000 8.863000 1.084000  8.814000 0.9023000 0.4888000E-01  1.410000  
1 1 1 34 25 37 o 3.602000 0.9850000 3.553000 1.368000  3.652000 1.418000  -0.9943000E-01 1.970000  
1 1 1 34 26 0  o 5.457000 1.060000  5.457000 1.060000  5.457000 1.060000  0.000000       0.000000  
1 1 1 34 26 2  o 6.589000 0.5773000 7.529000 0.6942000 5.648000 0.9226000 1.880000       1.155000  
1 1 1 34 26 4  o 6.836000 0.5689000 6.336000 0.7586000 7.336000 0.8480000 -1.000000      1.138000  
1 1 1 34 26 6  o 3.820000 0.8174000 4.373000 1.155000  3.268000 1.157000  1.105000       1.635000  
1 1 1 34 26 8  o 2.561000 0.7692000 2.525000 1.045000  2.597000 1.129000  -0.7197000E-01 1.538000  
1 1 1 34 26 10 o 5.285000 0.7795000 4.731000 1.309000  5.839000 0.8469000 -1.109000      1.559000  
1 1 1 34 26 12 o 5.777000 0.7641000 6.406000 1.028000  5.148000 1.131000  1.257000       1.528000  
1 1 1 34 26 14 o 15.01000 0.3558000 14.88000 0.5738000 15.14000 0.4208000 -0.2597000     0.7116000 
1 1 1 34 26 16 o 6.737000 0.6808000 7.206000 0.5780000 6.267000 1.233000  0.9388000      1.362000  
1 1 1 34 26 18 o 9.738000 0.6197000 9.697000 0.7715000 9.780000 0.9699000 -0.8340000E-01 1.239000  
1 1 1 34 26 20 o 8.506000 0.8064000 8.867000 1.208000  8.145000 1.068000  0.7215000      1.613000  
1 1 1 34 26 22 o 6.622000 0.9362000 7.510000 1.046000  5.733000 1.553000  1.777000       1.872000  
1 1 1 34 26 24 o 4.332000 1.011000  4.684000 1.400000  3.981000 1.458000  0.7030000      2.021000  
1 1 1 34 26 26 o 6.532000 0.9350000 7.054000 1.070000  6.011000 1.534000  1.043000       1.870000  
1 1 1 34 26 28 o 13.90000 0.5095000 13.63000 0.7424000 14.18000 0.6979000 -0.5433000     1.019000  
1 1 1 34 26 30 o 9.259000 0.7674000 9.694000 1.206000  8.825000 0.9499000 0.8689000      1.535000  
1 1 1 34 26 32 o 8.861000 0.7899000 8.532000 1.145000  9.191000 1.089000  -0.6586000     1.580000  
1 1 1 34 26 34 o 6.856000 0.8555000 7.576000 1.048000  6.136000 1.353000  1.441000       1.711000  
1 1 1 34 26 36 o 3.354000 0.9753000 3.319000 1.345000  3.388000 1.413000  -0.6831000E-01 1.951000  
1 1 1 34 27 1  o 2.876000 0.7552000 2.164000 1.005000  3.589000 1.128000  -1.424000      1.510000  
1 1 1 34 27 3  f 12.81000 0.3269000 12.70000 0.4509000 12.92000 0.4734000 -0.2163000     0.6537000 
1 1 1 34 27 5  o 7.928000 0.4674000 8.022000 0.6073000 7.834000 0.7106000 0.1882000      0.9348000 
1 1 1 34 27 7  o 9.123000 0.4078000 9.299000 0.6067000 8.947000 0.5452000 0.3523000      0.8157000 
1 1 1 34 27 9  o 8.803000 0.5078000 8.417000 0.8477000 9.188000 0.5594000 -0.7709000     1.016000  
1 1 1 34 27 11 o 10.14000 0.4626000 10.49000 0.7101000 9.785000 0.5932000 0.7057000      0.9252000 
1 1 1 34 27 13 o 8.297000 0.6003000 8.323000 1.030000  8.270000 0.6170000 0.5309000E-01  1.201000  
1 1 1 34 27 15 o 9.001000 0.5912000 8.823000 0.8490000 9.180000 0.8231000 -0.3569000     1.182000  
1 1 1 34 27 17 o 4.749000 1.129000  3.836000 1.329000  5.662000 1.825000  -1.826000      2.258000  
1 1 1 34 27 19 o 5.124000 1.071000  5.416000 1.440000  4.833000 1.585000  0.5834000      2.141000  
1 1 1 34 27 21 o 6.512000 0.8938000 6.814000 1.068000  6.210000 1.433000  0.6042000      1.788000  
1 1 1 34 27 23 o 3.100000 0.9190000 3.557000 1.375000  2.643000 1.220000  0.9135000      1.838000  
1 1 1 34 27 25 o 2.999000 0.9516000 2.443000 1.135000  3.555000 1.527000  -1.111000      1.903000  
1 1 1 34 27 27 o 4.695000 1.003000  4.125000 1.516000  5.265000 1.313000  -1.141000      2.005000  
1 1 1 34 27 29 o 5.221000 1.063000  3.642000 1.541000  6.801000 1.465000  -3.160000      2.126000  
1 1 1 34 27 31 o 4.383000 1.046000  4.143000 1.451000  4.624000 1.506000  -0.4806000     2.092000  
1 1 1 34 27 33 o 3.177000 0.9717000 3.177000 1.385000  3.178000 1.363000  -0.9911000E-03 1.943000  
1 1 1 34 27 35 o 6.909000 0.8414000 6.292000 1.254000  7.525000 1.122000  -1.233000      1.683000  
1 1 1 34 27 37 o 3.514000 1.596000  ?        ?         3.514000 1.596000  ?              ?         
1 1 1 34 28 0  o 6.400000 0.8573000 6.400000 0.8573000 6.400000 0.8573000 0.000000       0.000000  
1 1 1 34 28 2  o 7.390000 0.4936000 7.453000 0.6578000 7.327000 0.7363000 0.1254000      0.9873000 
1 1 1 34 28 4  o 16.13000 0.3361000 16.04000 0.4141000 16.23000 0.5295000 -0.1886000     0.6722000 
1 1 1 34 28 6  o 8.767000 0.4969000 8.740000 0.7736000 8.794000 0.6238000 -0.5369000E-01 0.9937000 
1 1 1 34 28 8  o 12.54000 0.4941000 12.96000 0.8792000 12.11000 0.4514000 0.8553000      0.9883000 
1 1 1 34 28 10 o 6.955000 0.6375000 7.368000 1.041000  6.541000 0.7362000 0.8265000      1.275000  
1 1 1 34 28 12 o 7.755000 0.5202000 8.092000 0.9284000 7.418000 0.4697000 0.6735000      1.040000  
1 1 1 34 28 14 o 11.69000 0.5417000 10.70000 0.7557000 12.67000 0.7763000 -1.976000      1.083000  
1 1 1 34 28 16 o 5.974000 0.9683000 5.961000 1.460000  5.988000 1.273000  -0.2765000E-01 1.937000  
1 1 1 34 28 18 o 6.278000 1.138000  6.982000 1.291000  5.575000 1.875000  1.407000       2.276000  
1 1 1 34 28 20 o 3.524000 1.025000  4.059000 1.555000  2.989000 1.335000  1.070000       2.049000  
1 1 1 34 28 22 o 6.272000 1.139000  5.446000 1.419000  7.098000 1.783000  -1.652000      2.278000  
1 1 1 34 28 24 o 10.32000 0.7057000 10.75000 1.039000  9.895000 0.9548000 0.8544000      1.411000  
1 1 1 34 28 26 o 12.98000 0.5499000 13.29000 0.8263000 12.68000 0.7258000 0.6087000      1.100000  
1 1 1 34 28 28 o 15.01000 0.5115000 15.25000 0.7693000 14.78000 0.6744000 0.4677000      1.023000  
1 1 1 34 28 30 o 4.274000 0.9970000 5.095000 1.456000  3.453000 1.362000  1.642000       1.994000  
1 1 1 34 28 32 o 3.011000 0.9307000 3.378000 1.435000  2.644000 1.186000  0.7341000      1.861000  
1 1 1 34 28 34 o 4.936000 0.9660000 3.967000 1.418000  5.904000 1.313000  -1.937000      1.932000  
1 1 1 34 28 36 o 3.648000 1.024000  4.005000 1.461000  3.291000 1.435000  0.7142000      2.048000  
1 1 1 34 29 1  o 4.737000 0.7392000 3.907000 1.222000  5.567000 0.8321000 -1.660000      1.478000  
1 1 1 34 29 3  o 6.168000 0.5819000 6.061000 0.8661000 6.276000 0.7773000 -0.2152000     1.164000  
1 1 1 34 29 5  f 5.097000 0.8865000 5.780000 1.142000  4.414000 1.356000  1.365000       1.773000  
1 1 1 34 29 7  o 10.73000 0.4431000 10.08000 0.7420000 11.39000 0.4846000 -1.316000      0.8863000 
1 1 1 34 29 9  o 7.538000 0.6035000 7.470000 1.021000  7.606000 0.6431000 -0.1355000     1.207000  
1 1 1 34 29 11 o 3.325000 0.9173000 2.995000 1.263000  3.656000 1.331000  -0.6612000     1.835000  
1 1 1 34 29 13 o 15.50000 0.4668000 15.82000 0.7066000 15.17000 0.6102000 0.6535000      0.9336000 
1 1 1 34 29 15 o 14.12000 0.4865000 14.15000 0.7670000 14.09000 0.5987000 0.6041000E-01  0.9730000 
1 1 1 34 29 17 o 6.597000 0.9791000 6.956000 1.376000  6.238000 1.393000  0.7174000      1.958000  
1 1 1 34 29 19 o 12.91000 0.6549000 12.38000 0.7059000 13.45000 1.103000  -1.070000      1.310000  
1 1 1 34 29 21 o 5.884000 1.177000  5.053000 1.496000  6.716000 1.818000  -1.663000      2.355000  
1 1 1 34 29 23 f 8.767000 0.7355000 8.547000 0.9982000 8.988000 1.080000  -0.4413000     1.471000  
1 1 1 34 29 25 o 13.06000 0.5713000 13.62000 0.8072000 12.51000 0.8085000 1.106000       1.143000  
1 1 1 34 29 27 o 14.09000 0.5288000 13.98000 0.7987000 14.20000 0.6931000 -0.2116000     1.058000  
1 1 1 34 29 29 o 5.496000 1.050000  4.854000 1.547000  6.138000 1.420000  -1.284000      2.100000  
1 1 1 34 29 31 o 5.893000 0.9540000 5.299000 1.468000  6.487000 1.219000  -1.188000      1.908000  
1 1 1 34 29 33 o 6.749000 0.8494000 6.893000 1.074000  6.606000 1.316000  0.2872000      1.699000  
1 1 1 34 29 35 o 5.609000 1.008000  4.940000 1.519000  6.278000 1.327000  -1.338000      2.017000  
1 1 1 34 30 0  o 2.299000 1.049000  2.299000 1.049000  2.299000 1.049000  0.000000       0.000000  
1 1 1 34 30 2  o 3.626000 0.8126000 3.441000 1.171000  3.811000 1.127000  -0.3707000     1.625000  
1 1 1 34 30 4  o 10.47000 0.4330000 10.59000 0.6954000 10.34000 0.5160000 0.2490000      0.8659000 
1 1 1 34 30 6  o 7.474000 0.5832000 7.342000 0.8723000 7.607000 0.7744000 -0.2648000     1.166000  
1 1 1 34 30 8  o 3.118000 0.9108000 3.737000 1.427000  2.499000 1.132000  1.239000       1.822000  
1 1 1 34 30 10 o 7.221000 0.8237000 6.607000 1.389000  7.835000 0.8856000 -1.228000      1.647000  
1 1 1 34 30 12 o 5.038000 0.9771000 5.915000 1.371000  4.161000 1.392000  1.753000       1.954000  
1 1 1 34 30 14 o 9.007000 0.5964000 9.521000 0.8663000 8.494000 0.8200000 1.027000       1.193000  
1 1 1 34 30 16 o 5.275000 1.018000  5.793000 1.279000  4.758000 1.584000  1.035000       2.036000  
1 1 1 34 30 18 o 11.57000 0.7187000 11.57000 0.7187000 ?        ?         ?              ?         
1 1 1 34 30 20 o 3.452000 1.038000  3.071000 1.393000  3.832000 1.538000  -0.7609000     2.075000  
1 1 1 34 30 22 o 4.913000 1.087000  5.567000 1.485000  4.259000 1.588000  1.308000       2.174000  
1 1 1 34 30 24 o 6.844000 1.006000  6.759000 1.530000  6.929000 1.306000  -0.1696000     2.012000  
1 1 1 34 30 26 o 8.271000 0.7308000 7.592000 1.090000  8.950000 0.9733000 -1.358000      1.462000  
1 1 1 34 30 28 o 4.901000 1.119000  4.899000 1.636000  4.903000 1.528000  -0.3763000E-02 2.239000  
1 1 1 34 30 30 o 4.260000 1.045000  4.182000 1.460000  4.338000 1.497000  -0.1557000     2.091000  
1 1 1 34 30 32 o 5.674000 0.9235000 5.586000 1.219000  5.763000 1.388000  -0.1770000     1.847000  
1 1 1 34 30 34 o 5.022000 1.030000  5.351000 1.475000  4.694000 1.438000  0.6575000      2.060000  
1 1 1 34 31 1  o 7.682000 0.5872000 6.054000 1.007000  9.310000 0.6041000 -3.256000      1.174000  
1 1 1 34 31 3  o 7.722000 0.5127000 7.787000 0.8325000 7.657000 0.5987000 0.1306000      1.025000  
1 1 1 34 31 5  o 6.733000 0.5742000 7.393000 0.8181000 6.073000 0.8059000 1.320000       1.148000  
1 1 1 34 31 7  o 7.340000 0.5862000 8.285000 1.027000  6.395000 0.5648000 1.889000       1.172000  
1 1 1 34 31 9  o 11.94000 0.7774000 12.71000 1.308000  11.17000 0.8405000 1.542000       1.555000  
1 1 1 34 31 11 o 11.39000 0.5561000 10.91000 0.7717000 11.86000 0.8008000 -0.9528000     1.112000  
1 1 1 34 31 13 o 11.69000 0.5571000 12.29000 0.6790000 11.08000 0.8834000 1.212000       1.114000  
1 1 1 34 31 15 o 4.731000 0.9364000 4.666000 1.414000  4.797000 1.228000  -0.1310000     1.873000  
1 1 1 34 31 17 f 4.528000 1.053000  4.912000 1.363000  4.143000 1.606000  0.7696000      2.106000  
1 1 1 34 31 19 o 6.158000 0.9161000 5.572000 1.418000  6.744000 1.161000  -1.172000      1.832000  
1 1 1 34 31 21 o 8.695000 0.9046000 9.900000 0.9858000 7.491000 1.517000  2.409000       1.809000  
1 1 1 34 31 23 o 10.92000 0.6564000 11.43000 0.9865000 10.40000 0.8661000 1.024000       1.313000  
1 1 1 34 31 25 o 5.526000 1.034000  5.437000 1.449000  5.615000 1.475000  -0.1779000     2.068000  
1 1 1 34 31 27 o 3.574000 0.9569000 2.301000 1.107000  4.847000 1.561000  -2.546000      1.914000  
1 1 1 34 31 29 o 3.462000 1.042000  3.047000 1.322000  3.877000 1.611000  -0.8304000     2.084000  
1 1 1 34 31 31 o 6.755000 0.9217000 6.668000 1.410000  6.842000 1.188000  -0.1737000     1.843000  
1 1 1 34 31 33 o 6.655000 0.8986000 7.093000 1.287000  6.217000 1.254000  0.8756000      1.797000  
1 1 1 34 32 0  o 6.943000 1.024000  6.943000 1.024000  6.943000 1.024000  0.000000       0.000000  
1 1 1 34 32 2  f 4.290000 0.9560000 5.097000 1.306000  3.483000 1.397000  1.614000       1.912000  
1 1 1 34 32 4  f 3.142000 0.8602000 3.021000 1.240000  3.264000 1.193000  -0.2435000     1.720000  
1 1 1 34 32 6  o 5.119000 0.7882000 5.555000 1.334000  4.683000 0.8408000 0.8728000      1.576000  
1 1 1 34 32 8  o 7.510000 0.8042000 6.839000 1.197000  8.181000 1.074000  -1.341000      1.608000  
1 1 1 34 32 10 o 12.03000 0.5641000 11.24000 0.7752000 12.81000 0.8198000 -1.568000      1.128000  
1 1 1 34 32 12 o 3.770000 0.9997000 4.260000 1.492000  3.279000 1.331000  0.9807000      1.999000  
1 1 1 34 32 14 o 9.070000 0.6972000 7.933000 1.015000  10.21000 0.9567000 -2.275000      1.394000  
1 1 1 34 32 16 o 6.895000 0.8525000 8.095000 1.060000  5.694000 1.335000  2.400000       1.705000  
1 1 1 34 32 18 o 9.894000 0.7843000 10.10000 0.9172000 9.691000 1.273000  0.4048000      1.569000  
1 1 1 34 32 20 o 4.835000 0.9730000 4.326000 1.367000  5.344000 1.385000  -1.017000      1.946000  
1 1 1 34 32 22 o 3.771000 1.001000  3.151000 1.300000  4.391000 1.523000  -1.240000      2.002000  
1 1 1 34 32 24 o 4.685000 1.042000  4.758000 1.373000  4.611000 1.568000  0.1472000      2.084000  
1 1 1 34 32 26 o 4.966000 1.010000  5.579000 1.357000  4.353000 1.496000  1.226000       2.020000  
1 1 1 34 32 28 o 3.963000 1.036000  3.883000 1.472000  4.043000 1.459000  -0.1604000     2.073000  
1 1 1 34 32 30 o 3.584000 1.030000  3.690000 1.470000  3.478000 1.443000  0.2121000      2.060000  
1 1 1 34 33 1  o 3.623000 0.9761000 4.269000 1.502000  2.977000 1.247000  1.292000       1.952000  
1 1 1 34 33 3  o 7.869000 0.4843000 8.067000 0.7703000 7.670000 0.5872000 0.3974000      0.9686000 
1 1 1 34 33 5  o 5.446000 0.6855000 5.462000 1.205000  5.430000 0.6530000 0.3274000E-01  1.371000  
1 1 1 34 33 7  o 7.554000 0.8549000 7.853000 0.8817000 7.256000 1.465000  0.5975000      1.710000  
1 1 1 34 33 9  o 3.869000 1.012000  4.512000 1.579000  3.227000 1.265000  1.285000       2.024000  
1 1 1 34 33 11 o 11.13000 0.5623000 10.56000 0.7797000 11.69000 0.8106000 -1.138000      1.125000  
1 1 1 34 33 13 o 5.915000 1.011000  6.978000 1.280000  4.853000 1.566000  2.125000       2.023000  
1 1 1 34 33 15 o 3.431000 0.9534000 3.398000 1.372000  3.465000 1.325000  -0.6655000E-01 1.907000  
1 1 1 34 33 17 o 5.273000 0.9986000 5.790000 1.364000  4.756000 1.459000  1.034000       1.997000  
1 1 1 34 33 19 o 7.897000 0.7349000 9.212000 0.9111000 6.583000 1.153000  2.629000       1.470000  
1 1 1 34 33 21 o 6.140000 0.8996000 7.103000 1.016000  5.178000 1.485000  1.925000       1.799000  
1 1 1 34 33 23 f 6.287000 0.8737000 6.149000 1.198000  6.425000 1.273000  -0.2755000     1.747000  
1 1 1 34 33 25 o 4.732000 1.124000  5.694000 1.608000  3.770000 1.572000  1.924000       2.249000  
1 1 1 34 33 27 o 3.374000 0.9918000 3.658000 1.465000  3.090000 1.337000  0.5685000      1.984000  
1 1 1 34 33 29 o 5.455000 1.227000  5.961000 1.642000  4.949000 1.823000  1.012000       2.453000  
1 1 1 34 34 0  o 10.47000 0.6859000 10.47000 0.6859000 10.47000 0.6859000 0.000000       0.000000  
1 1 1 34 34 2  o 10.63000 0.3987000 11.10000 0.6345000 10.16000 0.4830000 0.9403000      0.7974000 
1 1 1 34 34 4  o 3.599000 0.9101000 3.390000 1.215000  3.808000 1.356000  -0.4182000     1.820000  
1 1 1 34 34 6  o 4.555000 0.9845000 4.429000 1.359000  4.681000 1.425000  -0.2518000     1.969000  
1 1 1 34 34 8  o 3.856000 1.037000  3.584000 1.493000  4.128000 1.439000  -0.5440000     2.073000  
1 1 1 34 34 10 o 4.367000 1.164000  5.579000 1.945000  3.156000 1.280000  2.422000       2.329000  
1 1 1 34 34 12 o 12.47000 0.4474000 12.87000 0.6200000 12.06000 0.6451000 0.8164000      0.8947000 
1 1 1 34 34 14 o 5.662000 0.8999000 6.462000 1.077000  4.861000 1.442000  1.601000       1.800000  
1 1 1 34 34 16 o 4.708000 0.9635000 3.747000 1.408000  5.668000 1.316000  -1.922000      1.927000  
1 1 1 34 34 18 o 3.933000 1.064000  4.359000 1.473000  3.507000 1.537000  0.8525000      2.129000  
1 1 1 34 34 20 o 9.889000 0.6291000 10.87000 0.8071000 8.911000 0.9652000 1.957000       1.258000  
1 1 1 34 34 22 o 4.507000 1.006000  4.585000 1.422000  4.430000 1.425000  0.1554000      2.013000  
1 1 1 34 34 24 o 5.204000 1.054000  5.396000 1.450000  5.011000 1.531000  0.3851000      2.109000  
1 1 1 34 34 26 o 4.049000 1.022000  4.278000 1.446000  3.820000 1.444000  0.4587000      2.044000  
1 1 1 34 34 28 o 4.103000 1.041000  4.492000 1.508000  3.714000 1.435000  0.7778000      2.082000  
1 1 1 34 35 1  o 9.118000 0.5345000 8.803000 0.9211000 9.434000 0.5426000 -0.6318000     1.069000  
1 1 1 34 35 3  o 7.294000 0.7274000 7.831000 0.8607000 6.756000 1.173000  1.075000       1.455000  
1 1 1 34 35 5  o 13.16000 0.4452000 12.91000 0.6546000 13.40000 0.6036000 -0.4856000     0.8904000 
1 1 1 34 35 7  o 3.433000 1.023000  3.082000 1.316000  3.784000 1.567000  -0.7023000     2.046000  
1 1 1 34 35 9  o 8.588000 0.6234000 8.526000 0.8998000 8.650000 0.8632000 -0.1243000     1.247000  
1 1 1 34 35 11 o 5.290000 0.9210000 4.749000 1.373000  5.832000 1.228000  -1.084000      1.842000  
1 1 1 34 35 13 o 9.312000 0.5890000 9.000000 0.8723000 9.625000 0.7919000 -0.6249000     1.178000  
1 1 1 34 35 15 o 5.456000 0.8978000 4.265000 1.378000  6.648000 1.152000  -2.384000      1.796000  
1 1 1 34 35 17 f 5.972000 0.8744000 6.111000 1.158000  5.832000 1.310000  0.2789000      1.749000  
1 1 1 34 35 19 o 6.107000 0.8997000 7.114000 1.072000  5.100000 1.445000  2.015000       1.799000  
1 1 1 34 35 21 o 4.085000 1.055000  4.019000 1.544000  4.151000 1.439000  -0.1319000     2.111000  
1 1 1 34 35 23 o 3.937000 1.026000  4.511000 1.492000  3.364000 1.408000  1.147000       2.051000  
1 1 1 34 35 25 o 5.131000 0.9820000 3.296000 1.397000  6.966000 1.381000  -3.670000      1.964000  
1 1 1 34 35 27 o 3.664000 0.9984000 3.480000 1.379000  3.848000 1.444000  -0.3687000     1.997000  
1 1 1 34 36 0  o 4.642000 1.545000  4.642000 1.545000  4.642000 1.545000  0.000000       0.000000  
1 1 1 34 36 2  o 3.677000 0.9631000 4.678000 1.508000  2.676000 1.198000  2.002000       1.926000  
1 1 1 34 36 4  o 3.711000 0.9285000 3.398000 1.268000  4.024000 1.357000  -0.6261000     1.857000  
1 1 1 34 36 6  o 3.045000 0.8903000 2.955000 1.243000  3.136000 1.275000  -0.1807000     1.781000  
1 1 1 34 36 8  o 4.392000 1.056000  4.395000 1.329000  4.389000 1.640000  0.6283000E-02  2.111000  
1 1 1 34 36 10 o 3.985000 1.003000  4.793000 1.535000  3.177000 1.291000  1.617000       2.006000  
1 1 1 34 36 12 o 3.524000 0.9774000 3.806000 1.428000  3.242000 1.335000  0.5642000      1.955000  
1 1 1 34 36 14 o 3.877000 0.9590000 4.617000 1.398000  3.136000 1.313000  1.481000       1.918000  
1 1 1 34 36 16 o 5.920000 0.9168000 6.773000 1.199000  5.066000 1.387000  1.707000       1.834000  
1 1 1 34 36 18 o 6.511000 0.9192000 7.280000 0.9508000 5.743000 1.573000  1.537000       1.838000  
1 1 1 34 36 20 o 14.48000 0.4983000 14.96000 0.6709000 14.01000 0.7370000 0.9474000      0.9967000 
1 1 1 34 36 22 o 9.804000 0.6465000 9.413000 0.9923000 10.19000 0.8289000 -0.7808000     1.293000  
1 1 1 34 36 24 o 5.385000 1.004000  5.389000 1.476000  5.380000 1.361000  0.8484000E-02  2.008000  
1 1 1 34 36 26 o 4.253000 1.075000  3.776000 1.549000  4.731000 1.491000  -0.9551000     2.150000  
1 1 1 34 37 1  o 10.11000 0.7859000 10.46000 1.017000  9.760000 1.198000  0.7014000      1.572000  
1 1 1 34 37 3  o 5.546000 1.132000  5.610000 1.543000  5.481000 1.655000  0.1292000      2.263000  
1 1 1 34 37 5  o 4.601000 0.8919000 3.772000 1.305000  5.429000 1.216000  -1.657000      1.784000  
1 1 1 34 37 7  o 4.965000 0.9267000 4.435000 1.331000  5.496000 1.290000  -1.061000      1.853000  
1 1 1 34 37 9  o 3.393000 0.9280000 3.871000 1.358000  2.915000 1.265000  0.9561000      1.856000  
1 1 1 34 37 11 o 9.491000 0.5770000 9.531000 0.8064000 9.451000 0.8256000 0.8051000E-01  1.154000  
1 1 1 34 37 13 o 9.686000 0.5639000 10.00000 0.7766000 9.371000 0.8179000 0.6299000      1.128000  
1 1 1 34 37 15 o 6.407000 0.9037000 6.664000 1.208000  6.149000 1.344000  0.5157000      1.807000  
1 1 1 34 37 17 o 7.471000 0.7284000 7.761000 0.9702000 7.180000 1.087000  0.5808000      1.457000  
1 1 1 34 37 19 o 3.347000 0.9936000 3.175000 1.364000  3.519000 1.445000  -0.3443000     1.987000  
1 1 1 34 37 21 o 8.917000 0.7305000 10.08000 1.074000  7.755000 0.9902000 2.324000       1.461000  
1 1 1 34 37 23 o 3.540000 0.9694000 4.274000 1.475000  2.806000 1.258000  1.469000       1.939000  
1 1 1 34 38 0  o 3.200000 1.369000  3.200000 1.369000  3.200000 1.369000  0.000000       0.000000  
1 1 1 34 38 2  o 5.489000 1.069000  6.829000 1.402000  4.150000 1.615000  2.680000       2.139000  
1 1 1 34 38 4  o 6.972000 0.8301000 6.414000 0.9449000 7.529000 1.365000  -1.115000      1.660000  
1 1 1 34 38 6  o 8.003000 0.7226000 8.285000 0.7580000 7.721000 1.230000  0.5634000      1.445000  
1 1 1 34 38 8  o 6.381000 1.008000  6.848000 1.048000  5.914000 1.722000  0.9339000      2.016000  
1 1 1 34 38 10 o 11.60000 0.6310000 11.29000 1.041000  11.92000 0.7131000 -0.6366000     1.262000  
1 1 1 34 38 12 o 11.90000 0.5189000 11.80000 0.7213000 12.01000 0.7462000 -0.2139000     1.038000  
1 1 1 34 38 14 o 7.123000 0.7630000 7.302000 1.048000  6.945000 1.109000  0.3570000      1.526000  
1 1 1 34 38 16 o 5.524000 0.9484000 5.688000 1.233000  5.359000 1.441000  0.3280000      1.897000  
1 1 1 34 38 18 o 3.603000 1.034000  4.074000 1.523000  3.133000 1.398000  0.9412000      2.068000  
1 1 1 34 38 20 o 4.559000 1.074000  5.056000 1.579000  4.062000 1.455000  0.9943000      2.147000  
1 1 1 34 38 22 o 3.310000 0.9636000 3.463000 1.363000  3.157000 1.362000  0.3057000      1.927000  
1 1 1 34 39 1  o 4.740000 1.117000  4.902000 1.487000  4.579000 1.666000  0.3227000      2.233000  
1 1 1 34 39 3  o 5.994000 1.154000  6.174000 1.588000  5.815000 1.674000  0.3590000      2.308000  
1 1 1 34 39 5  o 4.323000 1.161000  4.643000 1.711000  4.002000 1.570000  0.6414000      2.322000  
1 1 1 34 39 7  o 7.521000 0.7082000 7.922000 0.8974000 7.120000 1.096000  0.8019000      1.416000  
1 1 1 34 39 9  o 11.97000 0.4832000 12.45000 0.6602000 11.49000 0.7058000 0.9520000      0.9664000 
1 1 1 34 39 11 f 9.998000 0.7565000 9.439000 1.258000  10.56000 0.8412000 -1.118000      1.513000  
1 1 1 34 39 13 o 11.51000 0.5299000 11.43000 0.7655000 11.60000 0.7328000 -0.1610000     1.060000  
1 1 1 34 39 15 o 4.379000 1.040000  3.781000 1.406000  4.976000 1.532000  -1.194000      2.080000  
1 1 1 34 39 17 o 6.649000 0.8429000 6.191000 1.322000  7.107000 1.047000  -0.9163000     1.686000  
1 1 1 34 39 19 o 3.847000 1.028000  4.036000 1.511000  3.659000 1.393000  0.3770000      2.055000  
1 1 1 34 40 0  o 4.521000 1.529000  4.521000 1.529000  4.521000 1.529000  0.000000       0.000000  
1 1 1 34 40 2  o 4.932000 1.165000  5.745000 1.670000  4.119000 1.624000  1.626000       2.330000  
1 1 1 34 40 4  f 5.247000 1.145000  5.172000 1.661000  5.322000 1.576000  -0.1503000     2.289000  
1 1 1 34 40 6  f 4.052000 1.132000  3.695000 1.487000  4.408000 1.707000  -0.7136000     2.264000  
1 1 1 34 40 8  o 3.582000 1.043000  3.863000 1.579000  3.302000 1.363000  0.5612000      2.086000  
1 1 1 34 40 10 o 4.322000 0.9867000 4.414000 1.397000  4.230000 1.394000  0.1833000      1.973000  
1 1 1 34 40 12 o 3.947000 0.9988000 4.070000 1.437000  3.825000 1.388000  0.2452000      1.998000  
1 1 1 34 40 14 o 5.627000 0.9531000 5.419000 1.456000  5.835000 1.230000  -0.4158000     1.906000  
1 1 1 34 40 16 o 5.347000 0.9986000 6.157000 1.394000  4.538000 1.430000  1.619000       1.997000  
1 1 1 34 40 18 o 4.592000 1.097000  3.065000 1.362000  6.120000 1.721000  -3.055000      2.195000  
1 1 1 34 41 1  o 3.503000 1.045000  3.150000 1.361000  3.856000 1.585000  -0.7060000     2.089000  
1 1 1 34 41 3  o 4.184000 1.188000  4.001000 1.680000  4.366000 1.681000  -0.3653000     2.377000  
1 1 1 34 41 5  o 6.494000 1.103000  6.333000 1.596000  6.655000 1.524000  -0.3218000     2.207000  
1 1 1 34 41 7  o 6.953000 1.154000  7.538000 1.291000  6.368000 1.913000  1.170000       2.308000  
1 1 1 34 41 9  o 4.995000 1.163000  4.250000 1.700000  5.739000 1.587000  -1.489000      2.326000  
1 1 1 34 41 11 o 3.721000 1.062000  4.087000 1.684000  3.355000 1.295000  0.7318000      2.124000  
1 1 1 34 41 13 o 3.967000 1.100000  3.769000 1.494000  4.165000 1.614000  -0.3967000     2.199000  
1 1 1 34 41 15 o 4.272000 1.190000  4.406000 1.822000  4.139000 1.533000  0.2671000      2.381000  
1 1 1 34 42 0  o 3.904000 1.564000  3.904000 1.564000  3.904000 1.564000  0.000000       0.000000  
1 1 1 34 42 2  o 4.126000 1.167000  3.573000 1.596000  4.679000 1.704000  -1.106000      2.335000  
1 1 1 34 42 4  o 7.701000 1.176000  8.500000 1.762000  6.901000 1.559000  1.599000       2.353000  
1 1 1 34 42 6  o 6.606000 1.150000  6.756000 1.561000  6.455000 1.688000  0.3012000      2.300000  
1 1 1 34 42 8  o 3.891000 1.142000  3.749000 1.601000  4.033000 1.628000  -0.2839000     2.284000  
1 1 1 34 42 10 o 8.166000 1.198000  7.822000 1.408000  8.510000 1.939000  -0.6882000     2.396000  
1 1 1 34 42 12 o 7.844000 2.358000  ?        ?         7.844000 2.358000  ?              ?         
1 1 1 34 43 1  o 10.56000 1.029000  11.00000 1.014000  10.13000 1.790000  0.8701000      2.057000  
1 1 1 34 43 3  o 8.536000 1.515000  8.478000 2.193000  8.594000 2.089000  -0.1165000     3.029000  
1 1 1 34 43 5  o 5.240000 1.416000  4.857000 1.876000  5.623000 2.121000  -0.7655000     2.832000  
1 1 1 34 43 7  o 5.845000 2.326000  ?        ?         5.845000 2.326000  ?              ?         
1 1 1 35 0  1  o 4.578000 1.240000  4.578000 1.240000  4.578000 1.240000  0.000000       0.000000  
1 1 1 35 0  3  o 22.03000 0.5015000 22.03000 0.5015000 22.03000 0.5015000 0.000000       0.000000  
1 1 1 35 0  5  o 16.10000 0.5257000 16.10000 0.5257000 16.10000 0.5257000 0.000000       0.000000  
1 1 1 35 0  7  o 2.994000 1.295000  2.994000 1.295000  2.994000 1.295000  0.000000       0.000000  
1 1 1 35 0  9  o 16.53000 0.5448000 16.53000 0.5448000 16.53000 0.5448000 0.000000       0.000000  
1 1 1 35 0  11 f 11.81000 0.6432000 11.81000 0.6432000 11.81000 0.6432000 0.000000       0.000000  
1 1 1 35 0  13 o 13.00000 0.6155000 13.00000 0.6155000 13.00000 0.6155000 0.000000       0.000000  
1 1 1 35 0  15 f 6.189000 1.182000  6.189000 1.182000  6.189000 1.182000  0.000000       0.000000  
1 1 1 35 0  17 o 3.080000 1.222000  3.080000 1.222000  3.080000 1.222000  0.000000       0.000000  
1 1 1 35 0  19 o 3.188000 1.198000  3.188000 1.198000  3.188000 1.198000  0.000000       0.000000  
1 1 1 35 0  21 o 21.51000 0.5000000 21.51000 0.5000000 21.51000 0.5000000 0.000000       0.000000  
1 1 1 35 0  23 o 3.213000 1.225000  3.213000 1.225000  3.213000 1.225000  0.000000       0.000000  
1 1 1 35 0  25 o 3.990000 1.577000  3.990000 1.577000  3.990000 1.577000  0.000000       0.000000  
1 1 1 35 0  27 o 6.532000 1.239000  6.532000 1.239000  6.532000 1.239000  0.000000       0.000000  
1 1 1 35 0  29 o 3.183000 1.283000  3.183000 1.283000  3.183000 1.283000  0.000000       0.000000  
1 1 1 35 0  31 o 5.166000 1.237000  5.166000 1.237000  5.166000 1.237000  0.000000       0.000000  
1 1 1 35 0  33 o 3.923000 1.294000  3.923000 1.294000  3.923000 1.294000  0.000000       0.000000  
1 1 1 35 0  35 o 4.708000 1.305000  4.708000 1.305000  4.708000 1.305000  0.000000       0.000000  
1 1 1 35 0  37 o 2.633000 1.205000  2.633000 1.205000  2.633000 1.205000  0.000000       0.000000  
1 1 1 35 0  39 o 3.170000 1.354000  3.170000 1.354000  3.170000 1.354000  0.000000       0.000000  
1 1 1 35 0  41 o 4.012000 1.398000  4.012000 1.398000  4.012000 1.398000  0.000000       0.000000  
1 1 1 35 0  43 o 7.472000 1.309000  7.472000 1.309000  7.472000 1.309000  0.000000       0.000000  
1 1 1 35 0  45 o 3.492000 1.379000  3.492000 1.379000  3.492000 1.379000  0.000000       0.000000  
1 1 1 35 1  0  o 9.031000 0.7790000 9.031000 0.7790000 9.031000 0.7790000 0.000000       0.000000  
1 1 1 35 1  2  f 7.062000 0.6538000 7.068000 0.9180000 7.056000 0.9312000 0.1157000E-01  1.308000  
1 1 1 35 1  4  o 7.920000 0.6263000 7.515000 0.9712000 8.326000 0.7910000 -0.8108000     1.253000  
1 1 1 35 1  6  o 25.49000 0.3742000 26.35000 0.6101000 24.62000 0.4336000 1.728000       0.7485000 
1 1 1 35 1  8  o 21.80000 0.3688000 22.09000 0.5328000 21.51000 0.5101000 0.5793000      0.7376000 
1 1 1 35 1  10 o 7.029000 0.6797000 7.322000 1.032000  6.736000 0.8854000 0.5862000      1.359000  
1 1 1 35 1  12 o 6.105000 0.6308000 5.680000 0.9005000 6.530000 0.8835000 -0.8507000     1.262000  
1 1 1 35 1  14 f 8.272000 0.5784000 8.115000 0.9263000 8.430000 0.6928000 -0.3149000     1.157000  
1 1 1 35 1  16 o 14.06000 0.3851000 14.11000 0.6014000 14.01000 0.4810000 0.9817000E-01  0.7701000 
1 1 1 35 1  18 f 14.17000 0.3921000 13.99000 0.6158000 14.36000 0.4855000 -0.3704000     0.7841000 
1 1 1 35 1  20 o 16.51000 0.3554000 16.61000 0.5406000 16.42000 0.4615000 0.1850000      0.7109000 
1 1 1 35 1  22 o 23.47000 0.4364000 24.04000 0.6228000 22.90000 0.6115000 1.138000       0.8728000 
1 1 1 35 1  24 o 17.24000 0.3997000 16.91000 0.5533000 17.56000 0.5770000 -0.6542000     0.7994000 
1 1 1 35 1  26 o 12.89000 0.4603000 12.74000 0.7072000 13.05000 0.5892000 -0.3088000     0.9205000 
1 1 1 35 1  28 o 6.608000 0.7577000 6.376000 1.043000  6.841000 1.100000  -0.4647000     1.515000  
1 1 1 35 1  30 o 13.65000 0.3872000 13.81000 0.5527000 13.50000 0.5424000 0.3056000      0.7744000 
1 1 1 35 1  32 o 14.44000 0.4548000 14.69000 0.6480000 14.19000 0.6382000 0.5020000      0.9095000 
1 1 1 35 1  34 o 6.129000 0.7738000 5.831000 1.113000  6.427000 1.075000  -0.5961000     1.548000  
1 1 1 35 1  36 o 4.269000 0.8661000 5.574000 1.198000  2.963000 1.251000  2.612000       1.732000  
1 1 1 35 1  38 o 15.82000 0.4185000 15.70000 0.4863000 15.94000 0.6811000 -0.2336000     0.8369000 
1 1 1 35 1  40 f 16.96000 0.3871000 16.89000 0.5431000 17.02000 0.5518000 -0.1271000     0.7742000 
1 1 1 35 1  42 o 11.75000 0.5567000 12.13000 0.6907000 11.37000 0.8732000 0.7610000      1.113000  
1 1 1 35 1  44 o 4.585000 1.059000  4.668000 1.564000  4.503000 1.428000  0.1644000      2.118000  
1 1 1 35 2  1  o 32.52000 0.4019000 32.84000 0.6293000 32.20000 0.5000000 0.6423000      0.8037000 
1 1 1 35 2  3  o 4.666000 0.9363000 3.721000 1.504000  5.612000 1.116000  -1.891000      1.873000  
1 1 1 35 2  5  f 24.78000 0.3258000 23.93000 0.4429000 25.62000 0.4780000 -1.686000      0.6516000 
1 1 1 35 2  7  o 15.73000 0.3817000 15.99000 0.5751000 15.46000 0.5020000 0.5377000      0.7634000 
1 1 1 35 2  9  o 20.87000 0.3086000 20.69000 0.4372000 21.06000 0.4356000 -0.3636000     0.6172000 
1 1 1 35 2  11 o 3.084000 0.8452000 2.933000 1.187000  3.235000 1.203000  -0.3023000     1.690000  
1 1 1 35 2  13 o 13.11000 0.3582000 13.10000 0.4993000 13.12000 0.5138000 -0.1952000E-01 0.7164000 
1 1 1 35 2  15 o 5.880000 0.7015000 5.432000 1.051000  6.327000 0.9292000 -0.8953000     1.403000  
1 1 1 35 2  17 o 16.52000 0.3104000 16.49000 0.4376000 16.55000 0.4404000 -0.6357000E-01 0.6208000 
1 1 1 35 2  19 o 21.29000 0.3280000 20.74000 0.5050000 21.84000 0.4188000 -1.094000      0.6561000 
1 1 1 35 2  21 o 16.29000 0.5966000 16.40000 1.100000  16.17000 0.4626000 0.2364000      1.193000  
1 1 1 35 2  23 o 7.046000 0.7409000 5.732000 1.211000  8.361000 0.8544000 -2.629000      1.482000  
1 1 1 35 2  25 o 10.74000 0.5430000 10.06000 0.7852000 11.41000 0.7503000 -1.348000      1.086000  
1 1 1 35 2  27 o 6.951000 0.9185000 7.612000 1.373000  6.290000 1.221000  1.322000       1.837000  
1 1 1 35 2  29 o 11.99000 0.4706000 11.84000 0.6206000 12.15000 0.7076000 -0.3090000     0.9412000 
1 1 1 35 2  31 o 20.66000 0.3563000 21.07000 0.4739000 20.24000 0.5322000 0.8340000      0.7126000 
1 1 1 35 2  33 o 6.852000 0.7544000 7.160000 1.169000  6.544000 0.9541000 0.6162000      1.509000  
1 1 1 35 2  35 o 9.240000 0.5347000 9.140000 0.7812000 9.340000 0.7303000 -0.2002000     1.069000  
1 1 1 35 2  37 o 9.464000 0.6296000 8.543000 0.7284000 10.38000 1.027000  -1.840000      1.259000  
1 1 1 35 2  39 o 8.442000 0.6512000 8.358000 0.8973000 8.527000 0.9438000 -0.1689000     1.302000  
1 1 1 35 2  41 o 5.523000 1.009000  5.421000 1.305000  5.624000 1.538000  -0.2033000     2.017000  
1 1 1 35 2  43 o 3.990000 1.013000  4.150000 1.453000  3.831000 1.411000  0.3193000      2.026000  
1 1 1 35 2  45 o 3.058000 0.9432000 3.390000 1.437000  2.725000 1.222000  0.6648000      1.886000  
1 1 1 35 3  0  o 7.985000 0.9566000 7.985000 0.9566000 7.985000 0.9566000 0.000000       0.000000  
1 1 1 35 3  2  o 8.421000 0.6407000 8.541000 0.8718000 8.301000 0.9391000 0.2396000      1.281000  
1 1 1 35 3  4  o 13.21000 0.4075000 13.00000 0.6211000 13.42000 0.5276000 -0.4193000     0.8149000 
1 1 1 35 3  6  o 4.147000 0.9516000 4.007000 1.384000  4.286000 1.307000  -0.2793000     1.903000  
1 1 1 35 3  8  o 14.50000 0.4301000 14.71000 0.6646000 14.29000 0.5462000 0.4196000      0.8603000 
1 1 1 35 3  10 o 19.25000 0.3448000 19.40000 0.5221000 19.10000 0.4506000 0.2938000      0.6897000 
1 1 1 35 3  12 o 31.39000 0.3377000 31.25000 0.5143000 31.52000 0.4376000 -0.2694000     0.6753000 
1 1 1 35 3  14 o 8.086000 0.5366000 8.242000 0.8008000 7.931000 0.7144000 0.3109000      1.073000  
1 1 1 35 3  16 o 10.64000 0.4147000 10.43000 0.6059000 10.86000 0.5665000 -0.4275000     0.8295000 
1 1 1 35 3  18 o 6.448000 0.6955000 6.581000 1.058000  6.315000 0.9030000 0.2667000      1.391000  
1 1 1 35 3  20 o 4.949000 0.8222000 4.047000 1.321000  5.851000 0.9793000 -1.804000      1.644000  
1 1 1 35 3  22 o 19.68000 0.3494000 19.61000 0.4729000 19.75000 0.5144000 -0.1402000     0.6988000 
1 1 1 35 3  24 o 13.93000 0.5054000 14.22000 0.6558000 13.64000 0.7692000 0.5862000      1.011000  
1 1 1 35 3  26 o 3.778000 0.8453000 2.686000 1.201000  4.870000 1.189000  -2.184000      1.691000  
1 1 1 35 3  28 o 6.576000 0.7109000 6.626000 1.007000  6.525000 1.004000  0.1009000      1.422000  
1 1 1 35 3  30 o 5.783000 0.7987000 5.336000 1.234000  6.230000 1.014000  -0.8939000     1.597000  
1 1 1 35 3  32 o 10.18000 0.5286000 10.29000 0.6846000 10.07000 0.8056000 0.2214000      1.057000  
1 1 1 35 3  34 o 6.014000 0.7550000 6.483000 1.004000  5.545000 1.128000  0.9383000      1.510000  
1 1 1 35 3  36 o 6.874000 0.8190000 7.285000 0.9950000 6.462000 1.301000  0.8228000      1.638000  
1 1 1 35 3  38 o 11.85000 0.6919000 12.79000 0.5688000 10.91000 1.262000  1.878000       1.384000  
1 1 1 35 3  40 o 6.564000 0.8075000 6.278000 1.231000  6.851000 1.045000  -0.5732000     1.615000  
1 1 1 35 3  42 o 8.512000 0.6418000 9.206000 0.8650000 7.818000 0.9483000 1.388000       1.284000  
1 1 1 35 3  44 o 3.341000 0.9440000 3.531000 1.368000  3.152000 1.301000  0.3797000      1.888000  
1 1 1 35 4  1  o 14.46000 0.4014000 14.73000 0.4859000 14.20000 0.6390000 0.5278000      0.8028000 
1 1 1 35 4  3  o 22.12000 0.3366000 22.05000 0.4472000 22.20000 0.5033000 -0.1496000     0.6733000 
1 1 1 35 4  5  o 22.96000 0.3116000 23.12000 0.4381000 22.80000 0.4431000 0.3251000      0.6231000 
1 1 1 35 4  7  o 17.76000 0.3367000 18.22000 0.4662000 17.30000 0.4859000 0.9126000      0.6734000 
1 1 1 35 4  9  o 39.55000 0.4346000 39.55000 0.6693000 39.55000 0.5545000 -0.7530000E-02 0.8691000 
1 1 1 35 4  11 o 18.60000 0.3243000 18.94000 0.4819000 18.26000 0.4341000 0.6742000      0.6486000 
1 1 1 35 4  13 o 14.45000 0.3459000 13.98000 0.4868000 14.92000 0.4915000 -0.9405000     0.6917000 
1 1 1 35 4  15 f 8.957000 0.4502000 9.329000 0.6093000 8.586000 0.6629000 0.7433000      0.9004000 
1 1 1 35 4  17 o 3.963000 0.8649000 3.968000 1.204000  3.959000 1.242000  0.9043000E-02  1.730000  
1 1 1 35 4  19 o 29.72000 0.3334000 29.70000 0.5061000 29.73000 0.4343000 -0.2303000E-01 0.6668000 
1 1 1 35 4  21 o 33.68000 0.3484000 34.25000 0.4655000 33.10000 0.5187000 1.143000       0.6969000 
1 1 1 35 4  23 o 8.762000 0.7840000 9.226000 0.8906000 8.298000 1.291000  0.9287000      1.568000  
1 1 1 35 4  25 o 24.86000 0.3476000 24.38000 0.5148000 25.34000 0.4672000 -0.9641000     0.6952000 
1 1 1 35 4  27 f 14.12000 0.4600000 14.66000 0.7527000 13.58000 0.5292000 1.080000       0.9201000 
1 1 1 35 4  29 o 2.800000 0.8372000 2.651000 1.172000  2.949000 1.196000  -0.2980000     1.674000  
1 1 1 35 4  31 o 24.64000 0.3264000 24.79000 0.4778000 24.49000 0.4448000 0.3006000      0.6528000 
1 1 1 35 4  33 o 3.959000 0.9742000 4.184000 1.342000  3.735000 1.412000  0.4488000      1.948000  
1 1 1 35 4  35 o 8.434000 0.5827000 8.992000 0.8409000 7.876000 0.8068000 1.116000       1.165000  
1 1 1 35 4  37 o 6.526000 0.9500000 7.410000 0.8173000 5.641000 1.715000  1.769000       1.900000  
1 1 1 35 4  39 o 4.210000 0.9462000 2.782000 1.185000  5.638000 1.475000  -2.856000      1.892000  
1 1 1 35 4  41 o 8.451000 0.6182000 8.882000 0.8895000 8.019000 0.8586000 0.8638000      1.236000  
1 1 1 35 4  43 o 3.545000 0.9484000 4.205000 1.428000  2.885000 1.249000  1.320000       1.897000  
1 1 1 35 4  45 o 3.841000 1.005000  3.524000 1.388000  4.157000 1.454000  -0.6326000     2.011000  
1 1 1 35 5  0  o 15.85000 0.4866000 15.85000 0.4866000 15.85000 0.4866000 0.000000       0.000000  
1 1 1 35 5  2  o 20.18000 0.3208000 19.98000 0.4510000 20.37000 0.4564000 -0.3828000     0.6417000 
1 1 1 35 5  4  o 14.60000 0.3920000 14.34000 0.5394000 14.85000 0.5689000 -0.5122000     0.7839000 
1 1 1 35 5  6  o 25.17000 0.3040000 25.59000 0.4195000 24.75000 0.4401000 0.8378000      0.6080000 
1 1 1 35 5  8  o 10.17000 0.4588000 9.990000 0.6317000 10.35000 0.6656000 -0.3576000     0.9176000 
1 1 1 35 5  10 o 8.541000 0.5389000 8.910000 0.7596000 8.171000 0.7646000 0.7385000      1.078000  
1 1 1 35 5  12 o 9.270000 0.4705000 9.327000 0.6434000 9.214000 0.6868000 0.1128000      0.9411000 
1 1 1 35 5  14 o 18.01000 0.3130000 18.52000 0.4353000 17.50000 0.4498000 1.020000       0.6260000 
1 1 1 35 5  16 f 3.982000 0.8574000 3.794000 1.218000  4.170000 1.207000  -0.3764000     1.715000  
1 1 1 35 5  18 o 21.64000 0.3235000 21.29000 0.4868000 22.00000 0.4261000 -0.7090000     0.6470000 
1 1 1 35 5  20 o 15.31000 0.3387000 15.17000 0.4863000 15.45000 0.4716000 -0.2858000     0.6774000 
1 1 1 35 5  22 o 12.02000 0.5289000 12.82000 0.6561000 11.21000 0.8297000 1.612000       1.058000  
1 1 1 35 5  24 o 4.787000 0.9295000 4.432000 1.253000  5.141000 1.373000  -0.7091000     1.859000  
1 1 1 35 5  26 o 8.837000 0.5273000 8.186000 0.8004000 9.489000 0.6867000 -1.303000      1.055000  
1 1 1 35 5  28 o 10.29000 0.5048000 9.491000 0.8014000 11.08000 0.6139000 -1.590000      1.010000  
1 1 1 35 5  30 o 6.171000 0.7525000 5.805000 1.202000  6.536000 0.9056000 -0.7305000     1.505000  
1 1 1 35 5  32 o 10.81000 0.4593000 10.71000 0.6779000 10.92000 0.6198000 -0.2116000     0.9185000 
1 1 1 35 5  34 o 3.401000 0.8744000 2.879000 1.200000  3.922000 1.273000  -1.043000      1.749000  
1 1 1 35 5  36 o 12.23000 0.5786000 12.62000 0.5824000 11.84000 0.9999000 0.7751000      1.157000  
1 1 1 35 5  38 o 8.668000 0.7350000 8.668000 0.7350000 ?        ?         ?              ?         
1 1 1 35 5  40 o 7.957000 0.7242000 7.707000 1.058000  8.206000 0.9887000 -0.4991000     1.448000  
1 1 1 35 5  42 o 6.408000 0.8388000 6.956000 1.099000  5.860000 1.267000  1.096000       1.678000  
1 1 1 35 5  44 o 3.370000 0.9513000 3.007000 1.306000  3.733000 1.384000  -0.7252000     1.903000  
1 1 1 35 6  1  o 24.17000 0.3021000 24.30000 0.4285000 24.04000 0.4259000 0.2584000      0.6042000 
1 1 1 35 6  3  o 16.09000 0.3334000 15.57000 0.4851000 16.61000 0.4575000 -1.040000      0.6668000 
1 1 1 35 6  5  o 18.37000 0.3472000 18.37000 0.4542000 18.37000 0.5254000 0.4049000E-02  0.6944000 
1 1 1 35 6  7  o 8.585000 0.5041000 8.593000 0.6934000 8.576000 0.7319000 0.1696000E-01  1.008000  
1 1 1 35 6  9  o 15.73000 0.3555000 16.05000 0.4667000 15.40000 0.5366000 0.6551000      0.7111000 
1 1 1 35 6  11 o 8.902000 0.5118000 8.701000 0.7850000 9.103000 0.6568000 -0.4023000     1.024000  
1 1 1 35 6  13 o 27.84000 0.2999000 27.46000 0.4272000 28.21000 0.4209000 -0.7510000     0.5998000 
1 1 1 35 6  15 o 19.25000 0.3034000 19.22000 0.4341000 19.28000 0.4239000 -0.6382000E-01 0.6067000 
1 1 1 35 6  17 o 9.313000 0.4807000 9.605000 0.7131000 9.022000 0.6447000 0.5827000      0.9613000 
1 1 1 35 6  19 o 26.81000 0.3329000 26.86000 0.4329000 26.77000 0.5058000 0.9178000E-01  0.6658000 
1 1 1 35 6  21 o 21.58000 0.3861000 21.82000 0.4997000 21.34000 0.5889000 0.4742000      0.7723000 
1 1 1 35 6  23 o 3.150000 0.8778000 3.125000 1.217000  3.175000 1.265000  -0.4981000E-01 1.756000  
1 1 1 35 6  25 o 18.23000 0.3732000 18.25000 0.5225000 18.22000 0.5331000 0.2783000E-01  0.7464000 
1 1 1 35 6  27 o 13.78000 0.3937000 13.38000 0.5615000 14.19000 0.5520000 -0.8078000     0.7874000 
1 1 1 35 6  29 o 10.97000 0.4544000 10.38000 0.6961000 11.56000 0.5843000 -1.177000      0.9088000 
1 1 1 35 6  31 f 15.04000 0.3906000 15.49000 0.5901000 14.59000 0.5120000 0.8997000      0.7813000 
1 1 1 35 6  33 o 14.26000 0.3838000 14.61000 0.5600000 13.90000 0.5249000 0.7100000      0.7675000 
1 1 1 35 6  35 o 15.96000 0.4731000 16.64000 0.4904000 15.29000 0.8093000 1.355000       0.9463000 
1 1 1 35 6  37 o 7.728000 0.7278000 7.351000 0.9677000 8.106000 1.087000  -0.7550000     1.456000  
1 1 1 35 6  39 o 4.870000 1.076000  4.118000 1.364000  5.622000 1.663000  -1.504000      2.151000  
1 1 1 35 6  41 o 4.903000 0.8963000 5.600000 1.198000  4.206000 1.334000  1.393000       1.793000  
1 1 1 35 6  43 o 3.686000 0.9856000 3.581000 1.369000  3.791000 1.418000  -0.2101000     1.971000  
1 1 1 35 6  45 o 5.072000 1.036000  5.782000 1.493000  4.362000 1.436000  1.420000       2.072000  
1 1 1 35 7  0  o 26.52000 0.4256000 26.52000 0.4256000 26.52000 0.4256000 0.000000       0.000000  
1 1 1 35 7  2  o 12.89000 0.3780000 12.77000 0.5467000 13.01000 0.5222000 -0.2402000     0.7561000 
1 1 1 35 7  4  o 5.896000 0.6961000 6.055000 0.9153000 5.737000 1.049000  0.3180000      1.392000  
1 1 1 35 7  6  o 11.41000 0.4404000 11.30000 0.5576000 11.53000 0.6819000 -0.2229000     0.8808000 
1 1 1 35 7  8  o 13.22000 0.3692000 13.50000 0.5106000 12.94000 0.5334000 0.5523000      0.7384000 
1 1 1 35 7  10 f 18.85000 0.3308000 18.93000 0.4814000 18.77000 0.4537000 0.1550000      0.6615000 
1 1 1 35 7  12 o 8.611000 0.5131000 8.463000 0.7656000 8.760000 0.6833000 -0.2968000     1.026000  
1 1 1 35 7  14 f 12.41000 0.3749000 12.10000 0.5490000 12.72000 0.5106000 -0.6237000     0.7497000 
1 1 1 35 7  16 o 13.91000 0.3647000 13.96000 0.5395000 13.87000 0.4910000 0.9000000E-01  0.7295000 
1 1 1 35 7  18 o 12.45000 0.4563000 12.69000 0.6461000 12.21000 0.6444000 0.4873000      0.9125000 
1 1 1 35 7  20 o 2.700000 0.7992000 3.020000 1.185000  2.380000 1.073000  0.6397000      1.598000  
1 1 1 35 7  22 o 8.259000 0.5340000 8.404000 0.6982000 8.114000 0.8082000 0.2895000      1.068000  
1 1 1 35 7  24 o 10.51000 0.4659000 11.13000 0.6481000 9.889000 0.6695000 1.237000       0.9319000 
1 1 1 35 7  26 o 14.74000 0.4049000 15.34000 0.5579000 14.14000 0.5870000 1.201000       0.8098000 
1 1 1 35 7  28 o 20.34000 0.3773000 19.91000 0.6098000 20.78000 0.4445000 -0.8683000     0.7546000 
1 1 1 35 7  30 o 10.59000 0.4520000 10.51000 0.6750000 10.66000 0.6012000 -0.1512000     0.9039000 
1 1 1 35 7  32 o 5.233000 0.8291000 5.013000 1.224000  5.454000 1.118000  -0.4409000     1.658000  
1 1 1 35 7  34 o 4.314000 1.077000  4.531000 1.426000  4.097000 1.615000  0.4337000      2.154000  
1 1 1 35 7  36 o 3.389000 0.9244000 3.150000 1.238000  3.628000 1.373000  -0.4779000     1.849000  
1 1 1 35 7  38 f 3.006000 0.8963000 3.483000 1.385000  2.529000 1.138000  0.9540000      1.793000  
1 1 1 35 7  40 o 7.206000 0.9435000 7.263000 1.128000  7.149000 1.513000  0.1137000      1.887000  
1 1 1 35 7  42 o 4.730000 0.9668000 5.828000 1.348000  3.632000 1.386000  2.195000       1.934000  
1 1 1 35 7  44 o 4.429000 0.9916000 4.804000 1.393000  4.054000 1.412000  0.7495000      1.983000  
1 1 1 35 8  1  o 27.87000 0.3006000 27.82000 0.4231000 27.92000 0.4273000 -0.9508000E-01 0.6013000 
1 1 1 35 8  3  o 15.18000 0.3417000 15.13000 0.4849000 15.23000 0.4815000 -0.9911000E-01 0.6833000 
1 1 1 35 8  5  f 10.87000 0.3945000 10.55000 0.5506000 11.20000 0.5651000 -0.6559000     0.7890000 
1 1 1 35 8  7  o 5.125000 0.8242000 6.316000 0.9385000 3.934000 1.355000  2.382000       1.648000  
1 1 1 35 8  9  o 24.72000 0.3025000 24.59000 0.4200000 24.86000 0.4354000 -0.2791000     0.6050000 
1 1 1 35 8  11 o 20.75000 0.3204000 20.80000 0.4253000 20.71000 0.4794000 0.9286000E-01  0.6408000 
1 1 1 35 8  13 o 23.92000 0.3131000 23.63000 0.4747000 24.21000 0.4083000 -0.5869000     0.6262000 
1 1 1 35 8  15 o 9.951000 0.4734000 9.219000 0.7220000 10.68000 0.6125000 -1.465000      0.9468000 
1 1 1 35 8  17 o 6.581000 0.6216000 5.665000 0.9874000 7.498000 0.7555000 -1.833000      1.243000  
1 1 1 35 8  19 o 14.04000 0.3430000 14.28000 0.4747000 13.81000 0.4952000 0.4720000      0.6859000 
1 1 1 35 8  21 o 8.048000 0.5623000 9.407000 0.5860000 6.688000 0.9600000 2.719000       1.125000  
1 1 1 35 8  23 o 11.08000 0.4213000 11.08000 0.5651000 11.07000 0.6250000 0.6335000E-02  0.8426000 
1 1 1 35 8  25 o 5.760000 0.7913000 5.561000 1.071000  5.959000 1.165000  -0.3975000     1.583000  
1 1 1 35 8  27 o 9.388000 0.4791000 9.025000 0.7252000 9.752000 0.6265000 -0.7262000     0.9583000 
1 1 1 35 8  29 o 21.63000 0.3354000 21.59000 0.5109000 21.68000 0.4348000 -0.8404000E-01 0.6709000 
1 1 1 35 8  31 o 5.717000 0.8809000 5.524000 1.237000  5.911000 1.255000  -0.3867000     1.762000  
1 1 1 35 8  33 o 9.967000 0.5057000 10.18000 0.6390000 9.759000 0.7840000 0.4171000      1.011000  
1 1 1 35 8  35 o 25.13000 0.3551000 25.22000 0.4810000 25.03000 0.5224000 0.1939000      0.7101000 
1 1 1 35 8  37 o 11.96000 0.5358000 11.52000 0.6852000 12.40000 0.8240000 -0.8834000     1.072000  
1 1 1 35 8  39 o 3.969000 0.9664000 4.463000 1.294000  3.475000 1.436000  0.9877000      1.933000  
1 1 1 35 8  41 o 6.950000 0.7606000 5.902000 1.130000  7.998000 1.018000  -2.097000      1.521000  
1 1 1 35 8  43 o 4.660000 0.9514000 4.880000 1.336000  4.440000 1.355000  0.4408000      1.903000  
1 1 1 35 9  0  o 26.53000 0.4154000 26.53000 0.4154000 26.53000 0.4154000 0.000000       0.000000  
1 1 1 35 9  2  o 18.92000 0.3045000 19.22000 0.4407000 18.63000 0.4202000 0.5857000      0.6089000 
1 1 1 35 9  4  o 6.692000 0.6108000 6.476000 0.9115000 6.909000 0.8133000 -0.4338000     1.222000  
1 1 1 35 9  6  o 7.619000 0.5069000 7.833000 0.6863000 7.406000 0.7461000 0.4273000      1.014000  
1 1 1 35 9  8  o 6.080000 0.7931000 6.625000 0.8581000 5.535000 1.334000  1.090000       1.586000  
1 1 1 35 9  10 o 17.88000 0.3230000 18.15000 0.4379000 17.60000 0.4749000 0.5483000      0.6460000 
1 1 1 35 9  12 o 24.64000 0.3453000 24.62000 0.4959000 24.65000 0.4807000 -0.3434000E-01 0.6906000 
1 1 1 35 9  14 o 17.62000 0.3885000 17.69000 0.6447000 17.55000 0.4338000 0.1360000      0.7771000 
1 1 1 35 9  16 o 10.42000 0.4108000 10.80000 0.5554000 10.04000 0.6054000 0.7519000      0.8216000 
1 1 1 35 9  18 o 15.39000 0.3306000 14.79000 0.4710000 15.98000 0.4640000 -1.192000      0.6611000 
1 1 1 35 9  20 o 18.63000 0.3750000 18.75000 0.4258000 18.51000 0.6175000 0.2404000      0.7501000 
1 1 1 35 9  22 o 3.234000 0.8420000 3.352000 1.155000  3.115000 1.226000  0.2374000      1.684000  
1 1 1 35 9  24 o 16.45000 0.3497000 16.55000 0.5040000 16.36000 0.4850000 0.1826000      0.6995000 
1 1 1 35 9  26 o 5.174000 0.8630000 4.857000 1.222000  5.491000 1.219000  -0.6339000     1.726000  
1 1 1 35 9  28 o 6.453000 0.6795000 6.301000 0.9923000 6.604000 0.9286000 -0.3031000     1.359000  
1 1 1 35 9  30 o 4.335000 0.9261000 3.434000 1.310000  5.235000 1.310000  -1.801000      1.852000  
1 1 1 35 9  32 o 9.626000 0.5041000 9.523000 0.7485000 9.730000 0.6754000 -0.2068000     1.008000  
1 1 1 35 9  34 o 13.02000 0.4713000 11.92000 0.5622000 14.11000 0.7567000 -2.182000      0.9427000 
1 1 1 35 9  36 o 7.433000 0.7755000 7.392000 0.9905000 7.473000 1.194000  -0.8109000E-01 1.551000  
1 1 1 35 9  38 o 4.032000 0.9070000 4.768000 1.239000  3.296000 1.325000  1.472000       1.814000  
1 1 1 35 9  40 o 7.459000 0.7147000 7.190000 0.9006000 7.727000 1.110000  -0.5371000     1.429000  
1 1 1 35 9  42 o 3.836000 1.003000  4.930000 1.554000  2.741000 1.269000  2.189000       2.007000  
1 1 1 35 9  44 o 7.376000 0.6975000 7.978000 0.8942000 6.775000 1.071000  1.203000       1.395000  
1 1 1 35 10 1  o 15.57000 0.3300000 15.38000 0.4855000 15.76000 0.4471000 -0.3775000     0.6600000 
1 1 1 35 10 3  o 7.425000 0.5579000 7.090000 0.8348000 7.761000 0.7404000 -0.6708000     1.116000  
1 1 1 35 10 5  f 13.24000 0.3527000 13.23000 0.4839000 13.24000 0.5132000 -0.1329000E-01 0.7053000 
1 1 1 35 10 7  o 11.92000 0.3862000 11.46000 0.5331000 12.39000 0.5589000 -0.9290000     0.7723000 
1 1 1 35 10 9  o 17.44000 0.3627000 17.76000 0.4476000 17.11000 0.5709000 0.6423000      0.7254000 
1 1 1 35 10 11 o 9.101000 0.5986000 9.228000 0.8398000 8.973000 0.8532000 0.2554000      1.197000  
1 1 1 35 10 13 o 13.69000 0.4257000 14.33000 0.6797000 13.05000 0.5128000 1.278000       0.8514000 
1 1 1 35 10 15 o 4.286000 0.8526000 4.611000 1.158000  3.961000 1.252000  0.6499000      1.705000  
1 1 1 35 10 17 o 8.456000 0.4859000 7.840000 0.7193000 9.072000 0.6533000 -1.232000      0.9717000 
1 1 1 35 10 19 o 13.52000 0.4508000 13.74000 0.5082000 13.31000 0.7447000 0.4301000      0.9016000 
1 1 1 35 10 21 o 16.88000 0.3634000 16.55000 0.4414000 17.21000 0.5773000 -0.6576000     0.7267000 
1 1 1 35 10 23 o 13.00000 0.3598000 13.26000 0.4861000 12.74000 0.5305000 0.5199000      0.7196000 
1 1 1 35 10 25 o 6.524000 0.6399000 6.422000 0.8804000 6.626000 0.9289000 -0.2032000     1.280000  
1 1 1 35 10 27 o 8.893000 0.4579000 9.061000 0.6841000 8.726000 0.6087000 0.3347000      0.9157000 
1 1 1 35 10 29 o 11.01000 0.5027000 11.44000 0.7101000 10.59000 0.7118000 0.8554000      1.005000  
1 1 1 35 10 31 o 7.370000 0.6627000 6.845000 1.015000  7.894000 0.8518000 -1.049000      1.325000  
1 1 1 35 10 33 o 10.64000 0.5347000 10.55000 0.7963000 10.73000 0.7139000 -0.1758000     1.069000  
1 1 1 35 10 35 o 15.02000 0.4510000 14.80000 0.5171000 15.24000 0.7391000 -0.4370000     0.9020000 
1 1 1 35 10 37 f 13.09000 0.4332000 12.95000 0.5310000 13.24000 0.6847000 -0.2902000     0.8664000 
1 1 1 35 10 39 o 8.878000 0.6730000 7.825000 0.9422000 9.931000 0.9611000 -2.105000      1.346000  
1 1 1 35 10 41 o 9.219000 0.6071000 9.356000 0.7423000 9.081000 0.9608000 0.2749000      1.214000  
1 1 1 35 10 43 o 6.494000 0.8669000 7.031000 1.286000  5.958000 1.163000  1.072000       1.734000  
1 1 1 35 11 0  o 27.93000 0.4137000 27.93000 0.4137000 27.93000 0.4137000 0.000000       0.000000  
1 1 1 35 11 2  o 29.85000 0.3032000 29.95000 0.4312000 29.76000 0.4264000 0.1949000      0.6064000 
1 1 1 35 11 4  o 15.31000 0.3200000 15.24000 0.4544000 15.38000 0.4506000 -0.1337000     0.6400000 
1 1 1 35 11 6  o 4.978000 0.7387000 5.388000 0.9778000 4.568000 1.107000  0.8200000      1.477000  
1 1 1 35 11 8  o 14.94000 0.3430000 15.34000 0.4522000 14.53000 0.5160000 0.8076000      0.6861000 
1 1 1 35 11 10 o 15.46000 0.4033000 15.80000 0.5353000 15.12000 0.6035000 0.6779000      0.8067000 
1 1 1 35 11 12 o 31.87000 0.3395000 32.03000 0.5053000 31.72000 0.4536000 0.3070000      0.6790000 
1 1 1 35 11 14 o 10.29000 0.4361000 10.07000 0.6499000 10.51000 0.5817000 -0.4421000     0.8722000 
1 1 1 35 11 16 o 11.62000 0.3746000 11.29000 0.5302000 11.95000 0.5293000 -0.6663000     0.7492000 
1 1 1 35 11 18 o 6.348000 0.6408000 5.853000 0.8748000 6.843000 0.9365000 -0.9905000     1.282000  
1 1 1 35 11 20 f 16.39000 0.4384000 17.20000 0.5286000 15.59000 0.6995000 1.607000       0.8768000 
1 1 1 35 11 22 o 2.989000 0.7841000 1.933000 0.9228000 4.046000 1.268000  -2.112000      1.568000  
1 1 1 35 11 24 o 14.40000 0.3526000 14.26000 0.4848000 14.54000 0.5122000 -0.2847000     0.7053000 
1 1 1 35 11 26 o 9.750000 0.5360000 9.143000 0.6795000 10.36000 0.8292000 -1.214000      1.072000  
1 1 1 35 11 28 f 14.91000 0.3797000 14.75000 0.5169000 15.07000 0.5562000 -0.3179000     0.7593000 
1 1 1 35 11 30 o 13.01000 0.4016000 13.24000 0.6123000 12.79000 0.5198000 0.4426000      0.8032000 
1 1 1 35 11 32 o 17.42000 0.4074000 17.86000 0.5795000 16.98000 0.5727000 0.8861000      0.8147000 
1 1 1 35 11 34 o 12.44000 0.4553000 12.06000 0.5423000 12.82000 0.7314000 -0.7638000     0.9105000 
1 1 1 35 11 36 o 16.08000 0.3918000 16.21000 0.4693000 15.96000 0.6276000 0.2534000      0.7837000 
1 1 1 35 11 38 o 7.743000 0.6564000 7.556000 0.8295000 7.930000 1.018000  -0.3737000     1.313000  
1 1 1 35 11 40 o 4.671000 0.9919000 5.015000 1.328000  4.326000 1.474000  0.6889000      1.984000  
1 1 1 35 11 42 o 3.749000 0.9896000 3.773000 1.283000  3.725000 1.507000  0.4773000E-01  1.979000  
1 1 1 35 11 44 o 3.340000 1.535000  ?        ?         3.340000 1.535000  ?              ?         
1 1 1 35 12 1  o 17.53000 0.3087000 17.34000 0.4454000 17.72000 0.4276000 -0.3798000     0.6175000 
1 1 1 35 12 3  o 4.648000 0.8446000 4.154000 1.251000  5.142000 1.135000  -0.9879000     1.689000  
1 1 1 35 12 5  o 9.812000 0.4215000 10.26000 0.5485000 9.369000 0.6401000 0.8864000      0.8430000 
1 1 1 35 12 7  f 24.09000 0.3526000 24.14000 0.5108000 24.05000 0.4862000 0.8677000E-01  0.7052000 
1 1 1 35 12 9  o 15.88000 0.3645000 15.91000 0.5106000 15.85000 0.5202000 0.5747000E-01  0.7289000 
1 1 1 35 12 11 o 5.766000 0.9468000 5.359000 1.150000  6.174000 1.504000  -0.8150000     1.894000  
1 1 1 35 12 13 o 3.790000 0.7964000 4.940000 1.080000  2.641000 1.171000  2.299000       1.593000  
1 1 1 35 12 15 o 10.73000 0.4466000 11.59000 0.5863000 9.869000 0.6740000 1.725000       0.8933000 
1 1 1 35 12 17 o 17.76000 0.3820000 17.62000 0.4341000 17.91000 0.6287000 -0.2862000     0.7640000 
1 1 1 35 12 19 o 6.647000 0.6632000 6.925000 0.7943000 6.368000 1.062000  0.5561000      1.326000  
1 1 1 35 12 21 o 5.900000 0.8035000 6.194000 0.8102000 5.605000 1.388000  0.5894000      1.607000  
1 1 1 35 12 23 o 8.408000 0.5389000 8.714000 0.6344000 8.103000 0.8712000 0.6113000      1.078000  
1 1 1 35 12 25 o 4.709000 0.8658000 4.247000 1.167000  5.170000 1.279000  -0.9230000     1.732000  
1 1 1 35 12 27 o 4.652000 0.8593000 5.152000 1.248000  4.153000 1.182000  0.9985000      1.719000  
1 1 1 35 12 29 o 4.460000 0.8393000 3.606000 1.283000  5.314000 1.083000  -1.707000      1.679000  
1 1 1 35 12 31 o 3.142000 0.9094000 3.354000 1.295000  2.930000 1.277000  0.4246000      1.819000  
1 1 1 35 12 33 o 7.491000 0.6368000 8.122000 0.7497000 6.860000 1.030000  1.261000       1.274000  
1 1 1 35 12 35 f 12.60000 0.4263000 12.16000 0.5573000 13.04000 0.6453000 -0.8824000     0.8526000 
1 1 1 35 12 37 o 10.46000 0.4992000 10.68000 0.5488000 10.23000 0.8339000 0.4587000      0.9983000 
1 1 1 35 12 39 o 4.488000 0.9967000 3.677000 1.270000  5.300000 1.536000  -1.623000      1.993000  
1 1 1 35 12 41 o 5.493000 1.003000  5.051000 1.438000  5.934000 1.398000  -0.8829000     2.005000  
1 1 1 35 12 43 o 4.343000 0.9866000 3.579000 1.252000  5.108000 1.525000  -1.529000      1.973000  
1 1 1 35 13 0  o 6.041000 0.9291000 6.041000 0.9291000 6.041000 0.9291000 0.000000       0.000000  
1 1 1 35 13 2  o 14.98000 0.3309000 14.72000 0.4844000 15.24000 0.4509000 -0.5229000     0.6618000 
1 1 1 35 13 4  o 4.478000 0.8789000 5.324000 1.188000  3.633000 1.296000  1.691000       1.758000  
1 1 1 35 13 6  o 19.21000 0.3223000 19.17000 0.4903000 19.25000 0.4183000 -0.7428000E-01 0.6445000 
1 1 1 35 13 8  f 7.215000 0.6138000 6.595000 0.9522000 7.834000 0.7748000 -1.239000      1.228000  
1 1 1 35 13 10 f 14.60000 0.3644000 14.71000 0.4523000 14.49000 0.5714000 0.2144000      0.7287000 
1 1 1 35 13 12 o 6.211000 0.6451000 6.207000 0.8172000 6.215000 0.9985000 -0.7600000E-02 1.290000  
1 1 1 35 13 14 o 7.104000 0.5710000 6.783000 0.7553000 7.425000 0.8566000 -0.6426000     1.142000  
1 1 1 35 13 16 o 8.493000 0.4716000 8.630000 0.6770000 8.357000 0.6568000 0.2730000      0.9433000 
1 1 1 35 13 18 o 19.35000 0.3448000 19.02000 0.4330000 19.68000 0.5367000 -0.6659000     0.6896000 
1 1 1 35 13 20 o 3.328000 0.7858000 4.242000 1.145000  2.414000 1.076000  1.828000       1.572000  
1 1 1 35 13 22 o 7.670000 0.7686000 8.183000 0.7139000 7.156000 1.361000  1.028000       1.537000  
1 1 1 35 13 24 o 14.19000 0.4865000 13.91000 0.6039000 14.47000 0.7628000 -0.5613000     0.9730000 
1 1 1 35 13 26 o 10.58000 0.4266000 10.21000 0.6263000 10.96000 0.5793000 -0.7531000     0.8532000 
1 1 1 35 13 28 o 10.08000 0.4625000 9.750000 0.7151000 10.41000 0.5867000 -0.6598000     0.9250000 
1 1 1 35 13 30 o 13.47000 0.3963000 13.07000 0.5311000 13.88000 0.5885000 -0.8151000     0.7927000 
1 1 1 35 13 32 o 15.96000 0.3633000 15.44000 0.4484000 16.49000 0.5717000 -1.055000      0.7266000 
1 1 1 35 13 34 o 4.212000 1.009000  3.933000 1.260000  4.491000 1.577000  -0.5580000     2.018000  
1 1 1 35 13 36 o 7.070000 0.6841000 6.135000 0.9670000 8.006000 0.9679000 -1.871000      1.368000  
1 1 1 35 13 38 o 8.323000 0.6438000 8.653000 0.6819000 7.994000 1.092000  0.6585000      1.288000  
1 1 1 35 13 40 o 4.236000 0.9642000 3.761000 1.186000  4.711000 1.520000  -0.9506000     1.928000  
1 1 1 35 13 42 o 3.111000 0.9215000 2.521000 1.087000  3.700000 1.489000  -1.179000      1.843000  
1 1 1 35 14 1  o 16.96000 0.3460000 17.02000 0.4580000 16.90000 0.5188000 0.1269000      0.6920000 
1 1 1 35 14 3  o 21.67000 0.3013000 21.42000 0.4370000 21.92000 0.4150000 -0.4951000     0.6026000 
1 1 1 35 14 5  o 10.36000 0.4729000 10.69000 0.6439000 10.03000 0.6928000 0.6603000      0.9458000 
1 1 1 35 14 7  o 16.07000 0.3598000 16.07000 0.4921000 16.06000 0.5252000 0.3481000E-02  0.7197000 
1 1 1 35 14 9  o 7.361000 0.5563000 7.299000 0.7139000 7.423000 0.8534000 -0.1236000     1.113000  
1 1 1 35 14 11 o 20.30000 0.3359000 20.02000 0.4024000 20.58000 0.5380000 -0.5550000     0.6718000 
1 1 1 35 14 13 o 9.418000 0.4524000 9.115000 0.6167000 9.720000 0.6622000 -0.6051000     0.9049000 
1 1 1 35 14 15 o 27.47000 0.3331000 27.19000 0.4707000 27.74000 0.4714000 -0.5458000     0.6662000 
1 1 1 35 14 17 f 4.356000 0.8703000 4.079000 1.190000  4.632000 1.271000  -0.5532000     1.741000  
1 1 1 35 14 19 o 9.819000 0.4516000 10.01000 0.5711000 9.632000 0.6998000 0.3749000      0.9033000 
1 1 1 35 14 21 o 11.72000 0.4287000 11.54000 0.5866000 11.90000 0.6253000 -0.3601000     0.8574000 
1 1 1 35 14 23 o 15.47000 0.3362000 15.90000 0.4541000 15.04000 0.4959000 0.8536000      0.6724000 
1 1 1 35 14 25 o 5.430000 0.7448000 6.359000 0.8703000 4.501000 1.209000  1.858000       1.490000  
1 1 1 35 14 27 o 3.053000 0.9193000 2.550000 1.143000  3.557000 1.440000  -1.007000      1.839000  
1 1 1 35 14 29 o 10.08000 0.4731000 10.05000 0.5962000 10.11000 0.7348000 -0.5489000E-01 0.9463000 
1 1 1 35 14 31 o 5.883000 0.7399000 5.111000 1.007000  6.654000 1.085000  -1.544000      1.480000  
1 1 1 35 14 33 o 8.220000 0.5918000 7.776000 0.6948000 8.663000 0.9582000 -0.8876000     1.184000  
1 1 1 35 14 35 o 4.866000 0.8877000 4.988000 1.126000  4.745000 1.373000  0.2437000      1.775000  
1 1 1 35 14 37 o 4.504000 0.9338000 3.859000 1.251000  5.148000 1.387000  -1.289000      1.868000  
1 1 1 35 14 39 o 5.683000 0.7860000 5.957000 0.9496000 5.408000 1.253000  0.5496000      1.572000  
1 1 1 35 14 41 o 8.501000 0.6190000 8.052000 0.7994000 8.949000 0.9453000 -0.8974000     1.238000  
1 1 1 35 15 0  o 3.733000 1.436000  3.733000 1.436000  3.733000 1.436000  0.000000       0.000000  
1 1 1 35 15 2  o 20.45000 0.3310000 20.39000 0.5095000 20.51000 0.4227000 -0.1288000     0.6620000 
1 1 1 35 15 4  o 18.80000 0.3424000 18.71000 0.4673000 18.89000 0.5007000 -0.1794000     0.6849000 
1 1 1 35 15 6  o 27.15000 0.3245000 27.22000 0.4209000 27.07000 0.4940000 0.1486000      0.6490000 
1 1 1 35 15 8  f 13.60000 0.3490000 13.42000 0.4666000 13.78000 0.5191000 -0.3651000     0.6980000 
1 1 1 35 15 10 o 15.92000 0.3321000 16.30000 0.4297000 15.53000 0.5066000 0.7674000      0.6643000 
1 1 1 35 15 12 o 15.90000 0.4578000 16.39000 0.4535000 15.42000 0.7953000 0.9710000      0.9155000 
1 1 1 35 15 14 o 11.31000 0.4848000 11.89000 0.6626000 10.72000 0.7080000 1.178000       0.9697000 
1 1 1 35 15 16 o 9.392000 0.5861000 9.903000 0.9263000 8.880000 0.7182000 1.023000       1.172000  
1 1 1 35 15 18 o 5.247000 0.9715000 5.338000 1.530000  5.156000 1.198000  0.1826000      1.943000  
1 1 1 35 15 20 o 5.307000 0.8092000 4.655000 1.334000  5.958000 0.9163000 -1.303000      1.618000  
1 1 1 35 15 22 o 6.712000 0.7408000 6.587000 1.206000  6.836000 0.8607000 -0.2496000     1.482000  
1 1 1 35 15 24 o 10.91000 0.4400000 11.34000 0.6344000 10.48000 0.6100000 0.8607000      0.8801000 
1 1 1 35 15 26 o 5.018000 0.7465000 5.452000 0.9897000 4.584000 1.118000  0.8682000      1.493000  
1 1 1 35 15 28 o 6.526000 0.6560000 6.196000 0.8574000 6.857000 0.9931000 -0.6609000     1.312000  
1 1 1 35 15 30 o 6.519000 0.8094000 6.049000 1.300000  6.990000 0.9652000 -0.9410000     1.619000  
1 1 1 35 15 32 o 9.602000 0.5441000 9.567000 0.5612000 9.638000 0.9323000 -0.7105000E-01 1.088000  
1 1 1 35 15 34 o 8.346000 0.5360000 7.965000 0.6315000 8.728000 0.8662000 -0.7633000     1.072000  
1 1 1 35 15 36 o 7.384000 0.6279000 6.975000 0.8019000 7.794000 0.9665000 -0.8190000     1.256000  
1 1 1 35 15 38 o 5.119000 0.9260000 4.525000 1.200000  5.713000 1.410000  -1.188000      1.852000  
1 1 1 35 15 40 o 3.915000 0.9981000 3.552000 1.232000  4.279000 1.571000  -0.7267000     1.996000  
1 1 1 35 15 42 o 7.858000 0.8591000 7.237000 0.8215000 8.480000 1.509000  -1.243000      1.718000  
1 1 1 35 16 1  o 4.001000 0.9513000 4.059000 1.353000  3.943000 1.338000  0.1158000      1.903000  
1 1 1 35 16 3  o 22.41000 0.5420000 22.57000 0.4701000 22.25000 0.9768000 0.3225000      1.084000  
1 1 1 35 16 5  o 15.87000 0.3413000 16.17000 0.4280000 15.57000 0.5317000 0.5988000      0.6826000 
1 1 1 35 16 7  o 24.35000 0.3611000 24.85000 0.4100000 23.86000 0.5946000 0.9996000      0.7223000 
1 1 1 35 16 9  o 3.443000 0.9410000 3.516000 1.318000  3.370000 1.344000  0.1467000      1.882000  
1 1 1 35 16 11 o 5.351000 0.9058000 6.070000 1.059000  4.632000 1.470000  1.438000       1.812000  
1 1 1 35 16 13 o 5.784000 0.8287000 5.676000 1.283000  5.891000 1.049000  -0.2156000     1.657000  
1 1 1 35 16 15 o 9.399000 0.4333000 8.781000 0.6402000 10.02000 0.5841000 -1.235000      0.8666000 
1 1 1 35 16 17 o 6.510000 0.6775000 6.256000 1.117000  6.764000 0.7673000 -0.5084000     1.355000  
1 1 1 35 16 19 o 16.30000 0.3281000 16.29000 0.4642000 16.32000 0.4638000 -0.3468000E-01 0.6562000 
1 1 1 35 16 21 o 14.40000 0.3478000 14.54000 0.5125000 14.26000 0.4704000 0.2760000      0.6957000 
1 1 1 35 16 23 o 4.053000 0.9984000 4.437000 1.570000  3.670000 1.234000  0.7666000      1.997000  
1 1 1 35 16 25 o 6.248000 0.7495000 5.962000 1.223000  6.534000 0.8666000 -0.5725000     1.499000  
1 1 1 35 16 27 o 7.341000 0.6226000 7.793000 0.6912000 6.889000 1.036000  0.9037000      1.245000  
1 1 1 35 16 29 o 8.301000 0.5780000 8.047000 0.7752000 8.556000 0.8575000 -0.5096000     1.156000  
1 1 1 35 16 31 o 6.341000 0.7424000 7.091000 0.7612000 5.590000 1.275000  1.500000       1.485000  
1 1 1 35 16 33 o 6.169000 0.7330000 5.758000 1.077000  6.581000 0.9948000 -0.8237000     1.466000  
1 1 1 35 16 35 o 6.266000 0.7126000 6.601000 0.7849000 5.930000 1.190000  0.6715000      1.425000  
1 1 1 35 16 37 o 2.825000 0.8452000 2.729000 1.098000  2.921000 1.285000  -0.1923000     1.690000  
1 1 1 35 16 39 o 8.836000 0.5720000 9.430000 0.6625000 8.243000 0.9327000 1.187000       1.144000  
1 1 1 35 16 41 o 3.032000 0.8798000 2.825000 1.125000  3.240000 1.353000  -0.4143000     1.760000  
1 1 1 35 17 0  o 8.331000 0.6900000 8.331000 0.6900000 8.331000 0.6900000 0.000000       0.000000  
1 1 1 35 17 2  o 15.97000 0.3515000 15.45000 0.4815000 16.48000 0.5124000 -1.026000      0.7031000 
1 1 1 35 17 4  o 11.74000 0.3750000 12.22000 0.5125000 11.25000 0.5477000 0.9730000      0.7501000 
1 1 1 35 17 6  o 4.267000 0.8931000 5.479000 1.210000  3.056000 1.314000  2.423000       1.786000  
1 1 1 35 17 8  o 5.543000 0.8350000 6.663000 1.023000  4.422000 1.320000  2.241000       1.670000  
1 1 1 35 17 10 o 11.88000 0.3712000 11.69000 0.5237000 12.06000 0.5262000 -0.3730000     0.7424000 
1 1 1 35 17 12 o 3.178000 0.8301000 3.491000 1.198000  2.866000 1.149000  0.6249000      1.660000  
1 1 1 35 17 14 o 13.27000 0.3672000 13.77000 0.5286000 12.76000 0.5098000 1.008000       0.7344000 
1 1 1 35 17 16 o 21.53000 0.3043000 21.78000 0.4276000 21.28000 0.4331000 0.4949000      0.6086000 
1 1 1 35 17 18 o 9.601000 0.4622000 9.536000 0.7061000 9.667000 0.5964000 -0.1311000     0.9243000 
1 1 1 35 17 20 f 4.820000 0.7784000 5.945000 1.001000  3.694000 1.192000  2.251000       1.557000  
1 1 1 35 17 22 o 6.094000 0.6634000 5.588000 1.016000  6.601000 0.8527000 -1.014000      1.327000  
1 1 1 35 17 24 o 5.115000 0.7704000 5.664000 1.008000  4.566000 1.166000  1.098000       1.541000  
1 1 1 35 17 26 o 13.00000 0.3765000 12.99000 0.4573000 13.00000 0.5981000 -0.8825000E-02 0.7529000 
1 1 1 35 17 28 o 8.366000 0.7181000 7.884000 0.9819000 8.847000 1.048000  -0.9632000     1.436000  
1 1 1 35 17 30 o 5.883000 0.7916000 6.001000 1.046000  5.765000 1.189000  0.2358000      1.583000  
1 1 1 35 17 32 o 14.93000 0.3926000 15.01000 0.4650000 14.86000 0.6326000 0.1510000      0.7852000 
1 1 1 35 17 34 o 10.76000 0.4750000 10.76000 0.5526000 10.76000 0.7727000 -0.4195000E-02 0.9500000 
1 1 1 35 17 36 o 3.875000 0.9402000 4.043000 1.291000  3.707000 1.367000  0.3360000      1.880000  
1 1 1 35 17 38 o 3.701000 1.013000  3.237000 1.171000  4.166000 1.654000  -0.9285000     2.027000  
1 1 1 35 17 40 o 3.143000 0.9678000 2.445000 1.072000  3.841000 1.611000  -1.395000      1.936000  
1 1 1 35 18 1  o 9.503000 0.4840000 9.091000 0.6750000 9.915000 0.6940000 -0.8244000     0.9681000 
1 1 1 35 18 3  o 24.05000 0.3017000 24.70000 0.4053000 23.41000 0.4471000 1.289000       0.6034000 
1 1 1 35 18 5  o 17.98000 0.3618000 18.69000 0.5413000 17.26000 0.4801000 1.429000       0.7235000 
1 1 1 35 18 7  o 13.98000 0.3967000 13.16000 0.6115000 14.80000 0.5055000 -1.640000      0.7934000 
1 1 1 35 18 9  o 8.969000 0.5315000 8.858000 0.7413000 9.081000 0.7620000 -0.2224000     1.063000  
1 1 1 35 18 11 o 3.190000 0.8599000 2.918000 1.184000  3.462000 1.247000  -0.5443000     1.720000  
1 1 1 35 18 13 o 13.68000 0.3907000 13.73000 0.5270000 13.63000 0.5769000 0.1028000      0.7814000 
1 1 1 35 18 15 o 3.304000 0.8741000 3.764000 1.306000  2.844000 1.162000  0.9199000      1.748000  
1 1 1 35 18 17 f 16.80000 0.3759000 17.54000 0.5699000 16.06000 0.4902000 1.482000       0.7517000 
1 1 1 35 18 19 o 3.211000 0.8068000 2.520000 1.086000  3.902000 1.193000  -1.382000      1.614000  
1 1 1 35 18 21 o 19.69000 0.2964000 20.01000 0.4118000 19.37000 0.4264000 0.6419000      0.5928000 
1 1 1 35 18 23 o 10.05000 0.4197000 10.46000 0.5627000 9.639000 0.6228000 0.8240000      0.8393000 
1 1 1 35 18 25 o 5.404000 0.7871000 4.782000 1.005000  6.025000 1.212000  -1.242000      1.574000  
1 1 1 35 18 27 o 6.403000 0.6501000 6.305000 0.8550000 6.501000 0.9794000 -0.1966000     1.300000  
1 1 1 35 18 29 o 9.578000 0.4678000 8.946000 0.5954000 10.21000 0.7216000 -1.264000      0.9355000 
1 1 1 35 18 31 o 8.042000 0.6573000 7.571000 0.8605000 8.513000 0.9938000 -0.9419000     1.315000  
1 1 1 35 18 33 o 3.454000 0.8856000 3.666000 1.183000  3.243000 1.318000  0.4231000      1.771000  
1 1 1 35 18 35 o 4.318000 0.9593000 3.920000 1.242000  4.716000 1.462000  -0.7967000     1.919000  
1 1 1 35 18 37 o 7.158000 0.8412000 6.634000 1.002000  7.681000 1.351000  -1.047000      1.682000  
1 1 1 35 18 39 f 4.611000 0.9057000 3.901000 1.196000  5.320000 1.360000  -1.420000      1.811000  
1 1 1 35 18 41 o 3.645000 1.044000  3.946000 1.538000  3.345000 1.411000  0.6010000      2.087000  
1 1 1 35 19 0  o 7.973000 0.8654000 7.973000 0.8654000 7.973000 0.8654000 0.000000       0.000000  
1 1 1 35 19 2  o 13.49000 0.3710000 13.10000 0.5548000 13.88000 0.4927000 -0.7860000     0.7420000 
1 1 1 35 19 4  o 17.68000 0.3570000 18.06000 0.5729000 17.30000 0.4260000 0.7584000      0.7139000 
1 1 1 35 19 6  o 12.81000 0.3504000 12.42000 0.5311000 13.21000 0.4573000 -0.7813000     0.7009000 
1 1 1 35 19 8  o 3.275000 0.8873000 3.272000 1.254000  3.277000 1.256000  -0.4171000E-02 1.775000  
1 1 1 35 19 10 o 14.16000 0.3436000 14.74000 0.4756000 13.58000 0.4961000 1.152000       0.6873000 
1 1 1 35 19 12 o 8.047000 0.5714000 7.933000 0.8211000 8.161000 0.7948000 -0.2279000     1.143000  
1 1 1 35 19 14 o 3.813000 0.9279000 4.055000 1.317000  3.571000 1.308000  0.4840000      1.856000  
1 1 1 35 19 16 o 6.741000 0.5903000 6.526000 0.8361000 6.955000 0.8335000 -0.4295000     1.181000  
1 1 1 35 19 18 o 18.25000 0.3566000 18.24000 0.4787000 18.27000 0.5287000 -0.2974000E-01 0.7132000 
1 1 1 35 19 20 o 12.54000 0.3589000 12.40000 0.4855000 12.67000 0.5287000 -0.2669000     0.7178000 
1 1 1 35 19 22 o 12.87000 0.3502000 12.73000 0.4919000 13.00000 0.4985000 -0.2656000     0.7004000 
1 1 1 35 19 24 o 12.60000 0.4196000 12.49000 0.4622000 12.72000 0.7004000 -0.2303000     0.8392000 
1 1 1 35 19 26 o 6.833000 0.6226000 6.558000 0.8025000 7.109000 0.9520000 -0.5515000     1.245000  
1 1 1 35 19 28 o 3.095000 0.8834000 2.206000 0.9882000 3.984000 1.465000  -1.778000      1.767000  
1 1 1 35 19 30 o 4.950000 0.8614000 5.221000 0.9448000 4.679000 1.441000  0.5417000      1.723000  
1 1 1 35 19 32 o 6.890000 0.6711000 6.848000 0.7388000 6.933000 1.121000  -0.8480000E-01 1.342000  
1 1 1 35 19 34 o 7.877000 0.6718000 6.882000 0.9551000 8.872000 0.9450000 -1.990000      1.344000  
1 1 1 35 19 36 o 4.711000 0.9932000 5.059000 1.041000  4.364000 1.691000  0.6955000      1.986000  
1 1 1 35 19 38 o 8.301000 0.6111000 6.581000 0.8742000 10.02000 0.8542000 -3.441000      1.222000  
1 1 1 35 19 40 o 4.261000 1.045000  2.915000 1.212000  5.606000 1.703000  -2.691000      2.090000  
1 1 1 35 20 1  o 9.015000 0.5009000 8.548000 0.7737000 9.482000 0.6364000 -0.9335000     1.002000  
1 1 1 35 20 3  o 10.11000 0.4818000 10.47000 0.7592000 9.748000 0.5934000 0.7256000      0.9636000 
1 1 1 35 20 5  o 7.448000 0.5128000 7.237000 0.7719000 7.659000 0.6752000 -0.4220000     1.026000  
1 1 1 35 20 7  o 12.43000 0.3803000 11.97000 0.5804000 12.89000 0.4916000 -0.9233000     0.7606000 
1 1 1 35 20 9  o 17.58000 0.3028000 17.65000 0.4309000 17.50000 0.4255000 0.1463000      0.6056000 
1 1 1 35 20 11 o 2.489000 0.7685000 2.510000 1.104000  2.468000 1.069000  0.4179000E-01  1.537000  
1 1 1 35 20 13 o 9.638000 0.4296000 9.991000 0.6038000 9.284000 0.6113000 0.7071000      0.8593000 
1 1 1 35 20 15 f 10.20000 0.4658000 11.14000 0.5454000 9.267000 0.7552000 1.875000       0.9316000 
1 1 1 35 20 17 o 7.716000 0.6012000 7.806000 0.7330000 7.626000 0.9531000 0.1792000      1.202000  
1 1 1 35 20 19 o 11.28000 0.3735000 11.79000 0.5012000 10.77000 0.5538000 1.015000       0.7469000 
1 1 1 35 20 21 o 9.171000 0.4393000 9.881000 0.5598000 8.461000 0.6771000 1.421000       0.8785000 
1 1 1 35 20 23 o 14.47000 0.3657000 14.75000 0.3990000 14.20000 0.6129000 0.5451000      0.7313000 
1 1 1 35 20 25 f 24.81000 0.3477000 25.34000 0.4470000 24.28000 0.5326000 1.057000       0.6953000 
1 1 1 35 20 27 o 13.74000 0.3632000 13.43000 0.4459000 14.05000 0.5734000 -0.6221000     0.7263000 
1 1 1 35 20 29 o 4.000000 0.9368000 3.461000 1.102000  4.540000 1.515000  -1.079000      1.874000  
1 1 1 35 20 31 o 4.962000 0.8625000 4.164000 1.148000  5.760000 1.288000  -1.596000      1.725000  
1 1 1 35 20 33 o 3.960000 0.8122000 4.853000 0.9819000 3.067000 1.294000  1.786000       1.624000  
1 1 1 35 20 35 o 5.124000 0.9920000 4.488000 1.134000  5.760000 1.628000  -1.272000      1.984000  
1 1 1 35 20 37 o 7.966000 0.6584000 7.567000 0.8239000 8.365000 1.027000  -0.7981000     1.317000  
1 1 1 35 20 39 o 3.811000 0.9936000 3.502000 1.315000  4.119000 1.490000  -0.6169000     1.987000  
1 1 1 35 21 0  o 5.310000 1.153000  5.310000 1.153000  5.310000 1.153000  0.000000       0.000000  
1 1 1 35 21 2  o 6.958000 0.8488000 6.771000 1.507000  7.145000 0.7822000 -0.3748000     1.698000  
1 1 1 35 21 4  o 9.958000 0.4503000 9.990000 0.6633000 9.926000 0.6092000 0.6369000E-01  0.9006000 
1 1 1 35 21 6  o 5.099000 0.7219000 4.892000 1.046000  5.306000 0.9957000 -0.4139000     1.444000  
1 1 1 35 21 8  o 3.032000 0.8311000 3.245000 1.211000  2.818000 1.138000  0.4269000      1.662000  
1 1 1 35 21 10 o 6.910000 0.5264000 6.998000 0.7678000 6.821000 0.7203000 0.1770000      1.053000  
1 1 1 35 21 12 o 7.897000 0.4708000 8.231000 0.6494000 7.563000 0.6819000 0.6686000      0.9417000 
1 1 1 35 21 14 o 13.17000 0.3446000 13.87000 0.4418000 12.48000 0.5290000 1.390000       0.6892000 
1 1 1 35 21 16 o 11.47000 0.3969000 11.21000 0.5130000 11.73000 0.6056000 -0.5134000     0.7937000 
1 1 1 35 21 18 o 8.881000 0.4750000 9.410000 0.6570000 8.351000 0.6863000 1.059000       0.9500000 
1 1 1 35 21 20 o 18.83000 0.3695000 18.92000 0.4635000 18.75000 0.5756000 0.1707000      0.7390000 
1 1 1 35 21 22 o 4.249000 0.8268000 4.963000 0.9507000 3.536000 1.353000  1.427000       1.654000  
1 1 1 35 21 24 o 6.779000 0.6342000 6.560000 0.7553000 6.999000 1.019000  -0.4386000     1.268000  
1 1 1 35 21 26 o 9.379000 0.4808000 9.151000 0.5460000 9.607000 0.7916000 -0.4560000     0.9616000 
1 1 1 35 21 28 o 4.405000 1.006000  4.355000 1.023000  4.455000 1.732000  -0.1001000     2.012000  
1 1 1 35 21 30 o 4.627000 0.7939000 5.726000 0.8545000 3.529000 1.338000  2.196000       1.588000  
1 1 1 35 21 32 o 6.832000 0.8436000 7.517000 0.8010000 6.147000 1.485000  1.370000       1.687000  
1 1 1 35 21 34 o 3.680000 0.9244000 4.069000 1.235000  3.290000 1.375000  0.7785000      1.849000  
1 1 1 35 21 36 o 5.165000 1.141000  4.925000 1.812000  5.405000 1.388000  -0.4798000     2.282000  
1 1 1 35 21 38 o 4.610000 1.012000  4.558000 1.423000  4.662000 1.440000  -0.1046000     2.024000  
1 1 1 35 22 1  o 4.342000 0.9919000 4.121000 1.609000  4.564000 1.160000  -0.4431000     1.984000  
1 1 1 35 22 3  o 13.08000 0.3740000 12.85000 0.5899000 13.32000 0.4600000 -0.4702000     0.7481000 
1 1 1 35 22 5  o 6.675000 0.5678000 6.455000 0.8550000 6.895000 0.7474000 -0.4394000     1.136000  
1 1 1 35 22 7  o 7.402000 0.5203000 7.531000 0.7004000 7.273000 0.7697000 0.2578000      1.041000  
1 1 1 35 22 9  f 16.09000 0.3063000 16.15000 0.4270000 16.03000 0.4392000 0.1190000      0.6125000 
1 1 1 35 22 11 o 10.01000 0.4059000 10.53000 0.5667000 9.487000 0.5813000 1.047000       0.8118000 
1 1 1 35 22 13 o 5.140000 0.7302000 4.438000 1.145000  5.842000 0.9066000 -1.404000      1.460000  
1 1 1 35 22 15 o 9.652000 0.5131000 9.952000 0.5609000 9.352000 0.8593000 0.5993000      1.026000  
1 1 1 35 22 17 o 6.189000 0.6515000 5.870000 0.9738000 6.508000 0.8657000 -0.6376000     1.303000  
1 1 1 35 22 19 o 9.228000 0.4572000 9.850000 0.6071000 8.605000 0.6837000 1.246000       0.9144000 
1 1 1 35 22 21 o 13.29000 0.4654000 14.02000 0.3947000 12.56000 0.8430000 1.466000       0.9308000 
1 1 1 35 22 23 o 14.64000 0.3805000 14.98000 0.4161000 14.30000 0.6372000 0.6723000      0.7610000 
1 1 1 35 22 25 o 8.226000 0.6773000 7.900000 0.6191000 8.552000 1.205000  -0.6516000     1.355000  
1 1 1 35 22 27 o 17.18000 0.3918000 17.23000 0.4259000 17.13000 0.6578000 0.9871000E-01  0.7836000 
1 1 1 35 22 29 o 8.648000 0.5692000 8.385000 0.7228000 8.911000 0.8796000 -0.5254000     1.138000  
1 1 1 35 22 31 o 5.725000 0.8830000 5.795000 1.026000  5.654000 1.437000  0.1417000      1.766000  
1 1 1 35 22 33 o 7.597000 0.7261000 8.354000 1.009000  6.841000 1.044000  1.513000       1.452000  
1 1 1 35 22 35 o 4.478000 1.157000  5.650000 1.869000  3.306000 1.364000  2.345000       2.314000  
1 1 1 35 22 37 o 8.220000 0.7063000 8.460000 0.9224000 7.979000 1.070000  0.4811000      1.413000  
1 1 1 35 23 0  o 8.826000 0.8610000 8.826000 0.8610000 8.826000 0.8610000 0.000000       0.000000  
1 1 1 35 23 2  o 9.799000 0.4193000 8.796000 0.6584000 10.80000 0.5194000 -2.006000      0.8386000 
1 1 1 35 23 4  o 12.00000 0.3975000 11.87000 0.6481000 12.13000 0.4606000 -0.2568000     0.7951000 
1 1 1 35 23 6  o 18.74000 0.2981000 18.46000 0.4198000 19.02000 0.4233000 -0.5610000     0.5962000 
1 1 1 35 23 8  o 3.116000 0.8242000 3.454000 1.197000  2.779000 1.134000  0.6750000      1.648000  
1 1 1 35 23 10 o 21.20000 0.2830000 21.63000 0.4011000 20.77000 0.3993000 0.8636000      0.5659000 
1 1 1 35 23 12 o 14.16000 0.3227000 14.34000 0.4577000 13.98000 0.4551000 0.3602000      0.6454000 
1 1 1 35 23 14 o 5.531000 0.7321000 5.533000 1.023000  5.529000 1.047000  0.3467000E-02  1.464000  
1 1 1 35 23 16 o 3.494000 0.9748000 2.468000 1.072000  4.520000 1.628000  -2.052000      1.950000  
1 1 1 35 23 18 o 11.42000 0.4830000 12.63000 0.5410000 10.21000 0.8003000 2.430000       0.9660000 
1 1 1 35 23 20 o 9.578000 0.5229000 9.183000 0.6060000 9.973000 0.8523000 -0.7894000     1.046000  
1 1 1 35 23 22 o 4.262000 0.9937000 4.113000 1.332000  4.411000 1.475000  -0.2971000     1.987000  
1 1 1 35 23 24 o 5.700000 0.7607000 4.252000 1.134000  7.148000 1.014000  -2.896000      1.521000  
1 1 1 35 23 26 o 20.27000 0.4098000 20.41000 0.4597000 20.13000 0.6785000 0.2821000      0.8196000 
1 1 1 35 23 28 o 7.222000 0.9166000 7.691000 1.011000  6.752000 1.529000  0.9390000      1.833000  
1 1 1 35 23 30 o 3.226000 0.9688000 3.147000 1.250000  3.305000 1.480000  -0.1586000     1.938000  
1 1 1 35 23 32 o 7.901000 0.8073000 7.561000 1.272000  8.242000 0.9947000 -0.6810000     1.615000  
1 1 1 35 23 34 o 9.865000 0.7732000 10.05000 1.288000  9.681000 0.8552000 0.3683000      1.546000  
1 1 1 35 23 36 o 8.424000 0.6942000 7.667000 1.043000  9.181000 0.9160000 -1.514000      1.388000  
1 1 1 35 23 38 o 3.583000 1.002000  3.458000 1.418000  3.708000 1.417000  -0.2503000     2.005000  
1 1 1 35 24 1  o 10.20000 0.4689000 10.20000 0.6291000 10.20000 0.6956000 -0.1335000E-04 0.9379000 
1 1 1 35 24 3  o 14.24000 0.3489000 14.11000 0.5170000 14.37000 0.4685000 -0.2645000     0.6977000 
1 1 1 35 24 5  o 2.431000 0.7542000 2.416000 1.100000  2.446000 1.032000  -0.2997000E-01 1.508000  
1 1 1 35 24 7  o 10.42000 0.4099000 9.591000 0.5406000 11.25000 0.6163000 -1.656000      0.8198000 
1 1 1 35 24 9  o 10.62000 0.3735000 11.18000 0.4992000 10.06000 0.5558000 1.124000       0.7471000 
1 1 1 35 24 11 o 17.24000 0.2978000 17.66000 0.4119000 16.83000 0.4301000 0.8345000      0.5955000 
1 1 1 35 24 13 o 12.92000 0.3792000 13.25000 0.4647000 12.59000 0.5994000 0.6610000      0.7585000 
1 1 1 35 24 15 o 4.088000 0.9229000 4.196000 1.437000  3.980000 1.158000  0.2163000      1.846000  
1 1 1 35 24 17 o 2.712000 0.8390000 2.819000 1.273000  2.606000 1.093000  0.2130000      1.678000  
1 1 1 35 24 19 o 8.438000 0.5984000 8.338000 0.6106000 8.537000 1.029000  -0.1996000     1.197000  
1 1 1 35 24 21 o 10.64000 0.5885000 11.53000 0.6009000 9.743000 1.012000  1.789000       1.177000  
1 1 1 35 24 23 o 6.546000 0.8164000 7.707000 0.7371000 5.386000 1.457000  2.321000       1.633000  
1 1 1 35 24 25 o 3.402000 0.9667000 3.125000 1.167000  3.678000 1.541000  -0.5528000     1.933000  
1 1 1 35 24 27 o 8.172000 0.8276000 7.612000 1.109000  8.733000 1.229000  -1.121000      1.655000  
1 1 1 35 24 29 o 7.876000 0.7464000 7.085000 1.162000  8.668000 0.9376000 -1.583000      1.493000  
1 1 1 35 24 31 o 4.200000 1.166000  5.312000 1.921000  3.088000 1.323000  2.224000       2.332000  
1 1 1 35 24 33 o 2.762000 0.8749000 2.556000 1.185000  2.968000 1.288000  -0.4121000     1.750000  
1 1 1 35 24 35 o 3.274000 0.9489000 3.933000 1.448000  2.615000 1.226000  1.318000       1.898000  
1 1 1 35 24 37 o 4.246000 1.111000  4.118000 1.567000  4.374000 1.574000  -0.2562000     2.221000  
1 1 1 35 25 0  o 2.739000 1.169000  2.739000 1.169000  2.739000 1.169000  0.000000       0.000000  
1 1 1 35 25 2  o 7.741000 0.5491000 7.404000 0.7296000 8.078000 0.8209000 -0.6735000     1.098000  
1 1 1 35 25 4  o 12.39000 0.3349000 12.81000 0.4673000 11.97000 0.4799000 0.8457000      0.6699000 
1 1 1 35 25 6  o 13.82000 0.3386000 13.74000 0.4742000 13.90000 0.4834000 -0.1545000     0.6772000 
1 1 1 35 25 8  o 11.85000 0.3371000 11.97000 0.4734000 11.73000 0.4801000 0.2384000      0.6742000 
1 1 1 35 25 10 o 5.351000 0.6855000 6.174000 0.8834000 4.528000 1.048000  1.646000       1.371000  
1 1 1 35 25 12 o 3.265000 0.8382000 4.599000 1.407000  1.930000 0.9122000 2.669000       1.676000  
1 1 1 35 25 14 o 3.125000 0.8641000 3.031000 1.315000  3.218000 1.122000  -0.1871000     1.728000  
1 1 1 35 25 16 o 4.045000 0.9296000 4.373000 1.390000  3.718000 1.234000  0.6547000      1.859000  
1 1 1 35 25 18 o 12.41000 0.5222000 13.44000 0.5297000 11.38000 0.9001000 2.063000       1.044000  
1 1 1 35 25 20 o 6.557000 0.7317000 6.163000 0.7824000 6.951000 1.237000  -0.7874000     1.463000  
1 1 1 35 25 22 o 2.772000 0.8031000 3.113000 1.099000  2.431000 1.171000  0.6824000      1.606000  
1 1 1 35 25 24 o 3.758000 0.9014000 3.900000 1.041000  3.616000 1.472000  0.2841000      1.803000  
1 1 1 35 25 26 o 6.022000 0.9850000 5.434000 1.349000  6.610000 1.436000  -1.175000      1.970000  
1 1 1 35 25 28 o 3.693000 0.9564000 2.938000 1.281000  4.448000 1.420000  -1.510000      1.913000  
1 1 1 35 25 30 o 3.728000 1.047000  3.858000 1.560000  3.599000 1.396000  0.2597000      2.094000  
1 1 1 35 25 32 o 3.288000 1.004000  3.569000 1.471000  3.007000 1.368000  0.5622000      2.009000  
1 1 1 35 25 34 o 5.913000 1.015000  5.931000 1.365000  5.895000 1.502000  0.3575000E-01  2.029000  
1 1 1 35 25 36 o 4.432000 1.076000  4.343000 1.516000  4.520000 1.527000  -0.1778000     2.152000  
1 1 1 35 26 1  o 3.340000 0.8516000 3.297000 1.240000  3.383000 1.167000  -0.8573000E-01 1.703000  
1 1 1 35 26 3  o 9.054000 0.4363000 8.881000 0.5643000 9.226000 0.6657000 -0.3450000     0.8727000 
1 1 1 35 26 5  f 8.034000 0.5085000 7.870000 0.8014000 8.198000 0.6261000 -0.3280000     1.017000  
1 1 1 35 26 7  o 3.371000 0.8510000 3.914000 1.231000  2.829000 1.175000  1.085000       1.702000  
1 1 1 35 26 9  o 3.388000 0.8631000 3.476000 1.162000  3.301000 1.277000  0.1751000      1.726000  
1 1 1 35 26 11 o 10.27000 0.4824000 9.850000 0.8189000 10.69000 0.5102000 -0.8391000     0.9648000 
1 1 1 35 26 13 f 5.015000 0.8484000 4.932000 1.400000  5.098000 0.9580000 -0.1665000     1.697000  
1 1 1 35 26 15 o 4.973000 0.9248000 4.908000 1.261000  5.039000 1.353000  -0.1310000     1.850000  
1 1 1 35 26 17 o 9.123000 0.5829000 9.917000 0.5607000 8.328000 1.022000  1.590000       1.166000  
1 1 1 35 26 19 o 4.068000 1.068000  3.895000 1.440000  4.241000 1.579000  -0.3466000     2.137000  
1 1 1 35 26 21 o 7.060000 0.8364000 9.384000 0.8392000 4.736000 1.447000  4.649000       1.673000  
1 1 1 35 26 23 o 7.538000 1.030000  9.335000 0.8776000 5.741000 1.863000  3.594000       2.059000  
1 1 1 35 26 25 o 10.25000 0.6861000 10.24000 1.037000  10.25000 0.8982000 -0.8734000E-02 1.372000  
1 1 1 35 26 27 o 15.32000 0.5000000 14.79000 0.7842000 15.85000 0.6205000 -1.054000      1.000000  
1 1 1 35 26 29 o 5.282000 1.189000  4.772000 1.758000  5.793000 1.602000  -1.021000      2.379000  
1 1 1 35 26 31 o 3.951000 1.064000  3.865000 1.525000  4.037000 1.485000  -0.1718000     2.128000  
1 1 1 35 26 33 o 5.587000 1.010000  5.556000 1.342000  5.618000 1.510000  -0.6187000E-01 2.020000  
1 1 1 35 26 35 o 7.165000 0.9127000 8.955000 1.059000  5.376000 1.487000  3.579000       1.825000  
1 1 1 35 27 0  o 3.922000 1.189000  3.922000 1.189000  3.922000 1.189000  0.000000       0.000000  
1 1 1 35 27 2  o 3.458000 0.7891000 2.962000 1.117000  3.954000 1.115000  -0.9918000     1.578000  
1 1 1 35 27 4  o 8.696000 0.4370000 8.662000 0.6073000 8.730000 0.6285000 -0.6780000E-01 0.8739000 
1 1 1 35 27 6  o 17.36000 0.3570000 17.91000 0.5422000 16.82000 0.4644000 1.089000       0.7139000 
1 1 1 35 27 8  o 16.44000 0.3920000 16.51000 0.5538000 16.36000 0.5549000 0.1502000      0.7840000 
1 1 1 35 27 10 o 7.834000 0.6574000 8.448000 1.061000  7.220000 0.7758000 1.227000       1.315000  
1 1 1 35 27 12 o 2.667000 0.7848000 2.393000 1.102000  2.941000 1.118000  -0.5483000     1.570000  
1 1 1 35 27 14 o 6.545000 0.6269000 7.517000 1.065000  5.574000 0.6619000 1.943000       1.254000  
1 1 1 35 27 16 o 7.388000 0.8635000 7.402000 1.153000  7.373000 1.286000  0.2902000E-01  1.727000  
1 1 1 35 27 18 o 6.833000 0.8786000 7.695000 0.9663000 5.971000 1.468000  1.724000       1.757000  
1 1 1 35 27 20 o 3.813000 1.093000  3.517000 1.344000  4.110000 1.724000  -0.5934000     2.186000  
1 1 1 35 27 22 o 11.34000 0.6273000 11.66000 0.6969000 11.01000 1.043000  0.6539000      1.255000  
1 1 1 35 27 24 o 6.871000 1.004000  9.172000 1.024000  4.571000 1.728000  4.601000       2.009000  
1 1 1 35 27 26 o 11.69000 0.6173000 10.99000 0.9741000 12.39000 0.7584000 -1.398000      1.235000  
1 1 1 35 27 28 o 3.381000 0.9723000 3.207000 1.360000  3.555000 1.390000  -0.3479000     1.945000  
1 1 1 35 27 30 o 3.937000 1.003000  3.673000 1.424000  4.201000 1.413000  -0.5280000     2.006000  
1 1 1 35 27 32 o 8.485000 0.6899000 9.196000 0.8562000 7.774000 1.082000  1.422000       1.380000  
1 1 1 35 27 34 o 3.293000 0.9227000 4.475000 1.526000  2.110000 1.037000  2.365000       1.845000  
1 1 1 35 28 1  o 4.770000 0.8033000 4.171000 1.294000  5.370000 0.9518000 -1.199000      1.607000  
1 1 1 35 28 3  o 9.147000 0.4811000 8.641000 0.7953000 9.653000 0.5415000 -1.012000      0.9621000 
1 1 1 35 28 5  f 16.14000 0.3271000 15.73000 0.4769000 16.54000 0.4477000 -0.8030000     0.6541000 
1 1 1 35 28 7  o 6.373000 0.8390000 6.529000 1.453000  6.217000 0.8395000 0.3119000      1.678000  
1 1 1 35 28 9  o 6.719000 0.6449000 6.779000 1.104000  6.660000 0.6674000 0.1181000      1.290000  
1 1 1 35 28 11 o 7.618000 0.6993000 7.999000 1.111000  7.237000 0.8492000 0.7622000      1.399000  
1 1 1 35 28 13 o 8.999000 0.5857000 8.981000 1.095000  9.017000 0.4168000 -0.3521000E-01 1.171000  
1 1 1 35 28 15 o 5.139000 0.9736000 5.001000 1.391000  5.278000 1.363000  -0.2775000     1.947000  
1 1 1 35 28 17 o 6.075000 1.107000  6.787000 1.163000  5.362000 1.884000  1.426000       2.214000  
1 1 1 35 28 19 o 4.958000 1.222000  4.680000 1.579000  5.237000 1.864000  -0.5573000     2.443000  
1 1 1 35 28 21 o 4.372000 0.9905000 5.403000 1.358000  3.341000 1.443000  2.062000       1.981000  
1 1 1 35 28 23 o 6.389000 1.057000  6.530000 1.604000  6.249000 1.377000  0.2806000      2.114000  
1 1 1 35 28 25 o 7.876000 0.9931000 9.670000 1.178000  6.082000 1.599000  3.588000       1.986000  
1 1 1 35 28 27 o 13.99000 0.5530000 13.81000 0.8819000 14.17000 0.6676000 -0.3680000     1.106000  
1 1 1 35 28 29 o 3.036000 0.9270000 2.896000 1.263000  3.176000 1.357000  -0.2792000     1.854000  
1 1 1 35 28 31 o 3.295000 0.9682000 3.761000 1.467000  2.829000 1.264000  0.9314000      1.936000  
1 1 1 35 28 33 o 3.549000 1.013000  3.150000 1.361000  3.948000 1.501000  -0.7983000     2.026000  
1 1 1 35 29 0  o 2.292000 1.029000  2.292000 1.029000  2.292000 1.029000  0.000000       0.000000  
1 1 1 35 29 2  o 4.744000 0.7512000 4.608000 1.080000  4.880000 1.045000  -0.2718000     1.502000  
1 1 1 35 29 4  o 3.347000 0.8202000 3.934000 1.168000  2.759000 1.151000  1.175000       1.640000  
1 1 1 35 29 6  o 3.998000 0.8356000 3.247000 1.265000  4.749000 1.092000  -1.502000      1.671000  
1 1 1 35 29 8  o 7.739000 0.6397000 7.508000 1.147000  7.970000 0.5672000 -0.4615000     1.279000  
1 1 1 35 29 10 o 8.748000 0.7112000 8.993000 1.144000  8.503000 0.8450000 0.4897000      1.422000  
1 1 1 35 29 12 o 7.574000 0.8431000 8.527000 0.9569000 6.621000 1.388000  1.907000       1.686000  
1 1 1 35 29 14 o 14.27000 0.5380000 13.99000 0.8021000 14.54000 0.7173000 -0.5442000     1.076000  
1 1 1 35 29 16 o 3.592000 1.040000  3.757000 1.373000  3.428000 1.563000  0.3294000      2.081000  
1 1 1 35 29 18 o 8.981000 0.6110000 9.253000 0.8038000 8.709000 0.9203000 0.5442000      1.222000  
1 1 1 35 29 20 o 5.606000 0.9146000 7.104000 1.029000  4.108000 1.512000  2.996000       1.829000  
1 1 1 35 29 22 o 4.550000 1.149000  4.835000 1.719000  4.266000 1.524000  0.5691000      2.297000  
1 1 1 35 29 24 o 7.094000 0.9584000 7.164000 1.404000  7.025000 1.305000  0.1385000      1.917000  
1 1 1 35 29 26 o 3.031000 0.9216000 2.782000 1.245000  3.280000 1.359000  -0.4973000     1.843000  
1 1 1 35 29 28 o 9.768000 0.6821000 10.48000 0.8277000 9.054000 1.084000  1.428000       1.364000  
1 1 1 35 29 30 o 3.566000 0.9873000 3.271000 1.349000  3.861000 1.442000  -0.5905000     1.975000  
1 1 1 35 29 32 o 5.459000 1.018000  5.265000 1.473000  5.652000 1.406000  -0.3874000     2.036000  
1 1 1 35 30 1  o 2.626000 0.8076000 2.392000 1.097000  2.861000 1.186000  -0.4691000     1.615000  
1 1 1 35 30 3  o 2.746000 0.7767000 2.210000 0.9908000 3.281000 1.196000  -1.071000      1.553000  
1 1 1 35 30 5  o 11.01000 0.5254000 11.27000 0.7789000 10.75000 0.7054000 0.5190000      1.051000  
1 1 1 35 30 7  o 17.18000 0.5979000 17.45000 1.013000  16.91000 0.6353000 0.5401000      1.196000  
1 1 1 35 30 9  o 15.34000 0.4697000 15.42000 0.5895000 15.26000 0.7313000 0.1583000      0.9393000 
1 1 1 35 30 11 o 3.979000 0.9924000 3.194000 1.334000  4.764000 1.469000  -1.570000      1.985000  
1 1 1 35 30 13 o 5.417000 0.9745000 6.375000 1.154000  4.460000 1.570000  1.915000       1.949000  
1 1 1 35 30 15 o 8.039000 0.7599000 9.115000 0.8185000 6.964000 1.281000  2.151000       1.520000  
1 1 1 35 30 17 o 6.199000 1.043000  5.766000 1.308000  6.633000 1.625000  -0.8667000     2.086000  
1 1 1 35 30 19 o 4.021000 0.9883000 5.379000 1.558000  2.663000 1.217000  2.716000       1.977000  
1 1 1 35 30 21 o 6.031000 1.022000  6.962000 1.327000  5.100000 1.555000  1.862000       2.044000  
1 1 1 35 30 23 f 5.895000 0.9162000 6.833000 1.182000  4.957000 1.400000  1.876000       1.832000  
1 1 1 35 30 25 o 3.741000 1.035000  3.969000 1.434000  3.513000 1.493000  0.4566000      2.070000  
1 1 1 35 30 27 o 3.777000 1.063000  3.988000 1.510000  3.566000 1.496000  0.4215000      2.126000  
1 1 1 35 30 29 o 3.954000 1.082000  3.121000 1.356000  4.787000 1.687000  -1.667000      2.164000  
1 1 1 35 30 31 o 4.102000 1.069000  4.073000 1.573000  4.131000 1.449000  -0.5770000E-01 2.138000  
1 1 1 35 31 0  f 3.506000 1.229000  3.506000 1.229000  3.506000 1.229000  0.000000       0.000000  
1 1 1 35 31 2  f 4.004000 0.8051000 3.683000 1.134000  4.324000 1.144000  -0.6414000     1.610000  
1 1 1 35 31 4  o 5.141000 0.8330000 4.564000 1.248000  5.718000 1.104000  -1.154000      1.666000  
1 1 1 35 31 6  o 9.302000 0.6941000 10.25000 0.7678000 8.352000 1.156000  1.898000       1.388000  
1 1 1 35 31 8  o 3.410000 1.018000  4.346000 1.684000  2.475000 1.145000  1.870000       2.036000  
1 1 1 35 31 10 o 4.474000 1.056000  4.624000 1.440000  4.324000 1.546000  0.3006000      2.113000  
1 1 1 35 31 12 o 6.567000 0.8872000 7.044000 1.033000  6.090000 1.443000  0.9534000      1.774000  
1 1 1 35 31 14 o 9.111000 0.6434000 9.504000 0.9166000 8.718000 0.9032000 0.7862000      1.287000  
1 1 1 35 31 16 o 3.635000 1.018000  3.388000 1.450000  3.881000 1.430000  -0.4936000     2.037000  
1 1 1 35 31 18 o 5.480000 1.114000  5.908000 1.576000  5.051000 1.574000  0.8572000      2.227000  
1 1 1 35 31 20 o 6.319000 0.9689000 7.339000 1.353000  5.299000 1.388000  2.039000       1.938000  
1 1 1 35 31 22 o 4.006000 1.046000  4.216000 1.453000  3.795000 1.504000  0.4210000      2.091000  
1 1 1 35 31 24 f 3.753000 1.028000  3.929000 1.466000  3.577000 1.442000  0.3522000      2.057000  
1 1 1 35 31 26 o 3.320000 0.9820000 3.515000 1.432000  3.124000 1.344000  0.3908000      1.964000  
1 1 1 35 31 28 o 3.149000 0.9411000 2.619000 1.215000  3.679000 1.437000  -1.060000      1.882000  
1 1 1 35 31 30 f 3.499000 1.005000  2.936000 1.321000  4.063000 1.516000  -1.127000      2.011000  
1 1 1 35 32 1  o 2.491000 0.7628000 2.205000 1.022000  2.778000 1.132000  -0.5736000     1.526000  
1 1 1 35 32 3  o 3.799000 0.9235000 3.408000 1.229000  4.191000 1.379000  -0.7831000     1.847000  
1 1 1 35 32 5  o 4.394000 0.8681000 5.167000 1.206000  3.621000 1.249000  1.546000       1.736000  
1 1 1 35 32 7  o 11.10000 0.5612000 11.29000 0.7350000 10.91000 0.8482000 0.3725000      1.122000  
1 1 1 35 32 9  o 8.431000 0.7355000 9.369000 0.9360000 7.493000 1.135000  1.877000       1.471000  
1 1 1 35 32 11 o 8.431000 0.6470000 8.604000 1.010000  8.259000 0.8089000 0.3453000      1.294000  
1 1 1 35 32 13 o 18.92000 0.4481000 19.04000 0.6783000 18.80000 0.5857000 0.2479000      0.8962000 
1 1 1 35 32 15 o 3.838000 0.9848000 3.837000 1.399000  3.838000 1.386000  -0.8554000E-03 1.970000  
1 1 1 35 32 17 f 10.10000 0.7381000 10.39000 0.7758000 9.816000 1.256000  0.5728000      1.476000  
1 1 1 35 32 19 o 7.787000 0.6899000 8.053000 0.8739000 7.522000 1.068000  0.5307000      1.380000  
1 1 1 35 32 21 o 5.033000 0.9492000 6.097000 1.174000  3.969000 1.492000  2.128000       1.898000  
1 1 1 35 32 23 o 4.341000 1.020000  4.634000 1.425000  4.047000 1.460000  0.5863000      2.040000  
1 1 1 35 32 25 o 4.776000 1.002000  5.935000 1.402000  3.617000 1.432000  2.318000       2.004000  
1 1 1 35 32 27 o 5.093000 1.043000  5.185000 1.415000  5.002000 1.531000  0.1827000      2.085000  
1 1 1 35 32 29 o 5.189000 1.132000  5.415000 1.708000  4.963000 1.487000  0.4513000      2.264000  
1 1 1 35 33 0  o 13.89000 0.4768000 13.89000 0.4768000 13.89000 0.4768000 0.000000       0.000000  
1 1 1 35 33 2  o 6.447000 0.5423000 6.589000 0.7751000 6.305000 0.7587000 0.2845000      1.085000  
1 1 1 35 33 4  o 8.016000 0.7363000 8.865000 0.7910000 7.168000 1.242000  1.697000       1.473000  
1 1 1 35 33 6  o 10.87000 0.6001000 10.82000 0.7739000 10.92000 0.9174000 -0.9949000E-01 1.200000  
1 1 1 35 33 8  o 5.147000 0.9416000 5.783000 1.269000  4.512000 1.392000  1.271000       1.883000  
1 1 1 35 33 10 o 7.565000 0.7412000 8.905000 0.8300000 6.225000 1.228000  2.680000       1.482000  
1 1 1 35 33 12 o 10.87000 0.5360000 10.25000 0.7968000 11.49000 0.7173000 -1.237000      1.072000  
1 1 1 35 33 14 o 5.655000 0.9751000 4.895000 1.478000  6.415000 1.272000  -1.520000      1.950000  
1 1 1 35 33 16 o 2.581000 0.8421000 2.702000 1.219000  2.460000 1.162000  0.2422000      1.684000  
1 1 1 35 33 18 o 4.245000 1.033000  3.790000 1.392000  4.701000 1.528000  -0.9114000     2.067000  
1 1 1 35 33 20 o 10.93000 0.6341000 11.94000 0.9547000 9.914000 0.8347000 2.030000       1.268000  
1 1 1 35 33 22 o 12.97000 0.6606000 13.61000 0.9009000 12.33000 0.9664000 1.276000       1.321000  
1 1 1 35 33 24 o 4.248000 1.061000  3.957000 1.434000  4.539000 1.565000  -0.5823000     2.123000  
1 1 1 35 33 26 o 4.180000 1.021000  3.754000 1.423000  4.606000 1.464000  -0.8520000     2.042000  
1 1 1 35 33 28 o 4.470000 1.034000  3.966000 1.571000  4.973000 1.344000  -1.006000      2.068000  
1 1 1 35 34 1  o 7.346000 0.6486000 8.410000 0.7353000 6.282000 1.069000  2.127000       1.297000  
1 1 1 35 34 3  o 4.482000 0.9334000 4.661000 1.223000  4.302000 1.411000  0.3591000      1.867000  
1 1 1 35 34 5  o 3.968000 0.8845000 4.982000 1.275000  2.953000 1.227000  2.029000       1.769000  
1 1 1 35 34 7  f 3.168000 0.8822000 2.781000 1.179000  3.554000 1.313000  -0.7728000     1.764000  
1 1 1 35 34 9  o 6.884000 0.9291000 7.464000 1.392000  6.304000 1.231000  1.159000       1.858000  
1 1 1 35 34 11 o 10.28000 0.5344000 10.44000 0.7905000 10.13000 0.7193000 0.3159000      1.069000  
1 1 1 35 34 13 o 5.873000 0.9220000 6.185000 1.198000  5.560000 1.402000  0.6253000      1.844000  
1 1 1 35 34 15 o 3.406000 0.9471000 3.412000 1.340000  3.400000 1.339000  0.1195000E-01  1.894000  
1 1 1 35 34 17 o 3.713000 0.9239000 4.706000 1.398000  2.720000 1.208000  1.985000       1.848000  
1 1 1 35 34 19 o 5.572000 0.9788000 6.141000 1.375000  5.003000 1.393000  1.138000       1.958000  
1 1 1 35 34 21 o 5.105000 1.038000  4.792000 1.496000  5.417000 1.440000  -0.6254000     2.076000  
1 1 1 35 34 23 o 3.364000 0.9560000 3.784000 1.386000  2.943000 1.317000  0.8407000      1.912000  
1 1 1 35 34 25 o 3.109000 0.9387000 2.861000 1.260000  3.357000 1.392000  -0.4963000     1.877000  
1 1 1 35 34 27 o 5.206000 1.956000  ?        ?         5.206000 1.956000  ?              ?         
1 1 1 35 35 0  o 5.846000 1.542000  5.846000 1.542000  5.846000 1.542000  0.000000       0.000000  
1 1 1 35 35 2  o 8.734000 0.9180000 7.747000 1.514000  9.722000 1.039000  -1.975000      1.836000  
1 1 1 35 35 4  o 4.235000 0.9280000 4.391000 1.203000  4.078000 1.413000  0.3132000      1.856000  
1 1 1 35 35 6  o 2.967000 0.8598000 3.242000 1.255000  2.691000 1.175000  0.5516000      1.720000  
1 1 1 35 35 8  o 2.998000 0.8925000 2.732000 1.221000  3.265000 1.303000  -0.5334000     1.785000  
1 1 1 35 35 10 f 4.489000 1.018000  4.870000 1.464000  4.109000 1.416000  0.7603000      2.037000  
1 1 1 35 35 12 o 9.672000 0.5932000 10.08000 0.8574000 9.261000 0.8201000 0.8228000      1.186000  
1 1 1 35 35 14 o 8.878000 0.6429000 9.650000 0.7322000 8.105000 1.057000  1.544000       1.286000  
1 1 1 35 35 16 o 5.445000 0.9060000 5.289000 1.308000  5.601000 1.254000  -0.3119000     1.812000  
1 1 1 35 35 18 o 4.036000 1.029000  4.810000 1.436000  3.262000 1.473000  1.548000       2.057000  
1 1 1 35 35 20 o 6.348000 1.064000  5.826000 1.763000  6.870000 1.190000  -1.044000      2.127000  
1 1 1 35 35 22 o 5.466000 0.9584000 6.523000 1.248000  4.410000 1.455000  2.113000       1.917000  
1 1 1 35 35 24 o 6.755000 0.8791000 6.173000 1.301000  7.337000 1.182000  -1.163000      1.758000  
1 1 1 35 36 1  o 6.829000 0.9864000 7.647000 1.309000  6.011000 1.476000  1.636000       1.973000  
1 1 1 35 36 3  o 8.241000 0.8198000 7.924000 0.8256000 8.557000 1.416000  -0.6328000     1.640000  
1 1 1 35 36 5  o 4.228000 0.9084000 3.879000 1.270000  4.578000 1.299000  -0.6989000     1.817000  
1 1 1 35 36 7  o 4.092000 1.013000  4.317000 1.357000  3.866000 1.505000  0.4509000      2.027000  
1 1 1 35 36 9  o 5.684000 1.039000  5.917000 1.581000  5.451000 1.347000  0.4659000      2.077000  
1 1 1 35 36 11 o 8.345000 0.6467000 8.133000 0.9712000 8.556000 0.8541000 -0.4227000     1.293000  
1 1 1 35 36 13 o 5.871000 0.9305000 5.750000 1.276000  5.992000 1.355000  -0.2424000     1.861000  
1 1 1 35 36 15 o 5.679000 0.9057000 6.377000 1.188000  4.982000 1.368000  1.395000       1.811000  
1 1 1 35 36 17 o 2.880000 0.8990000 2.631000 1.203000  3.130000 1.336000  -0.4984000     1.798000  
1 1 1 35 36 19 o 6.400000 0.9018000 6.685000 1.279000  6.115000 1.271000  0.5699000      1.804000  
1 1 1 35 36 21 o 4.213000 1.028000  4.665000 1.492000  3.761000 1.415000  0.9044000      2.056000  
1 1 1 35 36 23 o 3.373000 1.015000  3.798000 1.548000  2.948000 1.313000  0.8504000      2.030000  
1 1 1 35 37 0  o 3.105000 1.387000  3.105000 1.387000  3.105000 1.387000  0.000000       0.000000  
1 1 1 35 37 2  o 4.094000 1.093000  4.282000 1.598000  3.907000 1.491000  0.3746000      2.185000  
1 1 1 35 37 4  f 4.082000 1.140000  3.646000 1.464000  4.518000 1.748000  -0.8720000     2.280000  
1 1 1 35 37 6  o 6.428000 0.7836000 7.834000 0.8630000 5.021000 1.308000  2.813000       1.567000  
1 1 1 35 37 8  o 3.277000 0.9357000 3.654000 1.390000  2.900000 1.253000  0.7542000      1.871000  
1 1 1 35 37 10 o 2.908000 0.9303000 3.014000 1.370000  2.801000 1.259000  0.2130000      1.861000  
1 1 1 35 37 12 o 5.549000 0.9055000 5.505000 1.205000  5.593000 1.351000  -0.8744000E-01 1.811000  
1 1 1 35 37 14 o 3.097000 0.9420000 2.776000 1.252000  3.418000 1.408000  -0.6421000     1.884000  
1 1 1 35 37 16 o 5.729000 0.9659000 5.363000 1.416000  6.095000 1.314000  -0.7321000     1.932000  
1 1 1 35 37 18 f 9.841000 0.7789000 11.12000 0.8093000 8.563000 1.331000  2.556000       1.558000  
1 1 1 35 37 20 o 10.23000 0.6549000 11.17000 0.9205000 9.286000 0.9319000 1.886000       1.310000  
1 1 1 35 37 22 o 5.019000 1.980000  ?        ?         5.019000 1.980000  ?              ?         
1 1 1 35 38 1  f 5.192000 1.044000  3.873000 1.571000  6.511000 1.374000  -2.638000      2.087000  
1 1 1 35 38 3  o 7.886000 1.019000  8.480000 1.277000  7.292000 1.589000  1.188000       2.038000  
1 1 1 35 38 5  o 3.642000 1.078000  3.530000 1.467000  3.755000 1.580000  -0.2247000     2.156000  
1 1 1 35 38 7  f 8.805000 0.7998000 7.779000 1.388000  9.832000 0.7957000 -2.053000      1.600000  
1 1 1 35 38 9  o 7.949000 0.7508000 7.571000 1.123000  8.326000 0.9971000 -0.7546000     1.502000  
1 1 1 35 38 11 o 6.684000 0.7683000 6.209000 1.137000  7.158000 1.034000  -0.9492000     1.537000  
1 1 1 35 38 13 o 10.06000 0.5783000 10.04000 0.8074000 10.09000 0.8282000 -0.5347000E-01 1.157000  
1 1 1 35 38 15 o 3.401000 0.9671000 3.648000 1.417000  3.155000 1.316000  0.4924000      1.934000  
1 1 1 35 38 17 o 4.517000 1.039000  4.715000 1.514000  4.319000 1.422000  0.3962000      2.077000  
1 1 1 35 38 19 o 5.056000 1.128000  5.076000 1.701000  5.036000 1.483000  0.3968000E-01  2.256000  
1 1 1 35 39 0  o 2.589000 1.256000  2.589000 1.256000  2.589000 1.256000  0.000000       0.000000  
1 1 1 35 39 2  o 6.124000 1.087000  6.804000 1.474000  5.445000 1.598000  1.359000       2.173000  
1 1 1 35 39 4  o 7.245000 1.054000  8.100000 1.253000  6.390000 1.696000  1.710000       2.108000  
1 1 1 35 39 6  o 6.371000 1.129000  7.977000 1.478000  4.764000 1.707000  3.213000       2.258000  
1 1 1 35 39 8  o 7.392000 1.056000  8.360000 1.302000  6.424000 1.664000  1.935000       2.113000  
1 1 1 35 39 10 o 7.544000 0.8105000 7.922000 1.260000  7.165000 1.020000  0.7572000      1.621000  
1 1 1 35 39 12 o 4.103000 1.015000  4.143000 1.488000  4.063000 1.380000  0.7960000E-01  2.029000  
1 1 1 35 39 14 o 3.930000 1.010000  3.891000 1.496000  3.968000 1.358000  -0.7624000E-01 2.020000  
1 1 1 35 39 16 o 6.695000 0.9013000 7.830000 1.194000  5.561000 1.350000  2.270000       1.803000  
1 1 1 35 40 1  o 7.927000 1.011000  7.781000 1.532000  8.073000 1.320000  -0.2926000     2.022000  
1 1 1 35 40 3  o 4.034000 1.162000  4.051000 1.622000  4.016000 1.665000  0.3547000E-01  2.325000  
1 1 1 35 40 5  o 5.851000 1.173000  6.317000 1.600000  5.384000 1.717000  0.9334000      2.347000  
1 1 1 35 40 7  o 4.551000 1.200000  5.370000 1.813000  3.733000 1.571000  1.636000       2.400000  
1 1 1 35 40 9  o 3.790000 1.115000  4.142000 1.621000  3.439000 1.532000  0.7035000      2.231000  
1 1 1 35 40 11 o 5.285000 1.165000  5.199000 1.578000  5.370000 1.714000  -0.1708000     2.330000  
1 1 1 35 40 13 o 6.169000 1.494000  5.849000 2.159000  6.490000 2.065000  -0.6409000     2.987000  
1 1 1 35 41 0  o 8.357000 1.493000  8.357000 1.493000  8.357000 1.493000  0.000000       0.000000  
1 1 1 35 41 2  o 10.75000 0.7900000 11.29000 1.087000  10.22000 1.146000  1.065000       1.580000  
1 1 1 35 41 4  o 7.963000 1.058000  7.646000 1.479000  8.281000 1.513000  -0.6346000     2.116000  
1 1 1 35 41 6  f 4.730000 1.067000  2.878000 1.355000  6.583000 1.647000  -3.705000      2.133000  
1 1 1 35 41 8  o 4.916000 1.359000  4.559000 1.819000  5.274000 2.021000  -0.7144000     2.718000  
1 1 1 35 42 1  o 5.623000 1.949000  ?        ?         5.623000 1.949000  ?              ?         
1 1 1 35 42 3  o 4.261000 1.932000  ?        ?         4.261000 1.932000  ?              ?         
1 1 1 36 0  0  o 4.837000 1.802000  4.837000 1.802000  4.837000 1.802000  0.000000       0.000000  
1 1 1 36 0  2  o 20.87000 0.4757000 20.87000 0.4757000 20.87000 0.4757000 0.000000       0.000000  
1 1 1 36 0  4  o 20.43000 0.4611000 20.43000 0.4611000 20.43000 0.4611000 0.000000       0.000000  
1 1 1 36 0  6  o 30.02000 0.5013000 30.02000 0.5013000 30.02000 0.5013000 0.000000       0.000000  
1 1 1 36 0  8  o 21.81000 0.5008000 21.81000 0.5008000 21.81000 0.5008000 0.000000       0.000000  
1 1 1 36 0  10 o 14.29000 0.5046000 14.29000 0.5046000 14.29000 0.5046000 0.000000       0.000000  
1 1 1 36 0  12 o 5.434000 1.092000  5.434000 1.092000  5.434000 1.092000  0.000000       0.000000  
1 1 1 36 0  14 o 15.60000 0.4510000 15.60000 0.4510000 15.60000 0.4510000 0.000000       0.000000  
1 1 1 36 0  16 o 5.505000 1.009000  5.505000 1.009000  5.505000 1.009000  0.000000       0.000000  
1 1 1 36 0  18 o 6.025000 0.9834000 6.025000 0.9834000 6.025000 0.9834000 0.000000       0.000000  
1 1 1 36 0  20 o 12.56000 0.7108000 12.56000 0.7108000 12.56000 0.7108000 0.000000       0.000000  
1 1 1 36 0  22 o 19.72000 0.4909000 19.72000 0.4909000 19.72000 0.4909000 0.000000       0.000000  
1 1 1 36 0  24 o 8.493000 0.9712000 8.493000 0.9712000 8.493000 0.9712000 0.000000       0.000000  
1 1 1 36 0  26 o 3.573000 1.335000  3.573000 1.335000  3.573000 1.335000  0.000000       0.000000  
1 1 1 36 0  28 o 4.397000 1.426000  4.397000 1.426000  4.397000 1.426000  0.000000       0.000000  
1 1 1 36 0  30 o 3.079000 1.273000  3.079000 1.273000  3.079000 1.273000  0.000000       0.000000  
1 1 1 36 0  32 o 3.398000 1.292000  3.398000 1.292000  3.398000 1.292000  0.000000       0.000000  
1 1 1 36 0  34 o 3.268000 1.315000  3.268000 1.315000  3.268000 1.315000  0.000000       0.000000  
1 1 1 36 0  36 o 3.903000 1.418000  3.903000 1.418000  3.903000 1.418000  0.000000       0.000000  
1 1 1 36 0  38 f 4.310000 1.431000  4.310000 1.431000  4.310000 1.431000  0.000000       0.000000  
1 1 1 36 0  40 o 3.395000 1.347000  3.395000 1.347000  3.395000 1.347000  0.000000       0.000000  
1 1 1 36 0  42 o 4.091000 1.535000  4.091000 1.535000  4.091000 1.535000  0.000000       0.000000  
1 1 1 36 1  1  o 16.22000 0.3538000 16.52000 0.5259000 15.92000 0.4733000 0.6072000      0.7076000 
1 1 1 36 1  3  o 10.23000 0.5027000 10.11000 0.8087000 10.35000 0.5974000 -0.2424000     1.005000  
1 1 1 36 1  5  o 15.58000 0.3682000 15.70000 0.5567000 15.45000 0.4819000 0.2489000      0.7364000 
1 1 1 36 1  7  o 4.039000 0.9458000 4.125000 1.367000  3.954000 1.308000  0.1716000      1.892000  
1 1 1 36 1  9  o 3.641000 0.8818000 3.399000 1.240000  3.883000 1.254000  -0.4839000     1.764000  
1 1 1 36 1  11 o 22.60000 0.3059000 22.43000 0.4365000 22.78000 0.4287000 -0.3467000     0.6118000 
1 1 1 36 1  13 o 4.221000 0.8162000 3.878000 1.131000  4.563000 1.177000  -0.6848000     1.632000  
1 1 1 36 1  15 o 20.67000 0.3249000 20.87000 0.4857000 20.46000 0.4317000 0.4154000      0.6498000 
1 1 1 36 1  17 o 19.11000 0.3333000 19.00000 0.5036000 19.22000 0.4366000 -0.2184000     0.6665000 
1 1 1 36 1  19 o 4.510000 0.9021000 5.378000 1.338000  3.642000 1.211000  1.736000       1.804000  
1 1 1 36 1  21 o 11.92000 0.4093000 11.99000 0.5358000 11.85000 0.6190000 0.1449000      0.8187000 
1 1 1 36 1  23 o 5.904000 0.8061000 5.918000 1.114000  5.890000 1.165000  0.2798000E-01  1.612000  
1 1 1 36 1  25 o 17.71000 0.4337000 18.09000 0.6663000 17.33000 0.5553000 0.7660000      0.8674000 
1 1 1 36 1  27 o 7.192000 0.6703000 7.021000 1.011000  7.362000 0.8804000 -0.3407000     1.341000  
1 1 1 36 1  29 o 15.96000 0.4461000 15.31000 0.6562000 16.62000 0.6044000 -1.312000      0.8921000 
1 1 1 36 1  31 o 23.54000 0.3438000 23.19000 0.5056000 23.88000 0.4659000 -0.6838000     0.6875000 
1 1 1 36 1  33 o 6.677000 0.7160000 6.963000 0.9697000 6.390000 1.054000  0.5736000      1.432000  
1 1 1 36 1  35 o 9.581000 0.5451000 9.848000 0.7679000 9.315000 0.7737000 0.5336000      1.090000  
1 1 1 36 1  37 o 16.15000 0.4283000 16.52000 0.5644000 15.79000 0.6444000 0.7210000      0.8566000 
1 1 1 36 1  39 o 3.459000 0.9400000 3.074000 1.300000  3.844000 1.358000  -0.7705000     1.880000  
1 1 1 36 1  41 o 6.917000 0.8555000 7.152000 1.025000  6.682000 1.370000  0.4697000      1.711000  
1 1 1 36 1  43 o 3.617000 0.9878000 3.237000 1.408000  3.997000 1.386000  -0.7598000     1.976000  
1 1 1 36 2  0  o 13.77000 0.5221000 13.77000 0.5221000 13.77000 0.5221000 0.000000       0.000000  
1 1 1 36 2  2  o 36.41000 0.3512000 36.32000 0.5273000 36.49000 0.4639000 -0.1718000     0.7023000 
1 1 1 36 2  4  o 20.77000 0.3208000 20.48000 0.4840000 21.06000 0.4211000 -0.5784000     0.6416000 
1 1 1 36 2  6  o 17.98000 0.5056000 19.13000 0.8949000 16.83000 0.4709000 2.299000       1.011000  
1 1 1 36 2  8  o 6.581000 0.8617000 7.581000 1.186000  5.581000 1.250000  2.000000       1.723000  
1 1 1 36 2  10 o 24.56000 0.3739000 24.48000 0.6077000 24.64000 0.4357000 -0.1593000     0.7478000 
1 1 1 36 2  12 o 13.02000 0.4516000 13.26000 0.7362000 12.79000 0.5234000 0.4761000      0.9033000 
1 1 1 36 2  14 o 9.065000 0.5589000 8.976000 0.9255000 9.154000 0.6268000 -0.1776000     1.118000  
1 1 1 36 2  16 o 21.80000 0.3683000 21.79000 0.6005000 21.80000 0.4265000 -0.4654000E-02 0.7365000 
1 1 1 36 2  18 o 25.30000 0.3814000 25.38000 0.6367000 25.23000 0.4201000 0.1547000      0.7628000 
1 1 1 36 2  20 o 12.33000 0.3803000 12.31000 0.5564000 12.35000 0.5186000 -0.3926000E-01 0.7606000 
1 1 1 36 2  22 o 2.765000 0.8170000 2.934000 1.192000  2.597000 1.117000  0.3375000      1.634000  
1 1 1 36 2  24 o 10.34000 0.5285000 10.17000 0.7872000 10.51000 0.7052000 -0.3396000     1.057000  
1 1 1 36 2  26 o 10.84000 0.4828000 11.02000 0.6185000 10.66000 0.7415000 0.3600000      0.9656000 
1 1 1 36 2  28 o 18.26000 0.3952000 18.10000 0.5135000 18.43000 0.6008000 -0.3330000     0.7904000 
1 1 1 36 2  30 f 11.13000 0.5305000 11.17000 0.7912000 11.08000 0.7069000 0.8214000E-01  1.061000  
1 1 1 36 2  32 o 11.37000 0.4659000 10.81000 0.6986000 11.93000 0.6164000 -1.120000      0.9317000 
1 1 1 36 2  34 o 14.30000 0.3952000 14.13000 0.5534000 14.47000 0.5645000 -0.3436000     0.7905000 
1 1 1 36 2  36 o 11.42000 0.5248000 10.57000 0.7715000 12.26000 0.7116000 -1.685000      1.050000  
1 1 1 36 2  38 o 10.15000 0.5762000 9.703000 0.7498000 10.59000 0.8750000 -0.8916000     1.152000  
1 1 1 36 2  40 o 6.158000 0.8807000 6.915000 1.128000  5.401000 1.353000  1.514000       1.761000  
1 1 1 36 2  42 o 7.682000 0.6880000 7.295000 1.008000  8.070000 0.9368000 -0.7752000     1.376000  
1 1 1 36 3  1  o 14.76000 0.3562000 14.47000 0.5152000 15.04000 0.4920000 -0.5623000     0.7123000 
1 1 1 36 3  3  o 19.16000 0.3592000 18.62000 0.5655000 19.71000 0.4430000 -1.093000      0.7183000 
1 1 1 36 3  5  o 23.42000 0.3813000 24.22000 0.6173000 22.61000 0.4477000 1.611000       0.7626000 
1 1 1 36 3  7  o 10.74000 0.5474000 11.34000 0.8761000 10.14000 0.6565000 1.204000       1.095000  
1 1 1 36 3  9  o 8.446000 0.5125000 7.953000 0.7683000 8.938000 0.6786000 -0.9852000     1.025000  
1 1 1 36 3  11 o 27.12000 0.3240000 27.40000 0.4867000 26.83000 0.4279000 0.5710000      0.6480000 
1 1 1 36 3  13 o 10.35000 0.4147000 10.12000 0.6035000 10.58000 0.5690000 -0.4557000     0.8295000 
1 1 1 36 3  15 o 30.50000 0.3087000 30.50000 0.4389000 30.50000 0.4342000 0.3563000E-02  0.6173000 
1 1 1 36 3  17 o 24.45000 0.3788000 24.73000 0.6326000 24.17000 0.4168000 0.5613000      0.7576000 
1 1 1 36 3  19 o 12.56000 0.4086000 13.21000 0.6207000 11.91000 0.5317000 1.301000       0.8173000 
1 1 1 36 3  21 o 4.226000 0.8897000 3.689000 1.389000  4.763000 1.112000  -1.074000      1.779000  
1 1 1 36 3  23 o 10.41000 0.4654000 10.41000 0.6716000 10.41000 0.6445000 -0.4668000E-02 0.9308000 
1 1 1 36 3  25 o 9.134000 0.5505000 8.989000 0.8303000 9.280000 0.7230000 -0.2907000     1.101000  
1 1 1 36 3  27 o 13.75000 0.3855000 13.42000 0.5541000 14.07000 0.5361000 -0.6421000     0.7710000 
1 1 1 36 3  29 o 14.17000 0.4513000 14.84000 0.5591000 13.50000 0.7086000 1.338000       0.9027000 
1 1 1 36 3  31 o 6.415000 0.7157000 7.048000 0.9822000 5.782000 1.041000  1.265000       1.431000  
1 1 1 36 3  33 o 8.123000 0.6250000 7.209000 0.9848000 9.037000 0.7699000 -1.827000      1.250000  
1 1 1 36 3  35 o 3.553000 0.9254000 3.208000 1.307000  3.899000 1.310000  -0.6903000     1.851000  
1 1 1 36 3  37 o 3.757000 1.083000  3.648000 1.280000  3.866000 1.746000  -0.2182000     2.166000  
1 1 1 36 3  39 o 4.148000 1.026000  4.254000 1.398000  4.043000 1.503000  0.2115000      2.053000  
1 1 1 36 3  41 o 5.924000 0.9058000 4.962000 1.402000  6.886000 1.147000  -1.924000      1.812000  
1 1 1 36 3  43 o 4.351000 0.9676000 4.729000 1.359000  3.974000 1.377000  0.7549000      1.935000  
1 1 1 36 4  0  o 36.10000 0.5420000 36.10000 0.5420000 36.10000 0.5420000 0.000000       0.000000  
1 1 1 36 4  2  o 29.38000 0.3340000 29.50000 0.5115000 29.25000 0.4297000 0.2555000      0.6680000 
1 1 1 36 4  4  o 13.09000 0.3676000 12.53000 0.5419000 13.66000 0.4967000 -1.126000      0.7351000 
1 1 1 36 4  6  o 22.94000 0.3285000 23.49000 0.4835000 22.39000 0.4449000 1.104000       0.6570000 
1 1 1 36 4  8  o 7.782000 0.5796000 7.184000 0.8071000 8.380000 0.8321000 -1.196000      1.159000  
1 1 1 36 4  10 o 9.812000 0.4402000 10.24000 0.5948000 9.386000 0.6490000 0.8510000      0.8803000 
1 1 1 36 4  12 o 13.82000 0.3452000 13.46000 0.4937000 14.18000 0.4826000 -0.7180000     0.6904000 
1 1 1 36 4  14 o 12.66000 0.3791000 12.93000 0.5256000 12.39000 0.5464000 0.5386000      0.7581000 
1 1 1 36 4  16 o 17.03000 0.3448000 17.65000 0.5150000 16.40000 0.4586000 1.247000       0.6896000 
1 1 1 36 4  18 o 11.02000 0.4026000 10.53000 0.6027000 11.50000 0.5339000 -0.9629000     0.8052000 
1 1 1 36 4  20 o 4.455000 0.9189000 4.784000 1.285000  4.125000 1.314000  0.6597000      1.838000  
1 1 1 36 4  22 f 13.06000 0.4498000 13.14000 0.5282000 12.98000 0.7283000 0.1618000      0.8997000 
1 1 1 36 4  24 o 11.81000 0.5750000 11.42000 0.9200000 12.20000 0.6899000 -0.7751000     1.150000  
1 1 1 36 4  26 o 2.501000 0.7886000 2.397000 1.104000  2.605000 1.126000  -0.2082000     1.577000  
1 1 1 36 4  28 o 6.752000 0.6984000 6.004000 1.086000  7.500000 0.8788000 -1.496000      1.397000  
1 1 1 36 4  30 o 12.05000 0.4432000 11.89000 0.6607000 12.20000 0.5910000 -0.3069000     0.8865000 
1 1 1 36 4  32 o 13.78000 0.4427000 12.75000 0.6184000 14.80000 0.6336000 -2.049000      0.8853000 
1 1 1 36 4  34 o 5.756000 0.9144000 5.627000 1.268000  5.885000 1.318000  -0.2574000     1.829000  
1 1 1 36 4  36 o 4.515000 1.002000  4.640000 1.229000  4.389000 1.583000  0.2517000      2.004000  
1 1 1 36 4  38 o 9.028000 0.6175000 9.289000 0.7193000 8.767000 1.004000  0.5216000      1.235000  
1 1 1 36 4  40 o 7.843000 0.7308000 8.103000 0.9359000 7.582000 1.123000  0.5216000      1.462000  
1 1 1 36 4  42 o 5.689000 0.8804000 7.222000 1.066000  4.156000 1.402000  3.066000       1.761000  
1 1 1 36 5  1  o 25.66000 0.3517000 25.92000 0.4963000 25.39000 0.4984000 0.5304000      0.7033000 
1 1 1 36 5  3  o 9.386000 0.4568000 8.747000 0.6967000 10.03000 0.5909000 -1.279000      0.9136000 
1 1 1 36 5  5  o 15.11000 0.3401000 15.21000 0.4893000 15.01000 0.4725000 0.1949000      0.6802000 
1 1 1 36 5  7  o 18.30000 0.3499000 18.44000 0.5134000 18.16000 0.4756000 0.2822000      0.6998000 
1 1 1 36 5  9  o 19.24000 0.3165000 18.98000 0.4391000 19.49000 0.4560000 -0.5167000     0.6330000 
1 1 1 36 5  11 o 6.617000 0.6053000 5.969000 0.9316000 7.265000 0.7731000 -1.297000      1.211000  
1 1 1 36 5  13 o 9.348000 0.4759000 8.883000 0.7032000 9.813000 0.6414000 -0.9303000     0.9518000 
1 1 1 36 5  15 o 2.992000 0.8266000 3.108000 1.169000  2.875000 1.169000  0.2332000      1.653000  
1 1 1 36 5  17 o 7.897000 0.5310000 8.602000 0.6863000 7.192000 0.8105000 1.410000       1.062000  
1 1 1 36 5  19 o 8.340000 0.5653000 8.490000 0.8697000 8.191000 0.7226000 0.2994000      1.131000  
1 1 1 36 5  21 o 9.127000 0.5247000 9.851000 0.6384000 8.403000 0.8330000 1.447000       1.049000  
1 1 1 36 5  23 o 21.38000 0.4020000 21.93000 0.5030000 20.83000 0.6273000 1.104000       0.8041000 
1 1 1 36 5  25 o 6.486000 0.6759000 6.594000 0.9377000 6.377000 0.9736000 0.2174000      1.352000  
1 1 1 36 5  27 o 4.408000 0.9351000 3.699000 1.447000  5.116000 1.184000  -1.417000      1.870000  
1 1 1 36 5  29 o 19.50000 0.3402000 19.55000 0.4957000 19.45000 0.4661000 0.9315000E-01  0.6804000 
1 1 1 36 5  31 o 26.78000 0.3346000 26.66000 0.4826000 26.89000 0.4636000 -0.2294000     0.6692000 
1 1 1 36 5  33 o 13.09000 0.4994000 12.93000 0.7468000 13.25000 0.6632000 -0.3251000     0.9988000 
1 1 1 36 5  35 o 9.184000 0.6628000 8.256000 0.9989000 10.11000 0.8714000 -1.857000      1.326000  
1 1 1 36 5  37 o 4.282000 1.028000  4.112000 1.270000  4.453000 1.617000  -0.3411000     2.056000  
1 1 1 36 5  39 o 4.979000 0.9438000 3.763000 1.410000  6.196000 1.255000  -2.432000      1.888000  
1 1 1 36 5  41 o 9.470000 0.5630000 10.24000 0.7808000 8.703000 0.8113000 1.534000       1.126000  
1 1 1 36 5  43 o 3.211000 0.9250000 3.582000 1.378000  2.840000 1.234000  0.7414000      1.850000  
1 1 1 36 6  0  f 30.33000 0.4332000 30.33000 0.4332000 30.33000 0.4332000 0.000000       0.000000  
1 1 1 36 6  2  o 20.31000 0.3354000 20.75000 0.4307000 19.86000 0.5143000 0.8850000      0.6708000 
1 1 1 36 6  4  o 9.760000 0.4407000 9.925000 0.6077000 9.595000 0.6385000 0.3302000      0.8815000 
1 1 1 36 6  6  o 22.81000 0.3037000 22.10000 0.4204000 23.53000 0.4384000 -1.433000      0.6074000 
1 1 1 36 6  8  o 13.21000 0.3986000 12.62000 0.5913000 13.79000 0.5346000 -1.176000      0.7971000 
1 1 1 36 6  10 o 7.552000 0.5581000 8.029000 0.7359000 7.076000 0.8394000 0.9530000      1.116000  
1 1 1 36 6  12 o 17.05000 0.3142000 16.59000 0.4428000 17.51000 0.4459000 -0.9188000     0.6284000 
1 1 1 36 6  14 o 16.26000 0.3508000 16.10000 0.5329000 16.42000 0.4563000 -0.3174000     0.7016000 
1 1 1 36 6  16 o 11.75000 0.4035000 11.32000 0.5157000 12.18000 0.6208000 -0.8550000     0.8070000 
1 1 1 36 6  18 o 8.839000 0.4692000 8.978000 0.6709000 8.700000 0.6560000 0.2773000      0.9383000 
1 1 1 36 6  20 o 17.83000 0.3357000 17.60000 0.4484000 18.05000 0.4997000 -0.4532000     0.6714000 
1 1 1 36 6  22 o 17.65000 0.3687000 17.34000 0.4709000 17.96000 0.5675000 -0.6132000     0.7374000 
1 1 1 36 6  24 o 17.92000 0.3526000 18.28000 0.5142000 17.56000 0.4827000 0.7197000      0.7053000 
1 1 1 36 6  26 o 8.820000 0.5393000 9.149000 0.7859000 8.491000 0.7386000 0.6583000      1.079000  
1 1 1 36 6  28 o 11.29000 0.4323000 10.90000 0.5962000 11.68000 0.6262000 -0.7789000     0.8647000 
1 1 1 36 6  30 o 8.649000 0.5955000 8.917000 0.9233000 8.382000 0.7524000 0.5350000      1.191000  
1 1 1 36 6  32 f 10.15000 0.4792000 10.75000 0.6972000 9.547000 0.6577000 1.207000       0.9585000 
1 1 1 36 6  34 o 9.779000 0.5210000 9.208000 0.7914000 10.35000 0.6778000 -1.142000      1.042000  
1 1 1 36 6  36 o 3.304000 0.9760000 3.086000 1.327000  3.523000 1.431000  -0.4370000     1.952000  
1 1 1 36 6  38 o 3.900000 1.013000  3.849000 1.401000  3.951000 1.463000  -0.1022000     2.026000  
1 1 1 36 6  40 o 4.896000 0.9602000 5.337000 1.147000  4.454000 1.540000  0.8827000      1.920000  
1 1 1 36 6  42 o 10.05000 0.5329000 10.58000 0.7394000 9.518000 0.7675000 1.066000       1.066000  
1 1 1 36 7  1  f 7.676000 0.5464000 7.462000 0.7684000 7.891000 0.7769000 -0.4290000     1.093000  
1 1 1 36 7  3  o 4.903000 0.8592000 3.903000 1.286000  5.903000 1.140000  -2.000000      1.718000  
1 1 1 36 7  5  o 7.852000 0.5050000 7.814000 0.7532000 7.890000 0.6729000 -0.7620000E-01 1.010000  
1 1 1 36 7  7  o 2.436000 0.7664000 2.288000 1.048000  2.584000 1.118000  -0.2961000     1.533000  
1 1 1 36 7  9  o 26.29000 0.3289000 25.47000 0.4813000 27.11000 0.4483000 -1.642000      0.6578000 
1 1 1 36 7  11 o 12.63000 0.3917000 12.37000 0.5425000 12.89000 0.5652000 -0.5175000     0.7834000 
1 1 1 36 7  13 o 20.50000 0.3231000 20.68000 0.4899000 20.33000 0.4214000 0.3523000      0.6462000 
1 1 1 36 7  15 o 13.76000 0.3671000 14.28000 0.5590000 13.24000 0.4762000 1.037000       0.7343000 
1 1 1 36 7  17 o 15.36000 0.3292000 15.80000 0.4499000 14.91000 0.4807000 0.8818000      0.6584000 
1 1 1 36 7  19 o 32.10000 0.3351000 32.11000 0.4431000 32.09000 0.5029000 0.2253000E-01  0.6703000 
1 1 1 36 7  21 o 5.661000 0.7099000 6.098000 0.9642000 5.223000 1.042000  0.8754000      1.420000  
1 1 1 36 7  23 o 3.640000 0.8746000 3.516000 1.195000  3.763000 1.277000  -0.2464000     1.749000  
1 1 1 36 7  25 o 12.66000 0.4028000 11.71000 0.5993000 13.61000 0.5384000 -1.901000      0.8056000 
1 1 1 36 7  27 o 7.480000 0.6550000 7.982000 0.8771000 6.979000 0.9729000 1.003000       1.310000  
1 1 1 36 7  29 o 7.936000 0.5445000 7.955000 0.8006000 7.917000 0.7384000 0.3729000E-01  1.089000  
1 1 1 36 7  31 o 12.36000 0.5000000 12.77000 0.7159000 11.95000 0.6982000 0.8214000      1.000000  
1 1 1 36 7  33 o 8.880000 0.6177000 8.783000 0.9713000 8.977000 0.7636000 -0.1939000     1.235000  
1 1 1 36 7  35 o 4.817000 0.9733000 3.963000 1.278000  5.670000 1.469000  -1.706000      1.947000  
1 1 1 36 7  37 o 7.525000 0.7971000 6.909000 0.9897000 8.141000 1.250000  -1.232000      1.594000  
1 1 1 36 7  39 o 3.542000 0.9769000 3.070000 1.272000  4.014000 1.483000  -0.9447000     1.954000  
1 1 1 36 7  41 o 3.582000 0.9611000 3.555000 1.255000  3.610000 1.456000  -0.5500000E-01 1.922000  
1 1 1 36 7  43 o 3.382000 0.9469000 3.395000 1.354000  3.369000 1.324000  0.2613000E-01  1.894000  
1 1 1 36 8  0  o 8.690000 0.6847000 8.690000 0.6847000 8.690000 0.6847000 0.000000       0.000000  
1 1 1 36 8  2  o 14.82000 0.3353000 14.89000 0.4708000 14.74000 0.4776000 0.1420000      0.6707000 
1 1 1 36 8  4  o 5.534000 0.7900000 7.046000 0.8562000 4.022000 1.328000  3.024000       1.580000  
1 1 1 36 8  6  o 11.16000 0.3719000 11.96000 0.5279000 10.37000 0.5239000 1.593000       0.7438000 
1 1 1 36 8  8  o 7.324000 0.5859000 6.923000 0.8340000 7.726000 0.8231000 -0.8034000     1.172000  
1 1 1 36 8  10 o 18.97000 0.3356000 19.47000 0.4965000 18.47000 0.4516000 0.9993000      0.6712000 
1 1 1 36 8  12 o 13.75000 0.4876000 13.43000 0.7536000 14.06000 0.6190000 -0.6223000     0.9752000 
1 1 1 36 8  14 o 9.973000 0.4219000 10.06000 0.6069000 9.886000 0.5863000 0.1747000      0.8438000 
1 1 1 36 8  16 o 16.31000 0.3181000 16.00000 0.4606000 16.63000 0.4388000 -0.6259000     0.6362000 
1 1 1 36 8  18 f 11.71000 0.4108000 11.93000 0.5404000 11.49000 0.6188000 0.4384000      0.8216000 
1 1 1 36 8  20 o 9.877000 0.4236000 10.35000 0.5384000 9.404000 0.6541000 0.9468000      0.8472000 
1 1 1 36 8  22 o 16.22000 0.4201000 16.11000 0.4629000 16.32000 0.7011000 -0.2096000     0.8401000 
1 1 1 36 8  24 o 12.61000 0.4508000 12.68000 0.6191000 12.55000 0.6556000 0.1318000      0.9017000 
1 1 1 36 8  26 o 15.07000 0.3803000 15.14000 0.5758000 15.01000 0.4971000 0.1285000      0.7607000 
1 1 1 36 8  28 o 10.96000 0.4546000 10.51000 0.6673000 11.42000 0.6175000 -0.9050000     0.9091000 
1 1 1 36 8  30 o 11.36000 0.4752000 11.35000 0.6318000 11.36000 0.7100000 -0.7017000E-02 0.9504000 
1 1 1 36 8  32 o 17.74000 0.3772000 17.99000 0.5876000 17.48000 0.4732000 0.5052000      0.7545000 
1 1 1 36 8  34 o 10.73000 0.5880000 10.59000 0.8520000 10.87000 0.8106000 -0.2772000     1.176000  
1 1 1 36 8  36 o 5.432000 0.8837000 4.600000 1.154000  6.264000 1.339000  -1.665000      1.767000  
1 1 1 36 8  38 o 10.57000 0.6395000 10.76000 0.7296000 10.37000 1.050000  0.3857000      1.279000  
1 1 1 36 8  40 o 5.733000 1.044000  6.142000 1.134000  5.324000 1.753000  0.8180000      2.088000  
1 1 1 36 8  42 o 5.422000 1.051000  5.369000 1.329000  5.475000 1.630000  -0.1061000     2.103000  
1 1 1 36 9  1  o 3.979000 0.8411000 3.717000 1.232000  4.240000 1.146000  -0.5236000     1.682000  
1 1 1 36 9  3  o 9.171000 0.4511000 9.316000 0.6621000 9.025000 0.6127000 0.2903000      0.9021000 
1 1 1 36 9  5  o 7.905000 0.4843000 7.960000 0.6689000 7.849000 0.7006000 0.1110000      0.9686000 
1 1 1 36 9  7  o 3.930000 0.8093000 3.215000 1.199000  4.645000 1.088000  -1.429000      1.619000  
1 1 1 36 9  9  o 10.80000 0.4398000 10.90000 0.5949000 10.70000 0.6478000 0.1971000      0.8795000 
1 1 1 36 9  11 o 10.59000 0.8207000 9.741000 1.522000  11.45000 0.6137000 -1.704000      1.641000  
1 1 1 36 9  13 o 15.77000 0.3325000 16.15000 0.4776000 15.39000 0.4627000 0.7634000      0.6650000 
1 1 1 36 9  15 o 11.67000 0.4005000 11.35000 0.5948000 11.98000 0.5366000 -0.6331000     0.8011000 
1 1 1 36 9  17 o 4.955000 0.8008000 5.344000 0.9837000 4.565000 1.264000  0.7787000      1.602000  
1 1 1 36 9  19 o 22.82000 0.2996000 22.55000 0.4177000 23.10000 0.4297000 -0.5531000     0.5992000 
1 1 1 36 9  21 o 10.25000 0.4144000 10.38000 0.5657000 10.11000 0.6057000 0.2699000      0.8288000 
1 1 1 36 9  23 o 5.000000 0.8100000 4.630000 1.094000  5.369000 1.195000  -0.7392000     1.620000  
1 1 1 36 9  25 o 7.083000 0.6411000 6.847000 0.8977000 7.319000 0.9156000 -0.4715000     1.282000  
1 1 1 36 9  27 o 16.87000 0.4230000 17.20000 0.6358000 16.55000 0.5581000 0.6545000      0.8460000 
1 1 1 36 9  29 o 19.03000 0.3349000 19.64000 0.4854000 18.41000 0.4615000 1.235000       0.6697000 
1 1 1 36 9  31 o 12.59000 0.4288000 12.08000 0.6563000 13.10000 0.5522000 -1.016000      0.8577000 
1 1 1 36 9  33 o 13.26000 0.4546000 12.65000 0.6375000 13.88000 0.6482000 -1.227000      0.9092000 
1 1 1 36 9  35 o 14.39000 0.4374000 13.94000 0.6007000 14.83000 0.6358000 -0.8926000     0.8747000 
1 1 1 36 9  37 o 4.815000 0.8944000 5.522000 1.089000  4.108000 1.419000  1.413000       1.789000  
1 1 1 36 9  39 o 3.223000 0.9700000 2.816000 1.202000  3.629000 1.523000  -0.8131000     1.940000  
1 1 1 36 9  41 o 5.027000 0.9722000 6.003000 0.9251000 4.052000 1.710000  1.951000       1.944000  
1 1 1 36 10 0  o 10.85000 0.5429000 10.85000 0.5429000 10.85000 0.5429000 0.000000       0.000000  
1 1 1 36 10 2  o 14.56000 0.3378000 14.62000 0.4768000 14.50000 0.4786000 0.1204000      0.6756000 
1 1 1 36 10 4  o 4.613000 0.8042000 4.092000 1.227000  5.135000 1.039000  -1.043000      1.608000  
1 1 1 36 10 6  o 3.220000 0.8138000 3.116000 1.145000  3.324000 1.157000  -0.2085000     1.628000  
1 1 1 36 10 8  o 7.707000 0.6085000 6.541000 0.9397000 8.872000 0.7734000 -2.331000      1.217000  
1 1 1 36 10 10 f 30.30000 0.3693000 30.55000 0.5849000 30.05000 0.4511000 0.5067000      0.7386000 
1 1 1 36 10 12 o 9.712000 0.4748000 9.870000 0.6549000 9.554000 0.6877000 0.3155000      0.9496000 
1 1 1 36 10 14 o 8.441000 0.4663000 8.208000 0.6719000 8.674000 0.6467000 -0.4660000     0.9326000 
1 1 1 36 10 16 o 16.46000 0.3297000 16.36000 0.4417000 16.56000 0.4895000 -0.1930000     0.6593000 
1 1 1 36 10 18 f 10.60000 0.3970000 10.54000 0.5555000 10.66000 0.5675000 -0.1223000     0.7941000 
1 1 1 36 10 20 o 7.130000 0.5480000 7.684000 0.7189000 6.576000 0.8273000 1.107000       1.096000  
1 1 1 36 10 22 o 4.439000 0.8751000 4.312000 1.185000  4.565000 1.288000  -0.2533000     1.750000  
1 1 1 36 10 24 o 12.27000 0.4075000 12.48000 0.6087000 12.06000 0.5420000 0.4211000      0.8150000 
1 1 1 36 10 26 o 9.156000 0.5237000 8.647000 0.7065000 9.666000 0.7732000 -1.019000      1.047000  
1 1 1 36 10 28 f 3.887000 0.8864000 4.688000 1.287000  3.085000 1.219000  1.603000       1.773000  
1 1 1 36 10 30 o 15.53000 0.3573000 15.11000 0.5183000 15.95000 0.4918000 -0.8474000     0.7145000 
1 1 1 36 10 32 o 6.220000 0.8168000 5.780000 1.223000  6.660000 1.083000  -0.8799000     1.634000  
1 1 1 36 10 34 o 8.103000 0.6426000 7.276000 0.8002000 8.930000 1.006000  -1.654000      1.285000  
1 1 1 36 10 36 o 5.103000 1.017000  3.846000 1.341000  6.361000 1.528000  -2.516000      2.033000  
1 1 1 36 10 38 o 10.38000 0.6043000 10.16000 0.6343000 10.59000 1.029000  -0.4349000     1.209000  
1 1 1 36 10 40 o 4.837000 0.9672000 4.640000 1.326000  5.034000 1.408000  -0.3933000     1.934000  
1 1 1 36 10 42 o 4.042000 1.096000  3.947000 1.472000  4.138000 1.626000  -0.1911000     2.193000  
1 1 1 36 11 1  o 15.20000 0.3214000 15.06000 0.4634000 15.33000 0.4455000 -0.2677000     0.6428000 
1 1 1 36 11 3  o 16.98000 0.3078000 16.84000 0.4500000 17.13000 0.4199000 -0.2882000     0.6155000 
1 1 1 36 11 5  o 4.861000 0.8522000 4.570000 1.257000  5.152000 1.151000  -0.5825000     1.704000  
1 1 1 36 11 7  o 10.38000 0.4718000 10.19000 0.6452000 10.57000 0.6885000 -0.3793000     0.9436000 
1 1 1 36 11 9  o 5.230000 0.7848000 6.053000 1.009000  4.407000 1.202000  1.646000       1.570000  
1 1 1 36 11 11 o 15.16000 0.3368000 15.12000 0.4570000 15.20000 0.4949000 -0.7790000E-01 0.6737000 
1 1 1 36 11 13 o 8.656000 0.4957000 8.679000 0.7390000 8.634000 0.6609000 0.4552000E-01  0.9914000 
1 1 1 36 11 15 o 5.294000 0.7788000 6.193000 0.8808000 4.395000 1.285000  1.797000       1.558000  
1 1 1 36 11 17 o 12.21000 0.3653000 12.33000 0.5061000 12.09000 0.5269000 0.2359000      0.7306000 
1 1 1 36 11 19 o 6.441000 0.6111000 6.746000 0.8156000 6.136000 0.9102000 0.6094000      1.222000  
1 1 1 36 11 21 o 7.242000 0.5518000 7.508000 0.6742000 6.976000 0.8736000 0.5316000      1.104000  
1 1 1 36 11 23 o 3.456000 0.8406000 4.000000 1.167000  2.912000 1.210000  1.088000       1.681000  
1 1 1 36 11 25 o 7.317000 0.6174000 7.642000 0.7453000 6.993000 0.9846000 0.6492000      1.235000  
1 1 1 36 11 27 o 6.684000 0.6572000 6.689000 0.8739000 6.679000 0.9818000 0.9301000E-02  1.314000  
1 1 1 36 11 29 o 13.99000 0.3968000 14.27000 0.6064000 13.71000 0.5119000 0.5635000      0.7936000 
1 1 1 36 11 31 o 9.692000 0.5505000 9.952000 0.7487000 9.433000 0.8073000 0.5190000      1.101000  
1 1 1 36 11 33 o 4.501000 1.035000  4.069000 1.332000  4.933000 1.585000  -0.8640000     2.070000  
1 1 1 36 11 35 o 4.883000 0.8839000 4.939000 1.144000  4.826000 1.347000  0.1127000      1.768000  
1 1 1 36 11 37 o 4.788000 0.9501000 4.792000 1.182000  4.784000 1.488000  0.7876000E-02  1.900000  
1 1 1 36 11 39 o 6.481000 0.8662000 6.273000 1.148000  6.689000 1.298000  -0.4163000     1.732000  
1 1 1 36 11 41 o 3.767000 0.9747000 3.900000 1.282000  3.635000 1.469000  0.2647000      1.949000  
1 1 1 36 12 0  o 15.31000 0.4577000 15.31000 0.4577000 15.31000 0.4577000 0.000000       0.000000  
1 1 1 36 12 2  o 3.517000 0.8693000 3.379000 1.250000  3.655000 1.208000  -0.2760000     1.739000  
1 1 1 36 12 4  o 7.054000 0.8487000 6.541000 1.515000  7.567000 0.7646000 -1.027000      1.697000  
1 1 1 36 12 6  o 3.822000 0.8631000 3.589000 1.230000  4.055000 1.211000  -0.4662000     1.726000  
1 1 1 36 12 8  o 14.33000 0.3782000 14.44000 0.4673000 14.22000 0.5947000 0.2165000      0.7563000 
1 1 1 36 12 10 o 21.77000 0.3192000 22.31000 0.4563000 21.24000 0.4465000 1.075000       0.6384000 
1 1 1 36 12 12 o 11.71000 0.3795000 12.25000 0.5022000 11.17000 0.5691000 1.086000       0.7590000 
1 1 1 36 12 14 o 18.86000 0.3176000 18.84000 0.4255000 18.88000 0.4716000 -0.3228000E-01 0.6352000 
1 1 1 36 12 16 o 19.61000 0.3121000 19.61000 0.4323000 19.61000 0.4502000 -0.2813000E-02 0.6241000 
1 1 1 36 12 18 o 11.45000 0.3892000 11.52000 0.5501000 11.38000 0.5507000 0.1427000      0.7784000 
1 1 1 36 12 20 o 15.48000 0.3726000 16.33000 0.4590000 14.63000 0.5870000 1.698000       0.7451000 
1 1 1 36 12 22 o 13.87000 0.3703000 13.56000 0.4774000 14.18000 0.5661000 -0.6172000     0.7405000 
1 1 1 36 12 24 o 3.756000 0.8608000 3.592000 1.211000  3.920000 1.224000  -0.3279000     1.722000  
1 1 1 36 12 26 o 6.639000 0.6110000 6.593000 0.8490000 6.685000 0.8790000 -0.9223000E-01 1.222000  
1 1 1 36 12 28 o 6.927000 0.7145000 6.412000 1.193000  7.441000 0.7873000 -1.029000      1.429000  
1 1 1 36 12 30 o 5.317000 0.8424000 5.862000 1.062000  4.771000 1.308000  1.090000       1.685000  
1 1 1 36 12 32 o 9.054000 0.5962000 8.806000 0.6664000 9.303000 0.9889000 -0.4969000     1.192000  
1 1 1 36 12 34 o 6.659000 0.7470000 5.627000 1.104000  7.691000 1.007000  -2.064000      1.494000  
1 1 1 36 12 36 o 4.867000 0.9607000 4.781000 1.221000  4.953000 1.483000  -0.1718000     1.921000  
1 1 1 36 12 38 o 3.473000 0.9274000 3.829000 1.268000  3.117000 1.354000  0.7123000      1.855000  
1 1 1 36 12 40 o 4.286000 1.010000  4.448000 1.373000  4.124000 1.482000  0.3240000      2.020000  
1 1 1 36 13 1  o 10.80000 1.018000  9.473000 1.955000  12.12000 0.5698000 -2.650000      2.036000  
1 1 1 36 13 3  o 26.91000 0.3261000 26.76000 0.5010000 27.06000 0.4176000 -0.3034000     0.6522000 
1 1 1 36 13 5  o 12.72000 0.3502000 12.52000 0.5084000 12.92000 0.4819000 -0.4088000     0.7005000 
1 1 1 36 13 7  o 2.260000 0.7150000 2.454000 1.064000  2.066000 0.9550000 0.3883000      1.430000  
1 1 1 36 13 9  o 3.021000 0.8383000 2.470000 1.064000  3.572000 1.296000  -1.102000      1.677000  
1 1 1 36 13 11 o 16.80000 0.3240000 16.76000 0.4266000 16.84000 0.4878000 -0.7428000E-01 0.6481000 
1 1 1 36 13 13 o 13.19000 0.4132000 13.56000 0.5435000 12.82000 0.6226000 0.7374000      0.8264000 
1 1 1 36 13 15 o 24.40000 0.4407000 24.00000 0.4110000 24.80000 0.7797000 -0.8012000     0.8814000 
1 1 1 36 13 17 o 9.660000 0.5439000 9.373000 0.6022000 9.947000 0.9060000 -0.5745000     1.088000  
1 1 1 36 13 19 o 8.355000 0.5399000 8.271000 0.6609000 8.439000 0.8539000 -0.1680000     1.080000  
1 1 1 36 13 21 o 4.157000 0.8946000 4.667000 1.113000  3.647000 1.401000  1.021000       1.789000  
1 1 1 36 13 23 o 2.297000 0.7332000 2.321000 1.033000  2.272000 1.041000  0.4939000E-01  1.466000  
1 1 1 36 13 25 o 4.660000 0.8780000 5.345000 1.232000  3.976000 1.251000  1.368000       1.756000  
1 1 1 36 13 27 o 7.786000 0.7816000 7.772000 1.269000  7.800000 0.9133000 -0.2872000E-01 1.563000  
1 1 1 36 13 29 o 8.542000 0.5290000 9.061000 0.7721000 8.022000 0.7233000 1.039000       1.058000  
1 1 1 36 13 31 o 13.28000 0.4093000 13.95000 0.4709000 12.60000 0.6696000 1.347000       0.8186000 
1 1 1 36 13 33 o 5.460000 0.8609000 5.305000 1.032000  5.615000 1.378000  -0.3100000     1.722000  
1 1 1 36 13 35 o 8.217000 0.5922000 7.050000 0.8855000 9.385000 0.7867000 -2.335000      1.184000  
1 1 1 36 13 37 o 7.734000 0.6397000 6.706000 0.9141000 8.762000 0.8950000 -2.056000      1.279000  
1 1 1 36 13 39 o 3.889000 0.9099000 4.699000 1.232000  3.079000 1.339000  1.620000       1.820000  
1 1 1 36 13 41 o 3.854000 0.9868000 3.916000 1.276000  3.793000 1.506000  0.1236000      1.974000  
1 1 1 36 14 0  o 14.25000 0.5539000 14.25000 0.5539000 14.25000 0.5539000 0.000000       0.000000  
1 1 1 36 14 2  o 6.743000 0.7735000 6.115000 1.057000  7.371000 1.130000  -1.256000      1.547000  
1 1 1 36 14 4  o 3.064000 0.8312000 2.253000 1.022000  3.875000 1.311000  -1.622000      1.662000  
1 1 1 36 14 6  o 11.23000 0.4226000 11.23000 0.5523000 11.23000 0.6398000 -0.5245000E-03 0.8452000 
1 1 1 36 14 8  o 12.69000 0.3873000 13.26000 0.4666000 12.12000 0.6184000 1.142000       0.7746000 
1 1 1 36 14 10 o 13.05000 0.4859000 13.05000 0.4859000 ?        ?         ?              ?         
1 1 1 36 14 12 o 10.69000 0.5311000 10.66000 0.5323000 10.72000 0.9193000 -0.6057000E-01 1.062000  
1 1 1 36 14 14 o 6.951000 0.8975000 8.061000 0.7990000 5.840000 1.607000  2.221000       1.795000  
1 1 1 36 14 16 o 27.76000 0.3013000 27.90000 0.4243000 27.61000 0.4280000 0.2908000      0.6027000 
1 1 1 36 14 18 o 13.13000 0.3955000 13.24000 0.4984000 13.01000 0.6142000 0.2285000      0.7910000 
1 1 1 36 14 20 o 3.911000 0.8440000 3.828000 1.173000  3.995000 1.214000  -0.1671000     1.688000  
1 1 1 36 14 22 o 11.06000 0.5069000 12.03000 0.5965000 10.09000 0.8196000 1.933000       1.014000  
1 1 1 36 14 24 o 13.56000 0.5065000 14.23000 0.6227000 12.89000 0.7989000 1.338000       1.013000  
1 1 1 36 14 26 o 7.382000 0.8635000 8.551000 0.7875000 6.213000 1.537000  2.338000       1.727000  
1 1 1 36 14 28 o 4.035000 0.9008000 3.706000 1.302000  4.364000 1.246000  -0.6577000     1.802000  
1 1 1 36 14 30 o 10.20000 0.5002000 10.62000 0.5474000 9.777000 0.8373000 0.8429000      1.000000  
1 1 1 36 14 32 o 12.03000 0.4211000 11.87000 0.5252000 12.19000 0.6583000 -0.3200000     0.8421000 
1 1 1 36 14 34 f 6.525000 0.6975000 6.403000 0.8374000 6.646000 1.116000  -0.2433000     1.395000  
1 1 1 36 14 36 o 3.217000 0.8832000 3.383000 1.182000  3.052000 1.313000  0.3311000      1.766000  
1 1 1 36 14 38 o 2.592000 0.8329000 2.416000 1.077000  2.769000 1.271000  -0.3535000     1.666000  
1 1 1 36 14 40 o 3.746000 0.9843000 3.278000 1.263000  4.215000 1.510000  -0.9369000     1.969000  
1 1 1 36 15 1  o 10.04000 0.4314000 10.10000 0.6118000 9.980000 0.6085000 0.1161000      0.8629000 
1 1 1 36 15 3  o 13.67000 0.3488000 13.60000 0.4987000 13.74000 0.4878000 -0.1402000     0.6976000 
1 1 1 36 15 5  o 6.954000 0.7328000 7.480000 0.9173000 6.428000 1.143000  1.052000       1.466000  
1 1 1 36 15 7  o 11.37000 0.4553000 10.96000 0.5416000 11.78000 0.7320000 -0.8280000     0.9106000 
1 1 1 36 15 9  o 5.737000 0.8111000 5.618000 0.9457000 5.856000 1.318000  -0.2383000     1.622000  
1 1 1 36 15 11 o 15.19000 0.3791000 14.96000 0.4487000 15.42000 0.6112000 -0.4633000     0.7582000 
1 1 1 36 15 13 o 2.668000 0.7856000 2.707000 1.089000  2.630000 1.132000  0.7776000E-01  1.571000  
1 1 1 36 15 15 o 15.97000 0.3282000 16.69000 0.4677000 15.25000 0.4605000 1.436000       0.6564000 
1 1 1 36 15 17 o 5.865000 0.6254000 5.520000 0.8835000 6.209000 0.8852000 -0.6882000     1.251000  
1 1 1 36 15 19 o 3.709000 0.8611000 3.410000 1.215000  4.009000 1.221000  -0.5996000     1.722000  
1 1 1 36 15 21 o 9.770000 0.4929000 10.07000 0.6712000 9.474000 0.7221000 0.5924000      0.9858000 
1 1 1 36 15 23 o 9.318000 0.5065000 9.128000 0.7485000 9.508000 0.6825000 -0.3798000     1.013000  
1 1 1 36 15 25 o 5.106000 0.7896000 5.359000 1.049000  4.854000 1.181000  0.5055000      1.579000  
1 1 1 36 15 27 o 6.940000 0.7224000 7.043000 0.9180000 6.836000 1.116000  0.2071000      1.445000  
1 1 1 36 15 29 o 3.893000 0.9377000 3.610000 1.307000  4.176000 1.345000  -0.5659000     1.875000  
1 1 1 36 15 31 o 12.73000 0.4681000 11.96000 0.5105000 13.50000 0.7849000 -1.539000      0.9363000 
1 1 1 36 15 33 o 9.121000 0.5495000 8.886000 0.6544000 9.356000 0.8829000 -0.4697000     1.099000  
1 1 1 36 15 35 o 4.685000 0.9153000 4.396000 1.181000  4.973000 1.399000  -0.5768000     1.831000  
1 1 1 36 15 37 o 4.145000 0.9637000 3.633000 1.218000  4.657000 1.493000  -1.024000      1.927000  
1 1 1 36 15 39 o 4.085000 0.9585000 4.479000 1.072000  3.692000 1.589000  0.7877000      1.917000  
1 1 1 36 16 0  o 7.188000 0.7435000 7.188000 0.7435000 7.188000 0.7435000 0.000000       0.000000  
1 1 1 36 16 2  o 11.37000 0.3824000 11.52000 0.5546000 11.22000 0.5267000 0.3040000      0.7649000 
1 1 1 36 16 4  o 5.254000 0.7666000 4.558000 1.127000  5.950000 1.039000  -1.391000      1.533000  
1 1 1 36 16 6  o 11.47000 0.4342000 11.51000 0.5327000 11.43000 0.6859000 0.7836000E-01  0.8684000 
1 1 1 36 16 8  o 13.51000 0.4087000 13.64000 0.5636000 13.39000 0.5921000 0.2477000      0.8174000 
1 1 1 36 16 10 o 10.18000 0.4057000 9.694000 0.5790000 10.67000 0.5683000 -0.9797000     0.8113000 
1 1 1 36 16 12 o 7.498000 0.4855000 7.837000 0.7055000 7.159000 0.6672000 0.6774000      0.9710000 
1 1 1 36 16 14 o 12.83000 0.4083000 12.94000 0.6258000 12.71000 0.5246000 0.2243000      0.8166000 
1 1 1 36 16 16 o 9.360000 0.6277000 9.045000 1.093000  9.675000 0.6176000 -0.6298000     1.255000  
1 1 1 36 16 18 o 10.22000 0.6243000 9.616000 1.106000  10.82000 0.5792000 -1.206000      1.249000  
1 1 1 36 16 20 o 6.166000 0.7707000 6.493000 1.277000  5.839000 0.8634000 0.6540000      1.541000  
1 1 1 36 16 22 o 3.827000 0.8928000 3.286000 1.331000  4.368000 1.191000  -1.081000      1.786000  
1 1 1 36 16 24 o 6.755000 0.6787000 6.955000 0.8490000 6.556000 1.059000  0.3987000      1.357000  
1 1 1 36 16 26 o 3.644000 0.8834000 4.217000 1.268000  3.072000 1.230000  1.145000       1.767000  
1 1 1 36 16 28 o 11.08000 0.4565000 11.21000 0.5609000 10.94000 0.7205000 0.2679000      0.9131000 
1 1 1 36 16 30 o 21.16000 0.3935000 21.18000 0.4678000 21.13000 0.6329000 0.4832000E-01  0.7870000 
1 1 1 36 16 32 o 11.27000 0.4773000 11.33000 0.5982000 11.20000 0.7440000 0.1236000      0.9546000 
1 1 1 36 16 34 f 13.22000 0.4240000 13.14000 0.5065000 13.30000 0.6802000 -0.1573000     0.8481000 
1 1 1 36 16 36 o 13.10000 0.4313000 12.75000 0.5078000 13.44000 0.6974000 -0.6928000     0.8627000 
1 1 1 36 16 38 o 4.116000 1.003000  3.536000 1.218000  4.697000 1.593000  -1.161000      2.006000  
1 1 1 36 16 40 o 4.421000 0.9639000 3.791000 1.223000  5.052000 1.491000  -1.261000      1.928000  
1 1 1 36 17 1  o 16.11000 0.3693000 15.59000 0.5475000 16.63000 0.4956000 -1.040000      0.7385000 
1 1 1 36 17 3  o 25.17000 0.3728000 25.49000 0.4914000 24.84000 0.5607000 0.6512000      0.7456000 
1 1 1 36 17 5  o 13.75000 0.3773000 13.63000 0.5104000 13.87000 0.5558000 -0.2432000     0.7546000 
1 1 1 36 17 7  o 15.53000 0.3378000 15.11000 0.4803000 15.94000 0.4751000 -0.8356000     0.6756000 
1 1 1 36 17 9  o 17.08000 0.3305000 17.64000 0.4774000 16.53000 0.4570000 1.106000       0.6609000 
1 1 1 36 17 11 o 4.674000 1.122000  5.680000 1.822000  3.667000 1.310000  2.012000       2.244000  
1 1 1 36 17 13 o 6.539000 0.7980000 5.182000 1.414000  7.896000 0.7406000 -2.714000      1.596000  
1 1 1 36 17 15 o 9.422000 0.4911000 8.938000 0.7679000 9.906000 0.6125000 -0.9678000     0.9823000 
1 1 1 36 17 17 o 8.391000 0.5349000 8.174000 0.7485000 8.608000 0.7644000 -0.4334000     1.070000  
1 1 1 36 17 19 o 8.360000 0.4850000 7.885000 0.6947000 8.835000 0.6771000 -0.9497000     0.9701000 
1 1 1 36 17 21 o 5.066000 0.7363000 4.826000 1.073000  5.306000 1.008000  -0.4801000     1.473000  
1 1 1 36 17 23 o 3.653000 0.8640000 3.939000 1.195000  3.366000 1.248000  0.5726000      1.728000  
1 1 1 36 17 25 o 4.269000 0.9736000 4.351000 1.516000  4.187000 1.222000  0.1639000      1.947000  
1 1 1 36 17 27 o 14.43000 0.4761000 14.65000 0.5975000 14.21000 0.7415000 0.4368000      0.9523000 
1 1 1 36 17 29 o 18.99000 0.4182000 19.55000 0.4970000 18.43000 0.6726000 1.116000       0.8363000 
1 1 1 36 17 31 o 6.791000 0.6884000 6.270000 0.8672000 7.311000 1.069000  -1.041000      1.377000  
1 1 1 36 17 33 o 2.916000 0.8580000 2.236000 1.037000  3.596000 1.367000  -1.360000      1.716000  
1 1 1 36 17 35 o 3.340000 0.9067000 2.693000 1.086000  3.987000 1.452000  -1.294000      1.813000  
1 1 1 36 17 37 o 4.975000 0.9634000 5.497000 0.9895000 4.452000 1.653000  1.045000       1.927000  
1 1 1 36 17 39 o 7.787000 0.8318000 7.257000 0.8874000 8.317000 1.407000  -1.060000      1.664000  
1 1 1 36 18 0  o 11.11000 0.5354000 11.11000 0.5354000 11.11000 0.5354000 0.000000       0.000000  
1 1 1 36 18 2  o 4.917000 0.8391000 5.350000 1.138000  4.485000 1.234000  0.8647000      1.678000  
1 1 1 36 18 4  o 8.315000 0.4807000 8.792000 0.6568000 7.839000 0.7020000 0.9536000      0.9614000 
1 1 1 36 18 6  o 3.246000 0.8175000 3.801000 1.177000  2.690000 1.134000  1.112000       1.635000  
1 1 1 36 18 8  f 7.883000 0.6136000 8.388000 0.9271000 7.377000 0.8042000 1.011000       1.227000  
1 1 1 36 18 10 o 15.18000 0.3716000 15.85000 0.5727000 14.51000 0.4736000 1.340000       0.7432000 
1 1 1 36 18 12 o 5.580000 0.7553000 4.533000 1.164000  6.627000 0.9624000 -2.093000      1.511000  
1 1 1 36 18 14 o 4.409000 0.8546000 3.295000 1.303000  5.522000 1.106000  -2.228000      1.709000  
1 1 1 36 18 16 o 3.622000 0.8732000 3.348000 1.251000  3.897000 1.219000  -0.5495000     1.746000  
1 1 1 36 18 18 o 13.67000 0.3761000 12.86000 0.5126000 14.49000 0.5504000 -1.631000      0.7521000 
1 1 1 36 18 20 o 8.923000 0.4603000 9.097000 0.6165000 8.749000 0.6837000 0.3483000      0.9206000 
1 1 1 36 18 22 o 15.26000 0.3287000 15.33000 0.4573000 15.19000 0.4722000 0.1330000      0.6573000 
1 1 1 36 18 24 o 8.314000 0.5324000 8.546000 0.7540000 8.082000 0.7519000 0.4640000      1.065000  
1 1 1 36 18 26 o 4.782000 0.8662000 5.059000 1.026000  4.505000 1.396000  0.5541000      1.732000  
1 1 1 36 18 28 o 5.902000 0.7893000 5.279000 0.9168000 6.525000 1.285000  -1.246000      1.579000  
1 1 1 36 18 30 o 3.377000 0.8836000 2.498000 1.125000  4.257000 1.363000  -1.758000      1.767000  
1 1 1 36 18 32 o 4.865000 0.8775000 4.382000 1.073000  5.349000 1.389000  -0.9674000     1.755000  
1 1 1 36 18 34 o 10.41000 0.5015000 9.292000 0.5997000 11.52000 0.8040000 -2.232000      1.003000  
1 1 1 36 18 36 o 10.69000 0.5980000 9.490000 0.6981000 11.89000 0.9710000 -2.404000      1.196000  
1 1 1 36 18 38 o 2.682000 0.8313000 3.014000 1.234000  2.349000 1.115000  0.6655000      1.663000  
1 1 1 36 19 1  o 5.925000 0.7502000 5.950000 1.011000  5.899000 1.109000  0.5103000E-01  1.500000  
1 1 1 36 19 3  f 8.568000 0.4629000 7.727000 0.7031000 9.408000 0.6023000 -1.681000      0.9258000 
1 1 1 36 19 5  o 8.034000 0.4813000 8.004000 0.6887000 8.064000 0.6726000 -0.6053000E-01 0.9626000 
1 1 1 36 19 7  o 3.515000 0.8909000 4.015000 1.345000  3.015000 1.168000  0.9992000      1.782000  
1 1 1 36 19 9  o 7.967000 0.4926000 8.235000 0.6592000 7.698000 0.7323000 0.5368000      0.9853000 
1 1 1 36 19 11 o 12.45000 0.3718000 12.77000 0.5068000 12.14000 0.5442000 0.6373000      0.7436000 
1 1 1 36 19 13 o 14.41000 0.3969000 14.79000 0.5469000 14.04000 0.5754000 0.7496000      0.7938000 
1 1 1 36 19 15 o 9.667000 0.4380000 9.853000 0.6129000 9.482000 0.6259000 0.3705000      0.8760000 
1 1 1 36 19 17 o 11.09000 0.4543000 11.14000 0.5501000 11.05000 0.7232000 0.9020000E-01  0.9086000 
1 1 1 36 19 19 o 6.715000 0.6314000 7.616000 0.7736000 5.814000 0.9980000 1.802000       1.263000  
1 1 1 36 19 21 o 17.12000 0.3247000 17.22000 0.4427000 17.02000 0.4752000 0.1979000      0.6495000 
1 1 1 36 19 23 o 15.32000 0.3471000 15.35000 0.5040000 15.29000 0.4775000 0.6917000E-01  0.6943000 
1 1 1 36 19 25 o 15.59000 0.3936000 15.64000 0.4648000 15.54000 0.6353000 0.9841000E-01  0.7872000 
1 1 1 36 19 27 o 11.12000 0.5470000 10.24000 0.5251000 12.00000 0.9597000 -1.761000      1.094000  
1 1 1 36 19 29 f 4.692000 0.8654000 5.125000 1.067000  4.259000 1.362000  0.8656000      1.731000  
1 1 1 36 19 31 f 11.96000 0.4383000 12.20000 0.4801000 11.73000 0.7335000 0.4775000      0.8766000 
1 1 1 36 19 33 o 3.675000 0.8780000 4.043000 1.241000  3.308000 1.243000  0.7355000      1.756000  
1 1 1 36 19 35 o 3.239000 0.7897000 4.110000 1.102000  2.368000 1.131000  1.742000       1.579000  
1 1 1 36 19 37 o 3.486000 0.9908000 3.574000 1.387000  3.398000 1.415000  0.1763000      1.982000  
1 1 1 36 20 0  f 8.207000 0.8064000 8.207000 0.8064000 8.207000 0.8064000 0.000000       0.000000  
1 1 1 36 20 2  o 11.49000 0.3927000 10.84000 0.5919000 12.14000 0.5162000 -1.295000      0.7854000 
1 1 1 36 20 4  o 3.777000 0.9016000 3.783000 1.351000  3.770000 1.194000  0.1306000E-01  1.803000  
1 1 1 36 20 6  o 13.84000 0.3637000 14.45000 0.5516000 13.22000 0.4740000 1.235000       0.7273000 
1 1 1 36 20 8  o 4.985000 0.7365000 5.723000 0.8710000 4.246000 1.188000  1.476000       1.473000  
1 1 1 36 20 10 o 11.94000 0.3593000 11.77000 0.5491000 12.10000 0.4637000 -0.3341000     0.7187000 
1 1 1 36 20 12 o 6.677000 0.5717000 7.096000 0.8022000 6.259000 0.8146000 0.8373000      1.143000  
1 1 1 36 20 14 o 7.358000 0.5523000 6.900000 0.8441000 7.817000 0.7124000 -0.9169000     1.105000  
1 1 1 36 20 16 o 9.158000 0.4953000 9.644000 0.6693000 8.673000 0.7302000 0.9705000      0.9905000 
1 1 1 36 20 18 o 7.038000 0.5446000 7.364000 0.7382000 6.712000 0.8008000 0.6520000      1.089000  
1 1 1 36 20 20 o 12.43000 0.3915000 12.64000 0.4991000 12.22000 0.6033000 0.4291000      0.7830000 
1 1 1 36 20 22 o 6.364000 0.7330000 7.058000 0.9433000 5.670000 1.122000  1.389000       1.466000  
1 1 1 36 20 24 o 5.199000 0.8475000 5.530000 0.8974000 4.868000 1.438000  0.6611000      1.695000  
1 1 1 36 20 26 o 3.475000 0.9458000 3.417000 1.139000  3.534000 1.511000  -0.1166000     1.892000  
1 1 1 36 20 28 o 3.450000 0.9015000 3.247000 1.160000  3.654000 1.380000  -0.4064000     1.803000  
1 1 1 36 20 30 o 4.856000 0.8221000 5.092000 1.026000  4.621000 1.285000  0.4715000      1.644000  
1 1 1 36 20 32 o 3.097000 0.9157000 2.803000 1.079000  3.391000 1.480000  -0.5877000     1.831000  
1 1 1 36 20 34 o 2.778000 0.8560000 1.828000 0.8722000 3.728000 1.473000  -1.900000      1.712000  
1 1 1 36 20 36 o 5.632000 1.199000  6.750000 1.847000  4.515000 1.529000  2.235000       2.398000  
1 1 1 36 20 38 o 8.021000 0.9005000 9.078000 1.171000  6.964000 1.369000  2.114000       1.801000  
1 1 1 36 21 1  o 8.812000 0.4598000 8.772000 0.6932000 8.851000 0.6043000 -0.7953000E-01 0.9196000 
1 1 1 36 21 3  o 10.94000 0.5158000 11.31000 0.8857000 10.57000 0.5289000 0.7375000      1.032000  
1 1 1 36 21 5  o 5.272000 0.7123000 5.200000 1.054000  5.344000 0.9586000 -0.1436000     1.425000  
1 1 1 36 21 7  o 4.289000 0.8556000 5.123000 1.131000  3.455000 1.284000  1.668000       1.711000  
1 1 1 36 21 9  o 5.590000 0.7181000 5.794000 1.020000  5.386000 1.011000  0.4071000      1.436000  
1 1 1 36 21 11 o 10.15000 0.3993000 9.981000 0.5899000 10.32000 0.5382000 -0.3392000     0.7985000 
1 1 1 36 21 13 o 10.82000 0.3984000 11.31000 0.5411000 10.34000 0.5850000 0.9764000      0.7969000 
1 1 1 36 21 15 o 3.553000 0.8749000 3.703000 1.198000  3.404000 1.275000  0.2992000      1.750000  
1 1 1 36 21 17 o 2.837000 0.8249000 2.753000 1.152000  2.920000 1.181000  -0.1667000     1.650000  
1 1 1 36 21 19 o 9.606000 0.4219000 10.47000 0.5364000 8.738000 0.6514000 1.736000       0.8438000 
1 1 1 36 21 21 o 11.72000 0.4153000 12.85000 0.5226000 10.59000 0.6455000 2.255000       0.8306000 
1 1 1 36 21 23 o 12.33000 0.4048000 12.23000 0.4530000 12.43000 0.6710000 -0.1984000     0.8096000 
1 1 1 36 21 25 o 4.699000 0.9464000 4.425000 0.9863000 4.972000 1.615000  -0.5468000     1.893000  
1 1 1 36 21 27 o 4.365000 0.8922000 4.828000 1.033000  3.902000 1.455000  0.9252000      1.784000  
1 1 1 36 21 29 o 8.048000 0.6137000 7.968000 0.7936000 8.129000 0.9364000 -0.1614000     1.227000  
1 1 1 36 21 31 o 4.950000 0.9836000 4.607000 1.230000  5.292000 1.535000  -0.6849000     1.967000  
1 1 1 36 21 33 o 4.311000 0.9173000 3.057000 1.311000  5.565000 1.283000  -2.509000      1.835000  
1 1 1 36 21 35 o 4.916000 1.137000  4.779000 1.813000  5.053000 1.372000  -0.2746000     2.274000  
1 1 1 36 21 37 o 5.295000 1.013000  5.459000 1.477000  5.132000 1.387000  0.3275000      2.026000  
1 1 1 36 22 0  o 2.764000 1.123000  2.764000 1.123000  2.764000 1.123000  0.000000       0.000000  
1 1 1 36 22 2  o 8.836000 0.6227000 9.162000 1.073000  8.509000 0.6316000 0.6535000      1.245000  
1 1 1 36 22 4  o 8.818000 0.4497000 8.785000 0.6511000 8.851000 0.6206000 -0.6538000E-01 0.8995000 
1 1 1 36 22 6  o 4.845000 0.7995000 4.626000 1.149000  5.064000 1.112000  -0.4384000     1.599000  
1 1 1 36 22 8  o 12.32000 0.3552000 12.95000 0.4849000 11.69000 0.5190000 1.259000       0.7103000 
1 1 1 36 22 10 o 21.87000 0.2889000 22.17000 0.4119000 21.57000 0.4052000 0.6018000      0.5778000 
1 1 1 36 22 12 o 9.129000 0.4268000 9.183000 0.5963000 9.075000 0.6108000 0.1076000      0.8536000 
1 1 1 36 22 14 o 16.56000 0.4234000 16.91000 0.4269000 16.22000 0.7313000 0.6885000      0.8468000 
1 1 1 36 22 16 o 16.18000 0.3191000 16.34000 0.4361000 16.01000 0.4659000 0.3342000      0.6382000 
1 1 1 36 22 18 o 11.27000 0.3966000 11.18000 0.5488000 11.36000 0.5727000 -0.1756000     0.7932000 
1 1 1 36 22 20 o 6.716000 0.6182000 6.737000 0.8665000 6.695000 0.8820000 0.4256000E-01  1.236000  
1 1 1 36 22 22 o 2.773000 0.8359000 2.507000 1.039000  3.039000 1.310000  -0.5317000     1.672000  
1 1 1 36 22 24 o 3.241000 0.8168000 3.791000 1.042000  2.691000 1.258000  1.100000       1.634000  
1 1 1 36 22 26 o 13.66000 0.4436000 13.23000 0.5359000 14.08000 0.7071000 -0.8562000     0.8872000 
1 1 1 36 22 28 o 6.004000 0.9540000 5.848000 0.9907000 6.160000 1.631000  -0.3124000     1.908000  
1 1 1 36 22 30 o 4.967000 1.072000  5.513000 1.635000  4.421000 1.386000  1.092000       2.143000  
1 1 1 36 22 32 o 2.814000 0.9074000 2.262000 1.083000  3.366000 1.456000  -1.104000      1.815000  
1 1 1 36 22 34 o 5.025000 1.051000  4.856000 1.561000  5.194000 1.407000  -0.3375000     2.102000  
1 1 1 36 22 36 o 4.220000 1.054000  5.055000 1.584000  3.386000 1.392000  1.669000       2.109000  
1 1 1 36 23 1  o 8.798000 0.6254000 7.890000 1.112000  9.705000 0.5733000 -1.815000      1.251000  
1 1 1 36 23 3  o 14.83000 0.3999000 14.80000 0.6776000 14.87000 0.4250000 -0.7615000E-01 0.7998000 
1 1 1 36 23 5  o 8.652000 0.4380000 8.546000 0.6677000 8.758000 0.5669000 -0.2119000     0.8759000 
1 1 1 36 23 7  o 9.934000 0.3943000 9.606000 0.5596000 10.26000 0.5556000 -0.6555000     0.7885000 
1 1 1 36 23 9  o 17.59000 0.2939000 17.81000 0.3944000 17.37000 0.4358000 0.4360000      0.5877000 
1 1 1 36 23 11 o 13.96000 0.3254000 14.20000 0.4522000 13.72000 0.4681000 0.4789000      0.6508000 
1 1 1 36 23 13 o 7.570000 0.5219000 8.059000 0.7168000 7.081000 0.7588000 0.9779000      1.044000  
1 1 1 36 23 15 o 4.996000 0.7937000 5.110000 1.071000  4.882000 1.171000  0.2283000      1.587000  
1 1 1 36 23 17 o 7.673000 0.5271000 7.258000 0.7613000 8.089000 0.7291000 -0.8311000     1.054000  
1 1 1 36 23 19 o 3.723000 0.9565000 4.025000 1.533000  3.422000 1.145000  0.6030000      1.913000  
1 1 1 36 23 21 o 5.786000 0.8684000 6.016000 0.8952000 5.557000 1.488000  0.4584000      1.737000  
1 1 1 36 23 23 o 6.562000 0.8753000 7.850000 0.6821000 5.273000 1.612000  2.577000       1.751000  
1 1 1 36 23 25 o 8.171000 0.8590000 8.815000 0.9532000 7.526000 1.429000  1.289000       1.718000  
1 1 1 36 23 27 o 4.418000 1.198000  2.784000 1.172000  6.051000 2.090000  -3.266000      2.396000  
1 1 1 36 23 29 o 5.607000 0.9875000 5.466000 1.394000  5.749000 1.399000  -0.2833000     1.975000  
1 1 1 36 23 31 o 5.688000 1.329000  6.362000 2.193000  5.014000 1.503000  1.349000       2.659000  
1 1 1 36 23 33 o 6.185000 0.9766000 6.358000 1.428000  6.011000 1.333000  0.3468000      1.953000  
1 1 1 36 23 35 o 4.873000 1.025000  5.563000 1.473000  4.183000 1.425000  1.380000       2.049000  
1 1 1 36 24 0  o 18.93000 0.7575000 18.93000 0.7575000 18.93000 0.7575000 0.000000       0.000000  
1 1 1 36 24 2  o 5.174000 0.7701000 4.744000 1.224000  5.604000 0.9353000 -0.8606000     1.540000  
1 1 1 36 24 4  o 7.586000 0.4939000 6.816000 0.7435000 8.355000 0.6503000 -1.540000      0.9878000 
1 1 1 36 24 6  o 13.64000 0.3405000 13.34000 0.4738000 13.93000 0.4890000 -0.5943000     0.6809000 
1 1 1 36 24 8  o 8.275000 0.4575000 9.155000 0.6044000 7.395000 0.6869000 1.760000       0.9150000 
1 1 1 36 24 10 o 2.309000 0.7147000 2.846000 1.146000  1.772000 0.8544000 1.074000       1.429000  
1 1 1 36 24 12 o 10.08000 0.4177000 9.633000 0.6073000 10.52000 0.5738000 -0.8872000     0.8355000 
1 1 1 36 24 14 o 12.84000 0.4304000 13.22000 0.6821000 12.47000 0.5251000 0.7486000      0.8608000 
1 1 1 36 24 16 o 5.484000 1.027000  5.598000 1.508000  5.371000 1.396000  0.2267000      2.055000  
1 1 1 36 24 18 f 6.171000 0.8426000 5.075000 1.519000  7.267000 0.7304000 -2.191000      1.685000  
1 1 1 36 24 20 o 8.506000 0.6178000 9.738000 0.5917000 7.275000 1.085000  2.463000       1.236000  
1 1 1 36 24 22 o 4.608000 1.062000  5.338000 1.404000  3.877000 1.593000  1.461000       2.124000  
1 1 1 36 24 24 o 16.83000 0.5375000 17.52000 0.7343000 16.15000 0.7852000 1.373000       1.075000  
1 1 1 36 24 26 o 8.980000 0.7276000 7.746000 1.032000  10.21000 1.026000  -2.469000      1.455000  
1 1 1 36 24 28 o 5.909000 1.079000  4.511000 1.509000  7.306000 1.544000  -2.796000      2.158000  
1 1 1 36 24 30 o 3.484000 1.101000  3.720000 1.742000  3.248000 1.346000  0.4722000      2.201000  
1 1 1 36 24 32 o 4.145000 1.085000  4.388000 1.549000  3.902000 1.520000  0.4866000      2.170000  
1 1 1 36 24 34 o 4.035000 1.066000  3.834000 1.535000  4.236000 1.480000  -0.4021000     2.133000  
1 1 1 36 25 1  o 4.104000 0.8931000 4.624000 1.253000  3.584000 1.273000  1.040000       1.786000  
1 1 1 36 25 3  o 2.521000 0.7583000 2.673000 1.103000  2.369000 1.041000  0.3041000      1.517000  
1 1 1 36 25 5  o 5.673000 0.6288000 6.079000 0.8325000 5.267000 0.9424000 0.8118000      1.258000  
1 1 1 36 25 7  o 10.60000 0.3859000 11.03000 0.5376000 10.18000 0.5537000 0.8519000      0.7718000 
1 1 1 36 25 9  o 3.867000 0.8013000 3.342000 1.183000  4.391000 1.081000  -1.049000      1.603000  
1 1 1 36 25 11 o 9.013000 0.4199000 9.204000 0.5957000 8.823000 0.5920000 0.3815000      0.8398000 
1 1 1 36 25 13 o 10.68000 0.5678000 11.02000 0.8966000 10.34000 0.6969000 0.6756000      1.136000  
1 1 1 36 25 15 o 2.894000 0.8827000 3.453000 1.426000  2.336000 1.041000  1.116000       1.765000  
1 1 1 36 25 17 o 19.54000 0.3648000 19.95000 0.5807000 19.12000 0.4415000 0.8337000      0.7295000 
1 1 1 36 25 19 o 6.053000 0.8462000 7.765000 0.7536000 4.342000 1.515000  3.423000       1.692000  
1 1 1 36 25 21 f 2.400000 0.7467000 2.536000 1.036000  2.264000 1.075000  0.2715000      1.493000  
1 1 1 36 25 23 o 9.151000 0.8921000 11.24000 0.7057000 7.065000 1.639000  4.173000       1.784000  
1 1 1 36 25 25 o 8.590000 0.7097000 8.440000 0.9746000 8.740000 1.032000  -0.3005000     1.419000  
1 1 1 36 25 27 o 12.99000 0.5820000 12.71000 0.9590000 13.28000 0.6598000 -0.5742000     1.164000  
1 1 1 36 25 29 o 7.500000 0.7986000 7.371000 1.184000  7.630000 1.072000  -0.2584000     1.597000  
1 1 1 36 25 31 o 3.498000 1.005000  3.342000 1.400000  3.655000 1.442000  -0.3125000     2.010000  
1 1 1 36 25 33 o 3.347000 1.021000  2.982000 1.369000  3.711000 1.514000  -0.7283000     2.041000  
1 1 1 36 26 0  o 13.43000 0.4634000 13.43000 0.4634000 13.43000 0.4634000 0.000000       0.000000  
1 1 1 36 26 2  o 9.984000 0.4701000 9.928000 0.6716000 10.04000 0.6580000 -0.1115000     0.9403000 
1 1 1 36 26 4  o 5.206000 0.8462000 4.687000 1.402000  5.726000 0.9484000 -1.040000      1.692000  
1 1 1 36 26 6  o 7.441000 0.5185000 6.872000 0.7366000 8.009000 0.7298000 -1.138000      1.037000  
1 1 1 36 26 8  o 3.303000 0.7941000 2.614000 1.096000  3.991000 1.149000  -1.378000      1.588000  
1 1 1 36 26 10 o 4.989000 0.7979000 3.492000 1.288000  6.486000 0.9416000 -2.994000      1.596000  
1 1 1 36 26 12 o 11.08000 0.5182000 11.72000 0.8674000 10.44000 0.5673000 1.275000       1.036000  
1 1 1 36 26 14 o 5.206000 0.9076000 5.769000 1.504000  4.643000 1.016000  1.126000       1.815000  
1 1 1 36 26 16 o 5.513000 0.9504000 4.934000 1.458000  6.091000 1.219000  -1.157000      1.901000  
1 1 1 36 26 18 o 14.95000 0.5631000 15.57000 0.4749000 14.34000 1.021000  1.227000       1.126000  
1 1 1 36 26 20 o 3.168000 0.9465000 3.347000 1.278000  2.990000 1.397000  0.3574000      1.893000  
1 1 1 36 26 22 o 2.977000 0.9203000 2.919000 1.257000  3.036000 1.345000  -0.1176000     1.841000  
1 1 1 36 26 24 o 6.320000 0.9004000 7.541000 1.016000  5.100000 1.487000  2.441000       1.801000  
1 1 1 36 26 26 o 8.130000 0.8861000 8.332000 1.369000  7.929000 1.125000  0.4026000      1.772000  
1 1 1 36 26 28 o 5.953000 1.018000  6.199000 1.286000  5.706000 1.579000  0.4924000      2.036000  
1 1 1 36 26 30 o 7.430000 1.074000  6.892000 1.875000  7.968000 1.049000  -1.076000      2.148000  
1 1 1 36 26 32 o 12.58000 0.6621000 12.97000 0.9402000 12.19000 0.9325000 0.7758000      1.324000  
1 1 1 36 27 1  o 12.16000 0.3978000 11.74000 0.6154000 12.58000 0.5042000 -0.8330000     0.7956000 
1 1 1 36 27 3  o 17.69000 0.2966000 18.00000 0.4292000 17.38000 0.4094000 0.6176000      0.5932000 
1 1 1 36 27 5  o 13.03000 0.3671000 12.71000 0.5573000 13.36000 0.4780000 -0.6474000     0.7342000 
1 1 1 36 27 7  o 8.722000 0.4602000 8.482000 0.6334000 8.962000 0.6677000 -0.4799000     0.9203000 
1 1 1 36 27 9  o 4.298000 1.004000  4.797000 1.464000  3.799000 1.373000  0.9982000      2.007000  
1 1 1 36 27 11 o 2.679000 0.8348000 2.962000 1.324000  2.396000 1.017000  0.5666000      1.670000  
1 1 1 36 27 13 o 13.02000 0.4716000 13.44000 0.6680000 12.60000 0.6659000 0.8427000      0.9432000 
1 1 1 36 27 15 o 6.425000 0.8123000 8.873000 0.8091000 3.976000 1.409000  4.897000       1.625000  
1 1 1 36 27 17 o 8.665000 0.8760000 8.111000 0.8784000 9.220000 1.516000  -1.109000      1.752000  
1 1 1 36 27 19 o 11.84000 0.6509000 13.11000 0.6481000 10.57000 1.129000  2.534000       1.302000  
1 1 1 36 27 21 o 8.875000 0.7718000 9.821000 0.8483000 7.928000 1.290000  1.893000       1.544000  
1 1 1 36 27 23 o 3.067000 0.9623000 3.547000 1.490000  2.587000 1.218000  0.9597000      1.925000  
1 1 1 36 27 25 f 4.171000 1.021000  4.117000 1.371000  4.225000 1.514000  -0.1088000     2.043000  
1 1 1 36 27 27 o 3.408000 0.8933000 2.305000 1.105000  4.512000 1.404000  -2.207000      1.787000  
1 1 1 36 27 29 o 3.516000 0.9738000 3.909000 1.461000  3.123000 1.287000  0.7867000      1.948000  
1 1 1 36 27 31 o 5.858000 1.002000  5.918000 1.367000  5.798000 1.464000  0.1197000      2.003000  
1 1 1 36 28 0  o 9.890000 0.5996000 9.890000 0.5996000 9.890000 0.5996000 0.000000       0.000000  
1 1 1 36 28 2  o 6.874000 0.5963000 6.057000 0.9659000 7.691000 0.6995000 -1.634000      1.193000  
1 1 1 36 28 4  o 4.745000 0.7731000 4.609000 1.193000  4.881000 0.9834000 -0.2715000     1.546000  
1 1 1 36 28 6  o 3.127000 0.8370000 3.043000 1.214000  3.210000 1.153000  -0.1671000     1.674000  
1 1 1 36 28 8  o 11.65000 0.4696000 11.42000 0.7776000 11.87000 0.5268000 -0.4486000     0.9393000 
1 1 1 36 28 10 o 10.55000 0.5643000 11.03000 0.7465000 10.07000 0.8464000 0.9648000      1.129000  
1 1 1 36 28 12 o 5.403000 1.009000  5.381000 1.366000  5.425000 1.484000  -0.4374000E-01 2.018000  
1 1 1 36 28 14 o 2.591000 0.8713000 2.338000 1.097000  2.843000 1.354000  -0.5050000     1.743000  
1 1 1 36 28 16 o 4.979000 1.087000  5.728000 1.357000  4.230000 1.699000  1.498000       2.174000  
1 1 1 36 28 18 o 7.010000 0.9267000 7.368000 1.427000  6.652000 1.182000  0.7162000      1.853000  
1 1 1 36 28 20 o 14.52000 0.6639000 13.61000 0.8378000 15.43000 1.030000  -1.814000      1.328000  
1 1 1 36 28 22 o 9.401000 0.7237000 9.876000 0.7879000 8.925000 1.214000  0.9510000      1.447000  
1 1 1 36 28 24 o 5.334000 0.9581000 4.984000 1.316000  5.683000 1.392000  -0.6988000     1.916000  
1 1 1 36 28 26 o 4.581000 0.9989000 5.508000 1.423000  3.653000 1.402000  1.856000       1.998000  
1 1 1 36 28 28 o 7.499000 0.8951000 7.618000 1.069000  7.381000 1.436000  0.2374000      1.790000  
1 1 1 36 28 30 o 4.053000 1.024000  3.269000 1.411000  4.836000 1.484000  -1.567000      2.047000  
1 1 1 36 29 1  o 3.407000 0.8833000 4.217000 1.360000  2.597000 1.127000  1.620000       1.767000  
1 1 1 36 29 3  o 2.732000 0.8226000 2.859000 1.153000  2.605000 1.173000  0.2534000      1.645000  
1 1 1 36 29 5  o 2.735000 0.8300000 2.608000 1.148000  2.861000 1.199000  -0.2529000     1.660000  
1 1 1 36 29 7  o 4.456000 0.9100000 5.848000 1.251000  3.064000 1.322000  2.783000       1.820000  
1 1 1 36 29 9  o 8.659000 0.6915000 9.264000 0.7927000 8.054000 1.133000  1.210000       1.383000  
1 1 1 36 29 11 o 5.324000 1.108000  6.227000 1.392000  4.420000 1.724000  1.807000       2.216000  
1 1 1 36 29 13 o 6.447000 0.9463000 7.330000 1.029000  5.563000 1.588000  1.768000       1.893000  
1 1 1 36 29 15 o 3.720000 1.029000  3.517000 1.428000  3.923000 1.483000  -0.4059000     2.059000  
1 1 1 36 29 17 o 3.583000 1.022000  4.393000 1.619000  2.773000 1.247000  1.620000       2.044000  
1 1 1 36 29 19 o 4.235000 1.182000  4.704000 1.880000  3.766000 1.432000  0.9377000      2.364000  
1 1 1 36 29 21 o 4.388000 0.9776000 5.559000 1.362000  3.217000 1.402000  2.342000       1.955000  
1 1 1 36 29 23 o 7.364000 0.8333000 9.150000 0.9389000 5.579000 1.377000  3.572000       1.667000  
1 1 1 36 29 25 o 3.568000 0.9995000 3.958000 1.449000  3.178000 1.377000  0.7799000      1.999000  
1 1 1 36 29 27 o 6.632000 0.8591000 6.873000 1.185000  6.390000 1.244000  0.4823000      1.718000  
1 1 1 36 29 29 o 4.540000 0.9596000 3.401000 1.347000  5.680000 1.367000  -2.279000      1.919000  
1 1 1 36 30 0  o 22.22000 0.4693000 22.22000 0.4693000 22.22000 0.4693000 0.000000       0.000000  
1 1 1 36 30 2  o 14.59000 0.3680000 14.92000 0.5698000 14.26000 0.4657000 0.6566000      0.7359000 
1 1 1 36 30 4  o 7.371000 0.5773000 6.713000 0.7699000 8.029000 0.8605000 -1.316000      1.155000  
1 1 1 36 30 6  o 7.624000 0.4828000 7.814000 0.6893000 7.433000 0.6761000 0.3815000      0.9655000 
1 1 1 36 30 8  o 9.247000 0.6000000 8.811000 0.7994000 9.684000 0.8950000 -0.8725000     1.200000  
1 1 1 36 30 10 o 4.034000 0.9949000 3.522000 1.316000  4.546000 1.492000  -1.024000      1.990000  
1 1 1 36 30 12 o 4.209000 1.029000  5.339000 1.610000  3.079000 1.283000  2.260000       2.059000  
1 1 1 36 30 14 o 8.096000 0.7887000 7.219000 1.314000  8.972000 0.8720000 -1.753000      1.577000  
1 1 1 36 30 16 o 12.36000 0.5877000 11.97000 0.7405000 12.75000 0.9128000 -0.7867000     1.175000  
1 1 1 36 30 18 o 11.82000 0.5137000 12.21000 0.7131000 11.43000 0.7396000 0.7884000      1.027000  
1 1 1 36 30 20 o 4.714000 0.9876000 5.755000 1.385000  3.674000 1.408000  2.081000       1.975000  
1 1 1 36 30 22 o 3.910000 1.040000  3.445000 1.463000  4.375000 1.479000  -0.9302000     2.081000  
1 1 1 36 30 24 o 2.880000 0.9085000 2.898000 1.286000  2.862000 1.283000  0.3686000E-01  1.817000  
1 1 1 36 30 26 o 3.564000 0.9701000 2.974000 1.288000  4.154000 1.451000  -1.181000      1.940000  
1 1 1 36 30 28 o 3.328000 1.024000  3.043000 1.323000  3.612000 1.564000  -0.5692000     2.049000  
1 1 1 36 31 1  o 3.955000 0.9023000 4.225000 1.329000  3.686000 1.220000  0.5388000      1.805000  
1 1 1 36 31 3  o 4.536000 0.7632000 3.619000 1.217000  5.453000 0.9219000 -1.835000      1.526000  
1 1 1 36 31 5  o 5.927000 0.7771000 7.446000 1.047000  4.408000 1.149000  3.038000       1.554000  
1 1 1 36 31 7  o 4.727000 1.121000  4.743000 1.758000  4.710000 1.393000  0.3326000E-01  2.243000  
1 1 1 36 31 9  o 3.112000 0.9185000 2.864000 1.266000  3.360000 1.332000  -0.4965000     1.837000  
1 1 1 36 31 11 o 3.896000 1.005000  3.481000 1.469000  4.311000 1.373000  -0.8292000     2.011000  
1 1 1 36 31 13 o 10.10000 0.5740000 9.683000 0.8046000 10.52000 0.8188000 -0.8387000     1.148000  
1 1 1 36 31 15 o 3.613000 1.041000  3.344000 1.410000  3.881000 1.533000  -0.5374000     2.083000  
1 1 1 36 31 17 o 7.592000 0.7825000 8.341000 0.8993000 6.843000 1.281000  1.498000       1.565000  
1 1 1 36 31 19 o 4.642000 1.076000  4.115000 1.621000  5.168000 1.416000  -1.053000      2.152000  
1 1 1 36 31 21 o 5.503000 1.027000  6.514000 1.356000  4.491000 1.543000  2.023000       2.054000  
1 1 1 36 31 23 o 6.429000 0.9212000 8.039000 1.096000  4.818000 1.481000  3.221000       1.842000  
1 1 1 36 31 25 o 2.801000 0.8898000 2.736000 1.225000  2.866000 1.291000  -0.1303000     1.780000  
1 1 1 36 31 27 o 4.823000 1.117000  3.907000 1.562000  5.739000 1.596000  -1.832000      2.233000  
1 1 1 36 32 0  o 9.733000 0.5760000 9.733000 0.5760000 9.733000 0.5760000 0.000000       0.000000  
1 1 1 36 32 2  o 6.497000 0.5954000 6.702000 0.9735000 6.292000 0.6857000 0.4100000      1.191000  
1 1 1 36 32 4  o 10.82000 0.5259000 11.92000 0.6932000 9.721000 0.7910000 2.200000       1.052000  
1 1 1 36 32 6  o 9.146000 0.5483000 9.018000 0.7363000 9.275000 0.8125000 -0.2571000     1.097000  
1 1 1 36 32 8  o 6.399000 1.019000  7.145000 1.618000  5.653000 1.237000  1.492000       2.037000  
1 1 1 36 32 10 o 5.049000 0.9046000 3.760000 1.441000  6.337000 1.094000  -2.577000      1.809000  
1 1 1 36 32 12 o 11.56000 0.5206000 10.69000 0.8237000 12.43000 0.6369000 -1.735000      1.041000  
1 1 1 36 32 14 o 7.621000 0.7012000 7.609000 0.9583000 7.632000 1.024000  -0.2307000E-01 1.402000  
1 1 1 36 32 16 o 3.320000 0.9234000 3.004000 1.269000  3.636000 1.342000  -0.6322000     1.847000  
1 1 1 36 32 18 o 3.425000 0.9651000 3.262000 1.327000  3.587000 1.402000  -0.3251000     1.930000  
1 1 1 36 32 20 o 5.678000 0.9553000 5.519000 1.377000  5.836000 1.325000  -0.3165000     1.911000  
1 1 1 36 32 22 o 11.25000 0.7237000 12.28000 0.7594000 10.21000 1.232000  2.065000       1.447000  
1 1 1 36 32 24 o 3.719000 0.9806000 4.681000 1.501000  2.757000 1.262000  1.924000       1.961000  
1 1 1 36 32 26 o 3.739000 1.095000  3.883000 1.570000  3.596000 1.527000  0.2865000      2.191000  
1 1 1 36 33 1  o 4.578000 0.9482000 4.274000 1.444000  4.882000 1.230000  -0.6081000     1.896000  
1 1 1 36 33 3  o 3.297000 0.9080000 2.829000 1.195000  3.764000 1.368000  -0.9352000     1.816000  
1 1 1 36 33 5  o 3.615000 0.9031000 3.691000 1.279000  3.540000 1.276000  0.1510000      1.806000  
1 1 1 36 33 7  o 13.41000 0.4338000 14.02000 0.6145000 12.80000 0.6124000 1.227000       0.8676000 
1 1 1 36 33 9  o 5.065000 0.9314000 4.188000 1.360000  5.941000 1.273000  -1.753000      1.863000  
1 1 1 36 33 11 o 5.866000 0.8958000 6.349000 1.236000  5.382000 1.297000  0.9662000      1.792000  
1 1 1 36 33 13 o 11.29000 0.5371000 11.32000 0.7336000 11.26000 0.7846000 0.5585000E-01  1.074000  
1 1 1 36 33 15 o 4.603000 1.032000  5.150000 1.498000  4.056000 1.421000  1.094000       2.065000  
1 1 1 36 33 17 o 4.360000 1.086000  5.105000 1.506000  3.615000 1.565000  1.491000       2.172000  
1 1 1 36 33 19 f 7.291000 1.138000  7.313000 1.870000  7.269000 1.297000  0.4448000E-01  2.276000  
1 1 1 36 33 21 o 4.796000 1.047000  4.786000 1.423000  4.806000 1.535000  -0.1979000E-01 2.093000  
1 1 1 36 33 23 o 3.559000 0.9960000 3.207000 1.361000  3.910000 1.455000  -0.7033000     1.992000  
1 1 1 36 33 25 o 4.006000 1.040000  3.667000 1.486000  4.346000 1.455000  -0.6789000     2.079000  
1 1 1 36 34 0  o 5.290000 1.731000  5.290000 1.731000  5.290000 1.731000  0.000000       0.000000  
1 1 1 36 34 2  o 3.352000 0.9718000 3.673000 1.378000  3.031000 1.371000  0.6419000      1.944000  
1 1 1 36 34 4  f 2.988000 0.8600000 3.265000 1.225000  2.711000 1.208000  0.5540000      1.720000  
1 1 1 36 34 6  o 8.055000 0.8415000 8.746000 0.8242000 7.364000 1.467000  1.383000       1.683000  
1 1 1 36 34 8  o 5.800000 1.066000  5.954000 1.749000  5.647000 1.220000  0.3064000      2.132000  
1 1 1 36 34 10 o 8.802000 0.6052000 9.327000 0.8249000 8.277000 0.8857000 1.050000       1.210000  
1 1 1 36 34 12 o 5.470000 0.8927000 6.188000 1.168000  4.751000 1.351000  1.436000       1.785000  
1 1 1 36 34 14 o 4.427000 0.9570000 5.598000 1.362000  3.255000 1.345000  2.343000       1.914000  
1 1 1 36 34 16 o 3.693000 0.9818000 4.350000 1.480000  3.037000 1.291000  1.313000       1.964000  
1 1 1 36 34 18 o 5.633000 0.9755000 5.191000 1.406000  6.074000 1.352000  -0.8835000     1.951000  
1 1 1 36 34 20 o 6.272000 0.9182000 6.811000 1.268000  5.733000 1.328000  1.078000       1.836000  
1 1 1 36 34 22 o 3.501000 0.9848000 3.093000 1.326000  3.909000 1.456000  -0.8160000     1.970000  
1 1 1 36 34 24 o 3.827000 1.117000  2.922000 1.361000  4.733000 1.771000  -1.810000      2.233000  
1 1 1 36 35 1  o 3.619000 1.087000  4.137000 1.657000  3.101000 1.406000  1.036000       2.173000  
1 1 1 36 35 3  o 7.187000 0.7806000 5.604000 1.064000  8.770000 1.142000  -3.165000      1.561000  
1 1 1 36 35 5  o 6.154000 0.8173000 7.303000 0.9082000 5.005000 1.359000  2.298000       1.635000  
1 1 1 36 35 7  o 8.330000 0.6064000 8.505000 0.8830000 8.155000 0.8313000 0.3501000      1.213000  
1 1 1 36 35 9  o 4.090000 1.010000  3.381000 1.478000  4.800000 1.376000  -1.419000      2.019000  
1 1 1 36 35 11 o 2.963000 0.9007000 3.122000 1.314000  2.804000 1.233000  0.3182000      1.801000  
1 1 1 36 35 13 o 12.49000 0.5052000 12.90000 0.6838000 12.09000 0.7439000 0.8043000      1.010000  
1 1 1 36 35 15 o 6.737000 0.8370000 6.896000 1.181000  6.577000 1.187000  0.3191000      1.674000  
1 1 1 36 35 17 o 8.696000 0.9307000 9.491000 0.9125000 7.901000 1.622000  1.590000       1.861000  
1 1 1 36 35 19 o 7.686000 0.9048000 9.024000 1.358000  6.348000 1.196000  2.675000       1.810000  
1 1 1 36 35 21 o 4.896000 1.131000  5.325000 1.694000  4.467000 1.500000  0.8578000      2.262000  
1 1 1 36 36 0  o 4.008000 1.618000  4.008000 1.618000  4.008000 1.618000  0.000000       0.000000  
1 1 1 36 36 2  o 4.546000 1.129000  4.384000 1.536000  4.708000 1.656000  -0.3235000     2.258000  
1 1 1 36 36 4  o 3.692000 1.078000  3.287000 1.485000  4.097000 1.562000  -0.8104000     2.156000  
1 1 1 36 36 6  o 10.32000 0.5414000 11.39000 0.6879000 9.254000 0.8363000 2.137000       1.083000  
1 1 1 36 36 8  o 8.172000 0.6200000 9.077000 0.7497000 7.267000 0.9877000 1.811000       1.240000  
1 1 1 36 36 10 f 3.119000 0.9269000 2.939000 1.269000  3.300000 1.351000  -0.3616000     1.854000  
1 1 1 36 36 12 o 7.278000 0.7743000 7.122000 1.153000  7.435000 1.033000  -0.3129000     1.549000  
1 1 1 36 36 14 o 4.877000 1.027000  4.695000 1.488000  5.058000 1.416000  -0.3635000     2.054000  
1 1 1 36 36 16 o 6.841000 0.8212000 7.667000 1.040000  6.014000 1.271000  1.654000       1.642000  
1 1 1 36 36 18 o 5.599000 0.9831000 4.929000 1.510000  6.268000 1.260000  -1.339000      1.966000  
1 1 1 36 36 20 o 3.738000 1.121000  4.422000 1.821000  3.053000 1.309000  1.368000       2.242000  
1 1 1 36 37 1  f 4.280000 1.165000  4.086000 1.603000  4.473000 1.692000  -0.3862000     2.331000  
1 1 1 36 37 3  o 4.472000 1.105000  4.016000 1.556000  4.929000 1.569000  -0.9136000     2.210000  
1 1 1 36 37 5  o 4.547000 1.246000  4.129000 1.661000  4.964000 1.858000  -0.8352000     2.493000  
1 1 1 36 37 7  o 3.298000 1.022000  3.579000 1.538000  3.017000 1.347000  0.5619000      2.044000  
1 1 1 36 37 9  o 3.989000 1.027000  3.455000 1.476000  4.524000 1.428000  -1.069000      2.053000  
1 1 1 36 37 11 o 3.216000 0.9303000 3.296000 1.350000  3.135000 1.280000  0.1607000      1.861000  
1 1 1 36 37 13 o 2.770000 0.8810000 2.826000 1.275000  2.713000 1.216000  0.1131000      1.762000  
1 1 1 36 37 15 o 7.022000 0.7915000 7.492000 1.122000  6.552000 1.116000  0.9399000      1.583000  
1 1 1 36 37 17 o 4.684000 1.233000  4.179000 1.579000  5.190000 1.894000  -1.012000      2.466000  
1 1 1 36 38 0  o 7.643000 1.442000  7.643000 1.442000  7.643000 1.442000  0.000000       0.000000  
1 1 1 36 38 2  o 3.848000 1.075000  4.431000 1.569000  3.265000 1.471000  1.165000       2.150000  
1 1 1 36 38 4  o 5.351000 1.137000  4.331000 1.738000  6.371000 1.466000  -2.039000      2.274000  
1 1 1 36 38 6  o 8.871000 0.9505000 8.780000 1.278000  8.962000 1.408000  -0.1815000     1.901000  
1 1 1 36 38 8  o 10.04000 0.6546000 11.22000 1.018000  8.851000 0.8227000 2.369000       1.309000  
1 1 1 36 38 10 o 6.929000 1.002000  7.732000 1.579000  6.125000 1.235000  1.607000       2.005000  
1 1 1 36 38 12 o 3.469000 1.023000  3.153000 1.347000  3.785000 1.539000  -0.6315000     2.045000  
1 1 1 36 38 14 o 4.044000 1.034000  3.719000 1.489000  4.369000 1.434000  -0.6493000     2.068000  
1 1 1 36 39 1  o 4.232000 1.192000  4.192000 1.621000  4.271000 1.747000  -0.7866000E-01 2.384000  
1 1 1 36 39 3  o 4.601000 1.166000  4.341000 1.669000  4.862000 1.628000  -0.5213000     2.332000  
1 1 1 36 39 5  o 4.932000 1.272000  5.865000 1.848000  3.999000 1.748000  1.866000       2.543000  
1 1 1 36 39 7  o 5.474000 1.136000  4.957000 1.670000  5.990000 1.541000  -1.033000      2.272000  
1 1 1 36 39 9  o 4.025000 1.172000  4.226000 1.635000  3.824000 1.678000  0.4017000      2.343000  
1 1 1 36 39 11 o 6.037000 1.478000  6.420000 2.119000  5.655000 2.063000  0.7649000      2.957000  
1 1 1 36 40 0  o 4.375000 1.762000  4.375000 1.762000  4.375000 1.762000  0.000000       0.000000  
1 1 1 36 40 2  o 6.373000 1.566000  6.455000 2.184000  6.292000 2.245000  0.1627000      3.132000  
1 1 1 36 40 4  o 3.768000 1.218000  3.761000 1.693000  3.775000 1.751000  -0.1402000E-01 2.436000  
1 1 1 36 40 6  o 6.600000 1.522000  7.316000 1.949000  5.884000 2.338000  1.432000       3.044000  
1 1 1 37 0  1  f 8.538000 0.6730000 8.538000 0.6730000 8.538000 0.6730000 0.000000       0.000000  
1 1 1 37 0  3  o 9.046000 0.6749000 9.046000 0.6749000 9.046000 0.6749000 0.000000       0.000000  
1 1 1 37 0  5  o 4.596000 1.458000  4.596000 1.458000  4.596000 1.458000  0.000000       0.000000  
1 1 1 37 0  7  f 22.70000 0.5584000 22.70000 0.5584000 22.70000 0.5584000 0.000000       0.000000  
1 1 1 37 0  9  o 29.74000 0.5944000 29.74000 0.5944000 29.74000 0.5944000 0.000000       0.000000  
1 1 1 37 0  11 o 12.81000 0.5936000 12.81000 0.5936000 12.81000 0.5936000 0.000000       0.000000  
1 1 1 37 0  13 o 19.42000 0.4784000 19.42000 0.4784000 19.42000 0.4784000 0.000000       0.000000  
1 1 1 37 0  15 o 14.08000 0.5343000 14.08000 0.5343000 14.08000 0.5343000 0.000000       0.000000  
1 1 1 37 0  17 o 3.992000 1.302000  3.992000 1.302000  3.992000 1.302000  0.000000       0.000000  
1 1 1 37 0  19 o 3.070000 1.133000  3.070000 1.133000  3.070000 1.133000  0.000000       0.000000  
1 1 1 37 0  21 o 8.400000 0.7033000 8.400000 0.7033000 8.400000 0.7033000 0.000000       0.000000  
1 1 1 37 0  23 o 12.21000 0.6500000 12.21000 0.6500000 12.21000 0.6500000 0.000000       0.000000  
1 1 1 37 0  25 o 13.08000 0.8493000 13.08000 0.8493000 13.08000 0.8493000 0.000000       0.000000  
1 1 1 37 0  27 o 3.450000 1.273000  3.450000 1.273000  3.450000 1.273000  0.000000       0.000000  
1 1 1 37 0  29 o 7.087000 0.9818000 7.087000 0.9818000 7.087000 0.9818000 0.000000       0.000000  
1 1 1 37 0  31 o 3.061000 1.292000  3.061000 1.292000  3.061000 1.292000  0.000000       0.000000  
1 1 1 37 0  33 o 2.566000 1.163000  2.566000 1.163000  2.566000 1.163000  0.000000       0.000000  
1 1 1 37 0  35 o 2.394000 1.110000  2.394000 1.110000  2.394000 1.110000  0.000000       0.000000  
1 1 1 37 0  37 o 3.660000 1.338000  3.660000 1.338000  3.660000 1.338000  0.000000       0.000000  
1 1 1 37 0  39 f 4.965000 1.351000  4.965000 1.351000  4.965000 1.351000  0.000000       0.000000  
1 1 1 37 0  41 o 5.884000 1.511000  5.884000 1.511000  5.884000 1.511000  0.000000       0.000000  
1 1 1 37 1  0  o 5.069000 1.101000  5.069000 1.101000  5.069000 1.101000  0.000000       0.000000  
1 1 1 37 1  2  o 13.58000 0.3828000 14.24000 0.4966000 12.92000 0.5826000 1.327000       0.7655000 
1 1 1 37 1  4  o 12.76000 0.4151000 12.55000 0.5573000 12.97000 0.6152000 -0.4186000     0.8301000 
1 1 1 37 1  6  o 11.25000 0.4883000 11.46000 0.5957000 11.04000 0.7738000 0.4215000      0.9766000 
1 1 1 37 1  8  o 9.876000 0.4756000 10.29000 0.6305000 9.463000 0.7122000 0.8264000      0.9512000 
1 1 1 37 1  10 o 18.07000 0.3171000 17.73000 0.4532000 18.41000 0.4436000 -0.6828000     0.6342000 
1 1 1 37 1  12 o 6.038000 0.6424000 6.487000 0.8682000 5.589000 0.9472000 0.8975000      1.285000  
1 1 1 37 1  14 o 7.518000 0.5189000 7.322000 0.7421000 7.713000 0.7253000 -0.3912000     1.038000  
1 1 1 37 1  16 o 4.893000 0.7803000 4.973000 1.075000  4.812000 1.131000  0.1610000      1.561000  
1 1 1 37 1  18 o 3.016000 0.8008000 2.967000 1.154000  3.066000 1.110000  -0.9926000E-01 1.602000  
1 1 1 37 1  20 o 13.80000 0.3801000 14.27000 0.4781000 13.34000 0.5910000 0.9354000      0.7601000 
1 1 1 37 1  22 o 9.662000 0.5150000 9.531000 0.7382000 9.794000 0.7184000 -0.2625000     1.030000  
1 1 1 37 1  24 o 10.73000 0.4431000 11.10000 0.6131000 10.36000 0.6397000 0.7394000      0.8861000 
1 1 1 37 1  26 o 10.61000 0.4885000 11.06000 0.7294000 10.16000 0.6500000 0.8994000      0.9770000 
1 1 1 37 1  28 o 4.521000 0.9227000 5.202000 1.263000  3.840000 1.345000  1.362000       1.845000  
1 1 1 37 1  30 o 13.31000 0.4517000 13.46000 0.6670000 13.16000 0.6093000 0.3006000      0.9034000 
1 1 1 37 1  32 o 16.86000 0.4140000 17.88000 0.6037000 15.85000 0.5666000 2.038000       0.8279000 
1 1 1 37 1  34 o 3.031000 0.9096000 2.832000 1.231000  3.231000 1.340000  -0.3986000     1.819000  
1 1 1 37 1  36 o 3.714000 0.9362000 4.497000 1.357000  2.931000 1.291000  1.566000       1.872000  
1 1 1 37 1  38 o 4.159000 0.9774000 4.549000 1.306000  3.769000 1.454000  0.7795000      1.955000  
1 1 1 37 1  40 o 8.965000 0.6144000 9.556000 0.7939000 8.373000 0.9378000 1.183000       1.229000  
1 1 1 37 1  42 o 3.609000 1.029000  3.466000 1.497000  3.753000 1.412000  -0.2877000     2.058000  
1 1 1 37 2  1  o 20.35000 0.3444000 20.53000 0.4911000 20.17000 0.4830000 0.3645000      0.6888000 
1 1 1 37 2  3  o 21.40000 0.2968000 21.99000 0.4189000 20.80000 0.4205000 1.187000       0.5936000 
1 1 1 37 2  5  o 23.97000 0.3311000 23.85000 0.4777000 24.09000 0.4586000 -0.2457000     0.6622000 
1 1 1 37 2  7  o 18.70000 0.3687000 18.42000 0.4833000 18.98000 0.5569000 -0.5604000     0.7374000 
1 1 1 37 2  9  o 20.17000 0.3251000 20.13000 0.4482000 20.21000 0.4709000 -0.7508000E-01 0.6501000 
1 1 1 37 2  11 o 5.001000 0.7709000 4.799000 1.152000  5.204000 1.025000  -0.4049000     1.542000  
1 1 1 37 2  13 o 4.932000 0.7903000 4.656000 1.167000  5.207000 1.066000  -0.5511000     1.581000  
1 1 1 37 2  15 o 8.876000 0.4782000 8.420000 0.6962000 9.332000 0.6556000 -0.9128000     0.9563000 
1 1 1 37 2  17 o 16.46000 0.3454000 16.67000 0.5185000 16.25000 0.4566000 0.4223000      0.6909000 
1 1 1 37 2  19 o 5.258000 0.7605000 6.042000 0.9167000 4.474000 1.214000  1.568000       1.521000  
1 1 1 37 2  21 o 5.505000 0.9017000 5.578000 1.278000  5.431000 1.272000  0.1476000      1.803000  
1 1 1 37 2  23 o 13.00000 0.4875000 12.41000 0.7620000 13.59000 0.6084000 -1.178000      0.9751000 
1 1 1 37 2  25 o 10.87000 0.4793000 10.25000 0.6770000 11.49000 0.6788000 -1.245000      0.9587000 
1 1 1 37 2  27 o 15.95000 0.3668000 15.77000 0.5244000 16.13000 0.5130000 -0.3680000     0.7336000 
1 1 1 37 2  29 o 12.03000 0.4614000 12.15000 0.6452000 11.91000 0.6597000 0.2395000      0.9227000 
1 1 1 37 2  31 o 4.827000 0.9225000 5.291000 1.272000  4.363000 1.337000  0.9281000      1.845000  
1 1 1 37 2  33 o 4.916000 0.9676000 4.668000 1.474000  5.163000 1.254000  -0.4955000     1.935000  
1 1 1 37 2  35 o 6.985000 0.7717000 7.168000 0.9198000 6.803000 1.239000  0.3648000      1.543000  
1 1 1 37 2  37 o 6.374000 0.8911000 6.778000 1.199000  5.969000 1.318000  0.8091000      1.782000  
1 1 1 37 2  39 o 3.236000 0.9489000 3.047000 1.230000  3.426000 1.445000  -0.3787000     1.898000  
1 1 1 37 2  41 o 2.918000 0.9118000 3.060000 1.294000  2.776000 1.285000  0.2839000      1.824000  
1 1 1 37 3  0  o 20.98000 0.4794000 20.98000 0.4794000 20.98000 0.4794000 0.000000       0.000000  
1 1 1 37 3  2  o 11.76000 0.4105000 11.38000 0.6087000 12.15000 0.5509000 -0.7666000     0.8210000 
1 1 1 37 3  4  o 10.72000 0.4401000 10.95000 0.6146000 10.50000 0.6299000 0.4465000      0.8801000 
1 1 1 37 3  6  o 8.720000 0.5312000 8.621000 0.7405000 8.818000 0.7618000 -0.1964000     1.062000  
1 1 1 37 3  8  o 7.073000 0.6160000 7.383000 0.7510000 6.764000 0.9767000 0.6191000      1.232000  
1 1 1 37 3  10 o 9.484000 0.5120000 9.557000 0.7567000 9.411000 0.6900000 0.1463000      1.024000  
1 1 1 37 3  12 o 12.93000 0.3938000 12.54000 0.6281000 13.32000 0.4753000 -0.7753000     0.7877000 
1 1 1 37 3  14 o 4.558000 0.8783000 4.198000 1.397000  4.919000 1.064000  -0.7208000     1.757000  
1 1 1 37 3  16 o 22.79000 0.3860000 23.32000 0.6486000 22.26000 0.4186000 1.068000       0.7720000 
1 1 1 37 3  18 o 19.98000 0.3072000 20.31000 0.4381000 19.65000 0.4308000 0.6684000      0.6144000 
1 1 1 37 3  20 o 24.92000 0.3595000 25.61000 0.4206000 24.23000 0.5832000 1.380000       0.7190000 
1 1 1 37 3  22 o 7.175000 0.5840000 7.980000 0.7666000 6.369000 0.8811000 1.610000       1.168000  
1 1 1 37 3  24 o 4.191000 0.8684000 4.544000 1.214000  3.838000 1.242000  0.7061000      1.737000  
1 1 1 37 3  26 o 9.268000 0.5457000 9.397000 0.6819000 9.139000 0.8521000 0.2577000      1.091000  
1 1 1 37 3  28 o 13.97000 0.4342000 13.83000 0.5499000 14.11000 0.6722000 -0.2774000     0.8685000 
1 1 1 37 3  30 o 7.146000 0.7328000 7.358000 0.9572000 6.935000 1.110000  0.4227000      1.466000  
1 1 1 37 3  32 o 13.88000 0.4094000 13.22000 0.6095000 14.53000 0.5467000 -1.317000      0.8188000 
1 1 1 37 3  34 o 9.316000 0.5878000 8.403000 0.9277000 10.23000 0.7222000 -1.826000      1.176000  
1 1 1 37 3  36 o 5.293000 1.011000  5.647000 1.295000  4.939000 1.552000  0.7083000      2.021000  
1 1 1 37 3  38 o 5.012000 0.9156000 5.959000 1.048000  4.065000 1.502000  1.893000       1.831000  
1 1 1 37 3  40 o 4.804000 1.038000  4.812000 1.375000  4.796000 1.555000  0.1527000E-01  2.076000  
1 1 1 37 3  42 o 4.646000 1.230000  5.369000 1.798000  3.923000 1.680000  1.446000       2.461000  
1 1 1 37 4  1  o 15.44000 0.3318000 15.56000 0.4613000 15.33000 0.4770000 0.2347000      0.6636000 
1 1 1 37 4  3  o 23.95000 0.3204000 24.31000 0.4797000 23.59000 0.4249000 0.7151000      0.6409000 
1 1 1 37 4  5  o 17.44000 0.3961000 17.73000 0.6533000 17.14000 0.4481000 0.5899000      0.7922000 
1 1 1 37 4  7  o 12.89000 0.5280000 12.03000 0.8871000 13.75000 0.5728000 -1.727000      1.056000  
1 1 1 37 4  9  o 16.25000 0.3810000 16.15000 0.5741000 16.35000 0.5011000 -0.1921000     0.7620000 
1 1 1 37 4  11 o 8.507000 0.5723000 7.738000 0.9522000 9.276000 0.6350000 -1.539000      1.145000  
1 1 1 37 4  13 o 9.961000 0.5034000 9.176000 0.8172000 10.75000 0.5879000 -1.570000      1.007000  
1 1 1 37 4  15 o 18.96000 0.3867000 18.77000 0.6406000 19.15000 0.4333000 -0.3770000     0.7733000 
1 1 1 37 4  17 o 12.88000 0.4276000 12.34000 0.6326000 13.42000 0.5754000 -1.078000      0.8552000 
1 1 1 37 4  19 o 9.858000 0.5037000 9.656000 0.7531000 10.06000 0.6691000 -0.4051000     1.007000  
1 1 1 37 4  21 o 19.86000 0.3731000 20.28000 0.5411000 19.44000 0.5139000 0.8345000      0.7463000 
1 1 1 37 4  23 o 11.00000 0.4550000 11.22000 0.6816000 10.77000 0.6028000 0.4514000      0.9099000 
1 1 1 37 4  25 o 4.739000 0.8426000 5.381000 1.139000  4.096000 1.242000  1.285000       1.685000  
1 1 1 37 4  27 o 10.05000 0.5023000 9.407000 0.7514000 10.68000 0.6668000 -1.276000      1.005000  
1 1 1 37 4  29 o 16.31000 0.4416000 16.75000 0.6268000 15.87000 0.6222000 0.8805000      0.8832000 
1 1 1 37 4  31 o 8.720000 0.7000000 9.084000 1.009000  8.356000 0.9703000 0.7273000      1.400000  
1 1 1 37 4  33 o 8.293000 0.6797000 7.761000 1.086000  8.824000 0.8177000 -1.064000      1.359000  
1 1 1 37 4  35 f 11.40000 0.7376000 11.26000 0.6547000 11.55000 1.322000  -0.2886000     1.475000  
1 1 1 37 4  37 o 3.377000 0.9546000 2.852000 1.215000  3.902000 1.473000  -1.050000      1.909000  
1 1 1 37 4  39 o 4.941000 0.9660000 6.167000 1.273000  3.715000 1.453000  2.452000       1.932000  
1 1 1 37 4  41 o 8.452000 0.6080000 8.148000 0.9076000 8.757000 0.8092000 -0.6098000     1.216000  
1 1 1 37 5  0  o 19.58000 0.4253000 19.58000 0.4253000 19.58000 0.4253000 0.000000       0.000000  
1 1 1 37 5  2  o 13.64000 0.3984000 13.74000 0.6135000 13.54000 0.5085000 0.1983000      0.7968000 
1 1 1 37 5  4  o 8.756000 0.6122000 9.098000 1.009000  8.414000 0.6942000 0.6839000      1.224000  
1 1 1 37 5  6  o 3.523000 0.8192000 2.696000 1.104000  4.350000 1.210000  -1.654000      1.638000  
1 1 1 37 5  8  o 3.123000 0.8545000 2.639000 1.124000  3.606000 1.288000  -0.9666000     1.709000  
1 1 1 37 5  10 o 13.96000 0.3521000 13.54000 0.4992000 14.39000 0.4966000 -0.8485000     0.7042000 
1 1 1 37 5  12 o 4.938000 0.7619000 5.205000 1.031000  4.670000 1.122000  0.5344000      1.524000  
1 1 1 37 5  14 o 11.67000 0.4350000 11.13000 0.6840000 12.21000 0.5377000 -1.079000      0.8700000 
1 1 1 37 5  16 o 14.00000 0.3870000 13.84000 0.6117000 14.16000 0.4742000 -0.3187000     0.7740000 
1 1 1 37 5  18 o 7.589000 0.5623000 7.617000 0.7806000 7.561000 0.8097000 0.5537000E-01  1.125000  
1 1 1 37 5  20 o 11.37000 0.3980000 11.44000 0.5518000 11.30000 0.5738000 0.1380000      0.7961000 
1 1 1 37 5  22 o 20.30000 0.3774000 20.89000 0.5355000 19.71000 0.5321000 1.179000       0.7549000 
1 1 1 37 5  24 o 3.312000 0.9104000 3.282000 1.348000  3.343000 1.224000  -0.6138000E-01 1.821000  
1 1 1 37 5  26 o 9.259000 0.5162000 8.530000 0.7970000 9.989000 0.6561000 -1.459000      1.032000  
1 1 1 37 5  28 o 16.37000 0.3613000 16.69000 0.5149000 16.05000 0.5069000 0.6432000      0.7225000 
1 1 1 37 5  30 o 20.40000 0.3469000 20.73000 0.4888000 20.06000 0.4925000 0.6714000      0.6939000 
1 1 1 37 5  32 o 12.08000 0.6813000 11.78000 0.9640000 12.39000 0.9630000 -0.6016000     1.363000  
1 1 1 37 5  34 o 12.81000 0.5190000 12.90000 0.7476000 12.72000 0.7200000 0.1814000      1.038000  
1 1 1 37 5  36 o 13.72000 0.5071000 14.92000 0.5000000 12.52000 0.8824000 2.397000       1.014000  
1 1 1 37 5  38 o 4.775000 1.038000  5.265000 1.408000  4.286000 1.526000  0.9788000      2.077000  
1 1 1 37 5  40 o 3.853000 0.9948000 3.131000 1.232000  4.575000 1.562000  -1.444000      1.990000  
1 1 1 37 6  1  f 4.908000 0.8729000 5.575000 1.209000  4.241000 1.259000  1.333000       1.746000  
1 1 1 37 6  3  o 13.22000 0.4037000 13.50000 0.6311000 12.93000 0.5036000 0.5717000      0.8074000 
1 1 1 37 6  5  o 7.144000 0.5665000 6.407000 0.8752000 7.882000 0.7193000 -1.476000      1.133000  
1 1 1 37 6  7  o 3.652000 0.8843000 3.579000 1.299000  3.725000 1.200000  -0.1459000     1.769000  
1 1 1 37 6  9  o 10.15000 0.4326000 10.63000 0.5611000 9.666000 0.6586000 0.9667000      0.8652000 
1 1 1 37 6  11 o 11.47000 0.4449000 11.16000 0.6518000 11.77000 0.6058000 -0.6154000     0.8899000 
1 1 1 37 6  13 o 15.18000 0.4452000 14.79000 0.7173000 15.57000 0.5275000 -0.7757000     0.8904000 
1 1 1 37 6  15 o 18.09000 0.3134000 17.91000 0.4338000 18.27000 0.4524000 -0.3615000     0.6268000 
1 1 1 37 6  17 o 7.443000 0.5524000 7.289000 0.7216000 7.597000 0.8366000 -0.3072000     1.105000  
1 1 1 37 6  19 o 17.22000 0.3181000 17.18000 0.4479000 17.25000 0.4517000 -0.7126000E-01 0.6361000 
1 1 1 37 6  21 o 7.674000 0.6543000 9.583000 0.6443000 5.766000 1.139000  3.818000       1.309000  
1 1 1 37 6  23 o 16.98000 0.3662000 17.09000 0.4762000 16.88000 0.5564000 0.2070000      0.7324000 
1 1 1 37 6  25 o 5.106000 0.7508000 3.737000 1.156000  6.475000 0.9580000 -2.738000      1.502000  
1 1 1 37 6  27 o 6.276000 0.8348000 5.009000 1.448000  7.543000 0.8311000 -2.534000      1.670000  
1 1 1 37 6  29 o 12.35000 0.4253000 12.55000 0.5981000 12.15000 0.6048000 0.4046000      0.8506000 
1 1 1 37 6  31 o 13.38000 0.5038000 12.50000 0.7497000 14.26000 0.6731000 -1.759000      1.008000  
1 1 1 37 6  33 o 6.618000 0.8141000 6.052000 1.175000  7.184000 1.127000  -1.132000      1.628000  
1 1 1 37 6  35 o 8.181000 0.7442000 8.361000 1.045000  8.002000 1.060000  0.3587000      1.488000  
1 1 1 37 6  37 o 4.967000 0.9611000 4.513000 1.250000  5.420000 1.461000  -0.9068000     1.922000  
1 1 1 37 6  39 o 4.987000 0.9498000 5.758000 1.107000  4.215000 1.544000  1.543000       1.900000  
1 1 1 37 6  41 o 3.624000 0.9359000 3.676000 1.257000  3.572000 1.387000  0.1034000      1.872000  
1 1 1 37 7  0  o 4.840000 1.310000  4.840000 1.310000  4.840000 1.310000  0.000000       0.000000  
1 1 1 37 7  2  o 4.425000 0.7663000 5.177000 1.045000  3.673000 1.121000  1.503000       1.533000  
1 1 1 37 7  4  o 14.01000 0.3466000 13.73000 0.5044000 14.30000 0.4755000 -0.5647000     0.6933000 
1 1 1 37 7  6  o 14.42000 0.3800000 14.26000 0.5955000 14.59000 0.4723000 -0.3322000     0.7600000 
1 1 1 37 7  8  o 11.62000 0.4054000 12.04000 0.5224000 11.20000 0.6200000 0.8359000      0.8107000 
1 1 1 37 7  10 o 14.61000 0.3691000 14.96000 0.5328000 14.25000 0.5109000 0.7044000      0.7382000 
1 1 1 37 7  12 o 8.925000 0.4659000 9.204000 0.6459000 8.646000 0.6715000 0.5575000      0.9317000 
1 1 1 37 7  14 o 7.641000 0.5213000 7.838000 0.7542000 7.444000 0.7199000 0.3933000      1.043000  
1 1 1 37 7  16 o 24.63000 0.3214000 24.31000 0.4220000 24.94000 0.4849000 -0.6355000     0.6428000 
1 1 1 37 7  18 o 7.831000 0.5004000 8.356000 0.6645000 7.305000 0.7484000 1.051000       1.001000  
1 1 1 37 7  20 o 9.240000 0.4315000 8.934000 0.6007000 9.547000 0.6194000 -0.6135000     0.8629000 
1 1 1 37 7  22 o 14.84000 0.4293000 14.95000 0.4981000 14.73000 0.6993000 0.2206000      0.8586000 
1 1 1 37 7  24 o 6.876000 0.6361000 6.302000 0.9714000 7.450000 0.8216000 -1.148000      1.272000  
1 1 1 37 7  26 o 4.527000 0.8825000 4.151000 1.256000  4.904000 1.240000  -0.7525000     1.765000  
1 1 1 37 7  28 o 7.039000 0.7999000 7.521000 1.138000  6.557000 1.124000  0.9638000      1.600000  
1 1 1 37 7  30 o 10.76000 0.5397000 10.52000 0.8048000 11.00000 0.7195000 -0.4733000     1.079000  
1 1 1 37 7  32 o 7.001000 0.7002000 6.789000 1.066000  7.213000 0.9080000 -0.4237000     1.400000  
1 1 1 37 7  34 o 11.20000 0.5596000 10.37000 0.8860000 12.04000 0.6838000 -1.667000      1.119000  
1 1 1 37 7  36 o 9.172000 1.036000  8.938000 0.8304000 9.405000 1.898000  -0.4666000     2.071000  
1 1 1 37 7  38 o 8.343000 0.6539000 7.218000 0.9603000 9.468000 0.8877000 -2.251000      1.308000  
1 1 1 37 7  40 o 3.684000 0.9656000 2.915000 1.193000  4.453000 1.519000  -1.538000      1.931000  
1 1 1 37 8  1  o 4.207000 0.8517000 3.475000 1.203000  4.938000 1.206000  -1.463000      1.703000  
1 1 1 37 8  3  f 9.060000 0.5170000 9.034000 0.6928000 9.086000 0.7676000 -0.5219000E-01 1.034000  
1 1 1 37 8  5  o 17.79000 0.3147000 17.95000 0.4541000 17.64000 0.4359000 0.3081000      0.6295000 
1 1 1 37 8  7  o 17.26000 0.3509000 17.25000 0.5482000 17.27000 0.4380000 -0.1181000E-01 0.7017000 
1 1 1 37 8  9  o 12.50000 0.5114000 12.45000 0.7901000 12.54000 0.6495000 -0.8321000E-01 1.023000  
1 1 1 37 8  11 f 8.925000 0.4714000 9.341000 0.6584000 8.510000 0.6748000 0.8308000      0.9428000 
1 1 1 37 8  13 o 15.90000 0.3169000 16.12000 0.4520000 15.68000 0.4443000 0.4392000      0.6338000 
1 1 1 37 8  15 o 2.498000 0.7560000 3.048000 1.193000  1.948000 0.9287000 1.100000       1.512000  
1 1 1 37 8  17 o 9.020000 0.4525000 9.396000 0.5978000 8.645000 0.6796000 0.7514000      0.9051000 
1 1 1 37 8  19 o 4.358000 0.8080000 3.848000 1.192000  4.868000 1.091000  -1.020000      1.616000  
1 1 1 37 8  21 o 8.375000 0.4799000 8.557000 0.6144000 8.193000 0.7374000 0.3632000      0.9598000 
1 1 1 37 8  23 o 6.669000 0.6989000 7.205000 0.8347000 6.133000 1.121000  1.072000       1.398000  
1 1 1 37 8  25 o 14.41000 0.4313000 15.17000 0.6642000 13.65000 0.5505000 1.523000       0.8627000 
1 1 1 37 8  27 o 10.59000 0.4957000 10.90000 0.6350000 10.27000 0.7614000 0.6326000      0.9915000 
1 1 1 37 8  29 o 17.01000 0.3761000 17.68000 0.5096000 16.35000 0.5532000 1.338000       0.7522000 
1 1 1 37 8  31 o 13.33000 0.4477000 12.75000 0.7304000 13.90000 0.5180000 -1.150000      0.8954000 
1 1 1 37 8  33 o 16.31000 0.4951000 17.11000 0.7968000 15.52000 0.5878000 1.589000       0.9901000 
1 1 1 37 8  35 o 5.350000 0.8389000 6.793000 0.8823000 3.908000 1.427000  2.885000       1.678000  
1 1 1 37 8  37 o 5.700000 1.113000  6.314000 1.413000  5.085000 1.721000  1.228000       2.227000  
1 1 1 37 8  39 o 5.699000 0.8792000 4.759000 1.182000  6.638000 1.302000  -1.879000      1.758000  
1 1 1 37 8  41 o 3.082000 0.8815000 3.608000 1.286000  2.557000 1.206000  1.051000       1.763000  
1 1 1 37 9  0  o 4.338000 1.150000  4.338000 1.150000  4.338000 1.150000  0.000000       0.000000  
1 1 1 37 9  2  o 10.66000 0.3837000 9.984000 0.5329000 11.33000 0.5523000 -1.344000      0.7675000 
1 1 1 37 9  4  o 16.44000 0.3558000 16.64000 0.4631000 16.25000 0.5403000 0.3848000      0.7116000 
1 1 1 37 9  6  o 8.756000 0.5342000 8.444000 0.7166000 9.069000 0.7925000 -0.6251000     1.068000  
1 1 1 37 9  8  o 6.042000 0.8288000 6.093000 1.241000  5.990000 1.099000  0.1025000      1.658000  
1 1 1 37 9  10 o 10.55000 0.4211000 10.55000 0.5637000 10.54000 0.6257000 0.1802000E-01  0.8422000 
1 1 1 37 9  12 o 14.68000 0.3478000 14.75000 0.4640000 14.60000 0.5183000 0.1513000      0.6957000 
1 1 1 37 9  14 o 8.329000 0.4850000 7.862000 0.6642000 8.796000 0.7068000 -0.9348000     0.9700000 
1 1 1 37 9  16 o 15.38000 0.3247000 15.49000 0.4538000 15.27000 0.4646000 0.2209000      0.6494000 
1 1 1 37 9  18 o 10.20000 0.4155000 10.16000 0.5776000 10.25000 0.5974000 -0.9103000E-01 0.8310000 
1 1 1 37 9  20 o 7.698000 0.5203000 7.494000 0.7761000 7.902000 0.6932000 -0.4086000     1.041000  
1 1 1 37 9  22 o 3.789000 0.8957000 3.796000 1.243000  3.783000 1.290000  0.1270000E-01  1.791000  
1 1 1 37 9  24 o 6.262000 0.8435000 4.776000 1.419000  7.747000 0.9123000 -2.970000      1.687000  
1 1 1 37 9  26 o 9.564000 0.5300000 8.858000 0.7548000 10.27000 0.7444000 -1.412000      1.060000  
1 1 1 37 9  28 o 10.61000 0.4640000 10.60000 0.6593000 10.62000 0.6530000 -0.1605000E-01 0.9279000 
1 1 1 37 9  30 o 7.827000 0.7115000 7.494000 1.181000  8.160000 0.7934000 -0.6664000     1.423000  
1 1 1 37 9  32 o 9.487000 0.5394000 9.247000 0.7514000 9.727000 0.7741000 -0.4794000     1.079000  
1 1 1 37 9  34 o 4.695000 0.9532000 4.596000 1.287000  4.794000 1.407000  -0.1983000     1.906000  
1 1 1 37 9  36 o 8.668000 0.6592000 8.036000 0.7659000 9.300000 1.073000  -1.264000      1.318000  
1 1 1 37 9  38 o 5.579000 0.9429000 6.292000 1.106000  4.867000 1.527000  1.425000       1.886000  
1 1 1 37 9  40 o 3.337000 0.9452000 2.603000 1.136000  4.071000 1.511000  -1.467000      1.890000  
1 1 1 37 10 1  o 10.43000 0.4175000 10.18000 0.6088000 10.67000 0.5715000 -0.4846000     0.8350000 
1 1 1 37 10 3  o 12.59000 0.3622000 12.46000 0.5296000 12.72000 0.4942000 -0.2639000     0.7244000 
1 1 1 37 10 5  o 21.07000 0.4297000 21.40000 0.6999000 20.74000 0.4985000 0.6630000      0.8593000 
1 1 1 37 10 7  o 18.99000 0.3331000 18.58000 0.5046000 19.40000 0.4350000 -0.8133000     0.6662000 
1 1 1 37 10 9  o 17.37000 0.3389000 17.68000 0.4960000 17.06000 0.4621000 0.6233000      0.6779000 
1 1 1 37 10 11 o 4.330000 0.8239000 5.033000 1.104000  3.627000 1.223000  1.406000       1.648000  
1 1 1 37 10 13 o 11.77000 0.3960000 11.40000 0.5326000 12.14000 0.5861000 -0.7424000     0.7919000 
1 1 1 37 10 15 o 12.30000 0.3550000 11.51000 0.5123000 13.09000 0.4915000 -1.585000      0.7099000 
1 1 1 37 10 17 f 6.304000 0.5815000 6.459000 0.8001000 6.149000 0.8441000 0.3102000      1.163000  
1 1 1 37 10 19 o 5.583000 0.7064000 5.896000 0.8825000 5.271000 1.103000  0.6243000      1.413000  
1 1 1 37 10 21 o 3.457000 0.8612000 3.741000 1.133000  3.173000 1.297000  0.5686000      1.722000  
1 1 1 37 10 23 o 11.92000 0.5004000 11.36000 0.5882000 12.49000 0.8096000 -1.127000      1.001000  
1 1 1 37 10 25 f 11.79000 0.4228000 10.95000 0.6388000 12.63000 0.5539000 -1.679000      0.8455000 
1 1 1 37 10 27 o 7.337000 0.6359000 6.218000 0.9789000 8.456000 0.8119000 -2.237000      1.272000  
1 1 1 37 10 29 o 5.613000 0.8869000 5.336000 1.419000  5.889000 1.064000  -0.5532000     1.774000  
1 1 1 37 10 31 o 2.586000 0.7968000 2.940000 1.209000  2.231000 1.038000  0.7092000      1.594000  
1 1 1 37 10 33 o 12.18000 0.4352000 11.96000 0.5455000 12.39000 0.6782000 -0.4326000     0.8703000 
1 1 1 37 10 35 o 12.72000 0.4803000 11.88000 0.6501000 13.56000 0.7071000 -1.675000      0.9605000 
1 1 1 37 10 37 o 3.300000 0.9602000 2.933000 1.182000  3.667000 1.513000  -0.7346000     1.920000  
1 1 1 37 10 39 o 5.091000 0.9990000 4.544000 1.280000  5.637000 1.534000  -1.094000      1.998000  
1 1 1 37 11 0  o 8.752000 0.6155000 8.752000 0.6155000 8.752000 0.6155000 0.000000       0.000000  
1 1 1 37 11 2  o 5.198000 1.021000  5.100000 1.675000  5.296000 1.168000  -0.1962000     2.042000  
1 1 1 37 11 4  f 7.270000 0.6278000 7.384000 0.9650000 7.156000 0.8033000 0.2283000      1.256000  
1 1 1 37 11 6  o 10.43000 0.4456000 9.918000 0.5881000 10.94000 0.6695000 -1.018000      0.8911000 
1 1 1 37 11 8  o 6.867000 0.5999000 5.797000 0.9475000 7.936000 0.7362000 -2.139000      1.200000  
1 1 1 37 11 10 o 17.45000 0.3601000 17.90000 0.5391000 16.99000 0.4776000 0.9125000      0.7202000 
1 1 1 37 11 12 o 11.51000 0.4012000 11.49000 0.5408000 11.54000 0.5928000 -0.5274000E-01 0.8025000 
1 1 1 37 11 14 o 7.829000 0.5022000 7.491000 0.6965000 8.167000 0.7238000 -0.6754000     1.004000  
1 1 1 37 11 16 o 10.17000 0.3985000 9.943000 0.5840000 10.39000 0.5425000 -0.4460000     0.7971000 
1 1 1 37 11 18 o 4.750000 0.8636000 4.566000 1.158000  4.933000 1.281000  -0.3673000     1.727000  
1 1 1 37 11 20 o 5.338000 0.8344000 5.326000 1.062000  5.350000 1.287000  -0.2427000E-01 1.669000  
1 1 1 37 11 22 o 3.801000 0.8384000 3.163000 1.154000  4.440000 1.217000  -1.277000      1.677000  
1 1 1 37 11 24 o 13.92000 0.4206000 14.14000 0.5550000 13.69000 0.6322000 0.4448000      0.8413000 
1 1 1 37 11 26 o 3.303000 0.8744000 3.004000 1.201000  3.602000 1.271000  -0.5978000     1.749000  
1 1 1 37 11 28 o 7.070000 0.7406000 7.428000 1.134000  6.713000 0.9525000 0.7147000      1.481000  
1 1 1 37 11 30 o 5.280000 0.7941000 6.084000 0.9705000 4.475000 1.257000  1.609000       1.588000  
1 1 1 37 11 32 o 6.325000 0.7692000 7.191000 0.7692000 5.460000 1.332000  1.731000       1.538000  
1 1 1 37 11 34 o 16.32000 0.3768000 15.20000 0.4767000 17.44000 0.5837000 -2.238000      0.7536000 
1 1 1 37 11 36 o 10.16000 0.5768000 8.953000 0.6963000 11.37000 0.9198000 -2.421000      1.154000  
1 1 1 37 11 38 o 3.731000 1.009000  3.323000 1.330000  4.138000 1.517000  -0.8146000     2.017000  
1 1 1 37 11 40 o 10.07000 0.5761000 9.540000 0.6423000 10.61000 0.9566000 -1.069000      1.152000  
1 1 1 37 12 1  o 6.965000 0.8684000 5.948000 1.326000  7.981000 1.122000  -2.033000      1.737000  
1 1 1 37 12 3  o 8.291000 0.5657000 9.054000 0.6849000 7.527000 0.9006000 1.527000       1.131000  
1 1 1 37 12 5  o 8.622000 0.5165000 8.605000 0.6450000 8.640000 0.8070000 -0.3444000E-01 1.033000  
1 1 1 37 12 7  o 13.65000 0.4913000 13.55000 0.4841000 13.75000 0.8549000 -0.2029000     0.9825000 
1 1 1 37 12 9  o 10.25000 0.5030000 10.21000 0.5295000 10.29000 0.8554000 -0.8346000E-01 1.006000  
1 1 1 37 12 11 o 3.797000 0.9305000 3.738000 1.251000  3.856000 1.378000  -0.1182000     1.861000  
1 1 1 37 12 13 f 19.29000 0.3333000 19.30000 0.4232000 19.27000 0.5149000 0.2478000E-01  0.6665000 
1 1 1 37 12 15 o 2.188000 0.7094000 2.150000 0.9638000 2.227000 1.041000  -0.7642000E-01 1.419000  
1 1 1 37 12 17 o 9.515000 0.4132000 9.515000 0.5753000 9.515000 0.5933000 -0.1526000E-03 0.8264000 
1 1 1 37 12 19 o 3.417000 0.8379000 2.872000 1.157000  3.963000 1.213000  -1.091000      1.676000  
1 1 1 37 12 21 o 9.537000 0.4533000 10.53000 0.5800000 8.544000 0.6967000 1.986000       0.9065000 
1 1 1 37 12 23 o 2.608000 0.7852000 2.718000 1.100000  2.498000 1.120000  0.2206000      1.570000  
1 1 1 37 12 25 o 2.366000 0.7617000 2.602000 1.141000  2.131000 1.009000  0.4714000      1.523000  
1 1 1 37 12 27 o 7.427000 0.6860000 6.645000 1.146000  8.208000 0.7545000 -1.563000      1.372000  
1 1 1 37 12 29 o 6.828000 0.6876000 6.438000 1.012000  7.218000 0.9307000 -0.7804000     1.375000  
1 1 1 37 12 31 o 6.106000 0.8298000 6.245000 0.8770000 5.968000 1.409000  0.2765000      1.660000  
1 1 1 37 12 33 o 6.676000 0.8386000 6.726000 0.8307000 6.626000 1.457000  0.9978000E-01  1.677000  
1 1 1 37 12 35 o 2.963000 0.8908000 3.020000 1.242000  2.906000 1.277000  0.1139000      1.782000  
1 1 1 37 12 37 o 7.258000 0.7668000 6.354000 0.9473000 8.162000 1.206000  -1.807000      1.534000  
1 1 1 37 12 39 o 2.881000 0.8821000 3.376000 1.346000  2.386000 1.141000  0.9892000      1.764000  
1 1 1 37 13 0  o 4.723000 1.128000  4.723000 1.128000  4.723000 1.128000  0.000000       0.000000  
1 1 1 37 13 2  o 17.81000 0.3165000 17.27000 0.4590000 18.35000 0.4357000 -1.078000      0.6329000 
1 1 1 37 13 4  o 14.09000 0.4475000 13.87000 0.5540000 14.31000 0.7030000 -0.4438000     0.8950000 
1 1 1 37 13 6  o 13.39000 0.4080000 13.38000 0.4717000 13.39000 0.6659000 -0.2625000E-02 0.8160000 
1 1 1 37 13 8  o 13.39000 0.5867000 13.70000 0.4715000 13.07000 1.074000  0.6327000      1.173000  
1 1 1 37 13 10 o 15.32000 0.3666000 15.29000 0.4483000 15.36000 0.5802000 -0.6901000E-01 0.7333000 
1 1 1 37 13 12 o 3.629000 0.8657000 3.907000 1.270000  3.351000 1.177000  0.5559000      1.731000  
1 1 1 37 13 14 o 10.12000 0.4104000 10.08000 0.5592000 10.15000 0.6008000 -0.6636000E-01 0.8208000 
1 1 1 37 13 16 o 7.111000 0.5324000 7.190000 0.7315000 7.031000 0.7737000 0.1583000      1.065000  
1 1 1 37 13 18 o 12.76000 0.3586000 13.39000 0.4956000 12.14000 0.5183000 1.255000       0.7171000 
1 1 1 37 13 20 f 18.79000 0.3559000 18.26000 0.5018000 19.33000 0.5048000 -1.075000      0.7118000 
1 1 1 37 13 22 o 13.67000 0.4087000 13.45000 0.5674000 13.89000 0.5885000 -0.4461000     0.8175000 
1 1 1 37 13 24 o 9.728000 0.5213000 9.926000 0.6456000 9.531000 0.8186000 0.3943000      1.043000  
1 1 1 37 13 26 o 10.31000 0.4720000 10.36000 0.7211000 10.27000 0.6091000 0.9256000E-01  0.9439000 
1 1 1 37 13 28 o 3.513000 0.8101000 2.355000 1.068000  4.671000 1.218000  -2.316000      1.620000  
1 1 1 37 13 30 o 16.89000 0.4295000 17.06000 0.4807000 16.71000 0.7118000 0.3507000      0.8589000 
1 1 1 37 13 32 o 14.55000 0.4101000 14.75000 0.5074000 14.34000 0.6445000 0.4146000      0.8202000 
1 1 1 37 13 34 o 17.15000 0.3683000 17.16000 0.4381000 17.14000 0.5921000 0.2248000E-01  0.7366000 
1 1 1 37 13 36 o 4.821000 0.8825000 5.537000 0.9866000 4.106000 1.463000  1.430000       1.765000  
1 1 1 37 13 38 o 3.727000 0.9332000 4.008000 1.171000  3.445000 1.453000  0.5639000      1.866000  
1 1 1 37 13 40 o 4.917000 1.728000  4.917000 1.728000  ?        ?         ?              ?         
1 1 1 37 14 1  o 5.492000 0.7004000 5.620000 0.9743000 5.364000 1.006000  0.2564000      1.401000  
1 1 1 37 14 3  o 3.466000 0.8768000 3.086000 1.201000  3.846000 1.278000  -0.7604000     1.754000  
1 1 1 37 14 5  o 6.458000 0.6410000 6.601000 0.8009000 6.315000 1.001000  0.2854000      1.282000  
1 1 1 37 14 7  f 7.054000 0.6974000 7.125000 0.9179000 6.982000 1.050000  0.1434000      1.395000  
1 1 1 37 14 9  o 4.755000 0.8198000 3.502000 1.144000  6.008000 1.174000  -2.506000      1.640000  
1 1 1 37 14 11 o 7.163000 0.5713000 7.658000 0.6953000 6.667000 0.9067000 0.9905000      1.143000  
1 1 1 37 14 13 o 5.492000 0.7079000 5.492000 0.9698000 5.492000 1.032000  -0.2646000E-03 1.416000  
1 1 1 37 14 15 o 5.773000 0.7539000 5.822000 0.8368000 5.725000 1.254000  0.9753000E-01  1.508000  
1 1 1 37 14 17 o 4.664000 0.8782000 4.428000 1.249000  4.900000 1.235000  -0.4715000     1.756000  
1 1 1 37 14 19 o 11.36000 0.4603000 11.28000 0.6263000 11.44000 0.6748000 -0.1604000     0.9207000 
1 1 1 37 14 21 f 6.603000 0.6448000 6.326000 0.8689000 6.881000 0.9528000 -0.5556000     1.290000  
1 1 1 37 14 23 o 3.936000 0.8842000 3.305000 1.265000  4.567000 1.236000  -1.262000      1.768000  
1 1 1 37 14 25 o 4.589000 0.8900000 3.983000 1.147000  5.195000 1.361000  -1.212000      1.780000  
1 1 1 37 14 27 o 12.63000 0.4123000 12.45000 0.6226000 12.80000 0.5406000 -0.3500000     0.8246000 
1 1 1 37 14 29 o 16.57000 0.5794000 16.10000 0.5643000 17.04000 1.012000  -0.9412000     1.159000  
1 1 1 37 14 31 o 3.250000 0.8672000 3.523000 1.165000  2.978000 1.285000  0.5448000      1.734000  
1 1 1 37 14 33 o 9.020000 0.5711000 9.175000 0.6503000 8.864000 0.9389000 0.3103000      1.142000  
1 1 1 37 14 35 o 4.481000 0.9212000 4.887000 1.128000  4.075000 1.457000  0.8121000      1.842000  
1 1 1 37 14 37 o 4.391000 0.9794000 3.464000 1.177000  5.317000 1.565000  -1.853000      1.959000  
1 1 1 37 14 39 o 5.737000 1.037000  6.092000 0.9346000 5.382000 1.850000  0.7096000      2.073000  
1 1 1 37 15 0  o 10.29000 0.6256000 10.29000 0.6256000 10.29000 0.6256000 0.000000       0.000000  
1 1 1 37 15 2  o 7.879000 0.5761000 7.909000 0.8316000 7.849000 0.7975000 0.5983000E-01  1.152000  
1 1 1 37 15 4  o 20.15000 0.3034000 19.75000 0.4403000 20.55000 0.4174000 -0.8001000     0.6067000 
1 1 1 37 15 6  o 20.97000 0.3103000 20.90000 0.4583000 21.04000 0.4183000 -0.1377000     0.6205000 
1 1 1 37 15 8  o 5.725000 0.6655000 6.500000 0.8127000 4.950000 1.054000  1.550000       1.331000  
1 1 1 37 15 10 o 7.763000 0.6485000 7.887000 0.7699000 7.640000 1.044000  0.2464000      1.297000  
1 1 1 37 15 12 o 5.497000 0.8239000 5.491000 0.9921000 5.503000 1.316000  -0.1236000E-01 1.648000  
1 1 1 37 15 14 o 5.482000 0.8240000 5.379000 1.094000  5.585000 1.233000  -0.2059000     1.648000  
1 1 1 37 15 16 o 15.61000 0.4135000 16.15000 0.5053000 15.06000 0.6548000 1.097000       0.8271000 
1 1 1 37 15 18 o 17.30000 0.3713000 17.31000 0.4420000 17.28000 0.5966000 0.2356000E-01  0.7425000 
1 1 1 37 15 20 o 8.073000 0.5048000 8.511000 0.6360000 7.635000 0.7841000 0.8760000      1.010000  
1 1 1 37 15 22 o 3.163000 0.8822000 2.936000 1.157000  3.390000 1.332000  -0.4536000     1.764000  
1 1 1 37 15 24 o 10.81000 0.4940000 10.77000 0.6043000 10.85000 0.7818000 -0.8002000E-01 0.9881000 
1 1 1 37 15 26 o 6.935000 0.8353000 6.281000 1.031000  7.590000 1.314000  -1.309000      1.671000  
1 1 1 37 15 28 o 5.201000 0.8590000 4.577000 1.229000  5.825000 1.200000  -1.248000      1.718000  
1 1 1 37 15 30 o 5.484000 0.8449000 5.841000 0.9139000 5.127000 1.421000  0.7137000      1.690000  
1 1 1 37 15 32 o 4.810000 0.8880000 4.634000 1.101000  4.986000 1.394000  -0.3520000     1.776000  
1 1 1 37 15 34 o 10.83000 0.4792000 11.27000 0.5446000 10.40000 0.7887000 0.8737000      0.9585000 
1 1 1 37 15 36 o 12.20000 0.4731000 12.61000 0.5352000 11.79000 0.7802000 0.8178000      0.9462000 
1 1 1 37 15 38 o 3.884000 1.044000  3.263000 1.197000  4.504000 1.711000  -1.240000      2.088000  
1 1 1 37 16 1  o 6.012000 0.6967000 6.882000 0.8545000 5.143000 1.101000  1.739000       1.393000  
1 1 1 37 16 3  o 6.550000 0.6917000 5.472000 1.167000  7.629000 0.7435000 -2.157000      1.383000  
1 1 1 37 16 5  o 5.071000 0.7856000 5.582000 1.059000  4.559000 1.161000  1.022000       1.571000  
1 1 1 37 16 7  o 4.474000 0.8741000 4.896000 1.133000  4.052000 1.331000  0.8437000      1.748000  
1 1 1 37 16 9  o 13.59000 0.4408000 13.67000 0.5144000 13.50000 0.7160000 0.1715000      0.8816000 
1 1 1 37 16 11 o 10.83000 0.3964000 10.33000 0.5941000 11.34000 0.5249000 -1.003000      0.7928000 
1 1 1 37 16 13 o 4.846000 0.8229000 5.031000 1.091000  4.662000 1.232000  0.3685000      1.646000  
1 1 1 37 16 15 o 6.661000 0.5401000 6.594000 0.7050000 6.728000 0.8186000 -0.1345000     1.080000  
1 1 1 37 16 17 o 6.294000 0.6409000 7.507000 0.7049000 5.081000 1.071000  2.426000       1.282000  
1 1 1 37 16 19 o 14.46000 0.3385000 14.64000 0.4639000 14.29000 0.4930000 0.3496000      0.6769000 
1 1 1 37 16 21 o 9.712000 0.4226000 9.909000 0.5708000 9.514000 0.6234000 0.3946000      0.8453000 
1 1 1 37 16 23 o 4.566000 0.9327000 4.081000 1.304000  5.051000 1.334000  -0.9706000     1.865000  
1 1 1 37 16 25 o 10.69000 0.4912000 10.14000 0.6833000 11.24000 0.7058000 -1.102000      0.9824000 
1 1 1 37 16 27 o 18.79000 0.5218000 18.42000 0.5495000 19.15000 0.8873000 -0.7301000     1.044000  
1 1 1 37 16 29 o 9.210000 0.5155000 9.096000 0.7123000 9.323000 0.7453000 -0.2268000     1.031000  
1 1 1 37 16 31 o 10.75000 0.4627000 10.97000 0.5036000 10.53000 0.7763000 0.4470000      0.9253000 
1 1 1 37 16 33 o 3.961000 0.9193000 4.520000 1.182000  3.402000 1.408000  1.118000       1.839000  
1 1 1 37 16 35 o 3.621000 0.8946000 4.148000 1.196000  3.095000 1.330000  1.053000       1.789000  
1 1 1 37 16 37 o 5.376000 1.216000  4.680000 1.148000  6.071000 2.144000  -1.391000      2.432000  
1 1 1 37 17 0  o 9.801000 0.5757000 9.801000 0.5757000 9.801000 0.5757000 0.000000       0.000000  
1 1 1 37 17 2  o 9.198000 0.4443000 8.566000 0.6762000 9.830000 0.5764000 -1.263000      0.8886000 
1 1 1 37 17 4  o 8.175000 0.4731000 7.248000 0.7129000 9.102000 0.6222000 -1.854000      0.9462000 
1 1 1 37 17 6  o 9.900000 0.4580000 10.28000 0.5580000 9.516000 0.7265000 0.7681000      0.9161000 
1 1 1 37 17 8  o 8.731000 0.4729000 8.887000 0.6137000 8.574000 0.7198000 0.3130000      0.9459000 
1 1 1 37 17 10 o 9.564000 0.4765000 9.491000 0.6178000 9.637000 0.7256000 -0.1463000     0.9529000 
1 1 1 37 17 12 o 10.45000 0.4048000 10.36000 0.5342000 10.53000 0.6083000 -0.1716000     0.8096000 
1 1 1 37 17 14 f 2.799000 0.7689000 3.571000 1.206000  2.027000 0.9539000 1.544000       1.538000  
1 1 1 37 17 16 o 9.055000 0.6402000 8.933000 1.006000  9.177000 0.7916000 -0.2439000     1.280000  
1 1 1 37 17 18 o 13.67000 0.4537000 13.70000 0.6863000 13.63000 0.5935000 0.7205000E-01  0.9074000 
1 1 1 37 17 20 o 2.944000 0.8867000 3.583000 1.427000  2.306000 1.053000  1.277000       1.773000  
1 1 1 37 17 22 o 6.283000 0.8397000 5.894000 1.421000  6.671000 0.8948000 -0.7774000     1.679000  
1 1 1 37 17 24 f 5.349000 0.9746000 5.882000 1.524000  4.815000 1.216000  1.067000       1.949000  
1 1 1 37 17 26 o 13.27000 0.4214000 14.46000 0.5753000 12.08000 0.6159000 2.386000       0.8428000 
1 1 1 37 17 28 o 8.334000 0.5935000 8.635000 0.6619000 8.033000 0.9853000 0.6023000      1.187000  
1 1 1 37 17 30 o 10.06000 0.4898000 10.45000 0.5846000 9.679000 0.7861000 0.7679000      0.9797000 
1 1 1 37 17 32 o 8.317000 0.5937000 8.541000 0.7124000 8.093000 0.9498000 0.4483000      1.187000  
1 1 1 37 17 34 o 5.319000 0.8235000 5.639000 0.8888000 4.999000 1.387000  0.6403000      1.647000  
1 1 1 37 17 36 o 4.790000 0.9277000 5.067000 1.035000  4.514000 1.540000  0.5529000      1.855000  
1 1 1 37 18 1  o 4.061000 0.8543000 4.305000 1.226000  3.817000 1.190000  0.4883000      1.709000  
1 1 1 37 18 3  o 5.656000 0.6954000 5.263000 1.089000  6.049000 0.8644000 -0.7866000     1.391000  
1 1 1 37 18 5  o 16.60000 0.3292000 16.79000 0.4383000 16.41000 0.4915000 0.3864000      0.6585000 
1 1 1 37 18 7  o 8.579000 0.4646000 8.693000 0.6383000 8.466000 0.6753000 0.2276000      0.9292000 
1 1 1 37 18 9  o 9.958000 0.4162000 10.24000 0.5487000 9.676000 0.6260000 0.5635000      0.8324000 
1 1 1 37 18 11 o 17.08000 0.3766000 17.94000 0.5356000 16.22000 0.5296000 1.720000       0.7532000 
1 1 1 37 18 13 o 18.91000 0.3393000 19.31000 0.5099000 18.52000 0.4478000 0.7949000      0.6786000 
1 1 1 37 18 15 o 3.500000 0.7678000 4.137000 1.015000  2.864000 1.152000  1.273000       1.536000  
1 1 1 37 18 17 o 3.210000 0.8217000 2.258000 1.029000  4.162000 1.282000  -1.904000      1.643000  
1 1 1 37 18 19 o 3.078000 0.8381000 2.563000 1.126000  3.593000 1.242000  -1.030000      1.676000  
1 1 1 37 18 21 o 4.893000 0.8542000 5.322000 1.160000  4.465000 1.255000  0.8567000      1.708000  
1 1 1 37 18 23 o 2.830000 0.8091000 2.989000 1.161000  2.671000 1.127000  0.3182000      1.618000  
1 1 1 37 18 25 o 6.896000 0.5636000 7.154000 0.7162000 6.637000 0.8704000 0.5178000      1.127000  
1 1 1 37 18 27 o 11.55000 0.5404000 10.29000 0.6948000 12.81000 0.8278000 -2.520000      1.081000  
1 1 1 37 18 29 o 12.67000 0.4556000 11.81000 0.6517000 13.52000 0.6369000 -1.704000      0.9112000 
1 1 1 37 18 31 o 9.151000 0.5236000 8.663000 0.5972000 9.638000 0.8602000 -0.9750000     1.047000  
1 1 1 37 18 33 o 3.417000 0.9863000 2.295000 1.019000  4.539000 1.689000  -2.243000      1.973000  
1 1 1 37 18 35 o 3.927000 0.9451000 3.251000 1.233000  4.603000 1.433000  -1.352000      1.890000  
1 1 1 37 18 37 o 3.404000 0.9860000 3.543000 1.434000  3.265000 1.353000  0.2784000      1.972000  
1 1 1 37 19 0  o 3.337000 1.193000  3.337000 1.193000  3.337000 1.193000  0.000000       0.000000  
1 1 1 37 19 2  o 12.74000 0.3680000 12.60000 0.5395000 12.89000 0.5007000 -0.2908000     0.7360000 
1 1 1 37 19 4  f 15.01000 0.3956000 15.22000 0.5523000 14.80000 0.5664000 0.4200000      0.7912000 
1 1 1 37 19 6  o 20.32000 0.2930000 20.09000 0.4057000 20.56000 0.4229000 -0.4675000     0.5860000 
1 1 1 37 19 8  o 18.44000 0.3258000 18.22000 0.4930000 18.66000 0.4262000 -0.4414000     0.6517000 
1 1 1 37 19 10 o 18.24000 0.3310000 18.14000 0.5095000 18.34000 0.4225000 -0.2026000     0.6619000 
1 1 1 37 19 12 o 11.55000 0.3960000 11.40000 0.5452000 11.69000 0.5744000 -0.2931000     0.7919000 
1 1 1 37 19 14 o 15.07000 0.3400000 15.43000 0.4865000 14.71000 0.4751000 0.7131000      0.6800000 
1 1 1 37 19 16 o 11.01000 0.5058000 10.93000 0.6307000 11.10000 0.7910000 -0.1765000     1.012000  
1 1 1 37 19 18 f 4.674000 0.7872000 5.783000 0.9458000 3.565000 1.259000  2.218000       1.574000  
1 1 1 37 19 20 o 6.805000 0.5693000 6.912000 0.7757000 6.698000 0.8336000 0.2135000      1.139000  
1 1 1 37 19 22 o 5.198000 0.7343000 5.643000 0.9397000 4.754000 1.129000  0.8887000      1.469000  
1 1 1 37 19 24 o 8.396000 0.5904000 8.518000 0.7616000 8.274000 0.9023000 0.2440000      1.181000  
1 1 1 37 19 26 o 3.712000 0.9449000 4.086000 1.216000  3.339000 1.446000  0.7470000      1.890000  
1 1 1 37 19 28 o 3.456000 0.9110000 3.352000 1.173000  3.560000 1.394000  -0.2085000     1.822000  
1 1 1 37 19 30 o 3.987000 0.8694000 3.139000 1.081000  4.836000 1.362000  -1.697000      1.739000  
1 1 1 37 19 32 o 8.241000 0.6911000 7.343000 0.8795000 9.139000 1.066000  -1.797000      1.382000  
1 1 1 37 19 34 o 10.41000 0.4879000 10.23000 0.5188000 10.60000 0.8264000 -0.3676000     0.9758000 
1 1 1 37 19 36 o 5.642000 0.9227000 4.484000 1.376000  6.799000 1.229000  -2.316000      1.845000  
1 1 1 37 20 1  o 7.208000 0.5822000 6.950000 0.8184000 7.465000 0.8285000 -0.5154000     1.164000  
1 1 1 37 20 3  o 10.97000 0.4060000 10.80000 0.6140000 11.15000 0.5314000 -0.3445000     0.8120000 
1 1 1 37 20 5  o 20.48000 0.2898000 20.55000 0.4119000 20.41000 0.4079000 0.1375000      0.5797000 
1 1 1 37 20 7  o 8.915000 0.5089000 9.417000 0.7517000 8.414000 0.6861000 1.004000       1.018000  
1 1 1 37 20 9  o 12.56000 0.3538000 12.74000 0.4925000 12.38000 0.5081000 0.3569000      0.7076000 
1 1 1 37 20 11 o 12.41000 0.3617000 13.03000 0.5103000 11.80000 0.5126000 1.234000       0.7233000 
1 1 1 37 20 13 o 6.371000 0.6535000 6.872000 0.9162000 5.871000 0.9320000 1.001000       1.307000  
1 1 1 37 20 15 o 9.791000 0.4615000 10.66000 0.6390000 8.921000 0.6662000 1.740000       0.9231000 
1 1 1 37 20 17 o 5.144000 0.7897000 4.992000 1.070000  5.297000 1.162000  -0.3055000     1.579000  
1 1 1 37 20 19 o 8.771000 0.4779000 9.042000 0.6512000 8.501000 0.6996000 0.5404000      0.9557000 
1 1 1 37 20 21 f 2.624000 0.7686000 2.997000 1.147000  2.250000 1.023000  0.7470000      1.537000  
1 1 1 37 20 23 o 6.909000 0.5964000 7.875000 0.7155000 5.943000 0.9544000 1.932000       1.193000  
1 1 1 37 20 25 o 4.242000 0.8727000 4.709000 0.9855000 3.776000 1.441000  0.9329000      1.745000  
1 1 1 37 20 27 o 5.653000 0.8340000 6.789000 0.7601000 4.517000 1.485000  2.272000       1.668000  
1 1 1 37 20 29 o 9.820000 0.7660000 8.737000 0.6313000 10.90000 1.396000  -2.165000      1.532000  
1 1 1 37 20 31 o 6.426000 0.8057000 7.056000 0.7687000 5.797000 1.416000  1.259000       1.611000  
1 1 1 37 20 33 o 4.526000 0.9130000 3.509000 1.227000  5.542000 1.353000  -2.033000      1.826000  
1 1 1 37 20 35 o 3.948000 1.028000  4.005000 1.506000  3.892000 1.399000  0.1128000      2.055000  
1 1 1 37 21 0  o 8.683000 0.8041000 8.683000 0.8041000 8.683000 0.8041000 0.000000       0.000000  
1 1 1 37 21 2  o 4.370000 0.8109000 3.741000 1.247000  5.000000 1.037000  -1.259000      1.622000  
1 1 1 37 21 4  o 7.864000 0.4791000 8.052000 0.6879000 7.676000 0.6670000 0.3760000      0.9582000 
1 1 1 37 21 6  o 4.250000 0.8584000 3.386000 1.310000  5.113000 1.110000  -1.727000      1.717000  
1 1 1 37 21 8  o 11.13000 0.3886000 11.21000 0.5411000 11.06000 0.5578000 0.1505000      0.7771000 
1 1 1 37 21 10 o 13.74000 0.3799000 14.59000 0.5349000 12.89000 0.5397000 1.701000       0.7599000 
1 1 1 37 21 12 o 6.379000 0.5989000 6.587000 0.7783000 6.170000 0.9106000 0.4169000      1.198000  
1 1 1 37 21 14 o 9.540000 0.4381000 9.713000 0.6087000 9.368000 0.6304000 0.3452000      0.8763000 
1 1 1 37 21 16 o 11.99000 0.4097000 12.43000 0.5744000 11.55000 0.5843000 0.8748000      0.8193000 
1 1 1 37 21 18 o 10.29000 0.4332000 10.85000 0.5844000 9.731000 0.6396000 1.116000       0.8664000 
1 1 1 37 21 20 o 2.106000 0.6897000 2.288000 1.024000  1.924000 0.9245000 0.3640000      1.379000  
1 1 1 37 21 22 o 3.931000 0.8532000 3.336000 1.172000  4.527000 1.241000  -1.191000      1.706000  
1 1 1 37 21 24 o 2.949000 0.8552000 2.708000 1.072000  3.191000 1.333000  -0.4828000     1.710000  
1 1 1 37 21 26 o 7.395000 0.8105000 7.644000 0.7858000 7.146000 1.418000  0.4974000      1.621000  
1 1 1 37 21 28 o 4.074000 1.033000  3.772000 1.252000  4.377000 1.642000  -0.6054000     2.065000  
1 1 1 37 21 30 o 6.705000 0.8904000 6.243000 1.349000  7.168000 1.163000  -0.9247000     1.781000  
1 1 1 37 21 32 o 3.323000 1.042000  3.558000 1.613000  3.089000 1.321000  0.4694000      2.084000  
1 1 1 37 21 34 o 4.855000 1.144000  5.242000 1.577000  4.469000 1.659000  0.7731000      2.289000  
1 1 1 37 22 1  o 9.396000 0.4867000 8.450000 0.7789000 10.34000 0.5837000 -1.893000      0.9734000 
1 1 1 37 22 3  o 5.745000 0.6851000 5.244000 1.073000  6.246000 0.8518000 -1.002000      1.370000  
1 1 1 37 22 5  o 5.518000 0.6611000 4.124000 1.117000  6.911000 0.7076000 -2.787000      1.322000  
1 1 1 37 22 7  o 7.447000 0.4921000 7.589000 0.7066000 7.306000 0.6852000 0.2830000      0.9843000 
1 1 1 37 22 9  f 13.30000 0.3719000 13.70000 0.5479000 12.89000 0.5031000 0.8135000      0.7438000 
1 1 1 37 22 11 o 5.027000 0.7604000 5.594000 1.024000  4.460000 1.125000  1.135000       1.521000  
1 1 1 37 22 13 o 3.614000 0.8652000 4.027000 1.218000  3.201000 1.230000  0.8260000      1.730000  
1 1 1 37 22 15 o 9.349000 0.4902000 9.736000 0.6356000 8.963000 0.7465000 0.7723000      0.9804000 
1 1 1 37 22 17 o 10.28000 0.4376000 10.75000 0.6026000 9.811000 0.6348000 0.9377000      0.8752000 
1 1 1 37 22 19 o 6.519000 0.5910000 6.923000 0.7949000 6.116000 0.8748000 0.8065000      1.182000  
1 1 1 37 22 21 o 3.884000 0.8523000 4.200000 1.195000  3.568000 1.216000  0.6317000      1.705000  
1 1 1 37 22 23 o 6.069000 0.7468000 6.533000 0.6580000 5.605000 1.341000  0.9281000      1.494000  
1 1 1 37 22 25 o 7.721000 0.7013000 7.060000 0.7591000 8.382000 1.180000  -1.323000      1.403000  
1 1 1 37 22 27 o 4.022000 1.037000  2.736000 1.241000  5.309000 1.663000  -2.574000      2.075000  
1 1 1 37 22 29 o 5.489000 1.055000  5.192000 1.617000  5.787000 1.354000  -0.5949000     2.109000  
1 1 1 37 22 31 o 6.162000 1.166000  6.279000 1.785000  6.046000 1.501000  0.2336000      2.332000  
1 1 1 37 22 33 o 7.295000 0.8703000 7.007000 1.327000  7.583000 1.127000  -0.5766000     1.741000  
1 1 1 37 23 0  o 7.518000 0.6741000 7.518000 0.6741000 7.518000 0.6741000 0.000000       0.000000  
1 1 1 37 23 2  o 5.149000 0.8851000 5.354000 1.425000  4.945000 1.050000  0.4088000      1.770000  
1 1 1 37 23 4  o 4.199000 0.8176000 3.837000 1.196000  4.561000 1.115000  -0.7240000     1.635000  
1 1 1 37 23 6  o 11.72000 0.4189000 12.24000 0.5628000 11.19000 0.6205000 1.049000       0.8377000 
1 1 1 37 23 8  f 12.65000 0.3528000 12.10000 0.5151000 13.20000 0.4821000 -1.091000      0.7055000 
1 1 1 37 23 10 o 15.01000 0.3199000 15.22000 0.4482000 14.80000 0.4567000 0.4197000      0.6399000 
1 1 1 37 23 12 o 2.448000 0.7486000 2.610000 1.094000  2.286000 1.023000  0.3245000      1.497000  
1 1 1 37 23 14 o 8.679000 0.5014000 9.104000 0.7012000 8.254000 0.7170000 0.8505000      1.003000  
1 1 1 37 23 16 o 2.642000 0.7776000 3.337000 1.247000  1.947000 0.9291000 1.389000       1.555000  
1 1 1 37 23 18 o 8.626000 0.4934000 8.333000 0.7182000 8.919000 0.6767000 -0.5855000     0.9868000 
1 1 1 37 23 20 f 4.244000 0.7897000 3.485000 1.224000  5.003000 0.9986000 -1.518000      1.579000  
1 1 1 37 23 22 o 6.668000 0.7954000 6.921000 0.8470000 6.416000 1.346000  0.5052000      1.591000  
1 1 1 37 23 24 o 6.681000 0.8873000 7.329000 0.7980000 6.034000 1.585000  1.295000       1.775000  
1 1 1 37 23 26 o 3.379000 1.013000  3.187000 1.375000  3.571000 1.487000  -0.3843000     2.026000  
1 1 1 37 23 28 o 3.189000 1.013000  3.243000 1.499000  3.136000 1.363000  0.1070000      2.026000  
1 1 1 37 23 30 o 4.891000 1.033000  5.578000 1.440000  4.204000 1.482000  1.374000       2.067000  
1 1 1 37 23 32 o 5.724000 1.120000  5.244000 1.718000  6.205000 1.437000  -0.9602000     2.239000  
1 1 1 37 24 1  o 12.54000 0.4745000 11.50000 0.8304000 13.58000 0.4595000 -2.080000      0.9490000 
1 1 1 37 24 3  o 15.85000 0.4033000 15.62000 0.6507000 16.08000 0.4768000 -0.4525000     0.8067000 
1 1 1 37 24 5  o 6.284000 0.6100000 6.129000 0.9122000 6.438000 0.8102000 -0.3092000     1.220000  
1 1 1 37 24 7  o 11.46000 0.3904000 11.85000 0.5691000 11.07000 0.5345000 0.7723000      0.7807000 
1 1 1 37 24 9  o 14.72000 0.3171000 14.93000 0.4540000 14.50000 0.4429000 0.4373000      0.6342000 
1 1 1 37 24 11 o 11.47000 0.3893000 12.02000 0.5607000 10.91000 0.5402000 1.116000       0.7786000 
1 1 1 37 24 13 o 8.221000 0.4929000 9.125000 0.6849000 7.317000 0.7090000 1.808000       0.9857000 
1 1 1 37 24 15 o 4.044000 0.7868000 4.979000 1.060000  3.110000 1.163000  1.869000       1.574000  
1 1 1 37 24 17 o 17.06000 0.4196000 17.65000 0.4924000 16.46000 0.6796000 1.190000       0.8392000 
1 1 1 37 24 19 o 7.748000 0.6756000 8.527000 0.6466000 6.969000 1.186000  1.558000       1.351000  
1 1 1 37 24 21 o 3.898000 1.056000  3.176000 1.327000  4.620000 1.643000  -1.444000      2.112000  
1 1 1 37 24 23 o 9.685000 0.6804000 10.30000 0.8365000 9.065000 1.073000  1.240000       1.361000  
1 1 1 37 24 25 o 3.395000 1.001000  3.681000 1.474000  3.109000 1.355000  0.5723000      2.002000  
1 1 1 37 24 27 o 4.446000 1.116000  4.675000 1.654000  4.216000 1.499000  0.4596000      2.232000  
1 1 1 37 24 29 o 8.987000 1.032000  9.479000 1.813000  8.495000 0.9871000 0.9839000      2.064000  
1 1 1 37 24 31 o 6.976000 0.9377000 6.752000 1.442000  7.200000 1.200000  -0.4486000     1.875000  
1 1 1 37 24 33 o 4.761000 1.211000  4.430000 1.809000  5.092000 1.611000  -0.6618000     2.423000  
1 1 1 37 25 0  o 3.202000 1.265000  3.202000 1.265000  3.202000 1.265000  0.000000       0.000000  
1 1 1 37 25 2  o 5.183000 0.8469000 6.209000 1.285000  4.156000 1.104000  2.053000       1.694000  
1 1 1 37 25 4  o 3.347000 0.8205000 3.139000 1.177000  3.555000 1.144000  -0.4161000     1.641000  
1 1 1 37 25 6  o 3.025000 0.8263000 3.006000 1.144000  3.044000 1.193000  -0.3751000E-01 1.653000  
1 1 1 37 25 8  o 10.23000 0.4186000 10.46000 0.6046000 10.00000 0.5791000 0.4549000      0.8372000 
1 1 1 37 25 10 o 13.32000 0.3445000 13.58000 0.5234000 13.05000 0.4481000 0.5262000      0.6891000 
1 1 1 37 25 12 o 10.39000 0.4000000 10.77000 0.5690000 10.01000 0.5624000 0.7641000      0.8000000 
1 1 1 37 25 14 o 4.316000 0.9475000 5.173000 1.175000  3.460000 1.487000  1.712000       1.895000  
1 1 1 37 25 16 o 2.312000 0.7215000 2.443000 1.069000  2.181000 0.9691000 0.2623000      1.443000  
1 1 1 37 25 18 o 11.23000 0.6780000 10.94000 0.7564000 11.53000 1.125000  -0.5831000     1.356000  
1 1 1 37 25 20 o 7.119000 0.9482000 7.358000 1.092000  6.879000 1.551000  0.4789000      1.896000  
1 1 1 37 25 22 o 9.194000 0.7589000 11.01000 0.8422000 7.375000 1.263000  3.638000       1.518000  
1 1 1 37 25 24 o 7.099000 0.9058000 8.170000 1.198000  6.028000 1.359000  2.143000       1.812000  
1 1 1 37 25 26 o 3.181000 0.9405000 3.170000 1.335000  3.193000 1.325000  -0.2277000E-01 1.881000  
1 1 1 37 25 28 o 7.580000 0.8452000 6.759000 1.334000  8.402000 1.039000  -1.643000      1.690000  
1 1 1 37 25 30 o 5.958000 1.004000  6.319000 1.387000  5.597000 1.452000  0.7216000      2.008000  
1 1 1 37 25 32 o 4.733000 1.147000  5.590000 1.738000  3.875000 1.498000  1.715000       2.295000  
1 1 1 37 26 1  o 9.850000 0.5245000 9.025000 0.8617000 10.68000 0.5983000 -1.651000      1.049000  
1 1 1 37 26 3  f 13.99000 0.3927000 14.03000 0.6428000 13.95000 0.4513000 0.8156000E-01  0.7854000 
1 1 1 37 26 5  f 6.848000 0.5768000 7.318000 0.7612000 6.379000 0.8667000 0.9389000      1.154000  
1 1 1 37 26 7  o 4.427000 0.7316000 6.033000 0.9245000 2.821000 1.134000  3.212000       1.463000  
1 1 1 37 26 9  o 3.083000 0.7995000 3.619000 1.182000  2.546000 1.077000  1.073000       1.599000  
1 1 1 37 26 11 o 4.806000 0.6840000 5.353000 0.9655000 4.259000 0.9692000 1.094000       1.368000  
1 1 1 37 26 13 o 4.042000 0.7299000 5.363000 0.9003000 2.722000 1.149000  2.642000       1.460000  
1 1 1 37 26 15 o 3.572000 0.8977000 3.695000 1.363000  3.450000 1.169000  0.2444000      1.795000  
1 1 1 37 26 17 o 3.743000 1.038000  4.709000 1.658000  2.777000 1.248000  1.933000       2.076000  
1 1 1 37 26 19 o 10.48000 0.6597000 11.00000 0.8092000 9.952000 1.042000  1.047000       1.319000  
1 1 1 37 26 21 o 6.007000 1.021000  7.070000 1.399000  4.945000 1.487000  2.126000       2.041000  
1 1 1 37 26 23 o 4.048000 1.049000  4.600000 1.506000  3.496000 1.459000  1.104000       2.097000  
1 1 1 37 26 25 o 3.807000 1.031000  3.619000 1.458000  3.995000 1.457000  -0.3763000     2.061000  
1 1 1 37 26 27 o 4.745000 1.079000  4.879000 1.497000  4.611000 1.554000  0.2682000      2.158000  
1 1 1 37 26 29 o 5.029000 1.060000  5.077000 1.592000  4.981000 1.399000  0.9666000E-01  2.120000  
1 1 1 37 26 31 o 4.748000 1.126000  4.065000 1.653000  5.431000 1.530000  -1.366000      2.253000  
1 1 1 37 27 0  o 4.376000 1.310000  4.376000 1.310000  4.376000 1.310000  0.000000       0.000000  
1 1 1 37 27 2  o 5.240000 0.8587000 5.635000 1.270000  4.845000 1.156000  0.7905000      1.717000  
1 1 1 37 27 4  o 3.339000 0.9230000 3.783000 1.456000  2.895000 1.135000  0.8877000      1.846000  
1 1 1 37 27 6  o 7.932000 0.5412000 8.545000 0.6045000 7.319000 0.8980000 1.226000       1.082000  
1 1 1 37 27 8  o 4.906000 0.7549000 4.732000 1.057000  5.079000 1.078000  -0.3466000     1.510000  
1 1 1 37 27 10 f 7.978000 0.6594000 8.303000 0.6132000 7.653000 1.168000  0.6506000      1.319000  
1 1 1 37 27 12 o 7.219000 0.7482000 9.070000 0.8090000 5.367000 1.259000  3.703000       1.496000  
1 1 1 37 27 14 o 6.758000 0.7761000 8.110000 0.9306000 5.406000 1.242000  2.704000       1.552000  
1 1 1 37 27 16 o 2.595000 0.8391000 2.711000 1.223000  2.479000 1.150000  0.2320000      1.678000  
1 1 1 37 27 18 o 2.875000 0.9264000 3.197000 1.419000  2.553000 1.191000  0.6434000      1.853000  
1 1 1 37 27 20 o 5.218000 1.083000  5.665000 1.592000  4.772000 1.468000  0.8925000      2.165000  
1 1 1 37 27 22 o 10.27000 0.7142000 11.74000 0.8038000 8.804000 1.181000  2.940000       1.428000  
1 1 1 37 27 24 o 6.912000 0.8412000 7.414000 1.106000  6.409000 1.268000  1.005000       1.682000  
1 1 1 37 27 26 o 3.286000 0.9636000 2.872000 1.289000  3.699000 1.433000  -0.8271000     1.927000  
1 1 1 37 27 28 o 3.532000 1.009000  3.535000 1.415000  3.529000 1.439000  0.5780000E-02  2.018000  
1 1 1 37 27 30 o 6.431000 1.014000  6.642000 1.516000  6.219000 1.346000  0.4238000      2.028000  
1 1 1 37 28 1  o 3.038000 0.8299000 3.244000 1.217000  2.833000 1.129000  0.4114000      1.660000  
1 1 1 37 28 3  f 7.994000 0.5080000 7.895000 0.7678000 8.092000 0.6654000 -0.1972000     1.016000  
1 1 1 37 28 5  o 11.93000 0.4327000 11.67000 0.5818000 12.19000 0.6406000 -0.5167000     0.8653000 
1 1 1 37 28 7  o 2.319000 0.7130000 2.515000 1.062000  2.122000 0.9513000 0.3921000      1.426000  
1 1 1 37 28 9  f 5.921000 0.5787000 5.520000 0.8638000 6.322000 0.7705000 -0.8018000     1.157000  
1 1 1 37 28 11 o 4.638000 0.9874000 3.919000 1.394000  5.357000 1.398000  -1.438000      1.975000  
1 1 1 37 28 13 o 3.879000 0.9989000 3.937000 1.469000  3.821000 1.354000  0.1153000      1.998000  
1 1 1 37 28 15 o 3.233000 1.030000  3.187000 1.421000  3.280000 1.492000  -0.9271000E-01 2.061000  
1 1 1 37 28 17 o 5.072000 1.010000  5.261000 1.435000  4.883000 1.422000  0.3778000      2.020000  
1 1 1 37 28 19 o 6.186000 0.8946000 7.034000 1.021000  5.339000 1.470000  1.695000       1.789000  
1 1 1 37 28 21 o 8.695000 0.7285000 10.50000 0.8156000 6.893000 1.207000  3.603000       1.457000  
1 1 1 37 28 23 o 7.461000 0.9501000 10.19000 0.8719000 4.734000 1.688000  5.453000       1.900000  
1 1 1 37 28 25 o 4.657000 1.017000  5.206000 1.335000  4.108000 1.533000  1.098000       2.033000  
1 1 1 37 28 27 o 5.373000 1.121000  5.404000 1.531000  5.341000 1.637000  0.6211000E-01  2.242000  
1 1 1 37 28 29 o 3.344000 1.024000  3.418000 1.538000  3.270000 1.354000  0.1485000      2.049000  
1 1 1 37 29 0  o 8.568000 0.6390000 8.568000 0.6390000 8.568000 0.6390000 0.000000       0.000000  
1 1 1 37 29 2  o 9.305000 0.5145000 8.539000 0.7611000 10.07000 0.6924000 -1.531000      1.029000  
1 1 1 37 29 4  o 2.817000 0.8016000 3.016000 1.169000  2.617000 1.097000  0.3992000      1.603000  
1 1 1 37 29 6  o 4.689000 0.7472000 4.696000 1.018000  4.682000 1.094000  0.1416000E-01  1.494000  
1 1 1 37 29 8  o 4.538000 0.9152000 5.107000 1.425000  3.969000 1.149000  1.138000       1.830000  
1 1 1 37 29 10 o 7.528000 0.7199000 8.645000 0.9564000 6.411000 1.076000  2.234000       1.440000  
1 1 1 37 29 12 o 4.367000 1.037000  4.378000 1.541000  4.356000 1.389000  0.2220000E-01  2.075000  
1 1 1 37 29 14 o 3.567000 0.9847000 3.078000 1.315000  4.056000 1.466000  -0.9782000     1.969000  
1 1 1 37 29 16 o 6.316000 0.8945000 5.821000 1.310000  6.811000 1.219000  -0.9902000     1.789000  
1 1 1 37 29 18 o 8.836000 0.8245000 9.353000 1.245000  8.319000 1.082000  1.035000       1.649000  
1 1 1 37 29 20 o 6.857000 0.8564000 7.585000 1.074000  6.128000 1.334000  1.457000       1.713000  
1 1 1 37 29 22 o 4.616000 1.026000  5.214000 1.425000  4.019000 1.476000  1.195000       2.052000  
1 1 1 37 29 24 o 4.149000 1.009000  4.344000 1.395000  3.954000 1.459000  0.3899000      2.018000  
1 1 1 37 29 26 o 4.140000 1.033000  3.496000 1.400000  4.783000 1.520000  -1.287000      2.066000  
1 1 1 37 29 28 o 3.591000 1.065000  3.153000 1.463000  4.029000 1.549000  -0.8762000     2.130000  
1 1 1 37 30 1  o 13.36000 0.3791000 12.95000 0.5591000 13.78000 0.5120000 -0.8265000     0.7581000 
1 1 1 37 30 3  o 7.226000 0.6696000 6.056000 1.143000  8.396000 0.6972000 -2.340000      1.339000  
1 1 1 37 30 5  o 10.61000 0.4789000 10.28000 0.5855000 10.94000 0.7579000 -0.6618000     0.9577000 
1 1 1 37 30 7  o 6.755000 0.7793000 6.535000 1.232000  6.975000 0.9550000 -0.4403000     1.559000  
1 1 1 37 30 9  o 6.374000 0.8180000 7.559000 1.007000  5.189000 1.289000  2.370000       1.636000  
1 1 1 37 30 11 o 9.599000 0.5869000 9.864000 0.7768000 9.333000 0.8801000 0.5312000      1.174000  
1 1 1 37 30 13 o 6.330000 0.8014000 7.034000 1.015000  5.627000 1.241000  1.407000       1.603000  
1 1 1 37 30 15 o 5.272000 1.071000  6.329000 1.308000  4.215000 1.696000  2.114000       2.142000  
1 1 1 37 30 17 o 3.312000 0.9749000 3.504000 1.458000  3.120000 1.294000  0.3841000      1.950000  
1 1 1 37 30 19 o 3.843000 1.021000  3.770000 1.435000  3.915000 1.454000  -0.1449000     2.043000  
1 1 1 37 30 21 o 4.321000 0.9534000 5.657000 1.356000  2.986000 1.340000  2.671000       1.907000  
1 1 1 37 30 23 o 5.594000 1.003000  6.669000 1.361000  4.518000 1.474000  2.151000       2.006000  
1 1 1 37 30 25 o 3.845000 1.023000  3.988000 1.399000  3.702000 1.492000  0.2866000      2.045000  
1 1 1 37 30 27 o 2.820000 1.369000  ?        ?         2.820000 1.369000  ?              ?         
1 1 1 37 31 0  o 3.179000 1.170000  3.179000 1.170000  3.179000 1.170000  0.000000       0.000000  
1 1 1 37 31 2  o 3.834000 0.9811000 3.431000 1.387000  4.237000 1.388000  -0.8057000     1.962000  
1 1 1 37 31 4  o 9.621000 0.6663000 9.935000 0.6981000 9.308000 1.135000  0.6270000      1.333000  
1 1 1 37 31 6  o 10.47000 0.6870000 10.23000 1.163000  10.70000 0.7316000 -0.4743000     1.374000  
1 1 1 37 31 8  o 2.410000 0.7854000 2.346000 1.104000  2.473000 1.117000  -0.1276000     1.571000  
1 1 1 37 31 10 o 4.277000 0.9650000 4.445000 1.373000  4.108000 1.356000  0.3375000      1.930000  
1 1 1 37 31 12 o 5.298000 1.074000  4.274000 1.525000  6.322000 1.512000  -2.048000      2.147000  
1 1 1 37 31 14 o 4.845000 0.9936000 5.510000 1.356000  4.180000 1.453000  1.330000       1.987000  
1 1 1 37 31 16 o 4.552000 1.110000  4.097000 1.439000  5.007000 1.692000  -0.9100000     2.221000  
1 1 1 37 31 18 f 6.724000 0.9205000 7.730000 1.306000  5.717000 1.297000  2.014000       1.841000  
1 1 1 37 31 20 o 6.276000 0.8642000 8.244000 1.011000  4.307000 1.402000  3.937000       1.728000  
1 1 1 37 31 22 f 4.668000 1.094000  4.421000 1.572000  4.916000 1.523000  -0.4941000     2.189000  
1 1 1 37 31 24 o 4.772000 1.017000  3.669000 1.474000  5.875000 1.402000  -2.206000      2.034000  
1 1 1 37 32 1  o 3.573000 0.9359000 3.075000 1.246000  4.070000 1.397000  -0.9948000     1.872000  
1 1 1 37 32 3  o 8.002000 0.6844000 7.308000 1.083000  8.697000 0.8368000 -1.389000      1.369000  
1 1 1 37 32 5  o 11.49000 0.5132000 11.87000 0.6819000 11.11000 0.7671000 0.7556000      1.026000  
1 1 1 37 32 7  o 6.186000 1.021000  5.853000 1.683000  6.518000 1.155000  -0.6645000     2.042000  
1 1 1 37 32 9  o 6.501000 0.7458000 6.420000 1.054000  6.582000 1.056000  -0.1620000     1.492000  
1 1 1 37 32 11 o 9.345000 0.6177000 9.976000 0.8051000 8.713000 0.9371000 1.263000       1.235000  
1 1 1 37 32 13 o 11.44000 0.5495000 10.66000 0.8616000 12.22000 0.6823000 -1.559000      1.099000  
1 1 1 37 32 15 o 9.891000 0.5955000 9.149000 0.8571000 10.63000 0.8270000 -1.485000      1.191000  
1 1 1 37 32 17 o 9.069000 0.6345000 8.504000 0.9134000 9.633000 0.8809000 -1.129000      1.269000  
1 1 1 37 32 19 o 4.544000 1.025000  4.237000 1.447000  4.852000 1.452000  -0.6154000     2.050000  
1 1 1 37 32 21 o 9.117000 0.7434000 10.11000 1.001000  8.123000 1.099000  1.988000       1.487000  
1 1 1 37 32 23 o 3.908000 1.055000  4.726000 1.661000  3.091000 1.301000  1.636000       2.110000  
1 1 1 37 33 0  o 4.360000 1.612000  4.360000 1.612000  4.360000 1.612000  0.000000       0.000000  
1 1 1 37 33 2  o 4.009000 1.063000  4.235000 1.395000  3.783000 1.605000  0.4521000      2.127000  
1 1 1 37 33 4  o 8.668000 0.6082000 9.739000 0.7543000 7.598000 0.9542000 2.140000       1.216000  
1 1 1 37 33 6  o 7.016000 0.7429000 7.309000 0.9560000 6.723000 1.137000  0.5853000      1.486000  
1 1 1 37 33 8  f 3.692000 0.7855000 5.271000 1.193000  2.113000 1.022000  3.157000       1.571000  
1 1 1 37 33 10 o 3.649000 0.9527000 3.440000 1.299000  3.857000 1.394000  -0.4174000     1.905000  
1 1 1 37 33 12 o 5.667000 1.022000  5.837000 1.455000  5.497000 1.434000  0.3400000      2.043000  
1 1 1 37 33 14 o 5.230000 0.9801000 5.600000 1.347000  4.859000 1.424000  0.7409000      1.960000  
1 1 1 37 33 16 o 4.167000 1.229000  4.074000 1.535000  4.260000 1.920000  -0.1855000     2.458000  
1 1 1 37 33 18 o 3.536000 1.010000  4.449000 1.618000  2.624000 1.208000  1.825000       2.020000  
1 1 1 37 33 20 o 5.249000 1.002000  5.600000 1.410000  4.897000 1.424000  0.7024000      2.004000  
1 1 1 37 33 22 o 6.885000 1.233000  8.321000 1.986000  5.448000 1.463000  2.873000       2.467000  
1 1 1 37 34 1  o 4.683000 1.189000  4.468000 1.615000  4.898000 1.747000  -0.4303000     2.379000  
1 1 1 37 34 3  o 6.153000 1.083000  5.038000 1.647000  7.268000 1.405000  -2.231000      2.165000  
1 1 1 37 34 5  o 3.420000 0.9930000 3.270000 1.296000  3.570000 1.505000  -0.3007000     1.986000  
1 1 1 37 34 7  o 5.537000 0.9107000 5.786000 1.213000  5.288000 1.358000  0.4978000      1.821000  
1 1 1 37 34 9  o 4.251000 0.9543000 4.028000 1.381000  4.473000 1.317000  -0.4450000     1.909000  
1 1 1 37 34 11 o 6.944000 0.8498000 8.519000 0.9274000 5.368000 1.424000  3.151000       1.700000  
1 1 1 37 34 13 o 3.107000 0.9270000 3.206000 1.336000  3.009000 1.285000  0.1972000      1.854000  
1 1 1 37 34 15 o 6.376000 0.9411000 5.634000 1.452000  7.119000 1.198000  -1.485000      1.882000  
1 1 1 37 34 17 o 3.471000 1.000000  2.936000 1.332000  4.005000 1.493000  -1.069000      2.001000  
1 1 1 37 34 19 o 7.860000 0.7462000 7.915000 1.076000  7.804000 1.034000  0.1104000      1.492000  
1 1 1 37 34 21 o 5.170000 2.062000  ?        ?         5.170000 2.062000  ?              ?         
1 1 1 37 35 0  o 5.038000 1.598000  5.038000 1.598000  5.038000 1.598000  0.000000       0.000000  
1 1 1 37 35 2  o 11.64000 0.7852000 9.593000 1.201000  13.69000 1.012000  -4.092000      1.570000  
1 1 1 37 35 4  o 5.793000 1.195000  5.618000 1.767000  5.969000 1.609000  -0.3506000     2.390000  
1 1 1 37 35 6  o 6.039000 0.9752000 6.276000 1.062000  5.801000 1.636000  0.4749000      1.950000  
1 1 1 37 35 8  o 5.481000 1.047000  5.257000 1.716000  5.705000 1.199000  -0.4481000     2.094000  
1 1 1 37 35 10 o 6.386000 0.8517000 7.119000 1.149000  5.652000 1.258000  1.467000       1.703000  
1 1 1 37 35 12 f 4.542000 1.004000  5.460000 1.453000  3.623000 1.385000  1.838000       2.008000  
1 1 1 37 35 14 o 3.518000 0.9779000 3.340000 1.349000  3.697000 1.416000  -0.3563000     1.956000  
1 1 1 37 35 16 f 3.946000 1.060000  4.579000 1.515000  3.314000 1.482000  1.265000       2.119000  
1 1 1 37 35 18 o 7.112000 0.9831000 6.923000 1.569000  7.300000 1.185000  -0.3770000     1.966000  
1 1 1 37 36 1  o 4.343000 1.162000  4.794000 1.644000  3.892000 1.641000  0.9019000      2.323000  
1 1 1 37 36 3  o 8.229000 0.9867000 7.834000 1.437000  8.624000 1.353000  -0.7902000     1.973000  
1 1 1 37 36 5  o 4.040000 1.115000  4.362000 1.637000  3.719000 1.515000  0.6430000      2.230000  
1 1 1 37 36 7  o 4.139000 1.064000  4.302000 1.632000  3.975000 1.365000  0.3279000      2.127000  
1 1 1 37 36 9  o 5.262000 0.8804000 5.486000 1.241000  5.038000 1.249000  0.4477000      1.761000  
1 1 1 37 36 11 o 5.946000 0.9088000 6.871000 1.250000  5.021000 1.320000  1.849000       1.818000  
1 1 1 37 36 13 f 8.686000 0.6614000 9.132000 0.9710000 8.239000 0.8985000 0.8930000      1.323000  
1 1 1 37 36 15 o 6.998000 0.8759000 6.916000 1.356000  7.080000 1.109000  -0.1632000     1.752000  
1 1 1 37 37 0  o 6.009000 1.679000  6.009000 1.679000  6.009000 1.679000  0.000000       0.000000  
1 1 1 37 37 2  o 3.726000 1.145000  3.706000 1.622000  3.747000 1.616000  -0.4019000E-01 2.289000  
1 1 1 37 37 4  o 4.641000 1.150000  5.348000 1.632000  3.934000 1.620000  1.414000       2.299000  
1 1 1 37 37 6  o 6.158000 1.165000  5.376000 1.708000  6.939000 1.585000  -1.562000      2.330000  
1 1 1 37 37 8  o 4.755000 1.223000  4.912000 1.792000  4.598000 1.666000  0.3141000      2.447000  
1 1 1 37 37 10 o 3.715000 1.091000  3.510000 1.485000  3.920000 1.600000  -0.4094000     2.183000  
1 1 1 37 37 12 o 7.326000 1.020000  7.210000 1.781000  7.441000 0.9966000 -0.2318000     2.040000  
1 1 1 37 38 1  o 4.341000 1.127000  5.017000 1.620000  3.665000 1.567000  1.352000       2.254000  
1 1 1 37 38 3  o 5.785000 1.303000  5.614000 1.887000  5.956000 1.799000  -0.3424000     2.607000  
1 1 1 37 38 5  o 5.345000 1.148000  4.293000 1.659000  6.397000 1.587000  -2.104000      2.296000  
1 1 1 37 38 7  o 4.369000 1.235000  4.024000 1.711000  4.714000 1.781000  -0.6899000     2.470000  
1 1 1 38 0  0  f 3.408000 1.391000  3.408000 1.391000  3.408000 1.391000  0.000000       0.000000  
1 1 1 38 0  2  o 13.58000 0.5274000 13.58000 0.5274000 13.58000 0.5274000 0.000000       0.000000  
1 1 1 38 0  4  o 21.81000 0.4383000 21.81000 0.4383000 21.81000 0.4383000 0.000000       0.000000  
1 1 1 38 0  6  o 4.230000 1.289000  4.230000 1.289000  4.230000 1.289000  0.000000       0.000000  
1 1 1 38 0  8  o 8.216000 0.7753000 8.216000 0.7753000 8.216000 0.7753000 0.000000       0.000000  
1 1 1 38 0  10 o 11.14000 0.5607000 11.14000 0.5607000 11.14000 0.5607000 0.000000       0.000000  
1 1 1 38 0  12 o 12.16000 0.5393000 12.16000 0.5393000 12.16000 0.5393000 0.000000       0.000000  
1 1 1 38 0  14 o 5.065000 1.065000  5.065000 1.065000  5.065000 1.065000  0.000000       0.000000  
1 1 1 38 0  16 o 11.03000 0.6141000 11.03000 0.6141000 11.03000 0.6141000 0.000000       0.000000  
1 1 1 38 0  18 o 22.37000 0.4326000 22.37000 0.4326000 22.37000 0.4326000 0.000000       0.000000  
1 1 1 38 0  20 o 10.82000 0.6270000 10.82000 0.6270000 10.82000 0.6270000 0.000000       0.000000  
1 1 1 38 0  22 o 6.585000 1.050000  6.585000 1.050000  6.585000 1.050000  0.000000       0.000000  
1 1 1 38 0  24 o 5.752000 1.099000  5.752000 1.099000  5.752000 1.099000  0.000000       0.000000  
1 1 1 38 0  26 o 6.014000 1.119000  6.014000 1.119000  6.014000 1.119000  0.000000       0.000000  
1 1 1 38 0  28 o 2.486000 1.115000  2.486000 1.115000  2.486000 1.115000  0.000000       0.000000  
1 1 1 38 0  30 o 9.794000 0.8229000 9.794000 0.8229000 9.794000 0.8229000 0.000000       0.000000  
1 1 1 38 0  32 o 3.833000 1.336000  3.833000 1.336000  3.833000 1.336000  0.000000       0.000000  
1 1 1 38 0  34 o 2.772000 1.219000  2.772000 1.219000  2.772000 1.219000  0.000000       0.000000  
1 1 1 38 0  36 o 12.42000 0.6260000 12.42000 0.6260000 12.42000 0.6260000 0.000000       0.000000  
1 1 1 38 0  38 o 2.941000 1.194000  2.941000 1.194000  2.941000 1.194000  0.000000       0.000000  
1 1 1 38 0  40 f 7.792000 0.9580000 7.792000 0.9580000 7.792000 0.9580000 0.000000       0.000000  
1 1 1 38 1  1  o 7.486000 0.5651000 7.489000 0.8338000 7.482000 0.7629000 0.7124000E-02  1.130000  
1 1 1 38 1  3  o 9.320000 0.4714000 8.688000 0.6936000 9.953000 0.6385000 -1.265000      0.9427000 
1 1 1 38 1  5  o 6.622000 0.6548000 7.063000 0.8900000 6.181000 0.9607000 0.8819000      1.310000  
1 1 1 38 1  7  o 10.88000 0.4535000 10.74000 0.6347000 11.02000 0.6479000 -0.2759000     0.9070000 
1 1 1 38 1  9  o 19.90000 0.3669000 19.78000 0.5080000 20.02000 0.5295000 -0.2374000     0.7337000 
1 1 1 38 1  11 o 12.53000 0.4015000 12.42000 0.5410000 12.64000 0.5933000 -0.2260000     0.8030000 
1 1 1 38 1  13 f 20.43000 0.3300000 20.70000 0.4471000 20.16000 0.4855000 0.5393000      0.6600000 
1 1 1 38 1  15 o 2.624000 0.8090000 2.504000 1.112000  2.743000 1.175000  -0.2393000     1.618000  
1 1 1 38 1  17 o 11.00000 0.4319000 10.80000 0.5609000 11.20000 0.6570000 -0.3927000     0.8638000 
1 1 1 38 1  19 o 8.040000 0.5474000 9.093000 0.6767000 6.986000 0.8605000 2.108000       1.095000  
1 1 1 38 1  21 o 12.59000 0.4065000 12.71000 0.6144000 12.48000 0.5325000 0.2304000      0.8130000 
1 1 1 38 1  23 o 10.55000 0.5900000 10.78000 0.7036000 10.32000 0.9472000 0.4593000      1.180000  
1 1 1 38 1  25 o 12.62000 0.4404000 12.41000 0.5853000 12.83000 0.6583000 -0.4168000     0.8809000 
1 1 1 38 1  27 f 5.239000 0.8500000 5.390000 1.203000  5.088000 1.201000  0.3025000      1.700000  
1 1 1 38 1  29 o 7.247000 0.6450000 7.211000 0.8866000 7.284000 0.9369000 -0.7265000E-01 1.290000  
1 1 1 38 1  31 o 9.718000 0.5302000 9.290000 0.7748000 10.14000 0.7238000 -0.8542000     1.060000  
1 1 1 38 1  33 o 3.299000 0.9278000 2.958000 1.256000  3.640000 1.366000  -0.6817000     1.856000  
1 1 1 38 1  35 o 9.272000 0.7086000 10.57000 1.024000  7.972000 0.9796000 2.600000       1.417000  
1 1 1 38 1  37 o 5.401000 0.9743000 5.832000 1.222000  4.971000 1.518000  0.8610000      1.949000  
1 1 1 38 1  39 o 3.500000 0.9673000 2.708000 1.147000  4.292000 1.558000  -1.584000      1.935000  
1 1 1 38 2  0  o 10.46000 0.5929000 10.46000 0.5929000 10.46000 0.5929000 0.000000       0.000000  
1 1 1 38 2  2  o 17.03000 0.3226000 17.04000 0.4546000 17.02000 0.4578000 0.1546000E-01  0.6452000 
1 1 1 38 2  4  o 23.41000 0.3279000 23.34000 0.4279000 23.48000 0.4969000 -0.1434000     0.6558000 
1 1 1 38 2  6  o 9.637000 0.5517000 8.996000 0.6971000 10.28000 0.8553000 -1.282000      1.103000  
1 1 1 38 2  8  f 6.678000 0.7283000 6.058000 1.075000  7.297000 0.9833000 -1.239000      1.457000  
1 1 1 38 2  10 f 10.62000 0.4758000 9.924000 0.5999000 11.32000 0.7387000 -1.397000      0.9516000 
1 1 1 38 2  12 o 8.859000 0.5065000 8.896000 0.6877000 8.822000 0.7438000 0.7413000E-01  1.013000  
1 1 1 38 2  14 o 9.608000 0.4964000 9.639000 0.7063000 9.578000 0.6978000 0.6066000E-01  0.9928000 
1 1 1 38 2  16 o 7.844000 0.5653000 8.100000 0.7076000 7.588000 0.8819000 0.5113000      1.131000  
1 1 1 38 2  18 o 11.62000 0.4640000 11.88000 0.6571000 11.35000 0.6551000 0.5272000      0.9279000 
1 1 1 38 2  20 o 6.314000 0.6743000 6.056000 0.9195000 6.573000 0.9865000 -0.5164000     1.349000  
1 1 1 38 2  22 o 17.08000 0.3661000 16.84000 0.4886000 17.32000 0.5454000 -0.4790000     0.7323000 
1 1 1 38 2  24 o 19.22000 0.3800000 18.95000 0.5264000 19.49000 0.5483000 -0.5414000     0.7601000 
1 1 1 38 2  26 o 3.319000 0.8890000 3.511000 1.282000  3.127000 1.232000  0.3838000      1.778000  
1 1 1 38 2  28 o 12.47000 0.4288000 13.30000 0.5659000 11.63000 0.6444000 1.672000       0.8576000 
1 1 1 38 2  30 o 12.85000 0.4274000 12.73000 0.6091000 12.97000 0.5996000 -0.2377000     0.8547000 
1 1 1 38 2  32 o 5.964000 0.8168000 5.835000 1.177000  6.093000 1.132000  -0.2586000     1.634000  
1 1 1 38 2  34 o 4.118000 0.9582000 4.792000 1.307000  3.445000 1.402000  1.347000       1.916000  
1 1 1 38 2  36 o 4.709000 0.9837000 5.758000 1.329000  3.660000 1.451000  2.097000       1.967000  
1 1 1 38 2  38 o 3.523000 0.9474000 2.646000 1.119000  4.400000 1.529000  -1.754000      1.895000  
1 1 1 38 2  40 o 5.282000 1.063000  4.545000 1.475000  6.018000 1.531000  -1.473000      2.126000  
1 1 1 38 3  1  o 3.343000 0.8634000 3.106000 1.219000  3.581000 1.222000  -0.4751000     1.727000  
1 1 1 38 3  3  o 27.79000 0.3286000 27.88000 0.4299000 27.70000 0.4971000 0.1881000      0.6573000 
1 1 1 38 3  5  f 25.51000 0.3441000 25.24000 0.4843000 25.77000 0.4890000 -0.5310000     0.6882000 
1 1 1 38 3  7  f 9.519000 0.5077000 8.978000 0.7346000 10.06000 0.7008000 -1.081000      1.015000  
1 1 1 38 3  9  o 17.22000 0.3638000 17.95000 0.5176000 16.48000 0.5114000 1.474000       0.7277000 
1 1 1 38 3  11 o 14.70000 0.3456000 15.15000 0.4822000 14.25000 0.4951000 0.9053000      0.6912000 
1 1 1 38 3  13 o 26.04000 0.3293000 26.37000 0.5025000 25.72000 0.4256000 0.6426000      0.6585000 
1 1 1 38 3  15 o 12.34000 0.3754000 12.40000 0.5525000 12.28000 0.5082000 0.1247000      0.7507000 
1 1 1 38 3  17 o 6.127000 0.6641000 6.261000 0.8823000 5.994000 0.9927000 0.2675000      1.328000  
1 1 1 38 3  19 o 2.039000 0.6781000 2.054000 0.9680000 2.024000 0.9499000 0.3031000E-01  1.356000  
1 1 1 38 3  21 o 11.45000 0.3991000 11.70000 0.6068000 11.20000 0.5187000 0.5010000      0.7982000 
1 1 1 38 3  23 o 14.38000 0.4269000 14.53000 0.6098000 14.23000 0.5976000 0.2907000      0.8538000 
1 1 1 38 3  25 o 18.05000 0.3859000 18.30000 0.5628000 17.80000 0.5281000 0.5020000      0.7718000 
1 1 1 38 3  27 o 6.825000 0.7709000 6.654000 1.131000  6.996000 1.048000  -0.3418000     1.542000  
1 1 1 38 3  29 o 9.880000 0.5195000 10.95000 0.6677000 8.811000 0.7960000 2.137000       1.039000  
1 1 1 38 3  31 o 11.29000 0.5408000 10.31000 0.7924000 12.27000 0.7361000 -1.964000      1.082000  
1 1 1 38 3  33 o 4.632000 1.029000  4.910000 1.366000  4.354000 1.539000  0.5563000      2.057000  
1 1 1 38 3  35 o 8.026000 0.6360000 7.565000 0.9256000 8.486000 0.8724000 -0.9214000     1.272000  
1 1 1 38 3  37 o 2.586000 0.8083000 2.290000 1.085000  2.883000 1.198000  -0.5931000     1.617000  
1 1 1 38 3  39 o 5.353000 0.9684000 6.042000 1.156000  4.664000 1.554000  1.378000       1.937000  
1 1 1 38 4  0  o 5.876000 1.059000  5.876000 1.059000  5.876000 1.059000  0.000000       0.000000  
1 1 1 38 4  2  o 9.649000 0.4723000 9.777000 0.6070000 9.520000 0.7238000 0.2565000      0.9446000 
1 1 1 38 4  4  o 11.95000 0.3951000 11.81000 0.5699000 12.09000 0.5474000 -0.2744000     0.7902000 
1 1 1 38 4  6  o 5.650000 0.7056000 5.198000 1.083000  6.102000 0.9050000 -0.9031000     1.411000  
1 1 1 38 4  8  o 9.645000 0.4919000 10.24000 0.6741000 9.050000 0.7165000 1.191000       0.9838000 
1 1 1 38 4  10 o 11.67000 0.4165000 11.82000 0.5999000 11.51000 0.5780000 0.3066000      0.8331000 
1 1 1 38 4  12 o 2.648000 0.7993000 3.036000 1.221000  2.260000 1.031000  0.7763000      1.599000  
1 1 1 38 4  14 o 8.959000 0.5536000 9.357000 0.7711000 8.560000 0.7947000 0.7966000      1.107000  
1 1 1 38 4  16 o 12.41000 0.3977000 12.52000 0.5363000 12.29000 0.5874000 0.2301000      0.7954000 
1 1 1 38 4  18 o 3.802000 0.8603000 4.170000 1.187000  3.434000 1.246000  0.7358000      1.721000  
1 1 1 38 4  20 o 11.22000 0.3914000 10.63000 0.5626000 11.82000 0.5443000 -1.190000      0.7828000 
1 1 1 38 4  22 o 8.496000 0.5461000 8.868000 0.8076000 8.123000 0.7354000 0.7457000      1.092000  
1 1 1 38 4  24 o 5.196000 0.8137000 5.634000 1.069000  4.758000 1.227000  0.8759000      1.627000  
1 1 1 38 4  26 o 11.16000 0.4905000 12.03000 0.6767000 10.30000 0.7101000 1.734000       0.9809000 
1 1 1 38 4  28 f 9.994000 0.5971000 11.27000 0.7188000 8.714000 0.9537000 2.559000       1.194000  
1 1 1 38 4  30 o 3.146000 0.8961000 3.618000 1.330000  2.675000 1.201000  0.9424000      1.792000  
1 1 1 38 4  32 o 7.388000 0.7099000 6.935000 0.9458000 7.841000 1.059000  -0.9057000     1.420000  
1 1 1 38 4  34 o 10.73000 0.6014000 11.03000 0.8875000 10.44000 0.8119000 0.5854000      1.203000  
1 1 1 38 4  36 o 5.222000 0.9187000 4.767000 1.398000  5.676000 1.192000  -0.9088000     1.837000  
1 1 1 38 4  38 o 3.471000 0.9672000 3.095000 1.213000  3.846000 1.507000  -0.7501000     1.934000  
1 1 1 38 4  40 o 4.598000 1.716000  4.598000 1.716000  ?        ?         ?              ?         
1 1 1 38 5  1  o 5.285000 0.7752000 5.435000 1.165000  5.135000 1.024000  0.2995000      1.550000  
1 1 1 38 5  3  o 2.631000 0.7766000 2.174000 1.012000  3.088000 1.178000  -0.9142000     1.553000  
1 1 1 38 5  5  o 26.45000 0.3069000 25.99000 0.4404000 26.91000 0.4276000 -0.9139000     0.6139000 
1 1 1 38 5  7  o 14.68000 0.3638000 13.81000 0.5124000 15.54000 0.5167000 -1.732000      0.7277000 
1 1 1 38 5  9  o 10.60000 0.5705000 10.44000 0.9383000 10.75000 0.6493000 -0.3079000     1.141000  
1 1 1 38 5  11 o 3.242000 0.9204000 3.286000 1.376000  3.199000 1.223000  0.8722000E-01  1.841000  
1 1 1 38 5  13 o 5.088000 0.8199000 5.565000 1.180000  4.611000 1.138000  0.9539000      1.640000  
1 1 1 38 5  15 o 12.83000 0.4175000 12.75000 0.5872000 12.91000 0.5936000 -0.1642000     0.8350000 
1 1 1 38 5  17 o 9.483000 0.4757000 10.08000 0.6952000 8.884000 0.6494000 1.199000       0.9513000 
1 1 1 38 5  19 o 16.73000 0.3742000 16.77000 0.5547000 16.69000 0.5024000 0.8458000E-01  0.7484000 
1 1 1 38 5  21 o 6.852000 0.5998000 7.174000 0.8402000 6.529000 0.8563000 0.6459000      1.200000  
1 1 1 38 5  23 o 6.283000 0.7016000 6.465000 1.003000  6.101000 0.9814000 0.3643000      1.403000  
1 1 1 38 5  25 o 6.920000 0.6380000 6.459000 0.9860000 7.380000 0.8098000 -0.9207000     1.276000  
1 1 1 38 5  27 o 3.812000 0.8779000 4.797000 1.267000  2.827000 1.216000  1.971000       1.756000  
1 1 1 38 5  29 o 6.705000 0.7674000 6.391000 0.9831000 7.020000 1.179000  -0.6291000     1.535000  
1 1 1 38 5  31 f 8.789000 0.6194000 8.257000 0.8440000 9.320000 0.9068000 -1.064000      1.239000  
1 1 1 38 5  33 o 2.428000 0.7934000 2.496000 1.125000  2.360000 1.119000  0.1361000      1.587000  
1 1 1 38 5  35 o 8.723000 0.6645000 8.111000 1.078000  9.334000 0.7775000 -1.223000      1.329000  
1 1 1 38 5  37 o 4.502000 1.008000  4.113000 1.325000  4.891000 1.520000  -0.7785000     2.017000  
1 1 1 38 5  39 o 3.247000 0.9366000 2.298000 1.054000  4.196000 1.549000  -1.899000      1.873000  
1 1 1 38 6  0  o 11.00000 0.5573000 11.00000 0.5573000 11.00000 0.5573000 0.000000       0.000000  
1 1 1 38 6  2  o 4.762000 0.8367000 4.853000 1.248000  4.671000 1.115000  0.1823000      1.673000  
1 1 1 38 6  4  o 12.21000 0.4681000 12.76000 0.7647000 11.67000 0.5402000 1.090000       0.9363000 
1 1 1 38 6  6  o 8.650000 0.6577000 8.002000 1.149000  9.299000 0.6399000 -1.297000      1.315000  
1 1 1 38 6  8  o 10.03000 0.5678000 9.623000 0.9514000 10.44000 0.6201000 -0.8180000     1.136000  
1 1 1 38 6  10 f 20.65000 0.4683000 20.06000 0.6167000 21.23000 0.7048000 -1.166000      0.9365000 
1 1 1 38 6  12 o 19.84000 0.3256000 19.57000 0.4334000 20.12000 0.4859000 -0.5563000     0.6511000 
1 1 1 38 6  14 o 9.918000 0.4376000 9.102000 0.6429000 10.73000 0.5938000 -1.632000      0.8752000 
1 1 1 38 6  16 o 12.63000 0.3668000 12.61000 0.5112000 12.66000 0.5262000 -0.4226000E-01 0.7336000 
1 1 1 38 6  18 o 5.377000 0.6903000 4.532000 1.077000  6.222000 0.8644000 -1.690000      1.381000  
1 1 1 38 6  20 o 3.769000 0.8051000 2.608000 1.053000  4.930000 1.218000  -2.321000      1.610000  
1 1 1 38 6  22 o 9.603000 0.5406000 10.30000 0.8241000 8.905000 0.7000000 1.397000       1.081000  
1 1 1 38 6  24 o 3.148000 0.8957000 3.494000 1.357000  2.802000 1.169000  0.6915000      1.791000  
1 1 1 38 6  26 f 4.139000 0.8537000 3.024000 1.222000  5.254000 1.192000  -2.230000      1.707000  
1 1 1 38 6  28 o 8.107000 0.6483000 7.859000 0.9227000 8.355000 0.9109000 -0.4967000     1.297000  
1 1 1 38 6  30 o 2.948000 0.8685000 2.663000 1.176000  3.234000 1.279000  -0.5707000     1.737000  
1 1 1 38 6  32 o 5.813000 1.198000  4.787000 1.287000  6.838000 2.022000  -2.051000      2.396000  
1 1 1 38 6  34 o 18.41000 0.5012000 18.00000 0.8363000 18.83000 0.5527000 -0.8282000     1.002000  
1 1 1 38 6  36 o 10.98000 0.5284000 11.11000 0.6011000 10.85000 0.8692000 0.2645000      1.057000  
1 1 1 38 6  38 o 6.910000 0.7806000 6.372000 0.9796000 7.448000 1.216000  -1.076000      1.561000  
1 1 1 38 7  1  o 13.82000 0.3397000 13.89000 0.4718000 13.75000 0.4888000 0.1398000      0.6794000 
1 1 1 38 7  3  o 19.39000 0.3809000 19.81000 0.6318000 18.97000 0.4258000 0.8413000      0.7619000 
1 1 1 38 7  5  o 27.71000 0.3801000 27.46000 0.6329000 27.97000 0.4211000 -0.5093000     0.7602000 
1 1 1 38 7  7  o 11.81000 0.7570000 11.12000 1.395000  12.50000 0.5889000 -1.383000      1.514000  
1 1 1 38 7  9  o 13.64000 0.3766000 13.86000 0.5039000 13.41000 0.5599000 0.4483000      0.7532000 
1 1 1 38 7  11 o 4.450000 0.8702000 4.272000 1.254000  4.627000 1.207000  -0.3551000     1.740000  
1 1 1 38 7  13 o 20.88000 0.3218000 21.43000 0.4324000 20.32000 0.4769000 1.108000       0.6437000 
1 1 1 38 7  15 o 14.47000 0.3363000 14.47000 0.4833000 14.47000 0.4679000 -0.6714000E-03 0.6727000 
1 1 1 38 7  17 o 4.914000 0.7612000 4.932000 1.076000  4.896000 1.077000  0.3644000E-01  1.522000  
1 1 1 38 7  19 o 6.718000 0.5973000 6.854000 0.8221000 6.581000 0.8667000 0.2727000      1.195000  
1 1 1 38 7  21 o 8.757000 0.5671000 8.533000 0.6403000 8.980000 0.9363000 -0.4472000     1.134000  
1 1 1 38 7  23 f 12.82000 0.4196000 13.43000 0.6137000 12.21000 0.5724000 1.226000       0.8392000 
1 1 1 38 7  25 o 7.229000 0.8032000 5.733000 1.395000  8.725000 0.7962000 -2.992000      1.606000  
1 1 1 38 7  27 o 2.974000 0.9035000 2.965000 1.298000  2.982000 1.257000  -0.1773000E-01 1.807000  
1 1 1 38 7  29 o 4.902000 0.9005000 5.822000 1.239000  3.982000 1.307000  1.839000       1.801000  
1 1 1 38 7  31 o 8.913000 0.5783000 9.769000 0.8421000 8.058000 0.7928000 1.711000       1.157000  
1 1 1 38 7  33 o 6.664000 0.9954000 5.084000 1.458000  8.245000 1.355000  -3.161000      1.991000  
1 1 1 38 7  35 o 12.00000 0.5661000 11.65000 0.6753000 12.35000 0.9087000 -0.7070000     1.132000  
1 1 1 38 7  37 o 5.215000 0.9548000 4.556000 1.186000  5.873000 1.496000  -1.316000      1.910000  
1 1 1 38 7  39 o 3.379000 0.9529000 3.233000 1.231000  3.526000 1.455000  -0.2928000     1.906000  
1 1 1 38 8  0  o 14.00000 0.5778000 14.00000 0.5778000 14.00000 0.5778000 0.000000       0.000000  
1 1 1 38 8  2  o 19.56000 0.3361000 19.67000 0.5196000 19.45000 0.4263000 0.2175000      0.6721000 
1 1 1 38 8  4  f 17.24000 0.3825000 16.99000 0.6215000 17.48000 0.4461000 -0.4835000     0.7651000 
1 1 1 38 8  6  o 21.90000 0.5726000 22.98000 1.064000  20.82000 0.4229000 2.164000       1.145000  
1 1 1 38 8  8  o 17.52000 0.3243000 18.05000 0.4416000 16.99000 0.4750000 1.058000       0.6486000 
1 1 1 38 8  10 o 11.37000 0.3801000 11.25000 0.5220000 11.50000 0.5527000 -0.2514000     0.7603000 
1 1 1 38 8  12 o 5.143000 0.7402000 3.919000 1.193000  6.367000 0.8760000 -2.448000      1.480000  
1 1 1 38 8  14 o 9.213000 0.4180000 9.132000 0.5706000 9.294000 0.6109000 -0.1619000     0.8359000 
1 1 1 38 8  16 o 5.628000 0.6851000 5.743000 0.9796000 5.513000 0.9582000 0.2305000      1.370000  
1 1 1 38 8  18 f 11.55000 0.3775000 11.44000 0.5342000 11.65000 0.5336000 -0.2134000     0.7550000 
1 1 1 38 8  20 o 14.63000 0.3353000 15.10000 0.4647000 14.15000 0.4835000 0.9483000      0.6706000 
1 1 1 38 8  22 o 10.87000 0.5851000 11.04000 0.5864000 10.70000 1.013000  0.3365000      1.170000  
1 1 1 38 8  24 o 18.12000 0.4129000 18.53000 0.6112000 17.71000 0.5554000 0.8158000      0.8258000 
1 1 1 38 8  26 o 4.506000 0.8871000 4.642000 1.278000  4.370000 1.230000  0.2722000      1.774000  
1 1 1 38 8  28 o 6.505000 0.8884000 6.535000 1.492000  6.475000 0.9644000 0.5976000E-01  1.777000  
1 1 1 38 8  30 o 8.369000 0.7198000 9.019000 1.172000  7.718000 0.8358000 1.301000       1.440000  
1 1 1 38 8  32 o 6.297000 0.7838000 6.880000 1.026000  5.715000 1.185000  1.165000       1.568000  
1 1 1 38 8  34 o 7.464000 0.8462000 6.350000 1.371000  8.579000 0.9926000 -2.229000      1.692000  
1 1 1 38 8  36 o 8.872000 0.6587000 7.866000 0.9571000 9.878000 0.9053000 -2.013000      1.317000  
1 1 1 38 8  38 o 3.504000 0.9578000 3.548000 1.233000  3.460000 1.466000  0.8829000E-01  1.916000  
1 1 1 38 9  1  o 14.67000 0.4037000 14.07000 0.5754000 15.28000 0.5663000 -1.210000      0.8073000 
1 1 1 38 9  3  o 5.020000 1.024000  4.566000 1.688000  5.475000 1.160000  -0.9088000     2.049000  
1 1 1 38 9  5  o 6.710000 0.6028000 7.095000 0.8649000 6.324000 0.8399000 0.7711000      1.206000  
1 1 1 38 9  7  o 4.298000 0.8890000 5.040000 1.264000  3.557000 1.250000  1.483000       1.778000  
1 1 1 38 9  9  o 12.02000 0.3783000 11.62000 0.5258000 12.42000 0.5440000 -0.8023000     0.7565000 
1 1 1 38 9  11 o 10.06000 0.4344000 9.520000 0.5828000 10.61000 0.6444000 -1.089000      0.8689000 
1 1 1 38 9  13 o 20.46000 0.3131000 20.55000 0.4276000 20.38000 0.4575000 0.1691000      0.6262000 
1 1 1 38 9  15 o 9.117000 0.4426000 8.824000 0.6392000 9.410000 0.6123000 -0.5859000     0.8851000 
1 1 1 38 9  17 o 5.873000 0.6374000 5.900000 0.8773000 5.846000 0.9249000 0.5442000E-01  1.275000  
1 1 1 38 9  19 o 6.276000 0.7095000 6.546000 0.8081000 6.005000 1.166000  0.5414000      1.419000  
1 1 1 38 9  21 o 10.67000 0.5267000 11.69000 0.5437000 9.649000 0.9022000 2.040000       1.053000  
1 1 1 38 9  23 o 3.192000 0.8584000 3.470000 1.215000  2.914000 1.213000  0.5563000      1.717000  
1 1 1 38 9  25 o 3.745000 0.8672000 4.688000 1.268000  2.803000 1.183000  1.885000       1.734000  
1 1 1 38 9  27 o 7.330000 0.6279000 7.034000 0.9004000 7.626000 0.8754000 -0.5922000     1.256000  
1 1 1 38 9  29 f 6.399000 0.7701000 6.904000 1.040000  5.894000 1.136000  1.010000       1.540000  
1 1 1 38 9  31 o 14.53000 0.4684000 14.96000 0.6537000 14.11000 0.6711000 0.8421000      0.9369000 
1 1 1 38 9  33 o 6.577000 0.7382000 7.835000 0.8776000 5.318000 1.187000  2.517000       1.476000  
1 1 1 38 9  35 o 9.781000 0.6568000 9.754000 0.7747000 9.808000 1.061000  -0.5408000E-01 1.314000  
1 1 1 38 9  37 o 3.998000 1.003000  4.178000 1.344000  3.817000 1.489000  0.3612000      2.006000  
1 1 1 38 9  39 o 3.816000 1.456000  3.816000 1.456000  ?        ?         ?              ?         
1 1 1 38 10 0  f 7.520000 1.814000  7.520000 1.814000  7.520000 1.814000  0.000000       0.000000  
1 1 1 38 10 2  o 15.18000 0.4193000 15.45000 0.4488000 14.92000 0.7084000 0.5355000      0.8387000 
1 1 1 38 10 4  o 4.997000 0.8163000 5.309000 1.058000  4.685000 1.244000  0.6243000      1.633000  
1 1 1 38 10 6  o 6.561000 0.5574000 6.794000 0.7329000 6.328000 0.8399000 0.4658000      1.115000  
1 1 1 38 10 8  o 8.449000 0.4845000 8.309000 0.6966000 8.589000 0.6735000 -0.2803000     0.9689000 
1 1 1 38 10 10 o 9.672000 0.4211000 9.815000 0.5762000 9.528000 0.6143000 0.2874000      0.8422000 
1 1 1 38 10 12 o 6.060000 0.5963000 6.616000 0.8071000 5.504000 0.8779000 1.112000       1.193000  
1 1 1 38 10 14 o 7.876000 0.5718000 8.597000 0.6488000 7.155000 0.9418000 1.442000       1.144000  
1 1 1 38 10 16 o 12.05000 0.3948000 12.09000 0.5085000 12.00000 0.6040000 0.9252000E-01  0.7895000 
1 1 1 38 10 18 o 7.972000 0.5504000 7.922000 0.6865000 8.023000 0.8604000 -0.1006000     1.101000  
1 1 1 38 10 20 o 7.412000 0.5467000 7.861000 0.7202000 6.964000 0.8229000 0.8972000      1.093000  
1 1 1 38 10 22 o 14.71000 0.4395000 14.63000 0.4969000 14.80000 0.7250000 -0.1608000     0.8790000 
1 1 1 38 10 24 o 9.936000 0.5314000 9.118000 0.7772000 10.75000 0.7249000 -1.634000      1.063000  
1 1 1 38 10 26 o 7.660000 0.6391000 7.761000 0.9378000 7.559000 0.8684000 0.2026000      1.278000  
1 1 1 38 10 28 o 2.437000 0.7683000 2.454000 1.084000  2.419000 1.089000  0.3417000E-01  1.537000  
1 1 1 38 10 30 f 11.51000 0.5307000 11.65000 0.6241000 11.37000 0.8584000 0.2798000      1.061000  
1 1 1 38 10 32 o 5.893000 0.7949000 6.108000 1.119000  5.678000 1.129000  0.4300000      1.590000  
1 1 1 38 10 34 o 14.10000 0.4472000 13.27000 0.6198000 14.93000 0.6448000 -1.658000      0.8944000 
1 1 1 38 10 36 o 4.152000 0.9705000 3.747000 1.205000  4.557000 1.522000  -0.8102000     1.941000  
1 1 1 38 10 38 o 7.373000 0.7288000 5.981000 0.9402000 8.766000 1.114000  -2.785000      1.458000  
1 1 1 38 11 1  o 19.53000 0.3071000 19.62000 0.4285000 19.45000 0.4400000 0.1711000      0.6142000 
1 1 1 38 11 3  o 18.82000 0.4131000 18.62000 0.4850000 19.01000 0.6688000 -0.3880000     0.8262000 
1 1 1 38 11 5  o 23.61000 0.3446000 24.45000 0.4916000 22.77000 0.4830000 1.688000       0.6892000 
1 1 1 38 11 7  o 8.822000 0.6091000 8.570000 0.6759000 9.075000 1.014000  -0.5055000     1.218000  
1 1 1 38 11 9  o 6.374000 0.7431000 7.453000 0.7761000 5.295000 1.267000  2.157000       1.486000  
1 1 1 38 11 11 o 13.48000 0.3788000 13.44000 0.4758000 13.53000 0.5895000 -0.8528000E-01 0.7576000 
1 1 1 38 11 13 o 10.86000 0.4322000 11.05000 0.5172000 10.68000 0.6926000 0.3681000      0.8644000 
1 1 1 38 11 15 o 10.79000 0.4222000 11.03000 0.5366000 10.55000 0.6520000 0.4826000      0.8444000 
1 1 1 38 11 17 o 3.724000 0.8287000 3.503000 1.162000  3.946000 1.182000  -0.4426000     1.657000  
1 1 1 38 11 19 f 3.370000 0.8692000 3.391000 1.225000  3.350000 1.233000  0.4016000E-01  1.738000  
1 1 1 38 11 21 o 9.929000 0.4413000 10.02000 0.6120000 9.834000 0.6358000 0.1887000      0.8825000 
1 1 1 38 11 23 o 13.27000 0.3963000 13.22000 0.5785000 13.31000 0.5419000 -0.8926000E-01 0.7927000 
1 1 1 38 11 25 o 10.51000 0.5011000 10.67000 0.7936000 10.34000 0.6120000 0.3218000      1.002000  
1 1 1 38 11 27 o 4.315000 0.7661000 5.965000 0.9855000 2.665000 1.173000  3.299000       1.532000  
1 1 1 38 11 29 o 5.534000 0.8769000 5.354000 1.139000  5.713000 1.334000  -0.3595000     1.754000  
1 1 1 38 11 31 o 3.391000 0.8970000 2.845000 1.204000  3.937000 1.330000  -1.092000      1.794000  
1 1 1 38 11 33 o 3.743000 0.9103000 3.969000 1.180000  3.518000 1.387000  0.4516000      1.821000  
1 1 1 38 11 35 o 4.260000 0.9266000 3.675000 1.164000  4.846000 1.442000  -1.171000      1.853000  
1 1 1 38 11 37 o 5.415000 0.9641000 3.815000 1.356000  7.015000 1.371000  -3.200000      1.928000  
1 1 1 38 12 0  o 4.070000 1.152000  4.070000 1.152000  4.070000 1.152000  0.000000       0.000000  
1 1 1 38 12 2  o 12.92000 0.3458000 12.84000 0.4917000 12.99000 0.4865000 -0.1486000     0.6916000 
1 1 1 38 12 4  o 4.529000 0.8895000 4.201000 1.208000  4.856000 1.306000  -0.6551000     1.779000  
1 1 1 38 12 6  o 15.93000 0.3609000 15.67000 0.5224000 16.20000 0.4981000 -0.5294000     0.7218000 
1 1 1 38 12 8  o 12.13000 0.3761000 12.42000 0.5051000 11.85000 0.5574000 0.5694000      0.7522000 
1 1 1 38 12 10 o 11.44000 0.4239000 11.76000 0.5920000 11.11000 0.6068000 0.6460000      0.8478000 
1 1 1 38 12 12 o 13.64000 0.3435000 13.92000 0.4665000 13.37000 0.5043000 0.5483000      0.6870000 
1 1 1 38 12 14 o 10.66000 0.4007000 10.79000 0.5499000 10.53000 0.5831000 0.2579000      0.8015000 
1 1 1 38 12 16 o 20.00000 0.3156000 19.99000 0.4119000 20.01000 0.4783000 -0.2114000E-01 0.6313000 
1 1 1 38 12 18 o 14.94000 0.3205000 14.44000 0.4445000 15.44000 0.4619000 -1.006000      0.6410000 
1 1 1 38 12 20 o 6.732000 0.6673000 6.955000 0.8999000 6.509000 0.9855000 0.4461000      1.335000  
1 1 1 38 12 22 o 8.847000 0.5945000 7.950000 0.9246000 9.744000 0.7477000 -1.794000      1.189000  
1 1 1 38 12 24 o 3.604000 0.8141000 4.544000 1.148000  2.663000 1.155000  1.881000       1.628000  
1 1 1 38 12 26 o 9.522000 0.6514000 8.521000 1.123000  10.52000 0.6607000 -2.002000      1.303000  
1 1 1 38 12 28 o 7.436000 0.6297000 6.784000 0.9018000 8.088000 0.8792000 -1.304000      1.259000  
1 1 1 38 12 30 o 3.418000 0.8811000 4.082000 1.303000  2.754000 1.187000  1.327000       1.762000  
1 1 1 38 12 32 o 6.426000 0.7756000 6.567000 0.8897000 6.285000 1.271000  0.2821000      1.551000  
1 1 1 38 12 34 o 2.976000 0.8902000 2.441000 1.064000  3.511000 1.427000  -1.071000      1.780000  
1 1 1 38 12 36 o 8.964000 0.6535000 8.200000 0.6734000 9.728000 1.120000  -1.529000      1.307000  
1 1 1 38 12 38 o 2.966000 0.9504000 2.999000 1.261000  2.934000 1.422000  0.6444000E-01  1.901000  
1 1 1 38 13 1  o 4.213000 0.9417000 4.336000 1.243000  4.089000 1.415000  0.2466000      1.883000  
1 1 1 38 13 3  o 15.31000 0.3519000 14.79000 0.4874000 15.84000 0.5076000 -1.057000      0.7037000 
1 1 1 38 13 5  o 19.58000 0.3566000 19.15000 0.4668000 20.00000 0.5392000 -0.8539000     0.7132000 
1 1 1 38 13 7  o 12.67000 0.4291000 12.31000 0.5294000 13.04000 0.6754000 -0.7308000     0.8581000 
1 1 1 38 13 9  o 4.681000 0.8358000 4.665000 1.180000  4.697000 1.184000  -0.3248000E-01 1.672000  
1 1 1 38 13 11 o 8.456000 0.4726000 8.384000 0.6496000 8.527000 0.6866000 -0.1421000     0.9452000 
1 1 1 38 13 13 o 4.546000 0.7462000 4.715000 0.9658000 4.377000 1.138000  0.3381000      1.492000  
1 1 1 38 13 15 o 18.20000 0.3302000 18.73000 0.4880000 17.67000 0.4449000 1.058000       0.6604000 
1 1 1 38 13 17 o 6.169000 0.6945000 5.800000 1.015000  6.538000 0.9477000 -0.7373000     1.389000  
1 1 1 38 13 19 o 11.77000 0.4254000 11.77000 0.5469000 11.76000 0.6519000 0.1482000E-01  0.8509000 
1 1 1 38 13 21 f 3.589000 0.8681000 3.357000 1.197000  3.821000 1.258000  -0.4636000     1.736000  
1 1 1 38 13 23 f 13.33000 0.3949000 13.83000 0.5141000 12.83000 0.5995000 0.9968000      0.7898000 
1 1 1 38 13 25 o 5.219000 0.8159000 5.212000 1.165000  5.226000 1.142000  -0.1428000E-01 1.632000  
1 1 1 38 13 27 o 10.53000 0.4449000 10.89000 0.6081000 10.17000 0.6497000 0.7199000      0.8899000 
1 1 1 38 13 29 o 8.694000 0.5126000 8.762000 0.6874000 8.627000 0.7605000 0.1351000      1.025000  
1 1 1 38 13 31 o 4.894000 0.9010000 4.572000 1.189000  5.217000 1.354000  -0.6451000     1.802000  
1 1 1 38 13 33 o 9.432000 0.5484000 9.688000 0.6239000 9.176000 0.9021000 0.5116000      1.097000  
1 1 1 38 13 35 o 4.228000 1.029000  3.531000 1.229000  4.924000 1.652000  -1.393000      2.059000  
1 1 1 38 13 37 o 4.366000 0.9725000 4.155000 1.161000  4.576000 1.560000  -0.4209000     1.945000  
1 1 1 38 14 0  o 19.25000 0.4494000 19.25000 0.4494000 19.25000 0.4494000 0.000000       0.000000  
1 1 1 38 14 2  o 9.185000 0.4582000 9.400000 0.7007000 8.970000 0.5905000 0.4295000      0.9163000 
1 1 1 38 14 4  o 11.40000 0.4192000 11.86000 0.6373000 10.94000 0.5449000 0.9176000      0.8385000 
1 1 1 38 14 6  o 25.80000 0.3412000 25.59000 0.4671000 26.01000 0.4975000 -0.4220000     0.6824000 
1 1 1 38 14 8  f 13.02000 0.3746000 13.30000 0.5152000 12.75000 0.5441000 0.5545000      0.7493000 
1 1 1 38 14 10 o 8.200000 0.5674000 8.585000 0.8624000 7.815000 0.7377000 0.7698000      1.135000  
1 1 1 38 14 12 o 3.468000 0.9272000 3.462000 1.306000  3.474000 1.317000  -0.1242000E-01 1.854000  
1 1 1 38 14 14 o 8.018000 0.5457000 8.582000 0.7452000 7.455000 0.7974000 1.126000       1.091000  
1 1 1 38 14 16 o 6.872000 0.5616000 7.169000 0.7347000 6.575000 0.8496000 0.5940000      1.123000  
1 1 1 38 14 18 o 6.156000 0.6216000 6.434000 0.8129000 5.878000 0.9406000 0.5566000      1.243000  
1 1 1 38 14 20 o 2.945000 0.8397000 2.911000 1.186000  2.979000 1.189000  -0.6834000E-01 1.679000  
1 1 1 38 14 22 o 7.912000 0.5260000 7.571000 0.7893000 8.254000 0.6954000 -0.6829000     1.052000  
1 1 1 38 14 24 o 10.09000 0.4707000 10.80000 0.6437000 9.382000 0.6869000 1.418000       0.9414000 
1 1 1 38 14 26 o 12.53000 0.4368000 13.89000 0.6428000 11.17000 0.5917000 2.718000       0.8737000 
1 1 1 38 14 28 o 3.015000 0.8565000 3.128000 1.232000  2.903000 1.191000  0.2249000      1.713000  
1 1 1 38 14 30 o 3.929000 0.9111000 4.083000 1.105000  3.776000 1.449000  0.3073000      1.822000  
1 1 1 38 14 32 o 4.036000 0.9676000 4.391000 1.196000  3.680000 1.521000  0.7114000      1.935000  
1 1 1 38 14 34 o 7.274000 0.7488000 7.982000 0.7715000 6.566000 1.283000  1.415000       1.498000  
1 1 1 38 14 36 o 10.72000 0.6283000 10.77000 0.5582000 10.66000 1.126000  0.1145000      1.257000  
1 1 1 38 15 1  o 7.716000 0.5365000 8.180000 0.7101000 7.252000 0.8045000 0.9276000      1.073000  
1 1 1 38 15 3  o 2.926000 0.7907000 2.175000 1.019000  3.676000 1.210000  -1.501000      1.581000  
1 1 1 38 15 5  o 12.52000 0.4036000 11.91000 0.6402000 13.13000 0.4918000 -1.218000      0.8072000 
1 1 1 38 15 7  o 11.57000 0.4217000 11.78000 0.5283000 11.35000 0.6574000 0.4371000      0.8433000 
1 1 1 38 15 9  o 10.98000 0.3735000 11.08000 0.5213000 10.88000 0.5350000 0.2002000      0.7469000 
1 1 1 38 15 11 o 3.712000 0.8425000 2.911000 1.173000  4.512000 1.210000  -1.600000      1.685000  
1 1 1 38 15 13 o 17.66000 0.3218000 18.01000 0.4318000 17.31000 0.4771000 0.6947000      0.6435000 
1 1 1 38 15 15 o 7.294000 0.6199000 7.821000 0.7484000 6.767000 0.9884000 1.054000       1.240000  
1 1 1 38 15 17 o 5.444000 0.7902000 5.505000 1.027000  5.383000 1.201000  0.1224000      1.580000  
1 1 1 38 15 19 o 13.52000 0.3960000 14.06000 0.5006000 12.99000 0.6139000 1.073000       0.7921000 
1 1 1 38 15 21 o 7.062000 0.6516000 7.138000 0.7551000 6.986000 1.062000  0.1519000      1.303000  
1 1 1 38 15 23 o 6.380000 0.6912000 6.688000 0.9338000 6.072000 1.019000  0.6158000      1.382000  
1 1 1 38 15 25 o 13.67000 0.4063000 13.99000 0.5907000 13.35000 0.5580000 0.6357000      0.8125000 
1 1 1 38 15 27 o 15.79000 0.4055000 16.17000 0.5624000 15.42000 0.5844000 0.7463000      0.8110000 
1 1 1 38 15 29 o 8.516000 0.7061000 9.001000 0.7079000 8.032000 1.222000  0.9686000      1.412000  
1 1 1 38 15 31 o 13.86000 0.3929000 13.32000 0.4928000 14.40000 0.6122000 -1.078000      0.7858000 
1 1 1 38 15 33 o 6.457000 0.7516000 6.354000 0.8716000 6.560000 1.225000  -0.2057000     1.503000  
1 1 1 38 15 35 o 6.362000 0.8172000 7.543000 0.7095000 5.181000 1.472000  2.363000       1.634000  
1 1 1 38 16 0  f 6.602000 0.8348000 6.602000 0.8348000 6.602000 0.8348000 0.000000       0.000000  
1 1 1 38 16 2  o 3.854000 0.8408000 3.470000 1.205000  4.238000 1.173000  -0.7672000     1.682000  
1 1 1 38 16 4  o 2.970000 0.8254000 2.671000 1.132000  3.270000 1.201000  -0.5993000     1.651000  
1 1 1 38 16 6  o 3.122000 0.7416000 4.172000 1.124000  2.072000 0.9682000 2.100000       1.483000  
1 1 1 38 16 8  o 4.730000 0.8579000 5.324000 1.028000  4.137000 1.374000  1.187000       1.716000  
1 1 1 38 16 10 o 6.965000 0.5784000 6.853000 0.8273000 7.077000 0.8087000 -0.2238000     1.157000  
1 1 1 38 16 12 o 22.97000 0.3615000 22.91000 0.4783000 23.04000 0.5421000 -0.1273000     0.7229000 
1 1 1 38 16 14 o 9.933000 0.5105000 10.54000 0.5499000 9.327000 0.8603000 1.211000       1.021000  
1 1 1 38 16 16 o 3.962000 0.8496000 4.725000 1.052000  3.200000 1.335000  1.524000       1.699000  
1 1 1 38 16 18 o 7.796000 0.5933000 8.779000 0.6921000 6.812000 0.9638000 1.967000       1.187000  
1 1 1 38 16 20 o 9.239000 0.4812000 9.318000 0.6353000 9.161000 0.7229000 0.1568000      0.9624000 
1 1 1 38 16 22 o 3.115000 0.8235000 2.583000 1.126000  3.647000 1.202000  -1.064000      1.647000  
1 1 1 38 16 24 o 11.87000 0.5236000 11.67000 0.5617000 12.06000 0.8838000 -0.3920000     1.047000  
1 1 1 38 16 26 o 4.603000 1.004000  4.073000 1.316000  5.132000 1.516000  -1.059000      2.008000  
1 1 1 38 16 28 o 8.098000 0.6352000 7.190000 0.9151000 9.007000 0.8812000 -1.817000      1.270000  
1 1 1 38 16 30 o 3.058000 0.8944000 2.515000 1.066000  3.601000 1.436000  -1.087000      1.789000  
1 1 1 38 16 32 o 13.22000 0.4345000 13.25000 0.4717000 13.18000 0.7297000 0.7424000E-01  0.8689000 
1 1 1 38 16 34 o 14.47000 0.5044000 14.42000 0.4594000 14.53000 0.8982000 -0.1108000     1.009000  
1 1 1 38 16 36 o 7.718000 1.042000  7.266000 0.8459000 8.170000 1.905000  -0.9040000     2.085000  
1 1 1 38 17 1  o 18.50000 0.2977000 18.27000 0.4228000 18.74000 0.4193000 -0.4728000     0.5955000 
1 1 1 38 17 3  o 8.574000 0.4679000 8.097000 0.7306000 9.051000 0.5846000 -0.9546000     0.9357000 
1 1 1 38 17 5  o 7.671000 0.4953000 7.329000 0.7439000 8.013000 0.6541000 -0.6834000     0.9906000 
1 1 1 38 17 7  o 5.609000 0.7187000 6.189000 0.8748000 5.030000 1.141000  1.159000       1.437000  
1 1 1 38 17 9  o 7.151000 0.6925000 6.725000 0.7529000 7.576000 1.162000  -0.8513000     1.385000  
1 1 1 38 17 11 o 12.67000 0.4016000 13.03000 0.4767000 12.31000 0.6465000 0.7135000      0.8033000 
1 1 1 38 17 13 o 14.70000 0.3428000 14.76000 0.4917000 14.64000 0.4777000 0.1270000      0.6855000 
1 1 1 38 17 15 o 5.434000 0.6853000 5.082000 1.001000  5.787000 0.9360000 -0.7049000     1.371000  
1 1 1 38 17 17 o 7.310000 0.5761000 7.678000 0.7159000 6.942000 0.9028000 0.7361000      1.152000  
1 1 1 38 17 19 o 2.870000 0.8227000 2.752000 1.134000  2.988000 1.192000  -0.2368000     1.645000  
1 1 1 38 17 21 f 4.423000 0.8317000 5.010000 1.047000  3.836000 1.293000  1.173000       1.663000  
1 1 1 38 17 23 o 4.649000 0.8741000 4.126000 1.274000  5.171000 1.197000  -1.045000      1.748000  
1 1 1 38 17 25 o 7.745000 0.5979000 8.399000 0.7555000 7.092000 0.9270000 1.307000       1.196000  
1 1 1 38 17 27 o 9.541000 0.6380000 10.16000 0.7372000 8.923000 1.042000  1.236000       1.276000  
1 1 1 38 17 29 o 3.076000 0.8757000 3.258000 1.227000  2.894000 1.249000  0.3641000      1.751000  
1 1 1 38 17 31 o 2.877000 0.8282000 3.458000 1.246000  2.297000 1.092000  1.161000       1.656000  
1 1 1 38 17 33 o 4.820000 0.9755000 3.764000 1.134000  5.876000 1.587000  -2.113000      1.951000  
1 1 1 38 17 35 f 2.606000 0.8337000 2.436000 1.088000  2.777000 1.264000  -0.3414000     1.667000  
1 1 1 38 18 0  o 3.988000 1.206000  3.988000 1.206000  3.988000 1.206000  0.000000       0.000000  
1 1 1 38 18 2  o 5.715000 0.7026000 5.553000 1.043000  5.876000 0.9415000 -0.3233000     1.405000  
1 1 1 38 18 4  o 7.404000 0.5715000 7.191000 0.8605000 7.618000 0.7522000 -0.4277000     1.143000  
1 1 1 38 18 6  o 6.207000 0.6886000 6.799000 0.7680000 5.616000 1.143000  1.183000       1.377000  
1 1 1 38 18 8  o 8.912000 0.4504000 8.700000 0.5815000 9.124000 0.6881000 -0.4238000     0.9009000 
1 1 1 38 18 10 o 14.67000 0.3614000 14.54000 0.4604000 14.81000 0.5572000 -0.2628000     0.7228000 
1 1 1 38 18 12 o 6.960000 0.5527000 6.961000 0.7832000 6.960000 0.7799000 0.9432000E-03  1.105000  
1 1 1 38 18 14 o 9.169000 0.4452000 8.971000 0.6120000 9.367000 0.6468000 -0.3957000     0.8904000 
1 1 1 38 18 16 o 11.18000 0.4780000 11.12000 0.7339000 11.24000 0.6128000 -0.1254000     0.9561000 
1 1 1 38 18 18 o 9.948000 0.6178000 9.902000 1.030000  9.993000 0.6827000 -0.9099000E-01 1.236000  
1 1 1 38 18 20 o 5.795000 0.8550000 5.144000 1.490000  6.446000 0.8384000 -1.302000      1.710000  
1 1 1 38 18 22 o 4.575000 0.9633000 4.603000 1.472000  4.546000 1.243000  0.5723000E-01  1.927000  
1 1 1 38 18 24 o 5.714000 0.9244000 5.950000 1.295000  5.478000 1.319000  0.4723000      1.849000  
1 1 1 38 18 26 o 11.75000 0.6906000 13.16000 0.9328000 10.34000 1.019000  2.827000       1.381000  
1 1 1 38 18 28 o 12.66000 0.8240000 14.00000 0.5599000 11.32000 1.550000  2.678000       1.648000  
1 1 1 38 18 30 o 4.083000 0.9295000 4.019000 1.161000  4.147000 1.452000  -0.1276000     1.859000  
1 1 1 38 18 32 o 5.287000 0.9315000 5.810000 0.8510000 4.765000 1.657000  1.044000       1.863000  
1 1 1 38 18 34 o 3.419000 0.9815000 3.872000 1.470000  2.965000 1.301000  0.9065000      1.963000  
1 1 1 38 19 1  o 8.861000 0.4363000 9.229000 0.5927000 8.493000 0.6405000 0.7360000      0.8727000 
1 1 1 38 19 3  o 6.063000 0.7045000 6.583000 0.9782000 5.544000 1.014000  1.039000       1.409000  
1 1 1 38 19 5  o 10.24000 0.4532000 10.54000 0.5498000 9.934000 0.7206000 0.6104000      0.9064000 
1 1 1 38 19 7  o 6.336000 0.5917000 6.435000 0.8258000 6.237000 0.8476000 0.1981000      1.183000  
1 1 1 38 19 9  o 11.58000 0.3692000 11.63000 0.5104000 11.54000 0.5337000 0.9013000E-01  0.7385000 
1 1 1 38 19 11 o 9.912000 0.4546000 9.522000 0.7155000 10.30000 0.5609000 -0.7802000     0.9092000 
1 1 1 38 19 13 o 2.943000 0.8771000 3.416000 1.387000  2.470000 1.075000  0.9463000      1.754000  
1 1 1 38 19 15 o 10.14000 0.4206000 10.13000 0.5513000 10.16000 0.6353000 -0.3669000E-01 0.8412000 
1 1 1 38 19 17 o 3.936000 0.9256000 3.842000 1.335000  4.029000 1.283000  -0.1875000     1.851000  
1 1 1 38 19 19 f 4.724000 0.8615000 4.987000 1.170000  4.460000 1.265000  0.5270000      1.723000  
1 1 1 38 19 21 o 5.759000 0.6604000 5.529000 0.9487000 5.990000 0.9188000 -0.4614000     1.321000  
1 1 1 38 19 23 o 5.684000 0.7631000 6.682000 0.8002000 4.686000 1.300000  1.996000       1.526000  
1 1 1 38 19 25 o 4.151000 0.9931000 3.644000 1.210000  4.658000 1.575000  -1.015000      1.986000  
1 1 1 38 19 27 o 3.669000 0.9530000 3.421000 1.179000  3.916000 1.498000  -0.4957000     1.906000  
1 1 1 38 19 29 o 3.772000 1.117000  2.162000 1.020000  5.382000 1.987000  -3.220000      2.234000  
1 1 1 38 19 31 o 3.419000 0.9935000 3.502000 1.336000  3.336000 1.471000  0.1665000      1.987000  
1 1 1 38 19 33 o 6.840000 0.9039000 6.582000 1.295000  7.098000 1.261000  -0.5155000     1.808000  
1 1 1 38 20 0  o 3.353000 1.208000  3.353000 1.208000  3.353000 1.208000  0.000000       0.000000  
1 1 1 38 20 2  o 4.209000 0.8463000 3.884000 1.282000  4.535000 1.105000  -0.6510000     1.693000  
1 1 1 38 20 4  o 3.422000 0.8785000 3.861000 1.266000  2.984000 1.219000  0.8768000      1.757000  
1 1 1 38 20 6  o 15.08000 0.3310000 14.69000 0.4649000 15.48000 0.4711000 -0.7864000     0.6619000 
1 1 1 38 20 8  o 11.80000 0.3658000 12.22000 0.4751000 11.38000 0.5563000 0.8316000      0.7315000 
1 1 1 38 20 10 o 7.281000 0.6129000 7.108000 0.9029000 7.453000 0.8292000 -0.3448000     1.226000  
1 1 1 38 20 12 o 4.780000 0.7680000 5.201000 1.100000  4.360000 1.073000  0.8409000      1.536000  
1 1 1 38 20 14 o 4.137000 0.8957000 4.230000 1.340000  4.045000 1.189000  0.1848000      1.791000  
1 1 1 38 20 16 o 5.719000 0.7955000 6.264000 1.008000  5.174000 1.231000  1.090000       1.591000  
1 1 1 38 20 18 o 3.450000 0.8519000 3.568000 1.217000  3.332000 1.192000  0.2368000      1.704000  
1 1 1 38 20 20 o 4.924000 0.7585000 4.698000 1.074000  5.151000 1.071000  -0.4538000     1.517000  
1 1 1 38 20 22 o 3.005000 0.8406000 3.123000 1.193000  2.887000 1.185000  0.2358000      1.681000  
1 1 1 38 20 24 o 3.157000 0.8568000 3.390000 1.247000  2.923000 1.176000  0.4668000      1.714000  
1 1 1 38 20 26 o 10.90000 0.5524000 11.11000 0.5015000 10.69000 0.9844000 0.4148000      1.105000  
1 1 1 38 20 28 o 7.148000 0.7831000 6.406000 0.7480000 7.890000 1.376000  -1.483000      1.566000  
1 1 1 38 20 30 o 7.285000 1.028000  7.101000 0.8772000 7.470000 1.860000  -0.3695000     2.057000  
1 1 1 38 20 32 o 4.348000 1.132000  4.804000 1.752000  3.893000 1.432000  0.9108000      2.263000  
1 1 1 38 21 1  o 7.451000 0.5502000 7.829000 0.7370000 7.072000 0.8171000 0.7566000      1.100000  
1 1 1 38 21 3  o 8.656000 0.5398000 7.870000 0.7868000 9.443000 0.7392000 -1.574000      1.080000  
1 1 1 38 21 5  o 15.41000 0.3135000 15.39000 0.4461000 15.43000 0.4407000 -0.4218000E-01 0.6271000 
1 1 1 38 21 7  o 7.294000 0.5770000 7.968000 0.8331000 6.620000 0.7986000 1.348000       1.154000  
1 1 1 38 21 9  o 7.866000 0.5258000 7.482000 0.7802000 8.249000 0.7049000 -0.7663000     1.052000  
1 1 1 38 21 11 o 4.272000 0.8687000 4.009000 1.210000  4.535000 1.247000  -0.5266000     1.737000  
1 1 1 38 21 13 o 5.750000 0.6918000 6.709000 0.8964000 4.791000 1.054000  1.918000       1.384000  
1 1 1 38 21 15 o 8.984000 0.6465000 10.55000 0.6283000 7.421000 1.130000  3.125000       1.293000  
1 1 1 38 21 17 o 9.185000 0.4606000 8.825000 0.6555000 9.546000 0.6471000 -0.7214000     0.9211000 
1 1 1 38 21 19 o 5.943000 0.6922000 7.029000 0.7970000 4.857000 1.132000  2.173000       1.384000  
1 1 1 38 21 21 o 5.288000 0.7170000 5.169000 1.012000  5.406000 1.015000  -0.2373000     1.434000  
1 1 1 38 21 23 f 8.612000 0.5540000 9.353000 0.8186000 7.871000 0.7466000 1.482000       1.108000  
1 1 1 38 21 25 o 11.61000 0.6869000 10.61000 0.7039000 12.61000 1.180000  -1.992000      1.374000  
1 1 1 38 21 27 o 3.897000 1.046000  3.551000 1.498000  4.243000 1.460000  -0.6922000     2.092000  
1 1 1 38 21 29 o 5.562000 0.9592000 5.039000 1.395000  6.086000 1.316000  -1.047000      1.918000  
1 1 1 38 21 31 f 3.658000 1.079000  3.691000 1.497000  3.625000 1.554000  0.6641000E-01  2.157000  
1 1 1 38 21 33 o 5.986000 1.274000  6.463000 1.883000  5.509000 1.717000  0.9540000      2.548000  
1 1 1 38 22 0  o 7.672000 0.6869000 7.672000 0.6869000 7.672000 0.6869000 0.000000       0.000000  
1 1 1 38 22 2  o 3.985000 0.9020000 3.568000 1.259000  4.401000 1.292000  -0.8327000     1.804000  
1 1 1 38 22 4  o 5.761000 0.7136000 5.961000 1.056000  5.561000 0.9602000 0.4003000      1.427000  
1 1 1 38 22 6  o 10.35000 0.4955000 9.750000 0.8032000 10.96000 0.5804000 -1.206000      0.9910000 
1 1 1 38 22 8  o 9.473000 0.4237000 9.972000 0.5788000 8.974000 0.6189000 0.9982000      0.8473000 
1 1 1 38 22 10 o 12.14000 0.3652000 12.05000 0.5220000 12.23000 0.5108000 -0.1864000     0.7304000 
1 1 1 38 22 12 o 3.880000 0.8621000 3.922000 1.235000  3.839000 1.203000  0.8362000E-01  1.724000  
1 1 1 38 22 14 f 4.607000 0.7399000 5.140000 0.9476000 4.075000 1.137000  1.065000       1.480000  
1 1 1 38 22 16 o 4.018000 0.8556000 4.692000 1.110000  3.344000 1.303000  1.348000       1.711000  
1 1 1 38 22 18 o 7.457000 0.5563000 7.916000 0.7331000 6.997000 0.8370000 0.9182000      1.113000  
1 1 1 38 22 20 o 8.653000 0.4601000 8.985000 0.6309000 8.322000 0.6698000 0.6630000      0.9202000 
1 1 1 38 22 22 o 3.791000 1.077000  2.958000 1.280000  4.624000 1.732000  -1.666000      2.154000  
1 1 1 38 22 24 o 3.431000 0.9969000 3.954000 1.468000  2.907000 1.350000  1.047000       1.994000  
1 1 1 38 22 26 f 3.978000 0.9874000 3.422000 1.371000  4.535000 1.421000  -1.112000      1.975000  
1 1 1 38 22 28 o 4.427000 1.192000  4.915000 1.888000  3.938000 1.457000  0.9764000      2.384000  
1 1 1 38 22 30 o 4.610000 1.075000  5.571000 1.568000  3.650000 1.472000  1.921000       2.151000  
1 1 1 38 22 32 o 3.434000 1.044000  3.898000 1.621000  2.969000 1.317000  0.9297000      2.088000  
1 1 1 38 23 1  o 7.757000 0.5700000 7.339000 0.7772000 8.174000 0.8339000 -0.8348000     1.140000  
1 1 1 38 23 3  o 7.752000 0.5802000 6.773000 0.9574000 8.731000 0.6555000 -1.958000      1.160000  
1 1 1 38 23 5  o 5.602000 0.7686000 6.166000 1.128000  5.038000 1.044000  1.128000       1.537000  
1 1 1 38 23 7  o 3.200000 0.8371000 3.503000 1.199000  2.897000 1.168000  0.6062000      1.674000  
1 1 1 38 23 9  f 5.522000 0.7533000 6.073000 1.065000  4.971000 1.066000  1.102000       1.507000  
1 1 1 38 23 11 o 5.489000 0.7214000 5.741000 1.051000  5.237000 0.9880000 0.5034000      1.443000  
1 1 1 38 23 13 o 5.236000 0.7282000 5.349000 1.016000  5.122000 1.044000  0.2272000      1.456000  
1 1 1 38 23 15 o 3.951000 0.8004000 2.805000 1.194000  5.097000 1.066000  -2.291000      1.601000  
1 1 1 38 23 17 o 4.634000 0.7927000 5.364000 1.045000  3.903000 1.192000  1.460000       1.585000  
1 1 1 38 23 19 o 4.303000 1.100000  3.422000 1.373000  5.183000 1.718000  -1.761000      2.199000  
1 1 1 38 23 21 o 4.943000 1.005000  6.195000 1.247000  3.690000 1.577000  2.505000       2.010000  
1 1 1 38 23 23 o 2.881000 0.9098000 2.735000 1.242000  3.028000 1.330000  -0.2927000     1.820000  
1 1 1 38 23 25 o 3.621000 1.067000  3.521000 1.508000  3.720000 1.510000  -0.1992000     2.134000  
1 1 1 38 23 27 o 3.282000 0.9986000 3.519000 1.541000  3.045000 1.270000  0.4743000      1.997000  
1 1 1 38 23 29 o 3.400000 0.9654000 2.995000 1.335000  3.805000 1.395000  -0.8103000     1.931000  
1 1 1 38 23 31 o 6.186000 1.088000  7.514000 1.562000  4.858000 1.515000  2.656000       2.176000  
1 1 1 38 24 0  o 3.863000 1.355000  3.863000 1.355000  3.863000 1.355000  0.000000       0.000000  
1 1 1 38 24 2  o 5.417000 0.7784000 4.730000 1.287000  6.104000 0.8759000 -1.374000      1.557000  
1 1 1 38 24 4  o 2.850000 0.7828000 2.571000 1.081000  3.130000 1.133000  -0.5592000     1.566000  
1 1 1 38 24 6  o 4.117000 0.8890000 4.528000 1.207000  3.706000 1.306000  0.8219000      1.778000  
1 1 1 38 24 8  o 3.396000 0.8756000 3.320000 1.277000  3.472000 1.198000  -0.1517000     1.751000  
1 1 1 38 24 10 o 9.653000 0.4300000 9.231000 0.6848000 10.07000 0.5203000 -0.8432000     0.8600000 
1 1 1 38 24 12 o 5.188000 0.7616000 6.397000 0.8429000 3.978000 1.269000  2.420000       1.523000  
1 1 1 38 24 14 o 3.749000 0.8824000 4.121000 1.178000  3.378000 1.314000  0.7427000      1.765000  
1 1 1 38 24 16 o 5.049000 1.099000  5.485000 1.582000  4.612000 1.526000  0.8723000      2.199000  
1 1 1 38 24 18 o 8.385000 0.8537000 8.402000 1.029000  8.367000 1.362000  0.3466000E-01  1.707000  
1 1 1 38 24 20 o 5.606000 0.9461000 5.439000 1.324000  5.774000 1.352000  -0.3349000     1.892000  
1 1 1 38 24 22 o 6.655000 0.8752000 6.726000 1.030000  6.584000 1.415000  0.1422000      1.750000  
1 1 1 38 24 24 o 12.85000 0.7472000 12.96000 0.9670000 12.75000 1.139000  0.2144000      1.494000  
1 1 1 38 24 26 f 4.473000 1.009000  5.342000 1.409000  3.604000 1.446000  1.739000       2.019000  
1 1 1 38 24 28 o 4.337000 1.057000  4.143000 1.546000  4.530000 1.443000  -0.3878000     2.115000  
1 1 1 38 24 30 o 2.823000 0.9345000 3.491000 1.542000  2.156000 1.057000  1.335000       1.869000  
1 1 1 38 25 1  f 9.417000 0.5793000 9.113000 0.9414000 9.722000 0.6754000 -0.6091000     1.159000  
1 1 1 38 25 3  o 3.871000 0.9212000 4.643000 1.381000  3.100000 1.220000  1.543000       1.842000  
1 1 1 38 25 5  o 4.467000 0.8962000 4.340000 1.258000  4.593000 1.277000  -0.2528000     1.792000  
1 1 1 38 25 7  f 5.339000 0.7484000 5.909000 0.9329000 4.769000 1.171000  1.140000       1.497000  
1 1 1 38 25 9  o 7.176000 0.5594000 7.099000 0.7802000 7.254000 0.8018000 -0.1547000     1.119000  
1 1 1 38 25 11 o 3.224000 0.7744000 4.132000 1.154000  2.315000 1.032000  1.817000       1.549000  
1 1 1 38 25 13 o 3.836000 0.9585000 3.686000 1.202000  3.987000 1.494000  -0.3013000     1.917000  
1 1 1 38 25 15 o 4.665000 1.011000  3.897000 1.477000  5.433000 1.381000  -1.536000      2.022000  
1 1 1 38 25 17 o 4.069000 1.033000  3.872000 1.466000  4.267000 1.457000  -0.3950000     2.066000  
1 1 1 38 25 19 o 4.922000 0.9895000 5.475000 1.263000  4.370000 1.523000  1.105000       1.979000  
1 1 1 38 25 21 o 8.102000 0.8349000 8.996000 1.188000  7.207000 1.173000  1.789000       1.670000  
1 1 1 38 25 23 o 4.753000 1.059000  5.416000 1.520000  4.090000 1.474000  1.327000       2.117000  
1 1 1 38 25 25 o 3.032000 0.9301000 3.138000 1.348000  2.927000 1.282000  0.2108000      1.860000  
1 1 1 38 25 27 o 9.864000 0.6645000 8.883000 0.9434000 10.85000 0.9362000 -1.963000      1.329000  
1 1 1 38 25 29 o 3.978000 1.211000  3.546000 1.607000  4.409000 1.814000  -0.8634000     2.423000  
1 1 1 38 26 0  o 4.952000 1.282000  4.952000 1.282000  4.952000 1.282000  0.000000       0.000000  
1 1 1 38 26 2  o 3.181000 0.9196000 3.796000 1.441000  2.565000 1.143000  1.231000       1.839000  
1 1 1 38 26 4  o 2.880000 0.8075000 2.513000 1.101000  3.247000 1.181000  -0.7333000     1.615000  
1 1 1 38 26 6  o 9.084000 0.4607000 9.185000 0.6245000 8.983000 0.6773000 0.2022000      0.9213000 
1 1 1 38 26 8  o 6.845000 0.5632000 6.917000 0.7439000 6.774000 0.8459000 0.1435000      1.126000  
1 1 1 38 26 10 o 7.951000 0.4776000 8.672000 0.6078000 7.230000 0.7370000 1.442000       0.9552000 
1 1 1 38 26 12 f 6.026000 0.8286000 7.164000 1.041000  4.888000 1.290000  2.276000       1.657000  
1 1 1 38 26 14 o 3.044000 0.9215000 2.721000 1.230000  3.367000 1.372000  -0.6459000     1.843000  
1 1 1 38 26 16 o 5.853000 1.047000  4.710000 1.828000  6.996000 1.020000  -2.286000      2.094000  
1 1 1 38 26 18 o 4.430000 1.052000  5.310000 1.530000  3.549000 1.443000  1.762000       2.103000  
1 1 1 38 26 20 o 3.060000 0.9242000 2.680000 1.247000  3.441000 1.365000  -0.7609000     1.848000  
1 1 1 38 26 22 o 3.966000 1.038000  4.698000 1.557000  3.235000 1.374000  1.463000       2.077000  
1 1 1 38 26 24 o 5.655000 0.9852000 6.402000 1.321000  4.908000 1.462000  1.494000       1.970000  
1 1 1 38 26 26 o 4.050000 1.107000  4.377000 1.557000  3.722000 1.573000  0.6549000      2.213000  
1 1 1 38 26 28 o 4.274000 1.083000  3.523000 1.593000  5.025000 1.468000  -1.502000      2.166000  
1 1 1 38 27 1  o 3.050000 0.8170000 3.014000 1.175000  3.085000 1.135000  -0.7110000E-01 1.634000  
1 1 1 38 27 3  o 3.263000 0.8700000 3.818000 1.368000  2.708000 1.075000  1.110000       1.740000  
1 1 1 38 27 5  f 5.743000 0.7124000 6.725000 0.7791000 4.761000 1.193000  1.964000       1.425000  
1 1 1 38 27 7  o 12.57000 0.3462000 12.68000 0.4866000 12.47000 0.4927000 0.2072000      0.6924000 
1 1 1 38 27 9  o 3.119000 0.9150000 3.087000 1.303000  3.151000 1.285000  -0.6362000E-01 1.830000  
1 1 1 38 27 11 o 4.935000 1.004000  4.535000 1.507000  5.335000 1.328000  -0.7995000     2.009000  
1 1 1 38 27 13 o 3.308000 0.9627000 3.367000 1.442000  3.249000 1.276000  0.1182000      1.925000  
1 1 1 38 27 15 o 4.997000 1.071000  4.780000 1.590000  5.215000 1.434000  -0.4345000     2.142000  
1 1 1 38 27 17 o 3.253000 0.9239000 3.695000 1.356000  2.811000 1.256000  0.8836000      1.848000  
1 1 1 38 27 19 o 7.488000 0.7894000 7.165000 1.131000  7.811000 1.101000  -0.6456000     1.579000  
1 1 1 38 27 21 o 4.444000 1.026000  4.514000 1.459000  4.374000 1.443000  0.1397000      2.052000  
1 1 1 38 27 23 f 4.379000 1.029000  3.517000 1.429000  5.242000 1.480000  -1.725000      2.058000  
1 1 1 38 27 25 o 3.322000 0.9922000 3.497000 1.427000  3.146000 1.379000  0.3505000      1.984000  
1 1 1 38 27 27 o 4.839000 1.102000  4.613000 1.667000  5.065000 1.442000  -0.4527000     2.204000  
1 1 1 38 28 0  o 4.235000 1.257000  4.235000 1.257000  4.235000 1.257000  0.000000       0.000000  
1 1 1 38 28 2  o 2.562000 0.8048000 2.686000 1.193000  2.438000 1.080000  0.2485000      1.610000  
1 1 1 38 28 4  o 3.959000 0.8928000 4.127000 1.349000  3.790000 1.170000  0.3376000      1.786000  
1 1 1 38 28 6  o 3.396000 0.8859000 2.471000 1.158000  4.322000 1.341000  -1.851000      1.772000  
1 1 1 38 28 8  o 4.151000 0.9386000 3.366000 1.383000  4.936000 1.269000  -1.570000      1.877000  
1 1 1 38 28 10 o 10.16000 0.6024000 10.75000 0.8621000 9.577000 0.8417000 1.170000       1.205000  
1 1 1 38 28 12 o 5.683000 0.8626000 6.927000 1.007000  4.438000 1.401000  2.489000       1.725000  
1 1 1 38 28 14 o 3.034000 0.9658000 2.777000 1.234000  3.291000 1.486000  -0.5138000     1.932000  
1 1 1 38 28 16 o 3.285000 0.9600000 3.136000 1.338000  3.435000 1.377000  -0.2996000     1.920000  
1 1 1 38 28 18 o 4.521000 1.010000  4.912000 1.368000  4.129000 1.485000  0.7833000      2.019000  
1 1 1 38 28 20 o 4.060000 0.9953000 4.280000 1.374000  3.839000 1.441000  0.4410000      1.991000  
1 1 1 38 28 22 o 2.997000 0.9292000 2.664000 1.227000  3.331000 1.396000  -0.6670000     1.858000  
1 1 1 38 28 24 o 3.026000 0.9041000 3.606000 1.386000  2.446000 1.161000  1.160000       1.808000  
1 1 1 38 28 26 o 3.853000 1.114000  3.019000 1.374000  4.686000 1.753000  -1.667000      2.227000  
1 1 1 38 29 1  o 13.97000 0.4520000 13.39000 0.5182000 14.56000 0.7407000 -1.164000      0.9039000 
1 1 1 38 29 3  o 3.805000 0.8223000 3.513000 1.234000  4.098000 1.087000  -0.5851000     1.645000  
1 1 1 38 29 5  o 7.050000 0.7895000 7.320000 0.9955000 6.779000 1.226000  0.5418000      1.579000  
1 1 1 38 29 7  o 9.986000 0.5384000 10.26000 0.7442000 9.714000 0.7782000 0.5453000      1.077000  
1 1 1 38 29 9  o 3.743000 0.9598000 3.858000 1.405000  3.629000 1.308000  0.2290000      1.920000  
1 1 1 38 29 11 o 6.763000 0.7902000 7.161000 0.9603000 6.366000 1.255000  0.7947000      1.580000  
1 1 1 38 29 13 o 5.578000 0.9085000 5.209000 1.413000  5.946000 1.142000  -0.7379000     1.817000  
1 1 1 38 29 15 o 11.61000 0.5639000 12.41000 0.7662000 10.81000 0.8277000 1.595000       1.128000  
1 1 1 38 29 17 o 6.114000 0.9882000 6.273000 1.548000  5.955000 1.229000  0.3187000      1.976000  
1 1 1 38 29 19 o 4.928000 0.9750000 6.036000 1.290000  3.821000 1.462000  2.215000       1.950000  
1 1 1 38 29 21 o 5.727000 1.015000  4.822000 1.511000  6.631000 1.355000  -1.809000      2.030000  
1 1 1 38 29 23 o 3.096000 0.9372000 2.652000 1.218000  3.540000 1.424000  -0.8881000     1.874000  
1 1 1 38 29 25 o 2.918000 0.9461000 2.919000 1.345000  2.917000 1.331000  0.2413000E-02  1.892000  
1 1 1 38 30 0  o 2.359000 1.063000  2.359000 1.063000  2.359000 1.063000  0.000000       0.000000  
1 1 1 38 30 2  o 2.479000 0.7992000 2.613000 1.189000  2.344000 1.069000  0.2691000      1.598000  
1 1 1 38 30 4  o 5.160000 0.8822000 4.000000 1.359000  6.321000 1.125000  -2.321000      1.764000  
1 1 1 38 30 6  o 5.950000 0.8999000 6.443000 1.166000  5.457000 1.371000  0.9858000      1.800000  
1 1 1 38 30 8  o 3.736000 0.9484000 3.532000 1.326000  3.941000 1.356000  -0.4092000     1.897000  
1 1 1 38 30 10 o 6.193000 0.8547000 7.278000 0.9180000 5.109000 1.442000  2.169000       1.709000  
1 1 1 38 30 12 f 3.806000 1.002000  4.104000 1.442000  3.508000 1.390000  0.5961000      2.003000  
1 1 1 38 30 14 o 3.448000 0.9382000 4.372000 1.499000  2.523000 1.129000  1.849000       1.876000  
1 1 1 38 30 16 o 3.792000 1.010000  3.071000 1.337000  4.514000 1.514000  -1.443000      2.020000  
1 1 1 38 30 18 o 5.619000 0.9999000 5.553000 1.444000  5.685000 1.383000  -0.1320000     2.000000  
1 1 1 38 30 20 o 8.091000 0.7788000 9.023000 1.025000  7.159000 1.173000  1.864000       1.558000  
1 1 1 38 30 22 o 3.024000 0.9359000 3.053000 1.314000  2.994000 1.333000  0.5891000E-01  1.872000  
1 1 1 38 30 24 o 3.844000 1.594000  ?        ?         3.844000 1.594000  ?              ?         
1 1 1 38 31 1  o 7.460000 0.5680000 7.694000 0.8716000 7.226000 0.7286000 0.4681000      1.136000  
1 1 1 38 31 3  o 11.84000 0.6864000 10.53000 1.100000  13.15000 0.8217000 -2.627000      1.373000  
1 1 1 38 31 5  o 6.154000 0.7623000 5.461000 1.142000  6.848000 1.010000  -1.387000      1.525000  
1 1 1 38 31 7  o 3.224000 0.9071000 3.582000 1.322000  2.867000 1.243000  0.7153000      1.814000  
1 1 1 38 31 9  f 7.333000 0.7934000 7.438000 1.115000  7.227000 1.129000  0.2109000      1.587000  
1 1 1 38 31 11 o 4.711000 0.9481000 5.889000 1.281000  3.532000 1.398000  2.356000       1.896000  
1 1 1 38 31 13 o 2.753000 0.8601000 2.926000 1.268000  2.579000 1.162000  0.3467000      1.720000  
1 1 1 38 31 15 o 8.118000 0.9093000 8.054000 1.005000  8.182000 1.516000  -0.1285000     1.819000  
1 1 1 38 31 17 o 8.566000 0.8270000 9.445000 1.313000  7.687000 1.006000  1.758000       1.654000  
1 1 1 38 31 19 o 3.814000 1.040000  4.197000 1.518000  3.431000 1.423000  0.7655000      2.081000  
1 1 1 38 31 21 o 6.114000 1.073000  7.560000 1.488000  4.669000 1.548000  2.891000       2.147000  
1 1 1 38 32 0  o 3.804000 1.498000  3.804000 1.498000  3.804000 1.498000  0.000000       0.000000  
1 1 1 38 32 2  o 5.178000 0.9852000 4.499000 1.532000  5.857000 1.239000  -1.358000      1.970000  
1 1 1 38 32 4  o 5.846000 0.9774000 5.366000 1.238000  6.327000 1.513000  -0.9606000     1.955000  
1 1 1 38 32 6  o 7.743000 0.7672000 8.067000 1.206000  7.419000 0.9493000 0.6487000      1.534000  
1 1 1 38 32 8  o 3.071000 0.9139000 3.272000 1.328000  2.869000 1.256000  0.4029000      1.828000  
1 1 1 38 32 10 o 8.343000 0.6769000 7.545000 1.034000  9.142000 0.8737000 -1.596000      1.354000  
1 1 1 38 32 12 o 8.070000 0.7411000 8.187000 0.9473000 7.953000 1.140000  0.2337000      1.482000  
1 1 1 38 32 14 o 10.94000 0.5766000 10.85000 0.8068000 11.02000 0.8241000 -0.1722000     1.153000  
1 1 1 38 32 16 o 4.947000 1.055000  4.614000 1.514000  5.280000 1.471000  -0.6664000     2.110000  
1 1 1 38 32 18 o 6.308000 0.9741000 7.053000 1.396000  5.564000 1.359000  1.489000       1.948000  
1 1 1 38 32 20 o 4.328000 1.033000  5.683000 1.615000  2.974000 1.288000  2.710000       2.066000  
1 1 1 38 33 1  o 8.101000 0.9501000 7.662000 1.389000  8.540000 1.297000  -0.8778000     1.900000  
1 1 1 38 33 3  o 3.853000 0.9926000 3.062000 1.392000  4.643000 1.415000  -1.582000      1.985000  
1 1 1 38 33 5  o 4.156000 0.9247000 4.641000 1.293000  3.671000 1.322000  0.9694000      1.849000  
1 1 1 38 33 7  o 3.737000 1.070000  3.921000 1.623000  3.554000 1.395000  0.3673000      2.140000  
1 1 1 38 33 9  o 4.697000 0.9450000 5.063000 1.337000  4.331000 1.336000  0.7329000      1.890000  
1 1 1 38 33 11 o 7.161000 0.8170000 7.967000 0.9461000 6.356000 1.332000  1.611000       1.634000  
1 1 1 38 33 13 o 5.422000 1.072000  4.772000 1.643000  6.072000 1.378000  -1.300000      2.144000  
1 1 1 38 33 15 o 5.498000 1.193000  6.176000 1.527000  4.820000 1.834000  1.356000       2.387000  
1 1 1 38 33 17 o 9.285000 0.7116000 9.538000 1.115000  9.033000 0.8845000 0.5052000      1.423000  
1 1 1 38 34 0  o 3.594000 1.520000  3.594000 1.520000  3.594000 1.520000  0.000000       0.000000  
1 1 1 38 34 2  o 2.960000 0.9778000 3.040000 1.423000  2.880000 1.341000  0.1603000      1.956000  
1 1 1 38 34 4  o 3.790000 0.9975000 3.363000 1.426000  4.216000 1.396000  -0.8537000     1.995000  
1 1 1 38 34 6  o 4.998000 0.9243000 5.082000 1.304000  4.913000 1.310000  0.1693000      1.849000  
1 1 1 38 34 8  o 4.325000 0.9974000 4.424000 1.423000  4.226000 1.398000  0.1974000      1.995000  
1 1 1 38 34 10 o 5.622000 0.9014000 6.229000 1.240000  5.015000 1.309000  1.215000       1.803000  
1 1 1 38 34 12 o 3.179000 0.9416000 3.076000 1.312000  3.282000 1.351000  -0.2059000     1.883000  
1 1 1 38 34 14 o 9.306000 0.6751000 10.32000 0.9654000 8.288000 0.9439000 2.036000       1.350000  
1 1 1 38 34 16 f 3.496000 1.041000  3.200000 1.493000  3.792000 1.450000  -0.5923000     2.081000  
1 1 1 38 35 1  o 6.652000 1.142000  7.550000 1.572000  5.754000 1.657000  1.796000       2.284000  
1 1 1 38 35 3  o 3.850000 1.149000  2.961000 1.364000  4.739000 1.849000  -1.778000      2.298000  
1 1 1 38 35 5  o 6.652000 1.065000  5.045000 1.740000  8.259000 1.229000  -3.214000      2.130000  
1 1 1 38 35 7  o 4.785000 1.188000  5.633000 1.672000  3.938000 1.687000  1.695000       2.375000  
1 1 1 38 35 9  o 4.335000 1.131000  4.952000 1.679000  3.718000 1.515000  1.234000       2.262000  
1 1 1 38 35 11 o 5.748000 0.8358000 5.392000 1.158000  6.103000 1.206000  -0.7114000     1.672000  
1 1 1 38 35 13 o 4.035000 1.121000  4.078000 1.757000  3.992000 1.391000  0.8546000E-01  2.241000  
1 1 1 38 36 0  o 10.19000 1.360000  10.19000 1.360000  10.19000 1.360000  0.000000       0.000000  
1 1 1 38 36 2  o 13.30000 0.6728000 12.39000 0.9974000 14.21000 0.9033000 -1.814000      1.346000  
1 1 1 38 36 4  o 3.441000 1.091000  3.472000 1.509000  3.410000 1.575000  0.6230000E-01  2.182000  
1 1 1 38 36 6  o 4.408000 1.173000  3.792000 1.654000  5.024000 1.665000  -1.232000      2.347000  
1 1 1 38 36 8  o 7.329000 1.217000  6.362000 1.948000  8.295000 1.459000  -1.933000      2.434000  
1 1 1 38 37 1  o 6.198000 1.472000  6.040000 2.065000  6.355000 2.098000  -0.3145000     2.943000  
1 1 1 38 37 3  o 5.433000 2.211000  ?        ?         5.433000 2.211000  ?              ?         
1 1 1 39 0  1  o 7.315000 0.7989000 7.315000 0.7989000 7.315000 0.7989000 0.000000       0.000000  
1 1 1 39 0  3  o 9.199000 0.6746000 9.199000 0.6746000 9.199000 0.6746000 0.000000       0.000000  
1 1 1 39 0  5  o 12.20000 0.5491000 12.20000 0.5491000 12.20000 0.5491000 0.000000       0.000000  
1 1 1 39 0  7  o 17.41000 0.5477000 17.41000 0.5477000 17.41000 0.5477000 0.000000       0.000000  
1 1 1 39 0  9  o 5.818000 1.093000  5.818000 1.093000  5.818000 1.093000  0.000000       0.000000  
1 1 1 39 0  11 f 8.856000 0.7066000 8.856000 0.7066000 8.856000 0.7066000 0.000000       0.000000  
1 1 1 39 0  13 o 20.72000 0.5265000 20.72000 0.5265000 20.72000 0.5265000 0.000000       0.000000  
1 1 1 39 0  15 o 8.225000 0.7003000 8.225000 0.7003000 8.225000 0.7003000 0.000000       0.000000  
1 1 1 39 0  17 o 4.838000 1.237000  4.838000 1.237000  4.838000 1.237000  0.000000       0.000000  
1 1 1 39 0  19 o 4.790000 1.347000  4.790000 1.347000  4.790000 1.347000  0.000000       0.000000  
1 1 1 39 0  21 o 7.385000 0.8096000 7.385000 0.8096000 7.385000 0.8096000 0.000000       0.000000  
1 1 1 39 0  23 o 17.12000 0.5444000 17.12000 0.5444000 17.12000 0.5444000 0.000000       0.000000  
1 1 1 39 0  25 o 30.36000 0.5281000 30.36000 0.5281000 30.36000 0.5281000 0.000000       0.000000  
1 1 1 39 0  27 o 12.88000 0.5655000 12.88000 0.5655000 12.88000 0.5655000 0.000000       0.000000  
1 1 1 39 0  29 o 9.227000 0.7631000 9.227000 0.7631000 9.227000 0.7631000 0.000000       0.000000  
1 1 1 39 0  31 o 3.095000 1.317000  3.095000 1.317000  3.095000 1.317000  0.000000       0.000000  
1 1 1 39 0  33 o 3.056000 1.298000  3.056000 1.298000  3.056000 1.298000  0.000000       0.000000  
1 1 1 39 0  35 o 11.55000 0.8447000 11.55000 0.8447000 11.55000 0.8447000 0.000000       0.000000  
1 1 1 39 0  37 o 5.978000 1.408000  5.978000 1.408000  5.978000 1.408000  0.000000       0.000000  
1 1 1 39 1  0  o 2.433000 1.087000  2.433000 1.087000  2.433000 1.087000  0.000000       0.000000  
1 1 1 39 1  2  o 11.12000 0.4144000 11.42000 0.5717000 10.81000 0.5999000 0.6080000      0.8287000 
1 1 1 39 1  4  o 12.54000 0.3743000 12.29000 0.5294000 12.79000 0.5294000 -0.5053000     0.7487000 
1 1 1 39 1  6  o 7.163000 0.6125000 7.036000 0.8341000 7.290000 0.8972000 -0.2534000     1.225000  
1 1 1 39 1  8  o 9.372000 0.5222000 9.791000 0.7126000 8.952000 0.7635000 0.8385000      1.044000  
1 1 1 39 1  10 f 12.90000 0.4532000 12.92000 0.7108000 12.88000 0.5624000 0.4189000E-01  0.9064000 
1 1 1 39 1  12 o 5.481000 0.7874000 4.919000 1.255000  6.043000 0.9518000 -1.124000      1.575000  
1 1 1 39 1  14 o 14.26000 0.3770000 14.28000 0.5073000 14.24000 0.5579000 0.3313000E-01  0.7541000 
1 1 1 39 1  16 o 12.28000 0.4364000 11.79000 0.5319000 12.78000 0.6921000 -0.9905000     0.8728000 
1 1 1 39 1  18 o 6.444000 0.6774000 6.960000 0.9218000 5.927000 0.9929000 1.034000       1.355000  
1 1 1 39 1  20 o 7.546000 0.6863000 7.821000 0.9066000 7.272000 1.031000  0.5490000      1.373000  
1 1 1 39 1  22 o 5.776000 0.7166000 5.685000 1.051000  5.867000 0.9745000 -0.1827000     1.433000  
1 1 1 39 1  24 f 6.227000 0.7339000 6.455000 0.9968000 5.999000 1.077000  0.4558000      1.468000  
1 1 1 39 1  26 o 14.02000 0.4344000 14.37000 0.6311000 13.66000 0.5972000 0.7012000      0.8688000 
1 1 1 39 1  28 f 11.26000 0.4542000 12.04000 0.6066000 10.49000 0.6762000 1.551000       0.9084000 
1 1 1 39 1  30 o 13.98000 0.4609000 13.48000 0.6501000 14.47000 0.6534000 -0.9947000     0.9217000 
1 1 1 39 1  32 o 3.342000 0.9194000 3.038000 1.255000  3.646000 1.344000  -0.6085000     1.839000  
1 1 1 39 1  34 o 9.968000 0.6303000 9.331000 0.9102000 10.60000 0.8721000 -1.274000      1.261000  
1 1 1 39 1  36 o 8.048000 0.7073000 7.037000 1.006000  9.059000 0.9942000 -2.023000      1.415000  
1 1 1 39 1  38 o 6.022000 1.018000  5.046000 1.670000  6.999000 1.163000  -1.953000      2.035000  
1 1 1 39 2  1  o 9.530000 0.4515000 9.453000 0.6352000 9.607000 0.6417000 -0.1539000     0.9030000 
1 1 1 39 2  3  o 4.715000 0.8117000 4.728000 1.137000  4.702000 1.159000  0.2634000E-01  1.623000  
1 1 1 39 2  5  o 14.28000 0.3549000 14.32000 0.5051000 14.24000 0.4986000 0.8521000E-01  0.7098000 
1 1 1 39 2  7  o 4.745000 0.8627000 4.661000 1.196000  4.829000 1.244000  -0.1678000     1.725000  
1 1 1 39 2  9  o 17.24000 0.3888000 18.34000 0.5757000 16.14000 0.5227000 2.205000       0.7776000 
1 1 1 39 2  11 o 12.14000 0.4397000 12.73000 0.5992000 11.54000 0.6436000 1.192000       0.8793000 
1 1 1 39 2  13 o 10.76000 0.4187000 11.21000 0.6012000 10.31000 0.5830000 0.8956000      0.8374000 
1 1 1 39 2  15 o 20.70000 0.3851000 21.43000 0.5104000 19.98000 0.5767000 1.449000       0.7702000 
1 1 1 39 2  17 o 11.39000 0.3922000 11.31000 0.5577000 11.47000 0.5517000 -0.1598000     0.7845000 
1 1 1 39 2  19 o 13.40000 0.3832000 13.07000 0.5795000 13.73000 0.5014000 -0.6625000     0.7663000 
1 1 1 39 2  21 o 3.673000 0.8820000 3.747000 1.251000  3.600000 1.244000  0.1469000      1.764000  
1 1 1 39 2  23 o 6.600000 0.6574000 7.036000 0.8839000 6.165000 0.9735000 0.8710000      1.315000  
1 1 1 39 2  25 o 14.43000 0.4582000 15.19000 0.6805000 13.68000 0.6137000 1.511000       0.9163000 
1 1 1 39 2  27 o 3.631000 0.8972000 4.478000 1.348000  2.783000 1.184000  1.695000       1.794000  
1 1 1 39 2  29 o 3.009000 0.8817000 3.238000 1.286000  2.780000 1.206000  0.4585000      1.763000  
1 1 1 39 2  31 o 2.962000 0.8789000 3.087000 1.269000  2.838000 1.216000  0.2485000      1.758000  
1 1 1 39 2  33 f 6.074000 0.9525000 5.206000 1.268000  6.943000 1.422000  -1.738000      1.905000  
1 1 1 39 2  35 o 3.505000 0.9189000 4.297000 1.381000  2.714000 1.212000  1.583000       1.838000  
1 1 1 39 2  37 o 2.807000 0.8669000 2.660000 1.202000  2.955000 1.249000  -0.2950000     1.734000  
1 1 1 39 3  0  o 3.270000 1.216000  3.270000 1.216000  3.270000 1.216000  0.000000       0.000000  
1 1 1 39 3  2  o 10.53000 0.4018000 10.12000 0.5648000 10.93000 0.5718000 -0.8009000     0.8037000 
1 1 1 39 3  4  o 12.40000 0.3754000 12.51000 0.5139000 12.30000 0.5473000 0.2109000      0.7508000 
1 1 1 39 3  6  o 7.801000 0.5568000 8.101000 0.7582000 7.501000 0.8157000 0.6007000      1.114000  
1 1 1 39 3  8  o 12.26000 0.4893000 11.06000 0.6787000 13.47000 0.7049000 -2.408000      0.9785000 
1 1 1 39 3  10 o 24.98000 0.4112000 24.85000 0.5741000 25.12000 0.5889000 -0.2670000     0.8224000 
1 1 1 39 3  12 o 13.97000 0.4133000 14.29000 0.4761000 13.64000 0.6758000 0.6447000      0.8267000 
1 1 1 39 3  14 o 15.42000 0.3963000 15.55000 0.4723000 15.30000 0.6365000 0.2478000      0.7926000 
1 1 1 39 3  16 o 9.878000 0.5407000 10.65000 0.6019000 9.105000 0.8985000 1.546000       1.081000  
1 1 1 39 3  18 o 6.860000 0.6277000 6.858000 0.8531000 6.863000 0.9210000 -0.5107000E-02 1.255000  
1 1 1 39 3  20 o 8.888000 0.5336000 8.340000 0.7628000 9.436000 0.7464000 -1.096000      1.067000  
1 1 1 39 3  22 o 8.799000 0.4718000 8.953000 0.6463000 8.646000 0.6875000 0.3066000      0.9436000 
1 1 1 39 3  24 o 6.284000 0.8203000 6.742000 1.009000  5.826000 1.294000  0.9159000      1.641000  
1 1 1 39 3  26 o 12.04000 0.4356000 12.21000 0.6489000 11.87000 0.5812000 0.3369000      0.8712000 
1 1 1 39 3  28 o 7.439000 0.6494000 7.716000 0.8790000 7.163000 0.9562000 0.5530000      1.299000  
1 1 1 39 3  30 o 5.403000 0.8772000 5.047000 1.331000  5.758000 1.143000  -0.7113000     1.754000  
1 1 1 39 3  32 o 9.356000 0.7665000 8.129000 0.8722000 10.58000 1.261000  -2.455000      1.533000  
1 1 1 39 3  34 o 12.36000 0.6183000 12.26000 0.9825000 12.46000 0.7510000 -0.1965000     1.237000  
1 1 1 39 3  36 o 4.734000 1.039000  5.374000 1.575000  4.094000 1.356000  1.280000       2.078000  
1 1 1 39 3  38 o 4.784000 1.692000  4.784000 1.692000  ?        ?         ?              ?         
1 1 1 39 4  1  o 10.19000 0.4074000 9.728000 0.6041000 10.66000 0.5468000 -0.9304000     0.8148000 
1 1 1 39 4  3  o 4.456000 0.8338000 4.261000 1.179000  4.651000 1.180000  -0.3901000     1.668000  
1 1 1 39 4  5  o 23.21000 0.3464000 22.97000 0.4789000 23.44000 0.5006000 -0.4685000     0.6927000 
1 1 1 39 4  7  f 15.27000 0.4791000 14.94000 0.7190000 15.61000 0.6333000 -0.6789000     0.9581000 
1 1 1 39 4  9  f 6.411000 0.7209000 6.208000 1.093000  6.615000 0.9399000 -0.4070000     1.442000  
1 1 1 39 4  11 o 9.859000 0.4955000 9.980000 0.7347000 9.739000 0.6649000 0.2402000      0.9909000 
1 1 1 39 4  13 o 16.56000 0.3463000 16.70000 0.4647000 16.41000 0.5136000 0.2874000      0.6926000 
1 1 1 39 4  15 o 12.50000 0.3699000 12.52000 0.5267000 12.48000 0.5195000 0.4284000E-01  0.7398000 
1 1 1 39 4  17 o 14.56000 0.3679000 14.56000 0.4758000 14.56000 0.5612000 0.4695000E-02  0.7357000 
1 1 1 39 4  19 o 19.72000 0.3410000 19.59000 0.4478000 19.85000 0.5145000 -0.2570000     0.6820000 
1 1 1 39 4  21 o 11.44000 0.4577000 10.94000 0.6687000 11.95000 0.6251000 -1.016000      0.9154000 
1 1 1 39 4  23 o 7.293000 0.6094000 6.847000 0.7978000 7.739000 0.9215000 -0.8924000     1.219000  
1 1 1 39 4  25 o 8.367000 0.5848000 9.273000 0.8041000 7.460000 0.8494000 1.813000       1.170000  
1 1 1 39 4  27 o 4.686000 0.8830000 5.274000 1.178000  4.097000 1.316000  1.178000       1.766000  
1 1 1 39 4  29 o 6.752000 0.8015000 6.804000 1.076000  6.700000 1.188000  0.1038000      1.603000  
1 1 1 39 4  31 o 8.996000 0.7014000 8.713000 0.8437000 9.280000 1.121000  -0.5665000     1.403000  
1 1 1 39 4  33 o 6.631000 0.7422000 7.042000 0.9793000 6.220000 1.115000  0.8219000      1.484000  
1 1 1 39 4  35 o 10.32000 0.6914000 8.903000 1.203000  11.74000 0.6820000 -2.838000      1.383000  
1 1 1 39 4  37 o 3.415000 0.9701000 2.934000 1.180000  3.896000 1.540000  -0.9615000     1.940000  
1 1 1 39 5  0  o 3.030000 1.179000  3.030000 1.179000  3.030000 1.179000  0.000000       0.000000  
1 1 1 39 5  2  o 9.310000 0.4802000 9.431000 0.6286000 9.188000 0.7260000 0.2427000      0.9603000 
1 1 1 39 5  4  o 15.78000 0.3788000 15.81000 0.5185000 15.75000 0.5524000 0.5854000E-01  0.7576000 
1 1 1 39 5  6  o 14.16000 0.4289000 13.99000 0.7040000 14.34000 0.4901000 -0.3483000     0.8578000 
1 1 1 39 5  8  o 8.574000 0.9586000 7.145000 1.621000  10.00000 1.024000  -2.858000      1.917000  
1 1 1 39 5  10 o 6.169000 0.7029000 6.455000 0.8663000 5.883000 1.107000  0.5720000      1.406000  
1 1 1 39 5  12 o 14.53000 0.3666000 14.06000 0.4869000 15.00000 0.5482000 -0.9383000     0.7332000 
1 1 1 39 5  14 f 4.916000 0.7894000 5.078000 1.101000  4.754000 1.131000  0.3238000      1.579000  
1 1 1 39 5  16 o 3.293000 0.8450000 3.720000 1.227000  2.867000 1.162000  0.8527000      1.690000  
1 1 1 39 5  18 o 9.562000 0.4582000 8.811000 0.6430000 10.31000 0.6529000 -1.503000      0.9164000 
1 1 1 39 5  20 o 10.64000 0.4186000 10.46000 0.5895000 10.82000 0.5944000 -0.3633000     0.8371000 
1 1 1 39 5  22 o 3.006000 0.8483000 2.964000 1.214000  3.049000 1.185000  -0.8453000E-01 1.697000  
1 1 1 39 5  24 o 3.934000 0.8760000 4.407000 1.201000  3.460000 1.275000  0.9466000      1.752000  
1 1 1 39 5  26 o 9.534000 0.5006000 9.480000 0.7034000 9.589000 0.7124000 -0.1091000     1.001000  
1 1 1 39 5  28 o 9.028000 0.5977000 9.370000 0.7698000 8.687000 0.9147000 0.6825000      1.195000  
1 1 1 39 5  30 o 7.076000 0.6820000 7.777000 0.8082000 6.374000 1.099000  1.403000       1.364000  
1 1 1 39 5  32 o 2.648000 0.8269000 2.805000 1.207000  2.492000 1.131000  0.3126000      1.654000  
1 1 1 39 5  34 o 2.978000 0.9071000 2.721000 1.254000  3.235000 1.311000  -0.5137000     1.814000  
1 1 1 39 5  36 o 7.279000 0.6633000 7.287000 0.9390000 7.271000 0.9370000 0.1571000E-01  1.327000  
1 1 1 39 5  38 o 3.457000 1.525000  3.457000 1.525000  ?        ?         ?              ?         
1 1 1 39 6  1  o 15.84000 0.3465000 16.15000 0.4560000 15.53000 0.5219000 0.6242000      0.6930000 
1 1 1 39 6  3  o 16.98000 0.3167000 16.39000 0.4481000 17.58000 0.4478000 -1.186000      0.6335000 
1 1 1 39 6  5  o 5.343000 0.8016000 4.969000 1.315000  5.717000 0.9167000 -0.7478000     1.603000  
1 1 1 39 6  7  o 7.611000 0.7051000 6.772000 1.213000  8.450000 0.7200000 -1.679000      1.410000  
1 1 1 39 6  9  o 3.575000 0.8490000 2.932000 1.173000  4.218000 1.227000  -1.287000      1.698000  
1 1 1 39 6  11 o 9.319000 0.5168000 9.896000 0.7485000 8.743000 0.7127000 1.153000       1.034000  
1 1 1 39 6  13 o 11.80000 0.4404000 11.55000 0.6775000 12.05000 0.5628000 -0.4956000     0.8807000 
1 1 1 39 6  15 o 13.28000 0.3923000 12.95000 0.6249000 13.61000 0.4743000 -0.6549000     0.7846000 
1 1 1 39 6  17 o 6.842000 0.6594000 7.254000 0.9574000 6.431000 0.9069000 0.8231000      1.319000  
1 1 1 39 6  19 o 6.264000 0.6191000 5.465000 0.9514000 7.063000 0.7925000 -1.598000      1.238000  
1 1 1 39 6  21 o 11.20000 0.4703000 11.28000 0.6259000 11.11000 0.7022000 0.1722000      0.9407000 
1 1 1 39 6  23 o 8.942000 0.5037000 9.563000 0.6687000 8.321000 0.7534000 1.242000       1.007000  
1 1 1 39 6  25 o 4.813000 0.9235000 4.823000 1.218000  4.803000 1.388000  0.1923000E-01  1.847000  
1 1 1 39 6  27 o 9.400000 0.5571000 9.748000 0.7606000 9.053000 0.8141000 0.6951000      1.114000  
1 1 1 39 6  29 o 18.84000 0.4343000 18.63000 0.5036000 19.05000 0.7076000 -0.4143000     0.8685000 
1 1 1 39 6  31 o 8.504000 0.6550000 9.352000 0.8721000 7.656000 0.9774000 1.695000       1.310000  
1 1 1 39 6  33 o 8.420000 0.7660000 9.469000 0.7594000 7.370000 1.330000  2.099000       1.532000  
1 1 1 39 6  35 o 3.830000 0.9455000 4.229000 1.375000  3.430000 1.299000  0.7988000      1.891000  
1 1 1 39 6  37 o 3.191000 0.9095000 1.969000 0.9308000 4.412000 1.563000  -2.443000      1.819000  
1 1 1 39 7  0  f 5.203000 1.232000  5.203000 1.232000  5.203000 1.232000  0.000000       0.000000  
1 1 1 39 7  2  o 9.190000 0.5712000 9.541000 0.9166000 8.838000 0.6818000 0.7035000      1.142000  
1 1 1 39 7  4  o 3.360000 0.9968000 3.713000 1.566000  3.007000 1.233000  0.7066000      1.994000  
1 1 1 39 7  6  o 4.361000 0.7844000 3.547000 1.185000  5.174000 1.028000  -1.627000      1.569000  
1 1 1 39 7  8  o 6.280000 0.7930000 5.166000 1.308000  7.394000 0.8971000 -2.229000      1.586000  
1 1 1 39 7  10 o 12.55000 0.4250000 12.36000 0.6079000 12.75000 0.5941000 -0.3954000     0.8499000 
1 1 1 39 7  12 o 10.63000 0.4634000 11.08000 0.6763000 10.18000 0.6338000 0.8993000      0.9268000 
1 1 1 39 7  14 o 3.586000 0.8309000 3.300000 1.146000  3.872000 1.204000  -0.5722000     1.662000  
1 1 1 39 7  16 o 8.156000 0.5805000 7.675000 0.9477000 8.637000 0.6708000 -0.9623000     1.161000  
1 1 1 39 7  18 o 10.52000 0.4785000 10.71000 0.7400000 10.32000 0.6068000 0.3858000      0.9570000 
1 1 1 39 7  20 o 6.075000 0.6548000 6.562000 1.039000  5.587000 0.7972000 0.9744000      1.310000  
1 1 1 39 7  22 o 17.81000 0.4827000 18.24000 0.6710000 17.39000 0.6942000 0.8526000      0.9654000 
1 1 1 39 7  24 o 6.661000 0.7394000 6.491000 1.150000  6.831000 0.9290000 -0.3405000     1.479000  
1 1 1 39 7  26 o 6.063000 0.6927000 6.276000 0.9575000 5.851000 1.001000  0.4254000      1.385000  
1 1 1 39 7  28 o 5.171000 0.8049000 3.966000 1.280000  6.377000 0.9761000 -2.411000      1.610000  
1 1 1 39 7  30 o 3.695000 0.9636000 4.625000 1.499000  2.764000 1.212000  1.862000       1.927000  
1 1 1 39 7  32 o 8.143000 0.7405000 9.602000 0.7525000 6.684000 1.276000  2.919000       1.481000  
1 1 1 39 7  34 o 10.31000 0.5112000 10.79000 0.6938000 9.834000 0.7510000 0.9526000      1.022000  
1 1 1 39 7  36 o 3.919000 0.9737000 2.965000 1.168000  4.873000 1.558000  -1.908000      1.947000  
1 1 1 39 8  1  o 3.965000 1.022000  3.552000 1.455000  4.378000 1.435000  -0.8264000     2.044000  
1 1 1 39 8  3  o 3.554000 0.8777000 2.827000 1.220000  4.280000 1.263000  -1.453000      1.755000  
1 1 1 39 8  5  o 3.488000 0.9295000 3.840000 1.429000  3.135000 1.189000  0.7049000      1.859000  
1 1 1 39 8  7  o 4.295000 0.9445000 4.162000 1.482000  4.428000 1.171000  -0.2667000     1.889000  
1 1 1 39 8  9  o 5.200000 0.7930000 4.712000 1.112000  5.688000 1.131000  -0.9767000     1.586000  
1 1 1 39 8  11 o 16.57000 0.3305000 16.79000 0.4407000 16.34000 0.4928000 0.4486000      0.6611000 
1 1 1 39 8  13 o 12.45000 0.3615000 12.29000 0.5031000 12.60000 0.5192000 -0.3142000     0.7230000 
1 1 1 39 8  15 o 11.61000 0.4129000 11.83000 0.5288000 11.39000 0.6342000 0.4340000      0.8257000 
1 1 1 39 8  17 o 14.01000 0.3873000 13.96000 0.4806000 14.06000 0.6075000 -0.9801000E-01 0.7746000 
1 1 1 39 8  19 o 12.53000 0.4449000 11.85000 0.5371000 13.20000 0.7094000 -1.357000      0.8897000 
1 1 1 39 8  21 o 3.018000 0.7937000 2.246000 1.032000  3.791000 1.206000  -1.545000      1.587000  
1 1 1 39 8  23 o 4.295000 0.8412000 4.799000 1.107000  3.790000 1.267000  1.009000       1.682000  
1 1 1 39 8  25 o 2.584000 0.8152000 2.917000 1.258000  2.250000 1.038000  0.6676000      1.630000  
1 1 1 39 8  27 o 7.246000 1.022000  7.035000 1.870000  7.457000 0.8232000 -0.4219000     2.043000  
1 1 1 39 8  29 o 14.66000 0.4754000 14.04000 0.5616000 15.28000 0.7672000 -1.239000      0.9508000 
1 1 1 39 8  31 o 6.285000 0.8771000 5.930000 1.439000  6.640000 1.004000  -0.7096000     1.754000  
1 1 1 39 8  33 o 3.953000 0.9748000 4.378000 1.351000  3.527000 1.406000  0.8516000      1.950000  
1 1 1 39 8  35 o 3.547000 0.8857000 3.988000 1.113000  3.107000 1.378000  0.8812000      1.771000  
1 1 1 39 8  37 o 4.376000 1.059000  4.043000 1.243000  4.709000 1.715000  -0.6655000     2.118000  
1 1 1 39 9  0  o 5.297000 1.125000  5.297000 1.125000  5.297000 1.125000  0.000000       0.000000  
1 1 1 39 9  2  o 3.483000 0.9611000 3.439000 1.407000  3.527000 1.310000  -0.8779000E-01 1.922000  
1 1 1 39 9  4  o 16.03000 0.4324000 15.68000 0.6946000 16.39000 0.5153000 -0.7149000     0.8649000 
1 1 1 39 9  6  o 16.38000 0.4077000 16.15000 0.5706000 16.60000 0.5826000 -0.4501000     0.8155000 
1 1 1 39 9  8  o 5.224000 0.8273000 5.969000 0.8505000 4.479000 1.419000  1.490000       1.655000  
1 1 1 39 9  10 o 3.488000 0.8683000 3.331000 1.129000  3.644000 1.319000  -0.3131000     1.737000  
1 1 1 39 9  12 f 7.504000 0.7038000 8.238000 0.6974000 6.771000 1.223000  1.468000       1.408000  
1 1 1 39 9  14 o 6.840000 0.6830000 7.209000 0.7513000 6.470000 1.141000  0.7391000      1.366000  
1 1 1 39 9  16 o 12.71000 0.4005000 12.71000 0.5285000 12.71000 0.6018000 -0.5342000E-02 0.8010000 
1 1 1 39 9  18 o 12.64000 0.3581000 12.96000 0.5098000 12.32000 0.5031000 0.6410000      0.7162000 
1 1 1 39 9  20 o 2.712000 0.8127000 2.433000 1.061000  2.991000 1.232000  -0.5577000     1.625000  
1 1 1 39 9  22 o 10.13000 0.4539000 10.84000 0.6194000 9.425000 0.6635000 1.415000       0.9077000 
1 1 1 39 9  24 o 4.267000 0.9084000 4.659000 1.291000  3.876000 1.279000  0.7830000      1.817000  
1 1 1 39 9  26 o 4.874000 0.9251000 4.722000 1.403000  5.025000 1.206000  -0.3026000     1.850000  
1 1 1 39 9  28 o 3.763000 0.9919000 4.308000 1.478000  3.218000 1.323000  1.090000       1.984000  
1 1 1 39 9  30 o 6.452000 0.7895000 7.094000 1.162000  5.809000 1.069000  1.285000       1.579000  
1 1 1 39 9  32 o 11.78000 0.4951000 12.50000 0.6110000 11.07000 0.7793000 1.433000       0.9903000 
1 1 1 39 9  34 o 7.645000 1.077000  7.391000 0.7613000 7.899000 2.015000  -0.5074000     2.154000  
1 1 1 39 9  36 o 5.264000 0.9455000 3.672000 1.372000  6.856000 1.302000  -3.184000      1.891000  
1 1 1 39 10 1  f 4.459000 0.8564000 5.326000 1.214000  3.593000 1.208000  1.734000       1.713000  
1 1 1 39 10 3  o 14.52000 0.4262000 14.44000 0.5416000 14.60000 0.6582000 -0.1598000     0.8524000 
1 1 1 39 10 5  o 12.65000 0.4367000 12.64000 0.6131000 12.65000 0.6221000 -0.9740000E-02 0.8734000 
1 1 1 39 10 7  o 8.071000 0.5778000 8.048000 0.8667000 8.095000 0.7645000 -0.4715000E-01 1.156000  
1 1 1 39 10 9  o 7.056000 0.5495000 7.346000 0.7256000 6.766000 0.8254000 0.5801000      1.099000  
1 1 1 39 10 11 o 11.00000 0.3870000 11.15000 0.5270000 10.86000 0.5667000 0.2876000      0.7739000 
1 1 1 39 10 13 o 9.823000 0.4424000 9.896000 0.5810000 9.749000 0.6672000 0.1469000      0.8847000 
1 1 1 39 10 15 o 13.98000 0.3353000 14.55000 0.4543000 13.41000 0.4933000 1.147000       0.6706000 
1 1 1 39 10 17 o 6.807000 0.5893000 6.924000 0.8234000 6.690000 0.8432000 0.2343000      1.179000  
1 1 1 39 10 19 o 5.563000 0.7227000 6.685000 0.8394000 4.441000 1.177000  2.244000       1.445000  
1 1 1 39 10 21 o 10.58000 0.4708000 11.27000 0.6613000 9.892000 0.6702000 1.375000       0.9415000 
1 1 1 39 10 23 o 8.304000 0.6135000 7.844000 0.9911000 8.764000 0.7233000 -0.9196000     1.227000  
1 1 1 39 10 25 o 3.289000 0.8810000 3.111000 1.227000  3.466000 1.265000  -0.3548000     1.762000  
1 1 1 39 10 27 o 4.286000 0.8836000 3.629000 1.313000  4.944000 1.183000  -1.315000      1.767000  
1 1 1 39 10 29 o 14.22000 0.4102000 14.08000 0.5615000 14.36000 0.5981000 -0.2779000     0.8204000 
1 1 1 39 10 31 o 5.503000 0.9211000 6.711000 1.338000  4.294000 1.266000  2.417000       1.842000  
1 1 1 39 10 33 o 4.656000 1.037000  4.405000 1.418000  4.908000 1.514000  -0.5034000     2.074000  
1 1 1 39 10 35 o 5.065000 1.044000  4.329000 1.177000  5.801000 1.724000  -1.471000      2.088000  
1 1 1 39 11 0  o 3.652000 1.425000  3.652000 1.425000  3.652000 1.425000  0.000000       0.000000  
1 1 1 39 11 2  o 7.667000 0.5295000 7.630000 0.7318000 7.704000 0.7656000 -0.7423000E-01 1.059000  
1 1 1 39 11 4  o 6.786000 0.5880000 6.951000 0.8095000 6.621000 0.8529000 0.3302000      1.176000  
1 1 1 39 11 6  o 4.751000 0.8559000 5.059000 1.134000  4.443000 1.282000  0.6154000      1.712000  
1 1 1 39 11 8  o 16.07000 0.3282000 15.74000 0.4455000 16.40000 0.4821000 -0.6676000     0.6564000 
1 1 1 39 11 10 o 6.887000 0.5955000 7.414000 0.7369000 6.360000 0.9356000 1.054000       1.191000  
1 1 1 39 11 12 f 16.87000 0.3202000 16.72000 0.4384000 17.02000 0.4669000 -0.2982000     0.6405000 
1 1 1 39 11 14 o 3.350000 0.8238000 4.068000 1.184000  2.633000 1.146000  1.435000       1.648000  
1 1 1 39 11 16 o 13.02000 0.4047000 13.40000 0.5720000 12.63000 0.5726000 0.7737000      0.8094000 
1 1 1 39 11 18 o 5.965000 0.6948000 5.641000 1.082000  6.288000 0.8717000 -0.6476000     1.390000  
1 1 1 39 11 20 o 6.984000 0.6577000 7.538000 0.8650000 6.429000 0.9909000 1.109000       1.315000  
1 1 1 39 11 22 o 3.093000 0.8566000 3.095000 1.201000  3.092000 1.222000  0.3723000E-02  1.713000  
1 1 1 39 11 24 o 4.658000 0.9056000 4.232000 1.421000  5.084000 1.123000  -0.8525000     1.811000  
1 1 1 39 11 26 o 5.533000 0.7770000 5.495000 1.072000  5.571000 1.125000  -0.7617000E-01 1.554000  
1 1 1 39 11 28 o 4.506000 0.8331000 3.323000 1.285000  5.690000 1.061000  -2.367000      1.666000  
1 1 1 39 11 30 o 14.10000 0.4138000 14.03000 0.5663000 14.17000 0.6034000 -0.1331000     0.8275000 
1 1 1 39 11 32 f 7.455000 0.6400000 8.939000 0.7872000 5.971000 1.009000  2.968000       1.280000  
1 1 1 39 11 34 o 4.718000 1.008000  4.949000 1.170000  4.487000 1.641000  0.4619000      2.015000  
1 1 1 39 11 36 o 5.014000 1.223000  4.429000 1.438000  5.599000 1.980000  -1.169000      2.447000  
1 1 1 39 12 1  o 11.45000 0.4632000 11.99000 0.5900000 10.91000 0.7143000 1.083000       0.9265000 
1 1 1 39 12 3  o 11.07000 0.4748000 10.82000 0.6862000 11.32000 0.6563000 -0.4948000     0.9496000 
1 1 1 39 12 5  o 7.806000 0.5981000 6.997000 0.9685000 8.615000 0.7019000 -1.618000      1.196000  
1 1 1 39 12 7  o 5.192000 0.8569000 4.722000 1.424000  5.662000 0.9538000 -0.9400000     1.714000  
1 1 1 39 12 9  o 12.64000 0.4061000 13.13000 0.5285000 12.15000 0.6166000 0.9872000      0.8122000 
1 1 1 39 12 11 o 10.61000 0.4169000 10.74000 0.5394000 10.48000 0.6359000 0.2673000      0.8339000 
1 1 1 39 12 13 o 14.98000 0.3633000 15.13000 0.5110000 14.83000 0.5166000 0.2988000      0.7267000 
1 1 1 39 12 15 o 14.79000 0.3721000 15.14000 0.5249000 14.43000 0.5276000 0.7167000      0.7442000 
1 1 1 39 12 17 o 10.88000 0.3984000 11.20000 0.5496000 10.56000 0.5769000 0.6382000      0.7968000 
1 1 1 39 12 19 o 7.409000 0.5332000 7.424000 0.7615000 7.394000 0.7466000 0.3016000E-01  1.066000  
1 1 1 39 12 21 o 8.727000 0.5411000 9.000000 0.6294000 8.455000 0.8804000 0.5449000      1.082000  
1 1 1 39 12 23 o 7.553000 0.5994000 7.141000 0.9230000 7.966000 0.7651000 -0.8255000     1.199000  
1 1 1 39 12 25 o 4.620000 0.8600000 4.827000 1.186000  4.412000 1.245000  0.4151000      1.720000  
1 1 1 39 12 27 f 5.883000 0.7742000 5.580000 1.086000  6.186000 1.103000  -0.6053000     1.548000  
1 1 1 39 12 29 o 3.509000 0.9006000 3.110000 1.266000  3.907000 1.281000  -0.7970000     1.801000  
1 1 1 39 12 31 o 3.288000 0.8665000 4.078000 1.333000  2.498000 1.107000  1.580000       1.733000  
1 1 1 39 12 33 o 6.201000 0.7758000 5.893000 0.9567000 6.510000 1.222000  -0.6170000     1.552000  
1 1 1 39 12 35 o 3.417000 0.9320000 1.896000 0.9171000 4.937000 1.623000  -3.041000      1.864000  
1 1 1 39 13 0  o 13.26000 0.4851000 13.26000 0.4851000 13.26000 0.4851000 0.000000       0.000000  
1 1 1 39 13 2  o 11.77000 0.3759000 12.18000 0.5099000 11.37000 0.5525000 0.8154000      0.7519000 
1 1 1 39 13 4  o 10.86000 0.4630000 10.79000 0.6331000 10.93000 0.6757000 -0.1432000     0.9259000 
1 1 1 39 13 6  f 16.13000 0.3602000 15.95000 0.5467000 16.32000 0.4691000 -0.3674000     0.7204000 
1 1 1 39 13 8  o 2.991000 0.8308000 2.466000 1.122000  3.517000 1.226000  -1.051000      1.662000  
1 1 1 39 13 10 o 6.217000 0.6370000 5.352000 1.022000  7.082000 0.7613000 -1.729000      1.274000  
1 1 1 39 13 12 o 7.751000 0.5742000 8.442000 0.6555000 7.061000 0.9430000 1.380000       1.148000  
1 1 1 39 13 14 o 14.74000 0.3829000 14.54000 0.5628000 14.95000 0.5194000 -0.4033000     0.7658000 
1 1 1 39 13 16 o 7.893000 0.5413000 8.477000 0.6320000 7.308000 0.8790000 1.169000       1.083000  
1 1 1 39 13 18 o 5.674000 0.6905000 5.064000 1.011000  6.284000 0.9403000 -1.221000      1.381000  
1 1 1 39 13 20 o 11.85000 0.4471000 11.32000 0.5409000 12.38000 0.7121000 -1.061000      0.8942000 
1 1 1 39 13 22 o 9.319000 0.5011000 8.923000 0.7238000 9.716000 0.6932000 -0.7928000     1.002000  
1 1 1 39 13 24 o 14.97000 0.3634000 14.80000 0.5355000 15.15000 0.4913000 -0.3473000     0.7267000 
1 1 1 39 13 26 o 11.71000 0.4769000 12.47000 0.6476000 10.96000 0.7002000 1.513000       0.9537000 
1 1 1 39 13 28 o 3.770000 0.8959000 3.983000 1.252000  3.556000 1.282000  0.4265000      1.792000  
1 1 1 39 13 30 o 8.157000 0.5196000 8.919000 0.6972000 7.396000 0.7705000 1.523000       1.039000  
1 1 1 39 13 32 o 7.717000 0.6721000 7.940000 0.7406000 7.493000 1.122000  0.4468000      1.344000  
1 1 1 39 13 34 o 3.783000 0.9443000 2.881000 1.149000  4.686000 1.499000  -1.805000      1.889000  
1 1 1 39 14 1  o 11.19000 0.3936000 10.44000 0.5791000 11.94000 0.5334000 -1.500000      0.7873000 
1 1 1 39 14 3  o 12.44000 0.3715000 12.08000 0.5611000 12.80000 0.4870000 -0.7153000     0.7430000 
1 1 1 39 14 5  o 12.74000 0.4133000 12.78000 0.5751000 12.71000 0.5937000 0.6526000E-01  0.8265000 
1 1 1 39 14 7  o 5.815000 0.7088000 5.974000 0.9572000 5.657000 1.046000  0.3169000      1.418000  
1 1 1 39 14 9  o 8.529000 0.5078000 9.094000 0.6992000 7.963000 0.7364000 1.131000       1.016000  
1 1 1 39 14 11 o 9.254000 0.4455000 10.18000 0.5360000 8.333000 0.7116000 1.843000       0.8909000 
1 1 1 39 14 13 o 10.02000 0.4549000 10.69000 0.5826000 9.359000 0.6990000 1.329000       0.9099000 
1 1 1 39 14 15 o 16.92000 0.3296000 16.89000 0.4428000 16.94000 0.4884000 -0.4718000E-01 0.6592000 
1 1 1 39 14 17 o 8.962000 0.5431000 9.246000 0.7215000 8.679000 0.8120000 0.5661000      1.086000  
1 1 1 39 14 19 o 5.309000 0.7407000 6.266000 0.8614000 4.352000 1.205000  1.914000       1.481000  
1 1 1 39 14 21 o 7.321000 0.5993000 7.041000 0.8789000 7.601000 0.8149000 -0.5602000     1.199000  
1 1 1 39 14 23 o 7.532000 0.5330000 7.496000 0.7728000 7.569000 0.7342000 -0.7292000E-01 1.066000  
1 1 1 39 14 25 f 5.413000 0.8222000 5.738000 1.062000  5.088000 1.255000  0.6502000      1.644000  
1 1 1 39 14 27 o 6.379000 0.6721000 6.321000 0.9643000 6.437000 0.9365000 -0.1159000     1.344000  
1 1 1 39 14 29 o 3.773000 0.8761000 4.228000 1.213000  3.318000 1.265000  0.9098000      1.752000  
1 1 1 39 14 31 o 3.870000 0.8944000 2.779000 1.113000  4.962000 1.400000  -2.183000      1.789000  
1 1 1 39 14 33 o 7.045000 0.6519000 6.929000 0.7358000 7.160000 1.076000  -0.2318000     1.304000  
1 1 1 39 14 35 o 3.662000 1.476000  3.662000 1.476000  ?        ?         ?              ?         
1 1 1 39 15 0  o 12.39000 0.5139000 12.39000 0.5139000 12.39000 0.5139000 0.000000       0.000000  
1 1 1 39 15 2  o 12.07000 0.3624000 12.21000 0.5071000 11.93000 0.5178000 0.2762000      0.7247000 
1 1 1 39 15 4  o 4.720000 0.8164000 5.093000 1.085000  4.346000 1.220000  0.7470000      1.633000  
1 1 1 39 15 6  o 16.72000 0.3724000 17.15000 0.5116000 16.30000 0.5413000 0.8497000      0.7448000 
1 1 1 39 15 8  o 9.062000 0.4562000 9.325000 0.6322000 8.799000 0.6580000 0.5265000      0.9125000 
1 1 1 39 15 10 o 7.212000 0.5539000 6.947000 0.8574000 7.477000 0.7016000 -0.5302000     1.108000  
1 1 1 39 15 12 o 16.09000 0.3390000 15.65000 0.4697000 16.52000 0.4890000 -0.8748000     0.6780000 
1 1 1 39 15 14 o 8.925000 0.4759000 8.742000 0.6356000 9.109000 0.7086000 -0.3669000     0.9519000 
1 1 1 39 15 16 f 9.734000 0.4481000 10.53000 0.5414000 8.932000 0.7142000 1.602000       0.8963000 
1 1 1 39 15 18 o 3.600000 0.8266000 3.948000 1.147000  3.252000 1.191000  0.6957000      1.653000  
1 1 1 39 15 20 o 11.55000 0.4765000 12.51000 0.6307000 10.60000 0.7143000 1.904000       0.9529000 
1 1 1 39 15 22 o 9.147000 0.5104000 8.748000 0.7236000 9.545000 0.7199000 -0.7970000     1.021000  
1 1 1 39 15 24 o 12.84000 0.3968000 13.26000 0.5073000 12.41000 0.6104000 0.8543000      0.7937000 
1 1 1 39 15 26 o 5.603000 0.7646000 6.766000 0.8706000 4.439000 1.257000  2.327000       1.529000  
1 1 1 39 15 28 o 3.322000 0.8721000 3.123000 1.224000  3.522000 1.243000  -0.3983000     1.744000  
1 1 1 39 15 30 o 4.723000 0.8274000 5.868000 0.8681000 3.579000 1.409000  2.289000       1.655000  
1 1 1 39 15 32 o 6.829000 0.6990000 6.346000 0.7731000 7.311000 1.165000  -0.9647000     1.398000  
1 1 1 39 15 34 o 3.622000 0.9084000 3.980000 1.147000  3.265000 1.409000  0.7152000      1.817000  
1 1 1 39 16 1  o 8.210000 0.4932000 8.711000 0.6594000 7.708000 0.7336000 1.003000       0.9864000 
1 1 1 39 16 3  o 3.691000 0.8488000 4.307000 1.256000  3.076000 1.142000  1.231000       1.698000  
1 1 1 39 16 5  o 7.871000 0.5360000 7.240000 0.8601000 8.502000 0.6399000 -1.262000      1.072000  
1 1 1 39 16 7  o 7.879000 0.6153000 8.411000 0.6759000 7.347000 1.028000  1.064000       1.231000  
1 1 1 39 16 9  o 2.683000 0.7985000 2.795000 1.139000  2.571000 1.119000  0.2240000      1.597000  
1 1 1 39 16 11 o 5.843000 0.6697000 6.791000 0.7678000 4.895000 1.098000  1.896000       1.339000  
1 1 1 39 16 13 o 14.32000 0.3450000 14.57000 0.4529000 14.08000 0.5206000 0.4878000      0.6900000 
1 1 1 39 16 15 o 11.08000 0.4159000 11.65000 0.5534000 10.50000 0.6210000 1.152000       0.8318000 
1 1 1 39 16 17 o 17.28000 0.3897000 16.87000 0.4522000 17.70000 0.6349000 -0.8376000     0.7794000 
1 1 1 39 16 19 o 11.89000 0.4990000 11.69000 0.5882000 12.10000 0.8063000 -0.4088000     0.9980000 
1 1 1 39 16 21 o 5.435000 0.8010000 5.274000 0.9397000 5.595000 1.297000  -0.3212000     1.602000  
1 1 1 39 16 23 o 7.708000 0.8514000 7.483000 0.7623000 7.933000 1.523000  -0.4503000     1.703000  
1 1 1 39 16 25 o 7.510000 0.6204000 7.263000 0.8567000 7.758000 0.8976000 -0.4947000     1.241000  
1 1 1 39 16 27 o 7.830000 0.5580000 7.477000 0.8114000 8.182000 0.7663000 -0.7048000     1.116000  
1 1 1 39 16 29 o 5.000000 0.9100000 5.152000 1.044000  4.848000 1.491000  0.3041000      1.820000  
1 1 1 39 16 31 o 7.365000 0.7459000 8.065000 0.6861000 6.666000 1.325000  1.398000       1.492000  
1 1 1 39 16 33 o 3.370000 0.9639000 2.413000 1.083000  4.328000 1.595000  -1.915000      1.928000  
1 1 1 39 17 0  o 2.759000 1.148000  2.759000 1.148000  2.759000 1.148000  0.000000       0.000000  
1 1 1 39 17 2  o 5.440000 0.7154000 5.602000 0.9861000 5.279000 1.037000  0.3227000      1.431000  
1 1 1 39 17 4  o 13.27000 0.3724000 13.22000 0.5475000 13.32000 0.5050000 -0.1001000     0.7449000 
1 1 1 39 17 6  o 9.175000 0.4732000 9.516000 0.5685000 8.835000 0.7566000 0.6814000      0.9464000 
1 1 1 39 17 8  f 5.741000 0.6482000 4.972000 1.005000  6.510000 0.8195000 -1.537000      1.296000  
1 1 1 39 17 10 o 5.553000 0.7109000 4.682000 1.093000  6.424000 0.9097000 -1.742000      1.422000  
1 1 1 39 17 12 o 10.90000 0.4497000 11.45000 0.5475000 10.35000 0.7136000 1.099000       0.8995000 
1 1 1 39 17 14 o 8.844000 0.5189000 8.700000 0.6453000 8.987000 0.8126000 -0.2867000     1.038000  
1 1 1 39 17 16 o 4.385000 0.8665000 4.059000 1.102000  4.712000 1.338000  -0.6534000     1.733000  
1 1 1 39 17 18 o 11.45000 0.4882000 11.59000 0.5944000 11.30000 0.7745000 0.2893000      0.9763000 
1 1 1 39 17 20 o 4.063000 0.8430000 4.692000 1.155000  3.433000 1.228000  1.259000       1.686000  
1 1 1 39 17 22 o 3.107000 0.8453000 2.381000 1.046000  3.833000 1.328000  -1.452000      1.691000  
1 1 1 39 17 24 o 3.852000 0.9086000 3.878000 1.206000  3.826000 1.360000  0.5185000E-01  1.817000  
1 1 1 39 17 26 o 2.869000 0.8670000 3.075000 1.238000  2.664000 1.214000  0.4118000      1.734000  
1 1 1 39 17 28 o 3.776000 1.017000  4.138000 1.343000  3.413000 1.528000  0.7257000      2.034000  
1 1 1 39 17 30 o 8.322000 1.078000  8.468000 0.6422000 8.176000 2.058000  0.2918000      2.156000  
1 1 1 39 17 32 o 6.082000 0.9981000 5.438000 1.166000  6.727000 1.620000  -1.290000      1.996000  
1 1 1 39 18 1  o 5.746000 0.6496000 5.942000 0.8914000 5.550000 0.9452000 0.3920000      1.299000  
1 1 1 39 18 3  o 2.941000 0.8490000 3.195000 1.268000  2.687000 1.129000  0.5085000      1.698000  
1 1 1 39 18 5  o 8.096000 0.5356000 8.357000 0.7935000 7.835000 0.7196000 0.5219000      1.071000  
1 1 1 39 18 7  o 3.564000 0.8318000 3.325000 1.171000  3.803000 1.182000  -0.4773000     1.664000  
1 1 1 39 18 9  o 4.874000 0.7731000 5.716000 0.8771000 4.032000 1.273000  1.684000       1.546000  
1 1 1 39 18 11 f 7.314000 0.6316000 7.714000 0.7931000 6.914000 0.9833000 0.7997000      1.263000  
1 1 1 39 18 13 o 8.081000 0.4941000 8.488000 0.6294000 7.674000 0.7620000 0.8141000      0.9883000 
1 1 1 39 18 15 o 3.178000 0.8511000 3.491000 1.250000  2.865000 1.156000  0.6261000      1.702000  
1 1 1 39 18 17 o 6.862000 0.6396000 7.536000 0.7791000 6.187000 1.015000  1.349000       1.279000  
1 1 1 39 18 19 o 3.322000 0.8753000 3.405000 1.226000  3.239000 1.249000  0.1660000      1.751000  
1 1 1 39 18 21 o 6.761000 0.5927000 7.172000 0.7086000 6.349000 0.9502000 0.8232000      1.185000  
1 1 1 39 18 23 o 3.480000 0.8810000 3.206000 1.194000  3.755000 1.295000  -0.5495000     1.762000  
1 1 1 39 18 25 o 3.824000 0.9204000 3.844000 1.260000  3.804000 1.342000  0.4077000E-01  1.841000  
1 1 1 39 18 27 o 3.563000 0.9166000 2.827000 1.109000  4.299000 1.459000  -1.472000      1.833000  
1 1 1 39 18 29 o 4.693000 1.000000  4.347000 1.114000  5.039000 1.662000  -0.6922000     2.001000  
1 1 1 39 18 31 o 5.178000 1.060000  5.889000 1.500000  4.467000 1.498000  1.422000       2.120000  
1 1 1 39 19 0  o 3.333000 1.199000  3.333000 1.199000  3.333000 1.199000  0.000000       0.000000  
1 1 1 39 19 2  o 4.653000 0.7787000 5.018000 1.054000  4.289000 1.146000  0.7286000      1.557000  
1 1 1 39 19 4  o 7.071000 0.6392000 6.309000 1.044000  7.833000 0.7377000 -1.524000      1.278000  
1 1 1 39 19 6  o 8.951000 0.4799000 9.130000 0.6386000 8.772000 0.7165000 0.3579000      0.9598000 
1 1 1 39 19 8  o 7.588000 0.7475000 8.675000 0.5965000 6.500000 1.371000  2.175000       1.495000  
1 1 1 39 19 10 f 3.821000 0.8500000 4.305000 1.213000  3.336000 1.191000  0.9688000      1.700000  
1 1 1 39 19 12 o 2.952000 0.8428000 3.076000 1.256000  2.828000 1.124000  0.2479000      1.686000  
1 1 1 39 19 14 o 6.161000 0.6541000 6.622000 0.8832000 5.699000 0.9651000 0.9228000      1.308000  
1 1 1 39 19 16 o 4.542000 0.8756000 5.273000 1.263000  3.811000 1.212000  1.461000       1.751000  
1 1 1 39 19 18 o 13.47000 0.4353000 13.78000 0.6441000 13.17000 0.5857000 0.6116000      0.8705000 
1 1 1 39 19 20 o 4.660000 0.9248000 4.639000 1.383000  4.681000 1.228000  -0.4210000E-01 1.850000  
1 1 1 39 19 22 o 7.142000 0.7442000 7.218000 1.178000  7.066000 0.9094000 0.1521000      1.488000  
1 1 1 39 19 24 o 7.226000 0.7611000 7.020000 1.292000  7.433000 0.8056000 -0.4134000     1.522000  
1 1 1 39 19 26 o 4.165000 1.064000  3.606000 1.377000  4.724000 1.623000  -1.118000      2.129000  
1 1 1 39 19 28 o 3.296000 0.9449000 3.741000 1.341000  2.851000 1.331000  0.8903000      1.890000  
1 1 1 39 19 30 o 5.691000 0.9517000 6.213000 1.131000  5.170000 1.531000  1.043000       1.903000  
1 1 1 39 19 32 o 5.125000 1.196000  4.425000 1.738000  5.825000 1.643000  -1.400000      2.392000  
1 1 1 39 20 1  o 5.995000 0.6831000 6.827000 0.8270000 5.164000 1.087000  1.663000       1.366000  
1 1 1 39 20 3  o 12.03000 0.3999000 12.09000 0.5816000 11.97000 0.5491000 0.1235000      0.7999000 
1 1 1 39 20 5  o 9.065000 0.5297000 8.697000 0.7978000 9.434000 0.6972000 -0.7376000     1.059000  
1 1 1 39 20 7  o 6.813000 0.5853000 6.872000 0.8235000 6.755000 0.8319000 0.1163000      1.171000  
1 1 1 39 20 9  o 7.532000 0.6013000 7.495000 0.7661000 7.569000 0.9269000 -0.7358000E-01 1.203000  
1 1 1 39 20 11 o 6.854000 0.7833000 6.081000 1.381000  7.627000 0.7389000 -1.546000      1.567000  
1 1 1 39 20 13 o 5.487000 1.019000  5.418000 1.818000  5.557000 0.9230000 -0.1393000     2.038000  
1 1 1 39 20 15 o 4.395000 0.8133000 4.658000 1.084000  4.132000 1.213000  0.5267000      1.627000  
1 1 1 39 20 17 o 3.786000 0.8966000 4.090000 1.241000  3.482000 1.294000  0.6074000      1.793000  
1 1 1 39 20 19 f 7.041000 0.6019000 6.612000 0.8572000 7.469000 0.8452000 -0.8563000     1.204000  
1 1 1 39 20 21 o 7.979000 0.5389000 7.994000 0.7569000 7.963000 0.7674000 0.3140000E-01  1.078000  
1 1 1 39 20 23 f 10.29000 0.5181000 10.68000 0.5820000 9.906000 0.8573000 0.7724000      1.036000  
1 1 1 39 20 25 o 4.071000 0.9684000 3.386000 1.122000  4.757000 1.579000  -1.370000      1.937000  
1 1 1 39 20 27 o 6.187000 0.7904000 6.443000 0.8741000 5.931000 1.317000  0.5116000      1.581000  
1 1 1 39 20 29 o 4.532000 1.158000  5.818000 1.879000  3.245000 1.354000  2.573000       2.316000  
1 1 1 39 20 31 o 6.150000 1.019000  5.428000 1.556000  6.872000 1.316000  -1.444000      2.038000  
1 1 1 39 21 0  o 6.910000 0.7846000 6.910000 0.7846000 6.910000 0.7846000 0.000000       0.000000  
1 1 1 39 21 2  f 6.110000 0.7165000 5.852000 1.150000  6.368000 0.8543000 -0.5165000     1.433000  
1 1 1 39 21 4  o 8.270000 0.5603000 7.989000 0.8154000 8.550000 0.7686000 -0.5615000     1.121000  
1 1 1 39 21 6  o 13.33000 0.3792000 13.96000 0.5122000 12.69000 0.5594000 1.263000       0.7585000 
1 1 1 39 21 8  o 13.37000 0.3762000 13.72000 0.5461000 13.02000 0.5176000 0.6973000      0.7524000 
1 1 1 39 21 10 o 15.02000 0.4572000 15.20000 0.7018000 14.84000 0.5861000 0.3578000      0.9144000 
1 1 1 39 21 12 o 3.041000 0.8382000 3.052000 1.208000  3.030000 1.162000  0.2207000E-01  1.676000  
1 1 1 39 21 14 o 2.410000 0.7449000 2.885000 1.176000  1.935000 0.9149000 0.9503000      1.490000  
1 1 1 39 21 16 o 5.552000 0.7918000 5.050000 1.139000  6.054000 1.100000  -1.004000      1.584000  
1 1 1 39 21 18 o 4.698000 0.8654000 4.223000 1.327000  5.174000 1.111000  -0.9512000     1.731000  
1 1 1 39 21 20 o 5.190000 0.7717000 5.838000 0.9184000 4.542000 1.240000  1.296000       1.543000  
1 1 1 39 21 22 o 5.312000 0.9068000 5.535000 1.301000  5.089000 1.263000  0.4464000      1.814000  
1 1 1 39 21 24 o 3.928000 1.058000  3.979000 1.427000  3.877000 1.564000  0.1023000      2.117000  
1 1 1 39 21 26 o 3.948000 0.9740000 4.746000 1.469000  3.149000 1.279000  1.597000       1.948000  
1 1 1 39 21 28 o 3.475000 1.065000  3.584000 1.614000  3.366000 1.390000  0.2176000      2.130000  
1 1 1 39 21 30 o 3.413000 1.035000  3.256000 1.408000  3.570000 1.517000  -0.3136000     2.070000  
1 1 1 39 22 1  o 5.365000 0.7695000 5.532000 1.077000  5.197000 1.100000  0.3346000      1.539000  
1 1 1 39 22 3  o 5.031000 0.8870000 5.546000 1.201000  4.516000 1.305000  1.030000       1.774000  
1 1 1 39 22 5  o 5.922000 0.7395000 4.487000 1.259000  7.357000 0.7766000 -2.870000      1.479000  
1 1 1 39 22 7  o 8.170000 0.6029000 8.210000 0.9657000 8.130000 0.7221000 0.7972000E-01  1.206000  
1 1 1 39 22 9  o 6.857000 0.5885000 6.591000 0.9092000 7.123000 0.7474000 -0.5321000     1.177000  
1 1 1 39 22 11 o 4.963000 0.7782000 5.063000 1.123000  4.863000 1.077000  0.2005000      1.556000  
1 1 1 39 22 13 o 4.425000 0.8407000 4.589000 1.275000  4.261000 1.097000  0.3283000      1.681000  
1 1 1 39 22 15 o 2.610000 0.7839000 3.190000 1.247000  2.030000 0.9501000 1.160000       1.568000  
1 1 1 39 22 17 o 3.980000 0.8840000 4.388000 1.224000  3.572000 1.276000  0.8158000      1.768000  
1 1 1 39 22 19 o 4.536000 0.9346000 4.926000 1.402000  4.145000 1.237000  0.7808000      1.869000  
1 1 1 39 22 21 o 8.625000 0.7360000 9.848000 0.7965000 7.402000 1.238000  2.447000       1.472000  
1 1 1 39 22 23 o 8.593000 0.7951000 10.08000 1.040000  7.103000 1.203000  2.981000       1.590000  
1 1 1 39 22 25 o 4.857000 1.152000  5.279000 1.742000  4.434000 1.507000  0.8451000      2.303000  
1 1 1 39 22 27 f 2.592000 0.8455000 2.278000 1.095000  2.906000 1.288000  -0.6276000     1.691000  
1 1 1 39 22 29 o 4.747000 1.042000  5.045000 1.476000  4.448000 1.472000  0.5973000      2.084000  
1 1 1 39 23 0  o 4.460000 1.288000  4.460000 1.288000  4.460000 1.288000  0.000000       0.000000  
1 1 1 39 23 2  o 5.656000 0.9055000 5.080000 1.410000  6.232000 1.136000  -1.152000      1.811000  
1 1 1 39 23 4  o 3.803000 0.8954000 4.792000 1.410000  2.814000 1.104000  1.978000       1.791000  
1 1 1 39 23 6  o 6.396000 0.8214000 8.263000 1.120000  4.529000 1.202000  3.734000       1.643000  
1 1 1 39 23 8  o 3.500000 0.8404000 4.126000 1.221000  2.874000 1.155000  1.252000       1.681000  
1 1 1 39 23 10 o 9.937000 0.4639000 10.46000 0.6095000 9.413000 0.6994000 1.047000       0.9277000 
1 1 1 39 23 12 o 6.823000 0.6684000 7.660000 0.8713000 5.987000 1.014000  1.673000       1.337000  
1 1 1 39 23 14 o 4.988000 0.8120000 6.327000 1.058000  3.649000 1.232000  2.678000       1.624000  
1 1 1 39 23 16 o 5.166000 0.8778000 6.164000 1.299000  4.168000 1.181000  1.997000       1.756000  
1 1 1 39 23 18 o 3.386000 0.9097000 3.264000 1.360000  3.509000 1.208000  -0.2448000     1.819000  
1 1 1 39 23 20 o 5.582000 0.9394000 6.098000 1.201000  5.066000 1.444000  1.033000       1.879000  
1 1 1 39 23 22 o 8.639000 0.8387000 9.642000 1.203000  7.637000 1.169000  2.006000       1.677000  
1 1 1 39 23 24 o 4.642000 1.145000  4.784000 1.614000  4.501000 1.625000  0.2831000      2.290000  
1 1 1 39 23 26 o 3.481000 0.9634000 3.925000 1.414000  3.037000 1.309000  0.8880000      1.927000  
1 1 1 39 23 28 o 3.334000 0.9893000 3.990000 1.556000  2.678000 1.222000  1.312000       1.979000  
1 1 1 39 24 1  o 7.035000 0.6997000 7.334000 0.9048000 6.736000 1.067000  0.5983000      1.399000  
1 1 1 39 24 3  o 6.819000 0.6566000 5.972000 1.062000  7.665000 0.7722000 -1.693000      1.313000  
1 1 1 39 24 5  o 6.478000 0.8073000 5.883000 1.279000  7.074000 0.9859000 -1.191000      1.615000  
1 1 1 39 24 7  o 5.884000 0.7661000 7.516000 0.7874000 4.251000 1.314000  3.265000       1.532000  
1 1 1 39 24 9  o 8.860000 0.5049000 9.118000 0.6730000 8.601000 0.7528000 0.5172000      1.010000  
1 1 1 39 24 11 o 4.515000 0.8443000 5.572000 1.140000  3.458000 1.246000  2.114000       1.689000  
1 1 1 39 24 13 o 8.232000 0.5811000 9.039000 0.9294000 7.424000 0.6978000 1.615000       1.162000  
1 1 1 39 24 15 o 8.276000 0.6909000 8.318000 0.9836000 8.233000 0.9706000 0.8481000E-01  1.382000  
1 1 1 39 24 17 o 5.795000 0.9250000 6.489000 1.131000  5.102000 1.464000  1.386000       1.850000  
1 1 1 39 24 19 o 4.132000 1.117000  3.938000 1.632000  4.326000 1.525000  -0.3887000     2.234000  
1 1 1 39 24 21 o 5.995000 0.9749000 5.688000 1.408000  6.303000 1.348000  -0.6150000     1.950000  
1 1 1 39 24 23 o 3.599000 0.9981000 3.964000 1.472000  3.234000 1.348000  0.7306000      1.996000  
1 1 1 39 24 25 o 2.955000 0.9133000 3.214000 1.357000  2.696000 1.222000  0.5181000      1.827000  
1 1 1 39 24 27 o 4.246000 1.047000  3.842000 1.574000  4.650000 1.382000  -0.8079000     2.095000  
1 1 1 39 25 0  o 2.710000 1.188000  2.710000 1.188000  2.710000 1.188000  0.000000       0.000000  
1 1 1 39 25 2  o 3.705000 0.8447000 3.065000 1.241000  4.345000 1.147000  -1.280000      1.689000  
1 1 1 39 25 4  o 5.126000 0.7668000 5.042000 1.093000  5.209000 1.075000  -0.1673000     1.534000  
1 1 1 39 25 6  o 12.38000 0.4239000 12.00000 0.5321000 12.77000 0.6600000 -0.7626000     0.8478000 
1 1 1 39 25 8  o 4.775000 0.8539000 4.661000 1.245000  4.890000 1.169000  -0.2288000     1.708000  
1 1 1 39 25 10 o 3.204000 0.8399000 3.190000 1.214000  3.219000 1.162000  -0.2932000E-01 1.680000  
1 1 1 39 25 12 f 3.525000 0.9818000 3.619000 1.385000  3.430000 1.392000  0.1888000      1.964000  
1 1 1 39 25 14 o 3.676000 0.8908000 5.048000 1.399000  2.303000 1.103000  2.746000       1.782000  
1 1 1 39 25 16 o 3.959000 0.9908000 5.057000 1.552000  2.862000 1.232000  2.195000       1.982000  
1 1 1 39 25 18 o 4.726000 0.9560000 3.224000 1.416000  6.227000 1.285000  -3.003000      1.912000  
1 1 1 39 25 20 o 8.512000 0.6980000 8.824000 0.9882000 8.200000 0.9860000 0.6240000      1.396000  
1 1 1 39 25 22 o 3.481000 1.011000  3.469000 1.414000  3.494000 1.445000  -0.2552000E-01 2.022000  
1 1 1 39 25 24 o 3.756000 1.015000  3.659000 1.462000  3.853000 1.408000  -0.1934000     2.030000  
1 1 1 39 25 26 f 5.086000 1.047000  5.150000 1.499000  5.022000 1.462000  0.1285000      2.094000  
1 1 1 39 26 1  o 4.517000 0.8814000 3.820000 1.420000  5.213000 1.045000  -1.393000      1.763000  
1 1 1 39 26 3  o 4.914000 0.8385000 4.845000 1.280000  4.982000 1.084000  -0.1375000     1.677000  
1 1 1 39 26 5  o 12.93000 0.4262000 12.94000 0.6387000 12.91000 0.5645000 0.3570000E-01  0.8524000 
1 1 1 39 26 7  o 10.14000 0.4189000 10.16000 0.6193000 10.12000 0.5642000 0.3935000E-01  0.8377000 
1 1 1 39 26 9  o 3.750000 0.9540000 4.351000 1.531000  3.150000 1.139000  1.201000       1.908000  
1 1 1 39 26 11 o 8.921000 0.7158000 9.575000 1.024000  8.268000 1.001000  1.307000       1.432000  
1 1 1 39 26 13 o 9.934000 0.5962000 10.20000 0.8765000 9.665000 0.8084000 0.5363000      1.192000  
1 1 1 39 26 15 o 7.578000 0.9272000 7.181000 1.514000  7.976000 1.070000  -0.7953000     1.854000  
1 1 1 39 26 17 o 3.606000 0.9846000 4.136000 1.482000  3.075000 1.297000  1.061000       1.969000  
1 1 1 39 26 19 o 9.746000 0.6687000 10.51000 0.8053000 8.982000 1.068000  1.528000       1.337000  
1 1 1 39 26 21 o 6.758000 0.9216000 8.344000 1.082000  5.172000 1.492000  3.173000       1.843000  
1 1 1 39 26 23 o 3.378000 0.9942000 4.023000 1.550000  2.733000 1.246000  1.290000       1.988000  
1 1 1 39 26 25 f 3.169000 1.023000  2.998000 1.363000  3.339000 1.525000  -0.3404000     2.046000  
1 1 1 39 27 0  o 4.088000 1.202000  4.088000 1.202000  4.088000 1.202000  0.000000       0.000000  
1 1 1 39 27 2  o 2.968000 0.8345000 2.882000 1.208000  3.053000 1.152000  -0.1704000     1.669000  
1 1 1 39 27 4  o 4.873000 0.8513000 4.463000 1.376000  5.282000 1.002000  -0.8185000     1.703000  
1 1 1 39 27 6  o 5.384000 0.7963000 6.074000 1.164000  4.693000 1.086000  1.381000       1.593000  
1 1 1 39 27 8  f 6.556000 0.6766000 6.929000 1.072000  6.182000 0.8256000 0.7473000      1.353000  
1 1 1 39 27 10 o 3.584000 0.9507000 2.980000 1.244000  4.188000 1.438000  -1.208000      1.901000  
1 1 1 39 27 12 o 3.351000 0.9077000 3.013000 1.257000  3.689000 1.310000  -0.6765000     1.815000  
1 1 1 39 27 14 o 5.278000 0.9874000 4.306000 1.416000  6.251000 1.377000  -1.944000      1.975000  
1 1 1 39 27 16 o 3.176000 0.9331000 2.856000 1.268000  3.496000 1.370000  -0.6397000     1.866000  
1 1 1 39 27 18 o 3.743000 0.9772000 4.373000 1.420000  3.112000 1.343000  1.261000       1.954000  
1 1 1 39 27 20 o 7.230000 0.8489000 7.533000 1.127000  6.928000 1.270000  0.6046000      1.698000  
1 1 1 39 27 22 o 2.508000 0.8333000 2.806000 1.274000  2.210000 1.075000  0.5957000      1.667000  
1 1 1 39 27 24 o 4.083000 1.075000  4.766000 1.649000  3.399000 1.380000  1.367000       2.150000  
1 1 1 39 28 1  o 6.589000 0.6507000 6.596000 0.9150000 6.583000 0.9254000 0.1394000E-01  1.301000  
1 1 1 39 28 3  o 4.443000 0.7706000 3.207000 1.268000  5.679000 0.8765000 -2.472000      1.541000  
1 1 1 39 28 5  o 7.538000 0.5893000 7.852000 0.9099000 7.223000 0.7491000 0.6287000      1.179000  
1 1 1 39 28 7  o 2.272000 0.7656000 2.090000 1.011000  2.453000 1.150000  -0.3634000     1.531000  
1 1 1 39 28 9  o 3.403000 0.9105000 3.721000 1.310000  3.084000 1.265000  0.6375000      1.821000  
1 1 1 39 28 11 o 6.284000 0.8814000 5.735000 1.326000  6.834000 1.162000  -1.099000      1.763000  
1 1 1 39 28 13 o 4.436000 0.9778000 5.530000 1.326000  3.342000 1.437000  2.187000       1.956000  
1 1 1 39 28 15 o 4.896000 1.028000  4.429000 1.420000  5.362000 1.486000  -0.9333000     2.056000  
1 1 1 39 28 17 o 5.007000 0.9745000 4.848000 1.476000  5.166000 1.273000  -0.3177000     1.949000  
1 1 1 39 28 19 o 3.996000 1.024000  3.612000 1.425000  4.379000 1.470000  -0.7665000     2.047000  
1 1 1 39 28 21 o 5.090000 1.009000  5.054000 1.402000  5.127000 1.451000  -0.7310000E-01 2.018000  
1 1 1 39 28 23 o 4.172000 1.529000  ?        ?         4.172000 1.529000  ?              ?         
1 1 1 39 29 0  o 3.016000 1.160000  3.016000 1.160000  3.016000 1.160000  0.000000       0.000000  
1 1 1 39 29 2  o 4.430000 0.8014000 3.323000 1.225000  5.537000 1.033000  -2.214000      1.603000  
1 1 1 39 29 4  o 5.997000 1.027000  5.705000 1.735000  6.289000 1.099000  -0.5838000     2.054000  
1 1 1 39 29 6  o 3.516000 0.8567000 4.529000 1.280000  2.503000 1.139000  2.027000       1.713000  
1 1 1 39 29 8  o 7.714000 0.6643000 8.615000 0.7913000 6.812000 1.067000  1.803000       1.329000  
1 1 1 39 29 10 f 7.436000 0.7419000 8.244000 0.9199000 6.628000 1.164000  1.617000       1.484000  
1 1 1 39 29 12 o 7.185000 0.8019000 7.920000 1.055000  6.449000 1.208000  1.472000       1.604000  
1 1 1 39 29 14 o 4.071000 0.9706000 4.986000 1.417000  3.156000 1.326000  1.830000       1.941000  
1 1 1 39 29 16 o 3.576000 1.063000  3.960000 1.653000  3.192000 1.339000  0.7689000      2.127000  
1 1 1 39 29 18 o 4.820000 1.101000  5.639000 1.437000  4.000000 1.668000  1.640000       2.201000  
1 1 1 39 29 20 o 6.208000 0.9421000 6.491000 1.194000  5.925000 1.458000  0.5661000      1.884000  
1 1 1 39 29 22 o 3.578000 1.684000  ?        ?         3.578000 1.684000  ?              ?         
1 1 1 39 30 1  o 3.275000 0.8403000 4.294000 1.363000  2.257000 0.9834000 2.037000       1.681000  
1 1 1 39 30 3  o 3.166000 0.9196000 2.429000 1.137000  3.903000 1.445000  -1.474000      1.839000  
1 1 1 39 30 5  o 4.988000 0.8600000 5.058000 1.246000  4.919000 1.186000  0.1388000      1.720000  
1 1 1 39 30 7  o 5.097000 0.9192000 5.929000 1.167000  4.266000 1.421000  1.663000       1.838000  
1 1 1 39 30 9  o 3.897000 0.9769000 4.190000 1.436000  3.604000 1.325000  0.5856000      1.954000  
1 1 1 39 30 11 o 4.410000 0.9656000 3.416000 1.336000  5.404000 1.394000  -1.988000      1.931000  
1 1 1 39 30 13 o 4.315000 0.9615000 4.823000 1.330000  3.806000 1.389000  1.018000       1.923000  
1 1 1 39 30 15 o 4.766000 1.066000  5.727000 1.528000  3.805000 1.485000  1.922000       2.131000  
1 1 1 39 30 17 o 3.953000 1.002000  3.232000 1.401000  4.674000 1.433000  -1.442000      2.004000  
1 1 1 39 30 19 f 3.732000 1.075000  3.619000 1.528000  3.846000 1.511000  -0.2276000     2.149000  
1 1 1 39 31 0  o 8.073000 1.401000  8.073000 1.401000  8.073000 1.401000  0.000000       0.000000  
1 1 1 39 31 2  o 3.856000 1.059000  2.914000 1.258000  4.798000 1.703000  -1.884000      2.117000  
1 1 1 39 31 4  o 4.541000 0.9828000 4.260000 1.411000  4.821000 1.368000  -0.5609000     1.966000  
1 1 1 39 31 6  o 11.54000 0.5432000 11.97000 0.7288000 11.12000 0.8057000 0.8551000      1.086000  
1 1 1 39 31 8  o 5.257000 0.8929000 6.499000 1.152000  4.015000 1.365000  2.484000       1.786000  
1 1 1 39 31 10 o 10.57000 0.5330000 10.62000 0.7537000 10.51000 0.7540000 0.1056000      1.066000  
1 1 1 39 31 12 o 15.09000 0.4459000 15.97000 0.6022000 14.20000 0.6579000 1.771000       0.8919000 
1 1 1 39 31 14 o 13.13000 0.6133000 13.60000 0.7023000 12.66000 1.006000  0.9358000      1.227000  
1 1 1 39 31 16 o 5.452000 0.9788000 4.704000 1.443000  6.199000 1.323000  -1.495000      1.958000  
1 1 1 39 31 18 o 7.259000 1.302000  6.612000 2.041000  7.906000 1.617000  -1.294000      2.604000  
1 1 1 39 32 1  o 4.276000 1.160000  4.585000 1.713000  3.967000 1.566000  0.6187000      2.321000  
1 1 1 39 32 3  o 4.652000 1.217000  3.958000 1.568000  5.346000 1.862000  -1.388000      2.434000  
1 1 1 39 32 5  o 6.192000 1.007000  6.557000 1.664000  5.827000 1.134000  0.7298000      2.014000  
1 1 1 39 32 7  f 3.496000 0.9733000 2.894000 1.258000  4.099000 1.485000  -1.205000      1.947000  
1 1 1 39 32 9  f 4.335000 0.9653000 4.378000 1.349000  4.292000 1.381000  0.8558000E-01  1.931000  
1 1 1 39 32 11 o 3.946000 0.9736000 4.595000 1.397000  3.297000 1.356000  1.298000       1.947000  
1 1 1 39 32 13 o 5.070000 1.070000  4.887000 1.593000  5.254000 1.427000  -0.3669000     2.139000  
1 1 1 39 32 15 o 4.205000 1.120000  4.491000 1.656000  3.919000 1.508000  0.5720000      2.240000  
1 1 1 39 33 0  o 3.834000 1.694000  3.834000 1.694000  3.834000 1.694000  0.000000       0.000000  
1 1 1 39 33 2  o 9.366000 0.8924000 9.328000 1.272000  9.404000 1.252000  -0.7654000E-01 1.785000  
1 1 1 39 33 4  o 6.706000 1.098000  5.426000 1.633000  7.987000 1.468000  -2.560000      2.196000  
1 1 1 39 33 6  o 3.557000 1.056000  4.600000 1.770000  2.513000 1.151000  2.088000       2.112000  
1 1 1 39 33 8  o 5.040000 1.076000  5.453000 1.288000  4.628000 1.723000  0.8253000      2.151000  
1 1 1 39 33 10 o 2.642000 0.8757000 2.705000 1.266000  2.578000 1.211000  0.1272000      1.751000  
1 1 1 39 33 12 o 3.939000 1.050000  4.014000 1.543000  3.864000 1.423000  0.1501000      2.099000  
1 1 1 39 34 1  o 5.194000 1.272000  5.130000 1.839000  5.257000 1.757000  -0.1263000     2.544000  
1 1 1 39 34 3  o 3.605000 1.084000  3.024000 1.393000  4.185000 1.661000  -1.162000      2.168000  
1 1 1 39 34 5  o 7.067000 1.111000  6.118000 1.685000  8.016000 1.447000  -1.898000      2.221000  
1 1 1 39 34 7  o 4.604000 1.112000  3.351000 1.483000  5.857000 1.658000  -2.507000      2.224000  
1 1 1 39 34 9  o 4.692000 1.296000  4.271000 1.878000  5.114000 1.788000  -0.8427000     2.593000  
1 1 1 39 35 0  o 7.126000 1.874000  7.126000 1.874000  7.126000 1.874000  0.000000       0.000000  
1 1 1 39 35 2  o 6.799000 1.245000  6.176000 1.902000  7.421000 1.607000  -1.245000      2.490000  
1 1 1 40 0  0  o 4.553000 1.461000  4.553000 1.461000  4.553000 1.461000  0.000000       0.000000  
1 1 1 40 0  2  o 8.377000 0.6965000 8.377000 0.6965000 8.377000 0.6965000 0.000000       0.000000  
1 1 1 40 0  4  o 9.433000 0.6333000 9.433000 0.6333000 9.433000 0.6333000 0.000000       0.000000  
1 1 1 40 0  6  o 15.58000 0.5565000 15.58000 0.5565000 15.58000 0.5565000 0.000000       0.000000  
1 1 1 40 0  8  o 11.66000 0.6877000 11.66000 0.6877000 11.66000 0.6877000 0.000000       0.000000  
1 1 1 40 0  10 o 7.130000 1.588000  7.130000 1.588000  7.130000 1.588000  0.000000       0.000000  
1 1 1 40 0  12 o 16.50000 0.4737000 16.50000 0.4737000 16.50000 0.4737000 0.000000       0.000000  
1 1 1 40 0  14 o 6.061000 0.9673000 6.061000 0.9673000 6.061000 0.9673000 0.000000       0.000000  
1 1 1 40 0  16 o 4.015000 1.467000  4.015000 1.467000  4.015000 1.467000  0.000000       0.000000  
1 1 1 40 0  18 o 7.317000 0.7776000 7.317000 0.7776000 7.317000 0.7776000 0.000000       0.000000  
1 1 1 40 0  20 o 3.398000 1.225000  3.398000 1.225000  3.398000 1.225000  0.000000       0.000000  
1 1 1 40 0  22 o 2.639000 1.130000  2.639000 1.130000  2.639000 1.130000  0.000000       0.000000  
1 1 1 40 0  24 o 2.686000 1.149000  2.686000 1.149000  2.686000 1.149000  0.000000       0.000000  
1 1 1 40 0  26 f 14.72000 0.6304000 14.72000 0.6304000 14.72000 0.6304000 0.000000       0.000000  
1 1 1 40 0  28 o 9.290000 0.7364000 9.290000 0.7364000 9.290000 0.7364000 0.000000       0.000000  
1 1 1 40 0  30 o 7.646000 0.8832000 7.646000 0.8832000 7.646000 0.8832000 0.000000       0.000000  
1 1 1 40 0  32 o 4.919000 1.395000  4.919000 1.395000  4.919000 1.395000  0.000000       0.000000  
1 1 1 40 0  34 o 2.806000 1.199000  2.806000 1.199000  2.806000 1.199000  0.000000       0.000000  
1 1 1 40 1  1  o 9.671000 0.4428000 9.461000 0.6343000 9.882000 0.6180000 -0.4215000     0.8856000 
1 1 1 40 1  3  f 5.028000 0.7800000 5.690000 1.015000  4.367000 1.185000  1.323000       1.560000  
1 1 1 40 1  5  o 19.21000 0.3106000 19.25000 0.4339000 19.17000 0.4446000 0.7854000E-01  0.6212000 
1 1 1 40 1  7  o 4.485000 0.9079000 4.182000 1.319000  4.789000 1.249000  -0.6077000     1.816000  
1 1 1 40 1  9  o 14.26000 0.4898000 14.30000 0.6422000 14.23000 0.7398000 0.7874000E-01  0.9796000 
1 1 1 40 1  11 o 4.171000 0.9045000 4.399000 1.179000  3.943000 1.372000  0.4552000      1.809000  
1 1 1 40 1  13 o 9.620000 0.5425000 9.622000 0.7765000 9.618000 0.7577000 0.3800000E-02  1.085000  
1 1 1 40 1  15 o 10.78000 0.4563000 10.87000 0.6239000 10.69000 0.6660000 0.1761000      0.9126000 
1 1 1 40 1  17 o 6.996000 0.7079000 6.790000 1.021000  7.202000 0.9810000 -0.4119000     1.416000  
1 1 1 40 1  19 o 15.79000 0.3403000 15.82000 0.4694000 15.75000 0.4928000 0.7699000E-01  0.6806000 
1 1 1 40 1  21 o 9.935000 0.4565000 9.657000 0.6537000 10.21000 0.6374000 -0.5557000     0.9130000 
1 1 1 40 1  23 o 4.061000 0.8486000 4.015000 1.213000  4.106000 1.188000  -0.9154000E-01 1.697000  
1 1 1 40 1  25 o 13.11000 0.4568000 13.46000 0.6060000 12.77000 0.6836000 0.6898000      0.9136000 
1 1 1 40 1  27 o 8.007000 0.5815000 7.775000 0.8291000 8.238000 0.8155000 -0.4635000     1.163000  
1 1 1 40 1  29 o 9.117000 0.5975000 10.03000 0.7658000 8.203000 0.9175000 1.827000       1.195000  
1 1 1 40 1  31 o 5.081000 0.9166000 5.977000 1.146000  4.185000 1.431000  1.792000       1.833000  
1 1 1 40 1  33 o 4.921000 0.9644000 4.582000 1.303000  5.260000 1.422000  -0.6788000     1.929000  
1 1 1 40 1  35 o 3.016000 0.8926000 3.029000 1.264000  3.004000 1.261000  0.2455000E-01  1.785000  
1 1 1 40 2  0  o 7.833000 0.7199000 7.833000 0.7199000 7.833000 0.7199000 0.000000       0.000000  
1 1 1 40 2  2  f 3.465000 0.8434000 4.009000 1.214000  2.922000 1.171000  1.087000       1.687000  
1 1 1 40 2  4  o 14.28000 0.3475000 14.56000 0.4885000 14.00000 0.4943000 0.5600000      0.6950000 
1 1 1 40 2  6  o 12.60000 0.3983000 12.67000 0.5996000 12.53000 0.5244000 0.1351000      0.7966000 
1 1 1 40 2  8  o 3.787000 0.9281000 4.400000 1.370000  3.175000 1.252000  1.225000       1.856000  
1 1 1 40 2  10 o 3.323000 0.8659000 2.879000 1.164000  3.768000 1.282000  -0.8894000     1.732000  
1 1 1 40 2  12 o 13.98000 0.4760000 14.82000 0.5906000 13.13000 0.7467000 1.694000       0.9520000 
1 1 1 40 2  14 f 8.918000 0.5023000 8.512000 0.6632000 9.324000 0.7546000 -0.8117000     1.005000  
1 1 1 40 2  16 o 9.745000 0.4403000 9.227000 0.6521000 10.26000 0.5920000 -1.038000      0.8807000 
1 1 1 40 2  18 o 4.360000 0.8259000 5.293000 1.083000  3.428000 1.247000  1.865000       1.652000  
1 1 1 40 2  20 f 11.61000 0.3941000 11.68000 0.5542000 11.54000 0.5606000 0.1344000      0.7883000 
1 1 1 40 2  22 o 7.340000 0.5740000 8.324000 0.7217000 6.357000 0.8929000 1.967000       1.148000  
1 1 1 40 2  24 o 2.620000 0.7854000 2.082000 0.9752000 3.159000 1.231000  -1.077000      1.571000  
1 1 1 40 2  26 o 7.298000 0.6442000 6.239000 0.9994000 8.358000 0.8129000 -2.119000      1.288000  
1 1 1 40 2  28 o 6.731000 0.7430000 7.023000 1.061000  6.438000 1.041000  0.5845000      1.486000  
1 1 1 40 2  30 o 5.549000 0.7705000 6.306000 0.9854000 4.792000 1.185000  1.514000       1.541000  
1 1 1 40 2  32 o 2.560000 0.8357000 2.674000 1.201000  2.446000 1.162000  0.2285000      1.671000  
1 1 1 40 2  34 o 5.060000 0.8652000 4.236000 1.323000  5.884000 1.115000  -1.647000      1.730000  
1 1 1 40 2  36 o 3.385000 1.099000  3.535000 1.606000  3.236000 1.500000  0.2996000      2.198000  
1 1 1 40 3  1  o 8.392000 0.4692000 8.270000 0.6659000 8.513000 0.6613000 -0.2432000     0.9385000 
1 1 1 40 3  3  o 17.26000 0.3184000 17.47000 0.4439000 17.04000 0.4564000 0.4377000      0.6367000 
1 1 1 40 3  5  o 6.560000 0.5982000 5.716000 0.8955000 7.405000 0.7933000 -1.689000      1.196000  
1 1 1 40 3  7  o 4.426000 0.9298000 4.304000 1.393000  4.547000 1.232000  -0.2432000     1.860000  
1 1 1 40 3  9  o 12.62000 0.5909000 12.26000 0.7961000 12.97000 0.8734000 -0.7072000     1.182000  
1 1 1 40 3  11 o 8.832000 0.5144000 9.705000 0.6253000 7.958000 0.8170000 1.747000       1.029000  
1 1 1 40 3  13 o 10.49000 0.4864000 10.05000 0.6041000 10.93000 0.7624000 -0.8730000     0.9727000 
1 1 1 40 3  15 o 3.714000 0.8485000 4.067000 1.183000  3.362000 1.216000  0.7050000      1.697000  
1 1 1 40 3  17 o 11.80000 0.4076000 11.87000 0.6095000 11.74000 0.5413000 0.1242000      0.8152000 
1 1 1 40 3  19 o 3.480000 0.8476000 3.227000 1.224000  3.734000 1.173000  -0.5071000     1.695000  
1 1 1 40 3  21 o 13.14000 0.4259000 13.16000 0.6042000 13.13000 0.6003000 0.2143000E-01  0.8517000 
1 1 1 40 3  23 o 6.795000 0.6554000 8.052000 0.6928000 5.537000 1.113000  2.515000       1.311000  
1 1 1 40 3  25 o 3.523000 0.8943000 3.759000 1.270000  3.288000 1.259000  0.4711000      1.789000  
1 1 1 40 3  27 o 5.704000 0.8091000 4.676000 1.305000  6.733000 0.9569000 -2.057000      1.618000  
1 1 1 40 3  29 o 3.857000 0.9593000 3.122000 1.281000  4.592000 1.428000  -1.471000      1.919000  
1 1 1 40 3  31 o 5.984000 0.8339000 5.589000 1.175000  6.379000 1.184000  -0.7908000     1.668000  
1 1 1 40 3  33 o 3.007000 0.8953000 2.963000 1.286000  3.050000 1.246000  -0.8692000E-01 1.791000  
1 1 1 40 3  35 o 3.751000 0.9731000 3.216000 1.384000  4.287000 1.369000  -1.071000      1.946000  
1 1 1 40 4  0  o 4.674000 1.104000  4.674000 1.104000  4.674000 1.104000  0.000000       0.000000  
1 1 1 40 4  2  o 8.270000 0.4872000 7.844000 0.7197000 8.695000 0.6568000 -0.8511000     0.9744000 
1 1 1 40 4  4  o 8.624000 0.5209000 8.369000 0.8108000 8.879000 0.6540000 -0.5100000     1.042000  
1 1 1 40 4  6  o 3.924000 0.9656000 3.572000 1.405000  4.275000 1.325000  -0.7029000     1.931000  
1 1 1 40 4  8  o 10.44000 0.4779000 10.56000 0.6598000 10.31000 0.6915000 0.2514000      0.9558000 
1 1 1 40 4  10 o 4.894000 0.8133000 4.450000 1.177000  5.338000 1.123000  -0.8880000     1.627000  
1 1 1 40 4  12 o 4.288000 0.9404000 3.677000 1.237000  4.898000 1.417000  -1.221000      1.881000  
1 1 1 40 4  14 o 13.32000 0.4321000 13.10000 0.5167000 13.55000 0.6927000 -0.4541000     0.8641000 
1 1 1 40 4  16 o 8.268000 0.5296000 7.952000 0.7424000 8.583000 0.7555000 -0.6310000     1.059000  
1 1 1 40 4  18 o 13.61000 0.3782000 13.67000 0.5540000 13.56000 0.5151000 0.1134000      0.7564000 
1 1 1 40 4  20 o 3.632000 0.8392000 4.272000 1.207000  2.992000 1.167000  1.281000       1.678000  
1 1 1 40 4  22 o 2.787000 0.8163000 3.308000 1.276000  2.266000 1.019000  1.042000       1.633000  
1 1 1 40 4  24 o 4.625000 0.8253000 5.048000 1.058000  4.201000 1.267000  0.8466000      1.651000  
1 1 1 40 4  26 o 3.310000 0.9273000 2.781000 1.172000  3.839000 1.437000  -1.058000      1.855000  
1 1 1 40 4  28 o 5.212000 0.8151000 6.215000 1.013000  4.208000 1.277000  2.008000       1.630000  
1 1 1 40 4  30 o 6.943000 0.7790000 7.581000 0.8971000 6.304000 1.274000  1.276000       1.558000  
1 1 1 40 4  32 f 3.935000 0.9826000 3.871000 1.457000  3.999000 1.319000  -0.1278000     1.965000  
1 1 1 40 4  34 o 4.909000 0.8840000 4.316000 1.266000  5.502000 1.235000  -1.186000      1.768000  
1 1 1 40 5  1  o 15.22000 0.3527000 15.52000 0.5261000 14.92000 0.4700000 0.6040000      0.7055000 
1 1 1 40 5  3  o 12.55000 0.3937000 12.32000 0.6021000 12.77000 0.5074000 -0.4503000     0.7874000 
1 1 1 40 5  5  o 11.78000 0.5335000 10.81000 0.8850000 12.76000 0.5961000 -1.948000      1.067000  
1 1 1 40 5  7  o 14.18000 0.4507000 13.85000 0.5582000 14.50000 0.7078000 -0.6505000     0.9015000 
1 1 1 40 5  9  o 3.021000 0.8583000 3.282000 1.186000  2.761000 1.241000  0.5217000      1.717000  
1 1 1 40 5  11 o 4.282000 0.8919000 4.875000 1.010000  3.688000 1.470000  1.187000       1.784000  
1 1 1 40 5  13 f 3.875000 0.8931000 3.995000 1.196000  3.754000 1.327000  0.2413000      1.786000  
1 1 1 40 5  15 o 7.326000 0.6759000 6.907000 0.8492000 7.744000 1.052000  -0.8375000     1.352000  
1 1 1 40 5  17 o 15.37000 0.3760000 14.92000 0.4905000 15.82000 0.5701000 -0.8961000     0.7521000 
1 1 1 40 5  19 o 12.84000 0.4197000 12.46000 0.6031000 13.22000 0.5839000 -0.7577000     0.8395000 
1 1 1 40 5  21 o 4.813000 0.8187000 5.515000 1.015000  4.111000 1.285000  1.403000       1.637000  
1 1 1 40 5  23 o 3.859000 0.9761000 3.878000 1.218000  3.841000 1.526000  0.3620000E-01  1.952000  
1 1 1 40 5  25 o 3.195000 0.8951000 3.284000 1.216000  3.106000 1.314000  0.1787000      1.790000  
1 1 1 40 5  27 o 6.452000 0.7337000 6.770000 0.9944000 6.133000 1.079000  0.6368000      1.467000  
1 1 1 40 5  29 f 10.77000 0.5242000 11.62000 0.6636000 9.921000 0.8116000 1.701000       1.048000  
1 1 1 40 5  31 o 5.412000 0.9626000 5.872000 1.383000  4.951000 1.340000  0.9203000      1.925000  
1 1 1 40 5  33 o 4.644000 0.9157000 4.661000 1.278000  4.627000 1.311000  0.3458000E-01  1.831000  
1 1 1 40 5  35 o 4.087000 0.9346000 3.542000 1.327000  4.633000 1.316000  -1.091000      1.869000  
1 1 1 40 6  0  o 3.074000 1.218000  3.074000 1.218000  3.074000 1.218000  0.000000       0.000000  
1 1 1 40 6  2  f 15.68000 0.4222000 15.57000 0.5746000 15.79000 0.6188000 -0.2183000     0.8444000 
1 1 1 40 6  4  o 4.289000 0.8758000 3.989000 1.213000  4.589000 1.264000  -0.5995000     1.752000  
1 1 1 40 6  6  o 11.37000 0.4593000 11.18000 0.6567000 11.55000 0.6423000 -0.3693000     0.9186000 
1 1 1 40 6  8  o 3.830000 0.9189000 3.151000 1.252000  4.508000 1.346000  -1.358000      1.838000  
1 1 1 40 6  10 o 3.605000 0.8436000 2.781000 1.124000  4.429000 1.258000  -1.648000      1.687000  
1 1 1 40 6  12 o 5.632000 0.7151000 5.639000 0.9802000 5.625000 1.042000  0.1391000E-01  1.430000  
1 1 1 40 6  14 o 6.369000 0.5942000 6.460000 0.8551000 6.277000 0.8253000 0.1831000      1.188000  
1 1 1 40 6  16 o 11.12000 0.4271000 11.32000 0.5678000 10.92000 0.6382000 0.3921000      0.8542000 
1 1 1 40 6  18 o 4.816000 0.8831000 5.226000 1.110000  4.407000 1.374000  0.8190000      1.766000  
1 1 1 40 6  20 f 4.805000 0.8871000 5.127000 1.191000  4.482000 1.315000  0.6445000      1.774000  
1 1 1 40 6  22 o 4.468000 0.8512000 5.122000 1.064000  3.813000 1.329000  1.310000       1.702000  
1 1 1 40 6  24 o 13.48000 0.4656000 13.53000 0.6465000 13.44000 0.6702000 0.9122000E-01  0.9312000 
1 1 1 40 6  26 o 8.092000 0.8654000 8.025000 1.108000  8.158000 1.329000  -0.1327000     1.731000  
1 1 1 40 6  28 o 3.553000 0.9791000 3.958000 1.478000  3.148000 1.285000  0.8098000      1.958000  
1 1 1 40 6  30 o 4.534000 0.9104000 5.459000 1.260000  3.608000 1.314000  1.851000       1.821000  
1 1 1 40 6  32 o 5.366000 0.8487000 6.433000 1.010000  4.298000 1.364000  2.135000       1.697000  
1 1 1 40 6  34 o 2.869000 0.8407000 2.235000 1.075000  3.503000 1.293000  -1.267000      1.681000  
1 1 1 40 7  1  o 7.668000 0.5570000 7.188000 0.8722000 8.148000 0.6931000 -0.9599000     1.114000  
1 1 1 40 7  3  o 10.00000 0.5157000 10.53000 0.5562000 9.471000 0.8687000 1.064000       1.031000  
1 1 1 40 7  5  o 9.258000 0.5269000 9.898000 0.6096000 8.618000 0.8595000 1.280000       1.054000  
1 1 1 40 7  7  o 5.622000 0.8912000 5.402000 1.200000  5.841000 1.318000  -0.4383000     1.782000  
1 1 1 40 7  9  o 4.949000 0.9071000 4.240000 1.178000  5.658000 1.380000  -1.418000      1.814000  
1 1 1 40 7  11 o 9.911000 0.5357000 10.13000 0.5881000 9.692000 0.8955000 0.4369000      1.071000  
1 1 1 40 7  13 o 3.450000 0.9057000 3.412000 1.202000  3.489000 1.355000  -0.7739000E-01 1.811000  
1 1 1 40 7  15 o 6.234000 0.6948000 6.294000 0.9351000 6.174000 1.028000  0.1202000      1.390000  
1 1 1 40 7  17 o 12.14000 0.4525000 11.43000 0.5386000 12.85000 0.7272000 -1.415000      0.9050000 
1 1 1 40 7  19 o 2.652000 0.7825000 3.129000 1.211000  2.176000 0.9917000 0.9532000      1.565000  
1 1 1 40 7  21 o 10.74000 0.4495000 10.50000 0.5854000 10.98000 0.6823000 -0.4782000     0.8990000 
1 1 1 40 7  23 o 10.75000 0.4801000 10.70000 0.6183000 10.80000 0.7346000 -0.1010000     0.9602000 
1 1 1 40 7  25 o 12.88000 0.4833000 12.75000 0.7840000 13.00000 0.5654000 -0.2462000     0.9666000 
1 1 1 40 7  27 o 11.46000 0.5246000 11.61000 0.7298000 11.31000 0.7537000 0.2938000      1.049000  
1 1 1 40 7  29 o 3.772000 0.9800000 3.359000 1.269000  4.184000 1.494000  -0.8258000     1.960000  
1 1 1 40 7  31 o 3.635000 0.9230000 3.671000 1.325000  3.600000 1.285000  0.7098000E-01  1.846000  
1 1 1 40 7  33 o 4.656000 0.8566000 5.884000 1.139000  3.427000 1.280000  2.456000       1.713000  
1 1 1 40 7  35 o 3.923000 0.9824000 4.174000 1.450000  3.672000 1.325000  0.5026000      1.965000  
1 1 1 40 8  0  o 4.196000 1.335000  4.196000 1.335000  4.196000 1.335000  0.000000       0.000000  
1 1 1 40 8  2  o 9.516000 0.4813000 10.69000 0.5687000 8.345000 0.7767000 2.341000       0.9626000 
1 1 1 40 8  4  o 11.26000 0.4478000 11.46000 0.6155000 11.07000 0.6505000 0.3891000      0.8956000 
1 1 1 40 8  6  o 10.26000 0.4590000 9.901000 0.7002000 10.61000 0.5937000 -0.7096000     0.9181000 
1 1 1 40 8  8  o 5.595000 0.7681000 5.250000 1.225000  5.940000 0.9272000 -0.6901000     1.536000  
1 1 1 40 8  10 o 2.841000 0.8105000 3.230000 1.210000  2.451000 1.079000  0.7791000      1.621000  
1 1 1 40 8  12 f 8.279000 0.5741000 8.433000 0.8647000 8.126000 0.7554000 0.3075000      1.148000  
1 1 1 40 8  14 o 6.128000 0.7306000 6.382000 1.100000  5.874000 0.9617000 0.5081000      1.461000  
1 1 1 40 8  16 o 3.695000 0.8667000 4.689000 1.324000  2.700000 1.119000  1.989000       1.733000  
1 1 1 40 8  18 o 6.926000 0.6190000 7.086000 0.9585000 6.767000 0.7837000 0.3189000      1.238000  
1 1 1 40 8  20 o 2.783000 0.8150000 2.894000 1.192000  2.672000 1.112000  0.2218000      1.630000  
1 1 1 40 8  22 o 6.580000 0.8948000 5.708000 1.595000  7.453000 0.8123000 -1.744000      1.790000  
1 1 1 40 8  24 o 7.125000 0.7332000 7.638000 1.143000  6.612000 0.9189000 1.026000       1.466000  
1 1 1 40 8  26 o 3.499000 0.9155000 3.163000 1.258000  3.835000 1.331000  -0.6723000     1.831000  
1 1 1 40 8  28 o 9.002000 0.6713000 9.680000 0.8716000 8.323000 1.021000  1.357000       1.343000  
1 1 1 40 8  30 o 11.98000 0.4531000 11.99000 0.6026000 11.97000 0.6768000 0.2521000E-01  0.9061000 
1 1 1 40 8  32 o 9.762000 0.6669000 10.94000 0.6650000 8.586000 1.156000  2.352000       1.334000  
1 1 1 40 8  34 o 3.069000 0.8740000 2.716000 1.207000  3.421000 1.264000  -0.7045000     1.748000  
1 1 1 40 9  1  o 18.11000 0.3895000 17.90000 0.5984000 18.32000 0.4988000 -0.4233000     0.7790000 
1 1 1 40 9  3  o 16.27000 0.3417000 16.03000 0.4631000 16.51000 0.5025000 -0.4823000     0.6833000 
1 1 1 40 9  5  o 8.865000 0.5052000 8.358000 0.7143000 9.372000 0.7146000 -1.014000      1.010000  
1 1 1 40 9  7  o 2.907000 0.8741000 2.873000 1.282000  2.942000 1.188000  -0.6892000E-01 1.748000  
1 1 1 40 9  9  o 4.151000 0.8944000 4.010000 1.350000  4.292000 1.174000  -0.2820000     1.789000  
1 1 1 40 9  11 o 8.251000 0.5073000 8.377000 0.6886000 8.124000 0.7452000 0.2530000      1.015000  
1 1 1 40 9  13 o 10.88000 0.4109000 11.13000 0.5323000 10.63000 0.6261000 0.5034000      0.8218000 
1 1 1 40 9  15 o 4.535000 0.7982000 5.352000 1.032000  3.717000 1.218000  1.635000       1.596000  
1 1 1 40 9  17 o 6.172000 0.6260000 6.399000 0.8982000 5.944000 0.8721000 0.4556000      1.252000  
1 1 1 40 9  19 o 15.04000 0.3647000 14.77000 0.5548000 15.30000 0.4736000 -0.5310000     0.7294000 
1 1 1 40 9  21 o 10.70000 0.5279000 10.27000 0.7961000 11.12000 0.6936000 -0.8554000     1.056000  
1 1 1 40 9  23 o 2.492000 0.7798000 2.701000 1.154000  2.284000 1.050000  0.4170000      1.560000  
1 1 1 40 9  25 o 11.82000 0.6165000 10.70000 1.082000  12.94000 0.5910000 -2.244000      1.233000  
1 1 1 40 9  27 o 10.81000 0.5649000 9.887000 0.8933000 11.74000 0.6916000 -1.854000      1.130000  
1 1 1 40 9  29 o 3.038000 0.8487000 3.818000 1.332000  2.257000 1.052000  1.561000       1.697000  
1 1 1 40 9  31 o 3.083000 0.8951000 3.135000 1.250000  3.032000 1.282000  0.1030000      1.790000  
1 1 1 40 9  33 o 2.966000 0.8989000 2.923000 1.192000  3.008000 1.346000  -0.8498000E-01 1.798000  
1 1 1 40 10 0  o 3.200000 1.273000  3.200000 1.273000  3.200000 1.273000  0.000000       0.000000  
1 1 1 40 10 2  o 5.760000 0.8378000 5.511000 1.361000  6.009000 0.9775000 -0.4984000     1.676000  
1 1 1 40 10 4  o 8.210000 0.7846000 7.252000 1.416000  9.167000 0.6753000 -1.914000      1.569000  
1 1 1 40 10 6  o 17.00000 0.4842000 17.87000 0.8431000 16.13000 0.4765000 1.736000       0.9684000 
1 1 1 40 10 8  o 3.516000 0.8752000 3.537000 1.129000  3.495000 1.337000  0.4161000E-01  1.750000  
1 1 1 40 10 10 o 5.361000 0.7222000 5.322000 0.8986000 5.400000 1.131000  -0.7812000E-01 1.444000  
1 1 1 40 10 12 o 8.856000 0.5116000 9.509000 0.7189000 8.203000 0.7281000 1.306000       1.023000  
1 1 1 40 10 14 o 10.52000 0.4617000 10.53000 0.6604000 10.51000 0.6455000 0.1280000E-01  0.9234000 
1 1 1 40 10 16 o 3.814000 0.8561000 3.411000 1.257000  4.216000 1.163000  -0.8054000     1.712000  
1 1 1 40 10 18 o 13.08000 0.4272000 13.46000 0.5851000 12.71000 0.6226000 0.7524000      0.8544000 
1 1 1 40 10 20 o 2.711000 0.8054000 2.603000 1.125000  2.819000 1.153000  -0.2160000     1.611000  
1 1 1 40 10 22 o 3.319000 0.9144000 3.775000 1.372000  2.863000 1.209000  0.9120000      1.829000  
1 1 1 40 10 24 o 8.918000 0.5026000 8.773000 0.7335000 9.064000 0.6874000 -0.2907000     1.005000  
1 1 1 40 10 26 o 5.463000 0.8350000 4.722000 1.276000  6.204000 1.077000  -1.482000      1.670000  
1 1 1 40 10 28 o 3.753000 0.9698000 4.421000 1.488000  3.085000 1.245000  1.336000       1.940000  
1 1 1 40 10 30 o 10.97000 0.5614000 11.02000 0.8436000 10.92000 0.7411000 0.9631000E-01  1.123000  
1 1 1 40 10 32 o 5.369000 0.9287000 4.407000 1.488000  6.330000 1.112000  -1.923000      1.857000  
1 1 1 40 10 34 o 3.662000 0.9650000 3.005000 1.132000  4.319000 1.563000  -1.314000      1.930000  
1 1 1 40 11 1  o 20.08000 0.3439000 20.26000 0.5383000 19.89000 0.4281000 0.3681000      0.6878000 
1 1 1 40 11 3  o 18.64000 0.3987000 18.62000 0.6742000 18.66000 0.4258000 -0.3779000E-01 0.7974000 
1 1 1 40 11 5  o 9.582000 0.4652000 9.664000 0.7262000 9.500000 0.5816000 0.1639000      0.9303000 
1 1 1 40 11 7  o 17.68000 0.3746000 17.44000 0.5671000 17.92000 0.4895000 -0.4799000     0.7491000 
1 1 1 40 11 9  o 13.19000 0.4295000 13.70000 0.5628000 12.68000 0.6488000 1.013000       0.8589000 
1 1 1 40 11 11 o 13.33000 0.4537000 13.90000 0.6125000 12.77000 0.6696000 1.133000       0.9075000 
1 1 1 40 11 13 o 20.76000 0.3447000 20.53000 0.4897000 20.99000 0.4852000 -0.4646000     0.6893000 
1 1 1 40 11 15 o 16.45000 0.3411000 16.07000 0.4642000 16.83000 0.4999000 -0.7618000     0.6822000 
1 1 1 40 11 17 o 15.93000 0.3507000 15.56000 0.4695000 16.30000 0.5211000 -0.7337000     0.7014000 
1 1 1 40 11 19 o 12.20000 0.4125000 12.65000 0.5307000 11.75000 0.6315000 0.8976000      0.8249000 
1 1 1 40 11 21 o 3.390000 0.8542000 4.010000 1.239000  2.769000 1.176000  1.241000       1.708000  
1 1 1 40 11 23 o 8.242000 0.5455000 7.456000 0.8284000 9.027000 0.7098000 -1.571000      1.091000  
1 1 1 40 11 25 o 5.656000 0.8580000 4.212000 1.432000  7.100000 0.9462000 -2.887000      1.716000  
1 1 1 40 11 27 o 3.830000 0.8874000 3.445000 1.230000  4.214000 1.280000  -0.7695000     1.775000  
1 1 1 40 11 29 o 13.31000 0.4802000 13.32000 0.6738000 13.29000 0.6845000 0.2879000E-01  0.9604000 
1 1 1 40 11 31 o 5.524000 0.8849000 6.996000 1.209000  4.052000 1.293000  2.944000       1.770000  
1 1 1 40 11 33 o 4.427000 1.081000  4.574000 1.448000  4.281000 1.604000  0.2934000      2.161000  
1 1 1 40 12 0  o 5.720000 1.123000  5.720000 1.123000  5.720000 1.123000  0.000000       0.000000  
1 1 1 40 12 2  o 10.38000 0.4058000 10.14000 0.5798000 10.62000 0.5679000 -0.4866000     0.8116000 
1 1 1 40 12 4  o 10.48000 0.4172000 10.47000 0.6078000 10.48000 0.5716000 -0.7783000E-02 0.8344000 
1 1 1 40 12 6  o 7.495000 0.5751000 7.373000 0.8668000 7.616000 0.7560000 -0.2431000     1.150000  
1 1 1 40 12 8  f 20.36000 0.3122000 20.77000 0.4366000 19.94000 0.4463000 0.8328000      0.6244000 
1 1 1 40 12 10 o 7.680000 0.5108000 7.614000 0.7359000 7.747000 0.7085000 -0.1327000     1.022000  
1 1 1 40 12 12 o 4.172000 0.8721000 4.387000 1.203000  3.956000 1.263000  0.4317000      1.744000  
1 1 1 40 12 14 o 13.55000 0.4222000 13.70000 0.4865000 13.39000 0.6902000 0.3060000      0.8444000 
1 1 1 40 12 16 o 16.16000 0.3613000 16.18000 0.5132000 16.14000 0.5089000 0.4558000E-01  0.7227000 
1 1 1 40 12 18 o 4.525000 0.7927000 5.675000 1.025000  3.375000 1.210000  2.300000       1.585000  
1 1 1 40 12 20 o 4.438000 0.8788000 5.501000 1.172000  3.375000 1.310000  2.127000       1.758000  
1 1 1 40 12 22 o 5.978000 0.7464000 5.951000 1.043000  6.005000 1.068000  -0.5433000E-01 1.493000  
1 1 1 40 12 24 o 5.572000 0.8045000 4.679000 1.199000  6.465000 1.073000  -1.786000      1.609000  
1 1 1 40 12 26 o 2.763000 0.8294000 3.105000 1.246000  2.421000 1.095000  0.6836000      1.659000  
1 1 1 40 12 28 o 4.599000 0.8634000 4.533000 1.215000  4.666000 1.226000  -0.1334000     1.727000  
1 1 1 40 12 30 o 4.300000 0.9038000 4.224000 1.279000  4.377000 1.277000  -0.1529000     1.808000  
1 1 1 40 12 32 o 5.360000 0.8728000 5.798000 0.9730000 4.922000 1.449000  0.8753000      1.746000  
1 1 1 40 13 1  o 16.05000 0.3514000 15.93000 0.4503000 16.17000 0.5396000 -0.2393000     0.7028000 
1 1 1 40 13 3  o 10.12000 0.4187000 9.650000 0.6183000 10.60000 0.5649000 -0.9452000     0.8375000 
1 1 1 40 13 5  o 4.069000 0.9065000 4.325000 1.336000  3.812000 1.225000  0.5134000      1.813000  
1 1 1 40 13 7  o 7.005000 0.6756000 6.865000 1.004000  7.145000 0.9046000 -0.2800000     1.351000  
1 1 1 40 13 9  o 8.068000 0.5014000 8.260000 0.6673000 7.877000 0.7484000 0.3824000      1.003000  
1 1 1 40 13 11 o 5.532000 0.6871000 4.826000 1.019000  6.238000 0.9221000 -1.413000      1.374000  
1 1 1 40 13 13 f 2.339000 0.7354000 2.312000 1.023000  2.366000 1.056000  -0.5387000E-01 1.471000  
1 1 1 40 13 15 o 5.764000 0.7061000 5.698000 0.9479000 5.830000 1.047000  -0.1319000     1.412000  
1 1 1 40 13 17 o 10.27000 0.4454000 10.51000 0.5466000 10.03000 0.7034000 0.4830000      0.8908000 
1 1 1 40 13 19 o 4.765000 0.9016000 4.853000 1.318000  4.677000 1.231000  0.1760000      1.803000  
1 1 1 40 13 21 o 3.310000 0.8436000 3.607000 1.158000  3.014000 1.227000  0.5936000      1.687000  
1 1 1 40 13 23 o 3.005000 0.8848000 2.648000 1.163000  3.362000 1.333000  -0.7148000     1.770000  
1 1 1 40 13 25 o 2.969000 0.8079000 2.436000 1.084000  3.502000 1.198000  -1.066000      1.616000  
1 1 1 40 13 27 o 6.090000 0.7599000 7.025000 0.9473000 5.155000 1.189000  1.870000       1.520000  
1 1 1 40 13 29 o 9.446000 0.5530000 10.01000 0.8466000 8.883000 0.7118000 1.125000       1.106000  
1 1 1 40 13 31 o 5.190000 0.8842000 6.351000 0.9475000 4.030000 1.493000  2.321000       1.768000  
1 1 1 40 13 33 o 4.066000 1.149000  4.063000 1.525000  4.068000 1.720000  -0.5167000E-02 2.299000  
1 1 1 40 14 0  o 4.841000 1.166000  4.841000 1.166000  4.841000 1.166000  0.000000       0.000000  
1 1 1 40 14 2  o 5.519000 0.8001000 6.058000 0.9648000 4.979000 1.277000  1.078000       1.600000  
1 1 1 40 14 4  o 7.271000 0.5769000 7.157000 0.8342000 7.386000 0.7969000 -0.2290000     1.154000  
1 1 1 40 14 6  o 10.81000 0.4247000 10.11000 0.6338000 11.50000 0.5656000 -1.392000      0.8495000 
1 1 1 40 14 8  o 16.23000 0.3436000 15.87000 0.5107000 16.58000 0.4598000 -0.7086000     0.6872000 
1 1 1 40 14 10 o 7.292000 0.5456000 7.805000 0.6846000 6.778000 0.8497000 1.027000       1.091000  
1 1 1 40 14 12 o 11.07000 0.4201000 11.58000 0.5539000 10.56000 0.6319000 1.021000       0.8403000 
1 1 1 40 14 14 f 5.277000 0.7554000 4.835000 1.056000  5.719000 1.080000  -0.8842000     1.511000  
1 1 1 40 14 16 o 6.681000 0.5666000 6.188000 0.8408000 7.173000 0.7597000 -0.9843000     1.133000  
1 1 1 40 14 18 o 3.297000 0.8446000 3.742000 1.237000  2.851000 1.150000  0.8914000      1.689000  
1 1 1 40 14 20 o 5.038000 0.7956000 5.080000 1.020000  4.996000 1.221000  0.8453000E-01  1.591000  
1 1 1 40 14 22 o 5.517000 0.8414000 5.889000 1.001000  5.146000 1.353000  0.7424000      1.683000  
1 1 1 40 14 24 o 3.837000 0.8970000 3.653000 1.301000  4.020000 1.235000  -0.3672000     1.794000  
1 1 1 40 14 26 o 3.481000 0.8728000 3.119000 1.221000  3.842000 1.248000  -0.7220000     1.746000  
1 1 1 40 14 28 o 4.039000 0.8157000 5.333000 1.125000  2.745000 1.181000  2.588000       1.631000  
1 1 1 40 14 30 o 2.998000 0.8638000 3.224000 1.291000  2.772000 1.149000  0.4520000      1.728000  
1 1 1 40 14 32 o 4.070000 0.9259000 2.978000 1.121000  5.162000 1.474000  -2.184000      1.852000  
1 1 1 40 15 1  o 14.72000 0.3236000 15.44000 0.4491000 13.99000 0.4660000 1.446000       0.6472000 
1 1 1 40 15 3  o 9.264000 0.4927000 9.022000 0.6943000 9.505000 0.6993000 -0.4832000     0.9854000 
1 1 1 40 15 5  o 6.734000 0.6102000 6.834000 0.8478000 6.634000 0.8778000 0.1999000      1.220000  
1 1 1 40 15 7  o 2.843000 0.8454000 3.141000 1.264000  2.545000 1.123000  0.5963000      1.691000  
1 1 1 40 15 9  f 4.505000 0.7975000 4.776000 1.068000  4.235000 1.184000  0.5407000      1.595000  
1 1 1 40 15 11 o 11.21000 0.3811000 11.60000 0.5245000 10.82000 0.5530000 0.7796000      0.7622000 
1 1 1 40 15 13 o 7.727000 0.5199000 7.327000 0.7365000 8.127000 0.7339000 -0.7999000     1.040000  
1 1 1 40 15 15 o 8.682000 0.4807000 8.236000 0.6725000 9.129000 0.6869000 -0.8933000     0.9613000 
1 1 1 40 15 17 o 4.629000 0.7790000 5.617000 0.9808000 3.640000 1.211000  1.977000       1.558000  
1 1 1 40 15 19 o 2.645000 0.7860000 2.250000 1.017000  3.039000 1.198000  -0.7892000     1.572000  
1 1 1 40 15 21 o 8.603000 0.5769000 8.497000 0.6643000 8.710000 0.9434000 -0.2133000     1.154000  
1 1 1 40 15 23 o 3.223000 0.8563000 3.289000 1.194000  3.156000 1.228000  0.1336000      1.713000  
1 1 1 40 15 25 o 4.838000 0.8048000 4.145000 1.231000  5.531000 1.037000  -1.386000      1.610000  
1 1 1 40 15 27 o 3.868000 0.9333000 3.923000 1.356000  3.813000 1.283000  0.1100000      1.867000  
1 1 1 40 15 29 o 6.217000 0.7092000 6.216000 1.057000  6.219000 0.9460000 -0.2603000E-02 1.418000  
1 1 1 40 15 31 o 4.181000 1.069000  3.273000 1.162000  5.090000 1.794000  -1.818000      2.137000  
1 1 1 40 16 0  o 7.954000 0.7437000 7.954000 0.7437000 7.954000 0.7437000 0.000000       0.000000  
1 1 1 40 16 2  o 7.146000 0.5686000 6.907000 0.8118000 7.384000 0.7964000 -0.4778000     1.137000  
1 1 1 40 16 4  o 17.81000 0.3764000 18.04000 0.5200000 17.58000 0.5444000 0.4557000      0.7529000 
1 1 1 40 16 6  o 10.50000 0.4497000 10.01000 0.6355000 10.99000 0.6364000 -0.9790000     0.8994000 
1 1 1 40 16 8  o 14.94000 0.4054000 15.28000 0.6343000 14.60000 0.5048000 0.6714000      0.8107000 
1 1 1 40 16 10 o 14.58000 0.3406000 14.93000 0.4720000 14.23000 0.4910000 0.6967000      0.6811000 
1 1 1 40 16 12 o 12.91000 0.3617000 13.45000 0.4876000 12.38000 0.5345000 1.072000       0.7235000 
1 1 1 40 16 14 o 5.777000 0.6385000 5.499000 0.8927000 6.055000 0.9130000 -0.5560000     1.277000  
1 1 1 40 16 16 o 4.436000 0.8203000 3.504000 1.215000  5.368000 1.102000  -1.864000      1.641000  
1 1 1 40 16 18 o 8.003000 0.6190000 8.289000 0.6831000 7.717000 1.033000  0.5719000      1.238000  
1 1 1 40 16 20 o 11.84000 0.4239000 11.94000 0.5407000 11.75000 0.6530000 0.1896000      0.8478000 
1 1 1 40 16 22 o 9.150000 0.4774000 9.579000 0.6018000 8.720000 0.7412000 0.8599000      0.9547000 
1 1 1 40 16 24 o 3.179000 0.8756000 3.090000 1.246000  3.269000 1.230000  -0.1786000     1.751000  
1 1 1 40 16 26 o 2.468000 0.7637000 2.928000 1.188000  2.009000 0.9604000 0.9184000      1.527000  
1 1 1 40 16 28 o 2.354000 0.7462000 2.012000 0.9645000 2.696000 1.139000  -0.6834000     1.492000  
1 1 1 40 16 30 o 3.095000 0.9591000 2.929000 1.221000  3.260000 1.479000  -0.3307000     1.918000  
1 1 1 40 17 1  o 3.901000 0.8173000 4.627000 1.112000  3.176000 1.198000  1.451000       1.635000  
1 1 1 40 17 3  o 7.046000 0.6321000 6.842000 0.9997000 7.251000 0.7737000 -0.4092000     1.264000  
1 1 1 40 17 5  o 5.100000 0.8549000 5.887000 1.081000  4.314000 1.325000  1.573000       1.710000  
1 1 1 40 17 7  o 3.116000 0.8105000 3.835000 1.226000  2.397000 1.060000  1.438000       1.621000  
1 1 1 40 17 9  o 11.60000 0.4117000 11.55000 0.6108000 11.66000 0.5523000 -0.1143000     0.8234000 
1 1 1 40 17 11 o 6.280000 0.6174000 6.367000 0.7953000 6.192000 0.9447000 0.1753000      1.235000  
1 1 1 40 17 13 o 9.200000 0.4698000 8.789000 0.7029000 9.611000 0.6237000 -0.8223000     0.9397000 
1 1 1 40 17 15 o 5.559000 0.7233000 5.215000 1.115000  5.902000 0.9217000 -0.6875000     1.447000  
1 1 1 40 17 17 o 3.997000 0.9119000 4.381000 1.132000  3.613000 1.430000  0.7677000      1.824000  
1 1 1 40 17 19 o 8.624000 0.6035000 8.560000 0.6625000 8.688000 1.009000  -0.1281000     1.207000  
1 1 1 40 17 21 o 8.640000 0.8377000 7.370000 0.7715000 9.910000 1.487000  -2.540000      1.675000  
1 1 1 40 17 23 o 13.63000 0.4321000 13.77000 0.5156000 13.49000 0.6935000 0.2897000      0.8642000 
1 1 1 40 17 25 o 6.893000 0.7365000 7.768000 0.7764000 6.019000 1.252000  1.749000       1.473000  
1 1 1 40 17 27 o 6.573000 0.7231000 5.957000 1.103000  7.189000 0.9355000 -1.231000      1.446000  
1 1 1 40 17 29 o 7.596000 0.7120000 6.738000 0.9197000 8.454000 1.087000  -1.717000      1.424000  
1 1 1 40 17 31 o 3.671000 1.574000  ?        ?         3.671000 1.574000  ?              ?         
1 1 1 40 18 0  o 12.22000 0.5270000 12.22000 0.5270000 12.22000 0.5270000 0.000000       0.000000  
1 1 1 40 18 2  o 2.794000 0.7561000 2.089000 0.9802000 3.498000 1.151000  -1.409000      1.512000  
1 1 1 40 18 4  o 3.414000 0.8637000 2.959000 1.225000  3.868000 1.218000  -0.9083000     1.727000  
1 1 1 40 18 6  o 2.786000 0.8305000 2.818000 1.113000  2.754000 1.233000  0.6375000E-01  1.661000  
1 1 1 40 18 8  o 3.920000 0.8338000 4.338000 1.111000  3.502000 1.243000  0.8363000      1.668000  
1 1 1 40 18 10 o 4.579000 0.8323000 4.817000 1.236000  4.340000 1.115000  0.4774000      1.665000  
1 1 1 40 18 12 f 7.756000 0.5395000 8.093000 0.7955000 7.418000 0.7289000 0.6757000      1.079000  
1 1 1 40 18 14 o 4.946000 0.8534000 4.166000 1.227000  5.727000 1.186000  -1.560000      1.707000  
1 1 1 40 18 16 o 2.585000 0.7858000 2.654000 1.096000  2.515000 1.126000  0.1387000      1.572000  
1 1 1 40 18 18 o 6.424000 0.6912000 6.397000 0.8731000 6.452000 1.072000  -0.5591000E-01 1.382000  
1 1 1 40 18 20 o 5.357000 0.7690000 5.651000 0.9751000 5.063000 1.189000  0.5875000      1.538000  
1 1 1 40 18 22 o 5.967000 0.7545000 5.442000 1.045000  6.492000 1.089000  -1.050000      1.509000  
1 1 1 40 18 24 o 8.240000 0.5567000 8.284000 0.7156000 8.195000 0.8531000 0.8900000E-01  1.113000  
1 1 1 40 18 26 o 8.399000 0.5579000 8.956000 0.7102000 7.843000 0.8605000 1.114000       1.116000  
1 1 1 40 18 28 o 3.622000 1.013000  3.491000 1.390000  3.753000 1.475000  -0.2620000     2.027000  
1 1 1 40 18 30 o 3.696000 1.527000  ?        ?         3.696000 1.527000  ?              ?         
1 1 1 40 19 1  o 3.865000 0.8804000 4.010000 1.237000  3.721000 1.254000  0.2887000      1.761000  
1 1 1 40 19 3  o 4.273000 0.8882000 4.527000 1.263000  4.019000 1.250000  0.5080000      1.776000  
1 1 1 40 19 5  o 3.804000 0.8749000 3.841000 1.298000  3.766000 1.173000  0.7486000E-01  1.750000  
1 1 1 40 19 7  o 15.63000 0.3795000 16.19000 0.4991000 15.07000 0.5718000 1.117000       0.7590000 
1 1 1 40 19 9  o 8.636000 0.5055000 8.911000 0.7005000 8.362000 0.7290000 0.5487000      1.011000  
1 1 1 40 19 11 o 4.960000 0.9186000 4.700000 1.414000  5.220000 1.173000  -0.5200000     1.837000  
1 1 1 40 19 13 o 7.912000 0.5072000 7.200000 0.7636000 8.624000 0.6679000 -1.424000      1.014000  
1 1 1 40 19 15 o 3.907000 0.8376000 4.811000 1.177000  3.003000 1.192000  1.808000       1.675000  
1 1 1 40 19 17 o 4.840000 0.7371000 6.704000 0.8512000 2.975000 1.203000  3.728000       1.474000  
1 1 1 40 19 19 o 3.089000 0.8507000 2.829000 1.133000  3.350000 1.269000  -0.5215000     1.701000  
1 1 1 40 19 21 o 2.949000 0.8370000 3.063000 1.151000  2.836000 1.216000  0.2276000      1.674000  
1 1 1 40 19 23 o 8.081000 0.5740000 8.228000 0.7013000 7.933000 0.9089000 0.2948000      1.148000  
1 1 1 40 19 25 o 5.272000 0.8580000 5.200000 1.148000  5.345000 1.275000  -0.1450000     1.716000  
1 1 1 40 19 27 o 6.224000 0.8703000 7.864000 1.013000  4.584000 1.416000  3.281000       1.741000  
1 1 1 40 19 29 o 4.203000 1.139000  5.070000 1.813000  3.337000 1.380000  1.733000       2.279000  
1 1 1 40 20 0  f 8.611000 0.6808000 8.611000 0.6808000 8.611000 0.6808000 0.000000       0.000000  
1 1 1 40 20 2  o 5.917000 0.7189000 5.629000 1.080000  6.206000 0.9494000 -0.5771000     1.438000  
1 1 1 40 20 4  o 5.391000 0.8053000 5.168000 1.226000  5.614000 1.045000  -0.4459000     1.611000  
1 1 1 40 20 6  o 5.209000 0.8275000 4.569000 1.255000  5.849000 1.079000  -1.280000      1.655000  
1 1 1 40 20 8  o 4.688000 0.9422000 3.739000 1.276000  5.637000 1.387000  -1.898000      1.884000  
1 1 1 40 20 10 o 8.573000 0.4760000 8.824000 0.6578000 8.322000 0.6883000 0.5013000      0.9521000 
1 1 1 40 20 12 o 5.384000 0.7278000 5.995000 0.9732000 4.773000 1.083000  1.222000       1.456000  
1 1 1 40 20 14 o 3.221000 0.8476000 3.201000 1.202000  3.241000 1.196000  -0.3957000E-01 1.695000  
1 1 1 40 20 16 o 3.210000 0.8437000 4.330000 1.369000  2.091000 0.9861000 2.238000       1.687000  
1 1 1 40 20 18 o 3.556000 0.9411000 3.128000 1.304000  3.985000 1.358000  -0.8576000     1.882000  
1 1 1 40 20 20 o 5.585000 0.7387000 5.143000 1.040000  6.028000 1.049000  -0.8849000     1.477000  
1 1 1 40 20 22 o 3.277000 0.8706000 2.784000 1.153000  3.770000 1.304000  -0.9859000     1.741000  
1 1 1 40 20 24 o 5.198000 0.9739000 4.325000 1.245000  6.071000 1.498000  -1.746000      1.948000  
1 1 1 40 20 26 o 3.557000 1.072000  3.936000 1.690000  3.177000 1.318000  0.7589000      2.143000  
1 1 1 40 20 28 o 3.845000 1.029000  3.646000 1.441000  4.043000 1.469000  -0.3973000     2.058000  
1 1 1 40 21 1  o 8.406000 0.5219000 8.566000 0.7770000 8.246000 0.6971000 0.3203000      1.044000  
1 1 1 40 21 3  o 6.107000 0.7479000 6.163000 1.150000  6.052000 0.9569000 0.1112000      1.496000  
1 1 1 40 21 5  o 4.830000 0.8799000 4.485000 1.319000  5.175000 1.165000  -0.6900000     1.760000  
1 1 1 40 21 7  o 2.731000 0.8250000 2.349000 1.037000  3.112000 1.283000  -0.7624000     1.650000  
1 1 1 40 21 9  o 4.486000 0.7965000 4.196000 1.197000  4.775000 1.051000  -0.5794000     1.593000  
1 1 1 40 21 11 o 6.558000 0.8253000 8.080000 1.195000  5.037000 1.139000  3.043000       1.651000  
1 1 1 40 21 13 o 5.927000 0.8058000 6.298000 1.092000  5.556000 1.185000  0.7417000      1.612000  
1 1 1 40 21 15 o 3.504000 0.8765000 3.245000 1.189000  3.764000 1.289000  -0.5192000     1.753000  
1 1 1 40 21 17 o 4.062000 0.8903000 4.638000 1.155000  3.486000 1.355000  1.153000       1.781000  
1 1 1 40 21 19 o 2.588000 0.7833000 2.684000 1.137000  2.492000 1.078000  0.1925000      1.567000  
1 1 1 40 21 21 o 4.429000 1.036000  5.187000 1.460000  3.672000 1.469000  1.515000       2.071000  
1 1 1 40 21 23 o 4.656000 1.107000  3.275000 1.482000  6.038000 1.646000  -2.763000      2.215000  
1 1 1 40 21 25 o 5.242000 1.258000  6.886000 2.078000  3.599000 1.420000  3.287000       2.517000  
1 1 1 40 21 27 o 3.002000 0.9235000 2.930000 1.290000  3.073000 1.322000  -0.1432000     1.847000  
1 1 1 40 22 0  o 3.763000 1.291000  3.763000 1.291000  3.763000 1.291000  0.000000       0.000000  
1 1 1 40 22 2  o 6.506000 0.7199000 6.754000 1.025000  6.258000 1.012000  0.4963000      1.440000  
1 1 1 40 22 4  o 3.096000 0.9075000 2.333000 1.084000  3.859000 1.456000  -1.527000      1.815000  
1 1 1 40 22 6  o 7.866000 0.5791000 8.189000 0.7269000 7.543000 0.9017000 0.6468000      1.158000  
1 1 1 40 22 8  o 10.67000 0.4825000 10.72000 0.5888000 10.62000 0.7645000 0.9376000E-01  0.9650000 
1 1 1 40 22 10 o 6.410000 0.7703000 7.467000 0.9030000 5.353000 1.248000  2.114000       1.541000  
1 1 1 40 22 12 o 8.523000 0.5462000 8.619000 0.7978000 8.427000 0.7461000 0.1929000      1.092000  
1 1 1 40 22 14 o 9.550000 0.4464000 10.08000 0.6099000 9.026000 0.6519000 1.049000       0.8927000 
1 1 1 40 22 16 o 5.306000 0.7364000 6.328000 0.8891000 4.283000 1.174000  2.046000       1.473000  
1 1 1 40 22 18 o 7.990000 0.8376000 8.708000 1.105000  7.272000 1.259000  1.436000       1.675000  
1 1 1 40 22 20 o 12.32000 0.5998000 12.89000 0.9354000 11.75000 0.7511000 1.133000       1.200000  
1 1 1 40 22 22 o 11.00000 0.7035000 11.68000 0.9998000 10.32000 0.9901000 1.361000       1.407000  
1 1 1 40 22 24 o 4.511000 1.037000  5.012000 1.437000  4.011000 1.496000  1.000000       2.074000  
1 1 1 40 22 26 o 2.919000 0.9054000 3.249000 1.371000  2.590000 1.183000  0.6590000      1.811000  
1 1 1 40 23 1  o 7.497000 0.5296000 7.934000 0.7240000 7.060000 0.7732000 0.8741000      1.059000  
1 1 1 40 23 3  o 6.659000 0.7428000 5.868000 1.137000  7.451000 0.9568000 -1.582000      1.486000  
1 1 1 40 23 5  o 11.49000 0.4551000 10.62000 0.6842000 12.36000 0.6002000 -1.733000      0.9102000 
1 1 1 40 23 7  f 8.875000 0.5685000 8.884000 0.8649000 8.866000 0.7382000 0.1833000E-01  1.137000  
1 1 1 40 23 9  o 8.629000 0.5204000 9.081000 0.6365000 8.176000 0.8235000 0.9051000      1.041000  
1 1 1 40 23 11 o 9.192000 0.4788000 9.977000 0.6734000 8.407000 0.6808000 1.570000       0.9576000 
1 1 1 40 23 13 o 3.007000 0.8658000 3.232000 1.315000  2.781000 1.127000  0.4505000      1.732000  
1 1 1 40 23 15 o 5.210000 0.9704000 5.193000 1.460000  5.227000 1.279000  -0.3431000E-01 1.941000  
1 1 1 40 23 17 o 5.324000 1.170000  5.091000 1.964000  5.557000 1.272000  -0.4657000     2.340000  
1 1 1 40 23 19 o 3.308000 0.9710000 2.945000 1.312000  3.671000 1.432000  -0.7262000     1.942000  
1 1 1 40 23 21 o 7.619000 0.8098000 8.660000 0.9920000 6.578000 1.280000  2.082000       1.620000  
1 1 1 40 23 23 o 3.961000 1.032000  4.626000 1.486000  3.297000 1.431000  1.329000       2.063000  
1 1 1 40 23 25 o 2.811000 0.8923000 3.160000 1.348000  2.462000 1.170000  0.6977000      1.785000  
1 1 1 40 24 0  o 5.746000 1.026000  5.746000 1.026000  5.746000 1.026000  0.000000       0.000000  
1 1 1 40 24 2  o 3.528000 0.8542000 4.206000 1.178000  2.850000 1.238000  1.356000       1.708000  
1 1 1 40 24 4  o 9.361000 0.4872000 8.700000 0.7453000 10.02000 0.6276000 -1.321000      0.9743000 
1 1 1 40 24 6  o 7.413000 0.5975000 7.511000 0.9093000 7.314000 0.7755000 0.1975000      1.195000  
1 1 1 40 24 8  o 9.647000 0.4881000 9.679000 0.7200000 9.616000 0.6593000 0.6290000E-01  0.9762000 
1 1 1 40 24 10 o 16.02000 0.3873000 16.06000 0.5337000 15.99000 0.5614000 0.7377000E-01  0.7746000 
1 1 1 40 24 12 o 8.321000 0.6205000 8.477000 1.068000  8.166000 0.6330000 0.3113000      1.241000  
1 1 1 40 24 14 o 3.802000 1.104000  3.940000 1.621000  3.664000 1.499000  0.2759000      2.208000  
1 1 1 40 24 16 o 3.204000 0.9511000 3.388000 1.412000  3.021000 1.275000  0.3674000      1.902000  
1 1 1 40 24 18 o 3.531000 1.010000  3.346000 1.407000  3.716000 1.449000  -0.3702000     2.020000  
1 1 1 40 24 20 o 5.706000 0.9660000 5.456000 1.369000  5.955000 1.363000  -0.4993000     1.932000  
1 1 1 40 24 22 f 4.149000 0.9658000 5.643000 1.479000  2.655000 1.242000  2.988000       1.932000  
1 1 1 40 24 24 o 3.582000 0.9964000 3.048000 1.329000  4.116000 1.485000  -1.068000      1.993000  
1 1 1 40 25 1  o 10.47000 0.5120000 11.12000 0.6357000 9.827000 0.8028000 1.296000       1.024000  
1 1 1 40 25 3  o 7.049000 0.8773000 5.385000 1.632000  8.713000 0.6446000 -3.328000      1.755000  
1 1 1 40 25 5  o 8.192000 0.8322000 7.118000 1.402000  9.265000 0.8974000 -2.147000      1.664000  
1 1 1 40 25 7  o 6.393000 0.6732000 7.119000 0.8550000 5.668000 1.040000  1.451000       1.346000  
1 1 1 40 25 9  o 2.538000 0.7863000 2.439000 1.124000  2.637000 1.100000  -0.1985000     1.573000  
1 1 1 40 25 11 o 3.437000 1.073000  2.860000 1.303000  4.015000 1.706000  -1.155000      2.146000  
1 1 1 40 25 13 o 3.529000 1.048000  3.729000 1.605000  3.329000 1.349000  0.4002000      2.096000  
1 1 1 40 25 15 o 3.241000 0.9502000 3.677000 1.409000  2.804000 1.275000  0.8737000      1.900000  
1 1 1 40 25 17 o 4.211000 1.007000  4.763000 1.466000  3.658000 1.380000  1.105000       2.014000  
1 1 1 40 25 19 o 4.975000 1.084000  5.859000 1.525000  4.090000 1.540000  1.769000       2.168000  
1 1 1 40 25 21 o 3.151000 0.9710000 3.242000 1.398000  3.060000 1.348000  0.1819000      1.942000  
1 1 1 40 25 23 o 2.883000 0.9044000 2.934000 1.291000  2.832000 1.267000  0.1026000      1.809000  
1 1 1 40 26 0  o 5.828000 1.244000  5.828000 1.244000  5.828000 1.244000  0.000000       0.000000  
1 1 1 40 26 2  o 3.563000 0.8361000 4.358000 1.215000  2.768000 1.149000  1.590000       1.672000  
1 1 1 40 26 4  o 3.436000 0.8633000 3.261000 1.205000  3.612000 1.237000  -0.3511000     1.727000  
1 1 1 40 26 6  o 5.760000 0.6859000 5.970000 0.9049000 5.550000 1.031000  0.4196000      1.372000  
1 1 1 40 26 8  o 6.175000 0.8491000 6.251000 1.098000  6.098000 1.295000  0.1530000      1.698000  
1 1 1 40 26 10 o 9.430000 0.6163000 9.655000 0.7780000 9.205000 0.9560000 0.4505000      1.233000  
1 1 1 40 26 12 o 8.375000 0.6913000 8.716000 0.9338000 8.034000 1.020000  0.6822000      1.383000  
1 1 1 40 26 14 o 8.761000 0.7773000 9.318000 1.137000  8.204000 1.061000  1.114000       1.555000  
1 1 1 40 26 16 o 3.941000 0.9129000 5.354000 1.394000  2.527000 1.179000  2.827000       1.826000  
1 1 1 40 26 18 o 4.676000 1.011000  3.435000 1.466000  5.916000 1.393000  -2.481000      2.023000  
1 1 1 40 26 20 o 3.794000 1.052000  3.679000 1.485000  3.909000 1.490000  -0.2301000     2.103000  
1 1 1 40 26 22 o 5.927000 1.246000  6.225000 2.020000  5.628000 1.461000  0.5964000      2.493000  
1 1 1 40 27 1  o 8.694000 0.5404000 8.595000 0.8091000 8.794000 0.7166000 -0.1987000     1.081000  
1 1 1 40 27 3  o 8.201000 0.5260000 7.183000 0.8374000 9.218000 0.6367000 -2.035000      1.052000  
1 1 1 40 27 5  o 10.50000 0.4577000 10.26000 0.7006000 10.74000 0.5892000 -0.4835000     0.9154000 
1 1 1 40 27 7  o 3.969000 0.8574000 5.678000 1.326000  2.260000 1.088000  3.418000       1.715000  
1 1 1 40 27 9  o 3.231000 0.9120000 3.644000 1.353000  2.818000 1.223000  0.8261000      1.824000  
1 1 1 40 27 11 o 4.628000 0.9933000 4.979000 1.475000  4.278000 1.331000  0.7002000      1.987000  
1 1 1 40 27 13 o 7.865000 0.6936000 8.155000 0.9401000 7.574000 1.020000  0.5807000      1.387000  
1 1 1 40 27 15 o 8.785000 0.7131000 10.16000 0.8070000 7.408000 1.176000  2.754000       1.426000  
1 1 1 40 27 17 o 2.516000 0.8301000 2.795000 1.272000  2.237000 1.067000  0.5579000      1.660000  
1 1 1 40 27 19 o 4.993000 1.030000  5.144000 1.416000  4.843000 1.495000  0.3008000      2.059000  
1 1 1 40 27 21 o 5.430000 2.093000  ?        ?         5.430000 2.093000  ?              ?         
1 1 1 40 28 0  o 2.916000 1.184000  2.916000 1.184000  2.916000 1.184000  0.000000       0.000000  
1 1 1 40 28 2  o 6.429000 0.7687000 4.987000 1.358000  7.871000 0.7205000 -2.884000      1.537000  
1 1 1 40 28 4  o 6.133000 1.028000  5.096000 1.706000  7.169000 1.148000  -2.073000      2.056000  
1 1 1 40 28 6  o 5.859000 0.8414000 6.171000 1.043000  5.547000 1.321000  0.6240000      1.683000  
1 1 1 40 28 8  o 5.672000 0.9236000 5.275000 1.343000  6.070000 1.268000  -0.7947000     1.847000  
1 1 1 40 28 10 o 4.364000 0.9692000 5.303000 1.378000  3.426000 1.363000  1.877000       1.938000  
1 1 1 40 28 12 o 4.604000 1.094000  4.046000 1.407000  5.163000 1.676000  -1.116000      2.188000  
1 1 1 40 28 14 o 2.756000 0.8722000 2.772000 1.248000  2.741000 1.219000  0.3169000E-01  1.744000  
1 1 1 40 28 16 o 3.297000 0.9729000 3.719000 1.472000  2.875000 1.273000  0.8448000      1.946000  
1 1 1 40 28 18 o 3.118000 0.9239000 3.598000 1.395000  2.637000 1.212000  0.9608000      1.848000  
1 1 1 40 29 1  o 3.892000 0.9446000 3.326000 1.237000  4.457000 1.428000  -1.131000      1.889000  
1 1 1 40 29 3  o 4.850000 1.096000  4.702000 1.712000  4.998000 1.369000  -0.2962000     2.192000  
1 1 1 40 29 5  f 5.210000 0.8968000 4.555000 1.427000  5.864000 1.087000  -1.309000      1.794000  
1 1 1 40 29 7  f 5.101000 0.9548000 5.649000 1.303000  4.554000 1.396000  1.095000       1.910000  
1 1 1 40 29 9  o 6.353000 0.8527000 7.653000 0.9317000 5.054000 1.429000  2.599000       1.705000  
1 1 1 40 29 11 o 5.892000 0.8939000 5.717000 1.292000  6.068000 1.236000  -0.3507000     1.788000  
1 1 1 40 29 13 f 4.281000 1.034000  4.341000 1.503000  4.220000 1.421000  0.1209000      2.069000  
1 1 1 40 29 15 o 4.163000 1.039000  3.437000 1.535000  4.888000 1.401000  -1.451000      2.078000  
1 1 1 40 29 17 o 3.878000 1.152000  4.286000 1.840000  3.470000 1.386000  0.8158000      2.303000  
1 1 1 40 30 0  o 4.378000 1.491000  4.378000 1.491000  4.378000 1.491000  0.000000       0.000000  
1 1 1 40 30 2  o 9.814000 0.5641000 9.780000 0.8417000 9.847000 0.7512000 -0.6687000E-01 1.128000  
1 1 1 40 30 4  o 8.180000 0.7396000 8.732000 1.150000  7.627000 0.9309000 1.104000       1.479000  
1 1 1 40 30 6  o 4.252000 0.8994000 5.613000 1.327000  2.891000 1.214000  2.722000       1.799000  
1 1 1 40 30 8  o 4.628000 0.9160000 5.772000 1.262000  3.485000 1.328000  2.287000       1.832000  
1 1 1 40 30 10 o 7.419000 0.7285000 8.068000 0.9242000 6.770000 1.126000  1.298000       1.457000  
1 1 1 40 30 12 o 10.26000 0.6036000 11.07000 0.7799000 9.449000 0.9214000 1.618000       1.207000  
1 1 1 40 30 14 o 5.740000 0.9491000 5.891000 1.295000  5.590000 1.388000  0.3013000      1.898000  
1 1 1 40 31 1  o 4.398000 1.251000  4.242000 1.764000  4.555000 1.773000  -0.3129000     2.501000  
1 1 1 40 31 3  o 5.153000 1.398000  3.706000 1.653000  6.600000 2.255000  -2.895000      2.796000  
1 1 1 40 31 5  o 4.126000 0.9838000 3.319000 1.381000  4.933000 1.401000  -1.615000      1.968000  
1 1 1 40 31 7  o 6.020000 0.8449000 5.817000 1.257000  6.223000 1.129000  -0.4060000     1.690000  
1 1 1 40 31 9  o 3.760000 1.004000  3.419000 1.343000  4.101000 1.493000  -0.6817000     2.008000  
1 1 1 40 31 11 o 3.963000 1.003000  4.061000 1.439000  3.865000 1.397000  0.1959000      2.005000  
1 1 1 40 32 0  o 5.237000 1.913000  5.237000 1.913000  5.237000 1.913000  0.000000       0.000000  
1 1 1 40 32 2  f 5.549000 1.230000  4.603000 1.656000  6.495000 1.819000  -1.891000      2.460000  
1 1 1 40 32 4  o 4.770000 1.292000  4.664000 1.731000  4.875000 1.917000  -0.2105000     2.583000  
1 1 1 40 32 6  o 10.75000 0.8708000 11.72000 1.033000  9.781000 1.402000  1.938000       1.742000  
1 1 1 40 32 8  o 7.217000 1.027000  8.285000 1.280000  6.148000 1.606000  2.137000       2.054000  
1 1 1 40 33 1  o 5.484000 1.292000  5.315000 1.775000  5.653000 1.877000  -0.3384000     2.583000  
1 1 1 40 33 3  o 4.303000 1.660000  4.303000 1.660000  ?        ?         ?              ?         
1 1 1 41 0  1  o 5.940000 0.9664000 5.940000 0.9664000 5.940000 0.9664000 0.000000       0.000000  
1 1 1 41 0  3  o 8.528000 0.7292000 8.528000 0.7292000 8.528000 0.7292000 0.000000       0.000000  
1 1 1 41 0  5  o 13.71000 0.5153000 13.71000 0.5153000 13.71000 0.5153000 0.000000       0.000000  
1 1 1 41 0  7  f 7.947000 1.024000  7.947000 1.024000  7.947000 1.024000  0.000000       0.000000  
1 1 1 41 0  9  o 25.08000 0.5393000 25.08000 0.5393000 25.08000 0.5393000 0.000000       0.000000  
1 1 1 41 0  11 o 9.142000 0.8592000 9.142000 0.8592000 9.142000 0.8592000 0.000000       0.000000  
1 1 1 41 0  13 o 10.02000 0.6874000 10.02000 0.6874000 10.02000 0.6874000 0.000000       0.000000  
1 1 1 41 0  15 o 4.661000 1.206000  4.661000 1.206000  4.661000 1.206000  0.000000       0.000000  
1 1 1 41 0  17 o 2.576000 1.126000  2.576000 1.126000  2.576000 1.126000  0.000000       0.000000  
1 1 1 41 0  19 o 5.913000 0.9677000 5.913000 0.9677000 5.913000 0.9677000 0.000000       0.000000  
1 1 1 41 0  21 o 8.172000 0.7317000 8.172000 0.7317000 8.172000 0.7317000 0.000000       0.000000  
1 1 1 41 0  23 o 3.381000 1.193000  3.381000 1.193000  3.381000 1.193000  0.000000       0.000000  
1 1 1 41 0  25 o 2.595000 1.129000  2.595000 1.129000  2.595000 1.129000  0.000000       0.000000  
1 1 1 41 0  27 o 4.045000 1.341000  4.045000 1.341000  4.045000 1.341000  0.000000       0.000000  
1 1 1 41 0  29 o 7.974000 0.8223000 7.974000 0.8223000 7.974000 0.8223000 0.000000       0.000000  
1 1 1 41 0  31 o 4.441000 1.373000  4.441000 1.373000  4.441000 1.373000  0.000000       0.000000  
1 1 1 41 0  33 o 11.48000 0.8059000 11.48000 0.8059000 11.48000 0.8059000 0.000000       0.000000  
1 1 1 41 1  0  o 5.971000 0.9767000 5.971000 0.9767000 5.971000 0.9767000 0.000000       0.000000  
1 1 1 41 1  2  o 10.79000 0.4104000 10.60000 0.5816000 10.98000 0.5793000 -0.3835000     0.8209000 
1 1 1 41 1  4  o 14.36000 0.3571000 14.13000 0.5111000 14.58000 0.4987000 -0.4567000     0.7141000 
1 1 1 41 1  6  o 4.989000 0.8847000 4.545000 1.361000  5.432000 1.130000  -0.8865000     1.769000  
1 1 1 41 1  8  o 6.853000 0.7684000 6.730000 1.017000  6.975000 1.152000  -0.2449000     1.537000  
1 1 1 41 1  10 o 4.684000 1.087000  4.664000 1.473000  4.704000 1.599000  -0.4009000E-01 2.174000  
1 1 1 41 1  12 o 12.18000 0.4139000 11.41000 0.5851000 12.95000 0.5857000 -1.540000      0.8279000 
1 1 1 41 1  14 o 5.090000 0.9552000 4.627000 1.392000  5.554000 1.308000  -0.9266000     1.910000  
1 1 1 41 1  16 o 2.600000 0.7987000 2.789000 1.172000  2.410000 1.085000  0.3795000      1.597000  
1 1 1 41 1  18 o 10.33000 0.4285000 10.56000 0.5949000 10.10000 0.6168000 0.4614000      0.8570000 
1 1 1 41 1  20 o 3.303000 0.8642000 3.100000 1.195000  3.506000 1.249000  -0.4062000     1.728000  
1 1 1 41 1  22 o 3.847000 0.8627000 4.253000 1.236000  3.440000 1.204000  0.8130000      1.725000  
1 1 1 41 1  24 o 3.573000 0.8694000 3.330000 1.209000  3.816000 1.250000  -0.4863000     1.739000  
1 1 1 41 1  26 o 2.855000 0.8223000 3.226000 1.222000  2.485000 1.101000  0.7419000      1.645000  
1 1 1 41 1  28 o 5.058000 0.9191000 4.802000 1.298000  5.314000 1.301000  -0.5113000     1.838000  
1 1 1 41 1  30 o 3.781000 0.9681000 3.384000 1.332000  4.178000 1.405000  -0.7941000     1.936000  
1 1 1 41 1  32 f 4.217000 0.9278000 3.487000 1.339000  4.947000 1.284000  -1.460000      1.856000  
1 1 1 41 2  1  o 9.850000 0.4495000 9.706000 0.6444000 9.995000 0.6269000 -0.2894000     0.8990000 
1 1 1 41 2  3  o 3.765000 0.9236000 3.838000 1.349000  3.692000 1.262000  0.1454000      1.847000  
1 1 1 41 2  5  o 3.068000 0.8321000 2.385000 1.097000  3.751000 1.252000  -1.366000      1.664000  
1 1 1 41 2  7  o 5.171000 0.8124000 4.396000 1.185000  5.945000 1.112000  -1.548000      1.625000  
1 1 1 41 2  9  o 7.583000 0.6287000 8.831000 0.7874000 6.336000 0.9804000 2.495000       1.257000  
1 1 1 41 2  11 o 7.388000 0.5638000 7.022000 0.8242000 7.754000 0.7696000 -0.7313000     1.128000  
1 1 1 41 2  13 o 8.419000 0.5089000 9.217000 0.6446000 7.620000 0.7875000 1.597000       1.018000  
1 1 1 41 2  15 o 7.045000 0.7496000 5.641000 1.330000  8.449000 0.6908000 -2.808000      1.499000  
1 1 1 41 2  17 o 3.096000 0.8378000 2.855000 1.175000  3.338000 1.194000  -0.4825000     1.676000  
1 1 1 41 2  19 o 10.44000 0.4243000 10.41000 0.6032000 10.48000 0.5967000 -0.7022000E-01 0.8485000 
1 1 1 41 2  21 o 7.120000 0.5865000 6.698000 0.8797000 7.542000 0.7758000 -0.8439000     1.173000  
1 1 1 41 2  23 o 3.921000 0.8823000 3.743000 1.279000  4.099000 1.216000  -0.3556000     1.765000  
1 1 1 41 2  25 o 4.231000 0.9020000 4.167000 1.254000  4.295000 1.297000  -0.1282000     1.804000  
1 1 1 41 2  27 f 5.668000 0.8390000 5.398000 1.123000  5.939000 1.247000  -0.5402000     1.678000  
1 1 1 41 2  29 o 7.090000 0.8325000 7.704000 0.8606000 6.477000 1.425000  1.227000       1.665000  
1 1 1 41 2  31 o 7.180000 0.6875000 6.364000 1.110000  7.996000 0.8122000 -1.631000      1.375000  
1 1 1 41 2  33 o 2.998000 0.8852000 2.991000 1.246000  3.005000 1.258000  -0.1406000E-01 1.770000  
1 1 1 41 3  0  o 2.260000 1.037000  2.260000 1.037000  2.260000 1.037000  0.000000       0.000000  
1 1 1 41 3  2  o 10.08000 0.4742000 9.844000 0.7125000 10.31000 0.6258000 -0.4638000     0.9483000 
1 1 1 41 3  4  o 11.62000 0.4025000 11.11000 0.5787000 12.13000 0.5595000 -1.019000      0.8050000 
1 1 1 41 3  6  o 10.24000 0.5588000 9.909000 0.9187000 10.57000 0.6362000 -0.6650000     1.118000  
1 1 1 41 3  8  f 4.026000 0.8899000 4.432000 1.245000  3.621000 1.271000  0.8103000      1.780000  
1 1 1 41 3  10 o 9.855000 0.6839000 9.132000 1.209000  10.58000 0.6393000 -1.447000      1.368000  
1 1 1 41 3  12 o 16.43000 0.3935000 16.56000 0.4839000 16.29000 0.6208000 0.2724000      0.7871000 
1 1 1 41 3  14 o 17.36000 0.3319000 16.85000 0.4791000 17.88000 0.4594000 -1.036000      0.6638000 
1 1 1 41 3  16 o 12.85000 0.4064000 11.89000 0.6327000 13.80000 0.5101000 -1.911000      0.8127000 
1 1 1 41 3  18 o 7.090000 0.6360000 7.182000 0.7762000 6.997000 1.008000  0.1852000      1.272000  
1 1 1 41 3  20 o 9.080000 0.4725000 9.040000 0.6992000 9.120000 0.6359000 -0.8032000E-01 0.9451000 
1 1 1 41 3  22 o 4.330000 0.8733000 4.349000 1.242000  4.311000 1.228000  0.3796000E-01  1.747000  
1 1 1 41 3  24 f 3.438000 0.9311000 2.988000 1.198000  3.888000 1.426000  -0.8999000     1.862000  
1 1 1 41 3  26 o 2.759000 0.8552000 2.685000 1.185000  2.833000 1.233000  -0.1473000     1.710000  
1 1 1 41 3  28 o 2.972000 0.8830000 2.895000 1.186000  3.050000 1.308000  -0.1549000     1.766000  
1 1 1 41 3  30 o 4.365000 0.8659000 5.632000 1.197000  3.098000 1.252000  2.534000       1.732000  
1 1 1 41 3  32 o 7.757000 0.7159000 8.602000 1.037000  6.912000 0.9872000 1.690000       1.432000  
1 1 1 41 4  1  o 4.698000 0.9152000 4.593000 1.325000  4.803000 1.262000  -0.2101000     1.830000  
1 1 1 41 4  3  o 9.604000 0.5272000 10.37000 0.7390000 8.841000 0.7520000 1.524000       1.054000  
1 1 1 41 4  5  o 19.62000 0.3187000 19.74000 0.4473000 19.50000 0.4541000 0.2343000      0.6374000 
1 1 1 41 4  7  o 3.033000 0.8844000 3.016000 1.224000  3.050000 1.276000  -0.3368000E-01 1.769000  
1 1 1 41 4  9  o 10.11000 0.4986000 9.872000 0.6901000 10.36000 0.7197000 -0.4846000     0.9971000 
1 1 1 41 4  11 o 4.281000 0.8486000 4.631000 1.150000  3.932000 1.248000  0.6985000      1.697000  
1 1 1 41 4  13 o 3.020000 0.8275000 3.441000 1.228000  2.600000 1.109000  0.8414000      1.655000  
1 1 1 41 4  15 o 5.664000 0.7461000 5.482000 1.117000  5.846000 0.9898000 -0.3638000     1.492000  
1 1 1 41 4  17 o 2.640000 0.7867000 2.818000 1.151000  2.461000 1.072000  0.3571000      1.573000  
1 1 1 41 4  19 o 2.970000 0.8835000 3.051000 1.250000  2.888000 1.249000  0.1630000      1.767000  
1 1 1 41 4  21 o 5.582000 0.8230000 4.893000 1.209000  6.271000 1.117000  -1.378000      1.646000  
1 1 1 41 4  23 o 3.223000 0.9107000 2.999000 1.175000  3.448000 1.392000  -0.4484000     1.821000  
1 1 1 41 4  25 o 3.641000 0.9282000 3.855000 1.353000  3.428000 1.271000  0.4276000      1.856000  
1 1 1 41 4  27 o 4.140000 0.8909000 3.445000 1.274000  4.834000 1.246000  -1.389000      1.782000  
1 1 1 41 4  29 o 5.680000 0.8953000 6.167000 1.248000  5.193000 1.284000  0.9736000      1.791000  
1 1 1 41 4  31 o 4.769000 1.079000  4.949000 1.736000  4.588000 1.280000  0.3617000      2.157000  
1 1 1 41 4  33 o 5.264000 1.046000  5.845000 1.581000  4.684000 1.370000  1.161000       2.092000  
1 1 1 41 5  0  o 2.681000 1.228000  2.681000 1.228000  2.681000 1.228000  0.000000       0.000000  
1 1 1 41 5  2  o 11.61000 0.4223000 11.71000 0.5525000 11.52000 0.6387000 0.1896000      0.8445000 
1 1 1 41 5  4  o 7.260000 0.6288000 7.187000 0.7900000 7.332000 0.9785000 -0.1445000     1.258000  
1 1 1 41 5  6  o 7.849000 0.7278000 7.165000 0.9603000 8.532000 1.094000  -1.367000      1.456000  
1 1 1 41 5  8  f 10.28000 0.4938000 10.01000 0.6836000 10.56000 0.7127000 -0.5560000     0.9875000 
1 1 1 41 5  10 o 4.799000 0.7921000 4.977000 1.087000  4.621000 1.152000  0.3557000      1.584000  
1 1 1 41 5  12 o 7.414000 0.7363000 8.538000 0.7074000 6.289000 1.292000  2.249000       1.473000  
1 1 1 41 5  14 o 9.531000 0.4963000 10.19000 0.6074000 8.873000 0.7851000 1.314000       0.9927000 
1 1 1 41 5  16 o 8.456000 0.5478000 9.025000 0.6560000 7.887000 0.8774000 1.138000       1.096000  
1 1 1 41 5  18 o 15.77000 0.3836000 14.98000 0.5093000 16.56000 0.5737000 -1.582000      0.7672000 
1 1 1 41 5  20 o 9.199000 0.5035000 8.593000 0.6840000 9.806000 0.7389000 -1.214000      1.007000  
1 1 1 41 5  22 o 5.031000 0.8212000 5.098000 1.155000  4.965000 1.168000  0.1336000      1.642000  
1 1 1 41 5  24 o 11.20000 0.5434000 11.45000 0.7778000 10.94000 0.7590000 0.5073000      1.087000  
1 1 1 41 5  26 o 3.384000 0.8383000 4.258000 1.241000  2.509000 1.127000  1.749000       1.677000  
1 1 1 41 5  28 o 3.457000 0.9551000 3.721000 1.418000  3.194000 1.280000  0.5277000      1.910000  
1 1 1 41 5  30 o 3.766000 0.9442000 3.746000 1.321000  3.786000 1.350000  -0.3947000E-01 1.888000  
1 1 1 41 5  32 o 2.687000 0.8224000 2.351000 1.094000  3.024000 1.228000  -0.6722000     1.645000  
1 1 1 41 6  1  o 28.74000 0.3435000 28.33000 0.4411000 29.14000 0.5266000 -0.8050000     0.6869000 
1 1 1 41 6  3  o 19.13000 0.3655000 19.60000 0.5056000 18.67000 0.5280000 0.9301000      0.7310000 
1 1 1 41 6  5  o 12.60000 0.4028000 12.28000 0.5490000 12.91000 0.5896000 -0.6305000     0.8057000 
1 1 1 41 6  7  o 9.625000 0.5351000 9.042000 0.7007000 10.21000 0.8088000 -1.166000      1.070000  
1 1 1 41 6  9  o 6.580000 0.9274000 6.479000 0.9546000 6.682000 1.590000  -0.2035000     1.855000  
1 1 1 41 6  11 f 14.92000 0.4977000 14.71000 0.4853000 15.13000 0.8692000 -0.4219000     0.9955000 
1 1 1 41 6  13 o 6.441000 1.039000  8.699000 0.7254000 4.183000 1.948000  4.516000       2.078000  
1 1 1 41 6  15 o 7.215000 0.6118000 7.905000 0.7587000 6.525000 0.9601000 1.380000       1.224000  
1 1 1 41 6  17 o 9.601000 0.5029000 9.390000 0.7049000 9.812000 0.7175000 -0.4222000     1.006000  
1 1 1 41 6  19 o 5.007000 0.8850000 5.025000 1.156000  4.988000 1.340000  0.3743000E-01  1.770000  
1 1 1 41 6  21 o 7.938000 0.5708000 7.802000 0.7560000 8.075000 0.8552000 -0.2723000     1.142000  
1 1 1 41 6  23 o 5.432000 0.9074000 6.950000 1.150000  3.914000 1.404000  3.036000       1.815000  
1 1 1 41 6  25 o 9.108000 0.5769000 8.114000 0.9400000 10.10000 0.6690000 -1.989000      1.154000  
1 1 1 41 6  27 o 3.833000 0.9469000 3.607000 1.285000  4.060000 1.391000  -0.4529000     1.894000  
1 1 1 41 6  29 o 7.674000 0.6257000 7.583000 0.8999000 7.765000 0.8696000 -0.1823000     1.251000  
1 1 1 41 6  31 o 5.735000 0.8287000 6.000000 1.149000  5.469000 1.195000  0.5310000      1.657000  
1 1 1 41 6  33 o 3.314000 1.515000  ?        ?         3.314000 1.515000  ?              ?         
1 1 1 41 7  0  o 9.868000 0.7368000 9.868000 0.7368000 9.868000 0.7368000 0.000000       0.000000  
1 1 1 41 7  2  o 6.011000 0.7577000 5.366000 1.145000  6.657000 0.9925000 -1.291000      1.515000  
1 1 1 41 7  4  f 5.762000 0.7535000 6.009000 0.9565000 5.516000 1.165000  0.4932000      1.507000  
1 1 1 41 7  6  o 16.45000 0.3930000 15.75000 0.5741000 17.16000 0.5369000 -1.406000      0.7860000 
1 1 1 41 7  8  o 8.055000 0.5886000 6.945000 0.9003000 9.166000 0.7585000 -2.221000      1.177000  
1 1 1 41 7  10 o 3.803000 0.8248000 4.047000 1.132000  3.559000 1.200000  0.4880000      1.650000  
1 1 1 41 7  12 f 9.633000 0.4868000 10.23000 0.6028000 9.030000 0.7646000 1.204000       0.9736000 
1 1 1 41 7  14 o 5.444000 0.8276000 6.280000 0.9239000 4.609000 1.373000  1.670000       1.655000  
1 1 1 41 7  16 o 3.100000 0.8327000 3.702000 1.255000  2.498000 1.095000  1.204000       1.665000  
1 1 1 41 7  18 o 12.66000 0.3924000 12.18000 0.6021000 13.15000 0.5033000 -0.9745000     0.7848000 
1 1 1 41 7  20 o 5.987000 0.7678000 5.169000 1.311000  6.805000 0.8003000 -1.636000      1.536000  
1 1 1 41 7  22 o 11.12000 0.5383000 11.64000 0.7739000 10.60000 0.7485000 1.045000       1.077000  
1 1 1 41 7  24 o 3.822000 0.9728000 3.634000 1.351000  4.009000 1.400000  -0.3750000     1.946000  
1 1 1 41 7  26 o 4.946000 1.022000  5.022000 1.209000  4.870000 1.648000  0.1513000      2.044000  
1 1 1 41 7  28 o 2.740000 0.8356000 2.896000 1.209000  2.584000 1.154000  0.3124000      1.671000  
1 1 1 41 7  30 o 9.694000 0.5362000 10.43000 0.6712000 8.953000 0.8365000 1.482000       1.072000  
1 1 1 41 7  32 o 5.771000 0.8142000 6.148000 1.106000  5.394000 1.195000  0.7535000      1.628000  
1 1 1 41 8  1  o 11.91000 0.4149000 12.06000 0.5938000 11.76000 0.5796000 0.2968000      0.8298000 
1 1 1 41 8  3  o 7.373000 0.6546000 7.846000 0.7936000 6.899000 1.041000  0.9472000      1.309000  
1 1 1 41 8  5  o 7.787000 0.6792000 8.523000 0.9334000 7.050000 0.9868000 1.473000       1.358000  
1 1 1 41 8  7  o 7.437000 0.7020000 7.622000 0.9410000 7.252000 1.042000  0.3702000      1.404000  
1 1 1 41 8  9  o 4.655000 0.8430000 4.531000 1.168000  4.779000 1.216000  -0.2481000     1.686000  
1 1 1 41 8  11 o 10.98000 0.4152000 10.62000 0.5626000 11.33000 0.6107000 -0.7182000     0.8304000 
1 1 1 41 8  13 o 5.270000 0.7031000 5.689000 0.8522000 4.851000 1.118000  0.8377000      1.406000  
1 1 1 41 8  15 o 10.09000 0.5304000 11.22000 0.6634000 8.958000 0.8277000 2.259000       1.061000  
1 1 1 41 8  17 o 3.484000 0.8924000 3.400000 1.324000  3.568000 1.197000  -0.1680000     1.785000  
1 1 1 41 8  19 o 3.857000 0.8912000 3.148000 1.342000  4.567000 1.173000  -1.419000      1.782000  
1 1 1 41 8  21 o 3.049000 0.8354000 3.436000 1.254000  2.661000 1.104000  0.7746000      1.671000  
1 1 1 41 8  23 o 5.163000 0.8230000 4.763000 1.202000  5.563000 1.124000  -0.8004000     1.646000  
1 1 1 41 8  25 o 4.905000 0.9217000 5.131000 1.196000  4.680000 1.403000  0.4515000      1.843000  
1 1 1 41 8  27 o 6.421000 0.8092000 5.664000 1.140000  7.179000 1.149000  -1.515000      1.618000  
1 1 1 41 8  29 o 6.555000 0.8675000 7.074000 0.9961000 6.036000 1.421000  1.038000       1.735000  
1 1 1 41 8  31 o 4.495000 0.9174000 4.688000 1.213000  4.302000 1.376000  0.3868000      1.835000  
1 1 1 41 9  0  o 6.542000 0.8883000 6.542000 0.8883000 6.542000 0.8883000 0.000000       0.000000  
1 1 1 41 9  2  o 21.30000 0.3359000 20.93000 0.4413000 21.67000 0.5065000 -0.7402000     0.6718000 
1 1 1 41 9  4  o 13.11000 0.3589000 12.84000 0.5221000 13.38000 0.4926000 -0.5368000     0.7178000 
1 1 1 41 9  6  o 11.30000 0.4573000 11.14000 0.6799000 11.47000 0.6117000 -0.3333000     0.9146000 
1 1 1 41 9  8  f 14.02000 0.4055000 13.81000 0.6205000 14.23000 0.5224000 -0.4233000     0.8111000 
1 1 1 41 9  10 o 9.415000 0.6086000 9.838000 0.8937000 8.992000 0.8263000 0.8464000      1.217000  
1 1 1 41 9  12 o 3.345000 0.9400000 3.313000 1.385000  3.376000 1.271000  -0.6271000E-01 1.880000  
1 1 1 41 9  14 f 5.487000 0.9184000 5.746000 1.456000  5.228000 1.120000  0.5177000      1.837000  
1 1 1 41 9  16 f 6.425000 0.7209000 7.044000 0.9371000 5.805000 1.096000  1.239000       1.442000  
1 1 1 41 9  18 o 4.385000 0.8334000 3.436000 1.343000  5.333000 0.9872000 -1.897000      1.667000  
1 1 1 41 9  20 o 3.945000 1.013000  4.067000 1.622000  3.822000 1.213000  0.2447000      2.025000  
1 1 1 41 9  22 o 6.951000 0.7641000 6.520000 1.235000  7.382000 0.8995000 -0.8626000     1.528000  
1 1 1 41 9  24 o 7.936000 0.6258000 7.597000 0.8566000 8.275000 0.9124000 -0.6776000     1.252000  
1 1 1 41 9  26 o 3.801000 0.8471000 2.711000 1.183000  4.891000 1.213000  -2.180000      1.694000  
1 1 1 41 9  28 o 8.835000 0.5953000 8.094000 0.7969000 9.576000 0.8846000 -1.482000      1.191000  
1 1 1 41 9  30 o 3.389000 0.8999000 3.515000 1.337000  3.263000 1.205000  0.2522000      1.800000  
1 1 1 41 9  32 o 3.803000 1.654000  ?        ?         3.803000 1.654000  ?              ?         
1 1 1 41 10 1  o 4.698000 0.8139000 4.575000 1.097000  4.821000 1.202000  -0.2457000     1.628000  
1 1 1 41 10 3  o 6.977000 0.6091000 7.736000 0.7763000 6.219000 0.9389000 1.517000       1.218000  
1 1 1 41 10 5  o 4.583000 0.8705000 4.381000 1.289000  4.785000 1.170000  -0.4040000     1.741000  
1 1 1 41 10 7  o 4.212000 0.9698000 3.902000 1.482000  4.523000 1.252000  -0.6204000     1.940000  
1 1 1 41 10 9  o 5.731000 0.7943000 4.980000 1.287000  6.481000 0.9307000 -1.501000      1.589000  
1 1 1 41 10 11 o 5.221000 0.8388000 4.969000 1.240000  5.472000 1.131000  -0.5036000     1.678000  
1 1 1 41 10 13 o 2.634000 0.8140000 2.454000 1.113000  2.813000 1.188000  -0.3582000     1.628000  
1 1 1 41 10 15 o 3.946000 0.8697000 3.951000 1.145000  3.941000 1.309000  0.9942000E-02  1.739000  
1 1 1 41 10 17 o 6.363000 0.6747000 6.705000 0.8867000 6.021000 1.017000  0.6840000      1.349000  
1 1 1 41 10 19 o 5.181000 0.8365000 4.771000 1.309000  5.591000 1.042000  -0.8195000     1.673000  
1 1 1 41 10 21 o 7.980000 0.5292000 7.834000 0.7571000 8.126000 0.7398000 -0.2922000     1.058000  
1 1 1 41 10 23 o 3.724000 0.9025000 2.895000 1.148000  4.553000 1.393000  -1.658000      1.805000  
1 1 1 41 10 25 o 3.616000 0.9180000 3.274000 1.341000  3.959000 1.254000  -0.6851000     1.836000  
1 1 1 41 10 27 o 3.821000 0.9522000 3.358000 1.393000  4.284000 1.298000  -0.9260000     1.904000  
1 1 1 41 10 29 o 4.279000 1.001000  4.764000 1.521000  3.795000 1.303000  0.9691000      2.003000  
1 1 1 41 10 31 o 4.170000 0.9672000 4.048000 1.372000  4.292000 1.363000  -0.2437000     1.934000  
1 1 1 41 11 0  f 3.729000 1.170000  3.729000 1.170000  3.729000 1.170000  0.000000       0.000000  
1 1 1 41 11 2  o 14.92000 0.3712000 14.01000 0.5821000 15.84000 0.4606000 -1.824000      0.7423000 
1 1 1 41 11 4  o 8.774000 0.4675000 9.375000 0.6507000 8.174000 0.6716000 1.201000       0.9351000 
1 1 1 41 11 6  o 5.811000 0.8098000 6.987000 1.085000  4.635000 1.202000  2.352000       1.620000  
1 1 1 41 11 8  o 4.756000 0.7608000 3.349000 1.187000  6.162000 0.9516000 -2.813000      1.522000  
1 1 1 41 11 10 f 3.468000 0.8508000 4.036000 1.205000  2.901000 1.201000  1.135000       1.702000  
1 1 1 41 11 12 o 8.775000 0.5068000 9.164000 0.6402000 8.386000 0.7858000 0.7779000      1.014000  
1 1 1 41 11 14 o 6.342000 0.6801000 6.910000 0.8122000 5.774000 1.091000  1.137000       1.360000  
1 1 1 41 11 16 o 4.737000 0.7977000 3.458000 1.185000  6.016000 1.069000  -2.558000      1.595000  
1 1 1 41 11 18 f 3.688000 0.8901000 3.139000 1.294000  4.236000 1.222000  -1.097000      1.780000  
1 1 1 41 11 20 o 5.836000 0.7731000 6.733000 1.060000  4.939000 1.125000  1.794000       1.546000  
1 1 1 41 11 22 o 3.934000 0.9002000 4.063000 1.223000  3.805000 1.321000  0.2581000      1.800000  
1 1 1 41 11 24 o 2.984000 0.8537000 3.194000 1.231000  2.773000 1.183000  0.4201000      1.707000  
1 1 1 41 11 26 o 6.090000 0.7234000 6.368000 0.9904000 5.811000 1.055000  0.5577000      1.447000  
1 1 1 41 11 28 o 7.025000 0.7950000 5.872000 1.378000  8.179000 0.7937000 -2.307000      1.590000  
1 1 1 41 11 30 o 3.889000 1.075000  4.278000 1.732000  3.500000 1.275000  0.7782000      2.151000  
1 1 1 41 12 1  o 12.38000 0.3664000 11.90000 0.5305000 12.86000 0.5056000 -0.9646000     0.7328000 
1 1 1 41 12 3  o 4.203000 0.9648000 3.913000 1.515000  4.493000 1.195000  -0.5800000     1.930000  
1 1 1 41 12 5  o 13.08000 0.5263000 12.33000 0.9115000 13.83000 0.5265000 -1.499000      1.053000  
1 1 1 41 12 7  f 12.56000 0.4256000 12.93000 0.6234000 12.20000 0.5796000 0.7288000      0.8512000 
1 1 1 41 12 9  o 20.05000 0.3396000 20.84000 0.4996000 19.26000 0.4600000 1.579000       0.6791000 
1 1 1 41 12 11 o 17.06000 0.3193000 17.14000 0.4504000 16.98000 0.4526000 0.1575000      0.6385000 
1 1 1 41 12 13 o 11.96000 0.4073000 12.57000 0.5252000 11.36000 0.6226000 1.207000       0.8146000 
1 1 1 41 12 15 o 6.651000 0.6284000 6.387000 0.8594000 6.915000 0.9171000 -0.5283000     1.257000  
1 1 1 41 12 17 o 7.171000 0.6217000 7.597000 0.8767000 6.745000 0.8818000 0.8523000      1.243000  
1 1 1 41 12 19 f 2.563000 0.7823000 2.847000 1.165000  2.279000 1.045000  0.5679000      1.565000  
1 1 1 41 12 21 o 4.971000 0.9528000 5.347000 1.247000  4.594000 1.441000  0.7529000      1.906000  
1 1 1 41 12 23 o 4.116000 0.8991000 4.594000 1.252000  3.637000 1.290000  0.9568000      1.798000  
1 1 1 41 12 25 o 5.503000 0.7632000 4.597000 1.208000  6.409000 0.9331000 -1.812000      1.526000  
1 1 1 41 12 27 o 3.833000 0.9125000 4.017000 1.309000  3.649000 1.272000  0.3684000      1.825000  
1 1 1 41 12 29 o 4.216000 0.8329000 2.855000 1.222000  5.576000 1.132000  -2.721000      1.666000  
1 1 1 41 12 31 o 3.014000 1.418000  ?        ?         3.014000 1.418000  ?              ?         
1 1 1 41 13 0  o 2.457000 1.091000  2.457000 1.091000  2.457000 1.091000  0.000000       0.000000  
1 1 1 41 13 2  o 11.64000 0.4357000 11.60000 0.6729000 11.68000 0.5537000 -0.8731000E-01 0.8714000 
1 1 1 41 13 4  o 9.424000 0.4864000 9.768000 0.7195000 9.080000 0.6546000 0.6887000      0.9727000 
1 1 1 41 13 6  o 9.440000 0.4660000 8.780000 0.6941000 10.10000 0.6220000 -1.319000      0.9320000 
1 1 1 41 13 8  f 15.21000 0.4080000 15.05000 0.6444000 15.36000 0.5006000 -0.3115000     0.8161000 
1 1 1 41 13 10 o 6.678000 0.6119000 6.514000 0.8681000 6.843000 0.8627000 -0.3290000     1.224000  
1 1 1 41 13 12 o 8.735000 0.4932000 9.479000 0.6385000 7.992000 0.7518000 1.487000       0.9863000 
1 1 1 41 13 14 o 4.856000 0.7705000 4.726000 1.095000  4.985000 1.084000  -0.2587000     1.541000  
1 1 1 41 13 16 o 5.021000 0.8277000 4.238000 1.235000  5.804000 1.102000  -1.566000      1.655000  
1 1 1 41 13 18 o 4.115000 0.8494000 4.909000 1.101000  3.321000 1.294000  1.588000       1.699000  
1 1 1 41 13 20 f 4.980000 0.8542000 5.245000 1.120000  4.716000 1.290000  0.5297000      1.708000  
1 1 1 41 13 22 o 6.782000 0.6449000 7.390000 0.7931000 6.174000 1.017000  1.216000       1.290000  
1 1 1 41 13 24 o 2.923000 0.8504000 3.271000 1.261000  2.575000 1.142000  0.6964000      1.701000  
1 1 1 41 13 26 o 2.898000 0.8510000 2.394000 1.105000  3.401000 1.295000  -1.007000      1.702000  
1 1 1 41 13 28 o 3.211000 0.8769000 3.610000 1.308000  2.812000 1.168000  0.7988000      1.754000  
1 1 1 41 13 30 o 2.940000 0.8912000 3.050000 1.339000  2.830000 1.176000  0.2202000      1.782000  
1 1 1 41 14 1  o 13.16000 0.3859000 12.93000 0.5918000 13.39000 0.4954000 -0.4606000     0.7718000 
1 1 1 41 14 3  o 9.567000 0.4566000 9.914000 0.6025000 9.221000 0.6862000 0.6924000      0.9132000 
1 1 1 41 14 5  o 7.770000 0.6059000 7.370000 0.9711000 8.169000 0.7249000 -0.7983000     1.212000  
1 1 1 41 14 7  o 3.421000 0.9003000 3.230000 1.271000  3.611000 1.276000  -0.3801000     1.801000  
1 1 1 41 14 9  o 9.638000 0.4456000 9.795000 0.6103000 9.481000 0.6496000 0.3140000      0.8913000 
1 1 1 41 14 11 o 9.750000 0.4435000 9.910000 0.6130000 9.589000 0.6411000 0.3212000      0.8871000 
1 1 1 41 14 13 o 5.928000 0.6892000 5.410000 0.9723000 6.447000 0.9769000 -1.037000      1.378000  
1 1 1 41 14 15 o 10.45000 0.4403000 10.81000 0.5998000 10.10000 0.6447000 0.7158000      0.8806000 
1 1 1 41 14 17 o 11.45000 0.4021000 11.02000 0.5516000 11.87000 0.5851000 -0.8507000     0.8041000 
1 1 1 41 14 19 o 3.167000 0.8773000 3.373000 1.191000  2.961000 1.289000  0.4116000      1.755000  
1 1 1 41 14 21 o 13.97000 0.4032000 13.12000 0.5202000 14.81000 0.6163000 -1.690000      0.8065000 
1 1 1 41 14 23 o 9.737000 0.4674000 10.00000 0.6313000 9.472000 0.6893000 0.5308000      0.9348000 
1 1 1 41 14 25 o 2.642000 0.7964000 2.468000 1.101000  2.815000 1.151000  -0.3465000     1.593000  
1 1 1 41 14 27 o 2.580000 0.8078000 2.991000 1.259000  2.168000 1.012000  0.8224000      1.616000  
1 1 1 41 14 29 o 7.117000 0.7556000 8.666000 0.9392000 5.569000 1.184000  3.097000       1.511000  
1 1 1 41 15 0  o 3.246000 1.215000  3.246000 1.215000  3.246000 1.215000  0.000000       0.000000  
1 1 1 41 15 2  o 4.954000 0.8568000 3.620000 1.286000  6.289000 1.133000  -2.670000      1.714000  
1 1 1 41 15 4  o 4.159000 0.8761000 3.825000 1.319000  4.493000 1.154000  -0.6675000     1.752000  
1 1 1 41 15 6  o 6.367000 0.7240000 5.648000 1.117000  7.086000 0.9216000 -1.439000      1.448000  
1 1 1 41 15 8  o 3.711000 0.8762000 4.005000 1.212000  3.416000 1.265000  0.5891000      1.752000  
1 1 1 41 15 10 o 16.27000 0.3382000 16.21000 0.4727000 16.34000 0.4838000 -0.1282000     0.6764000 
1 1 1 41 15 12 o 9.997000 0.4082000 9.274000 0.5748000 10.72000 0.5797000 -1.446000      0.8163000 
1 1 1 41 15 14 o 6.583000 0.6610000 6.233000 0.9577000 6.932000 0.9113000 -0.6989000     1.322000  
1 1 1 41 15 16 o 7.206000 0.5797000 7.835000 0.7486000 6.577000 0.8854000 1.259000       1.159000  
1 1 1 41 15 18 o 6.170000 0.6831000 7.118000 0.7798000 5.222000 1.122000  1.896000       1.366000  
1 1 1 41 15 20 o 6.321000 0.7196000 8.015000 0.7360000 4.628000 1.237000  3.386000       1.439000  
1 1 1 41 15 22 o 8.461000 0.5537000 9.444000 0.7339000 7.479000 0.8291000 1.965000       1.107000  
1 1 1 41 15 24 o 5.545000 0.8188000 5.740000 1.088000  5.350000 1.224000  0.3909000      1.638000  
1 1 1 41 15 26 o 7.183000 0.5720000 7.042000 0.8453000 7.323000 0.7710000 -0.2812000     1.144000  
1 1 1 41 15 28 o 5.914000 0.8065000 5.972000 1.112000  5.855000 1.169000  0.1169000      1.613000  
1 1 1 41 16 1  o 3.102000 0.8134000 3.574000 1.180000  2.631000 1.120000  0.9425000      1.627000  
1 1 1 41 16 3  o 10.48000 0.4588000 10.56000 0.5838000 10.40000 0.7081000 0.1597000      0.9177000 
1 1 1 41 16 5  o 4.336000 0.8603000 5.168000 1.216000  3.504000 1.217000  1.665000       1.721000  
1 1 1 41 16 7  f 5.380000 0.7873000 4.930000 1.258000  5.830000 0.9467000 -0.8997000     1.575000  
1 1 1 41 16 9  o 16.03000 0.3434000 16.02000 0.4603000 16.04000 0.5097000 -0.1955000E-01 0.6868000 
1 1 1 41 16 11 o 18.38000 0.3363000 19.03000 0.4806000 17.72000 0.4706000 1.302000       0.6726000 
1 1 1 41 16 13 o 5.657000 0.7126000 6.580000 0.8921000 4.734000 1.111000  1.845000       1.425000  
1 1 1 41 16 15 o 4.101000 0.8493000 4.137000 1.149000  4.064000 1.251000  0.7311000E-01  1.699000  
1 1 1 41 16 17 o 3.796000 0.8397000 4.117000 1.124000  3.474000 1.248000  0.6432000      1.679000  
1 1 1 41 16 19 o 5.494000 0.7629000 6.319000 0.9275000 4.669000 1.211000  1.650000       1.526000  
1 1 1 41 16 21 o 10.85000 0.4589000 10.87000 0.5967000 10.82000 0.6975000 0.5229000E-01  0.9179000 
1 1 1 41 16 23 o 8.291000 0.5427000 8.314000 0.7822000 8.268000 0.7524000 0.4559000E-01  1.085000  
1 1 1 41 16 25 o 4.377000 0.9075000 4.374000 1.264000  4.380000 1.302000  -0.6387000E-02 1.815000  
1 1 1 41 16 27 f 5.381000 1.040000  4.291000 1.496000  6.471000 1.444000  -2.179000      2.079000  
1 1 1 41 16 29 o 5.226000 1.953000  ?        ?         5.226000 1.953000  ?              ?         
1 1 1 41 17 0  o 2.155000 1.005000  2.155000 1.005000  2.155000 1.005000  0.000000       0.000000  
1 1 1 41 17 2  o 5.599000 0.7104000 7.237000 0.7835000 3.961000 1.185000  3.276000       1.421000  
1 1 1 41 17 4  o 3.772000 0.9163000 3.032000 1.221000  4.512000 1.367000  -1.480000      1.833000  
1 1 1 41 17 6  o 5.652000 0.7905000 5.534000 1.053000  5.770000 1.179000  -0.2364000     1.581000  
1 1 1 41 17 8  o 8.678000 0.5970000 8.427000 0.8861000 8.929000 0.8005000 -0.5021000     1.194000  
1 1 1 41 17 10 o 5.133000 0.8106000 4.312000 1.300000  5.954000 0.9684000 -1.642000      1.621000  
1 1 1 41 17 12 o 4.140000 0.8743000 4.085000 1.226000  4.195000 1.247000  -0.1098000     1.749000  
1 1 1 41 17 14 o 10.61000 0.4072000 11.06000 0.5369000 10.17000 0.6123000 0.8851000      0.8143000 
1 1 1 41 17 16 o 5.271000 0.7606000 4.514000 1.117000  6.028000 1.033000  -1.514000      1.521000  
1 1 1 41 17 18 o 3.902000 0.8805000 4.383000 1.208000  3.421000 1.281000  0.9621000      1.761000  
1 1 1 41 17 20 o 6.552000 0.6499000 6.688000 0.8552000 6.416000 0.9789000 0.2726000      1.300000  
1 1 1 41 17 22 o 4.044000 0.8028000 5.026000 1.115000  3.062000 1.155000  1.964000       1.606000  
1 1 1 41 17 24 o 5.770000 0.7739000 5.529000 1.087000  6.012000 1.102000  -0.4824000     1.548000  
1 1 1 41 17 26 o 4.091000 0.8726000 2.974000 1.284000  5.207000 1.182000  -2.233000      1.745000  
1 1 1 41 17 28 o 3.822000 1.671000  ?        ?         3.822000 1.671000  ?              ?         
1 1 1 41 18 1  o 8.142000 0.5247000 7.988000 0.7665000 8.296000 0.7166000 -0.3082000     1.049000  
1 1 1 41 18 3  f 3.634000 0.8625000 4.276000 1.226000  2.993000 1.213000  1.282000       1.725000  
1 1 1 41 18 5  o 3.098000 0.8485000 3.514000 1.218000  2.683000 1.182000  0.8310000      1.697000  
1 1 1 41 18 7  f 8.175000 0.5605000 7.227000 0.8769000 9.124000 0.6984000 -1.897000      1.121000  
1 1 1 41 18 9  o 5.531000 0.7638000 4.812000 1.147000  6.251000 1.009000  -1.440000      1.528000  
1 1 1 41 18 11 o 15.75000 0.3356000 15.94000 0.4646000 15.56000 0.4844000 0.3741000      0.6711000 
1 1 1 41 18 13 o 13.71000 0.3846000 13.64000 0.5176000 13.78000 0.5689000 -0.1354000     0.7692000 
1 1 1 41 18 15 o 9.912000 0.4672000 9.653000 0.6446000 10.17000 0.6766000 -0.5183000     0.9345000 
1 1 1 41 18 17 o 4.441000 0.8536000 5.225000 1.012000  3.658000 1.375000  1.566000       1.707000  
1 1 1 41 18 19 o 5.279000 0.9914000 5.326000 1.098000  5.231000 1.651000  0.9451000E-01  1.983000  
1 1 1 41 18 21 o 5.807000 1.021000  7.211000 0.7673000 4.403000 1.892000  2.808000       2.042000  
1 1 1 41 18 23 o 4.198000 0.9165000 5.023000 1.180000  3.374000 1.402000  1.649000       1.833000  
1 1 1 41 18 25 f 3.821000 1.021000  3.952000 1.448000  3.690000 1.440000  0.2613000      2.042000  
1 1 1 41 18 27 o 4.955000 1.253000  6.628000 1.985000  3.282000 1.529000  3.346000       2.505000  
1 1 1 41 19 0  o 2.784000 1.151000  2.784000 1.151000  2.784000 1.151000  0.000000       0.000000  
1 1 1 41 19 2  o 3.887000 0.9165000 4.123000 1.366000  3.651000 1.223000  0.4723000      1.833000  
1 1 1 41 19 4  o 2.942000 0.8152000 2.124000 1.021000  3.761000 1.271000  -1.637000      1.630000  
1 1 1 41 19 6  o 6.468000 0.7383000 5.356000 1.269000  7.581000 0.7549000 -2.225000      1.477000  
1 1 1 41 19 8  o 7.913000 0.5402000 8.141000 0.6969000 7.685000 0.8257000 0.4560000      1.080000  
1 1 1 41 19 10 o 4.864000 0.8165000 4.485000 1.207000  5.243000 1.100000  -0.7575000     1.633000  
1 1 1 41 19 12 o 3.774000 0.8838000 4.058000 1.265000  3.491000 1.235000  0.5672000      1.768000  
1 1 1 41 19 14 o 2.671000 0.7802000 3.343000 1.226000  1.999000 0.9652000 1.344000       1.560000  
1 1 1 41 19 16 o 2.905000 0.8331000 2.724000 1.134000  3.086000 1.220000  -0.3620000     1.666000  
1 1 1 41 19 18 o 8.831000 0.8199000 10.23000 0.6247000 7.428000 1.516000  2.804000       1.640000  
1 1 1 41 19 20 o 2.790000 0.8297000 2.759000 1.162000  2.821000 1.185000  -0.6163000E-01 1.659000  
1 1 1 41 19 22 o 4.144000 0.8585000 3.617000 1.254000  4.670000 1.173000  -1.053000      1.717000  
1 1 1 41 19 24 o 5.011000 1.171000  4.173000 1.913000  5.848000 1.352000  -1.674000      2.343000  
1 1 1 41 19 26 o 3.253000 1.010000  3.244000 1.482000  3.261000 1.372000  -0.1722000E-01 2.019000  
1 1 1 41 20 1  o 3.177000 0.8816000 2.744000 1.174000  3.610000 1.316000  -0.8660000     1.763000  
1 1 1 41 20 3  o 6.554000 0.7282000 7.144000 0.8133000 5.964000 1.208000  1.179000       1.456000  
1 1 1 41 20 5  o 9.022000 0.5456000 8.099000 0.7639000 9.944000 0.7792000 -1.845000      1.091000  
1 1 1 41 20 7  o 5.569000 0.7788000 6.380000 0.8808000 4.759000 1.285000  1.621000       1.558000  
1 1 1 41 20 9  o 3.263000 0.9406000 3.004000 1.248000  3.522000 1.408000  -0.5174000     1.881000  
1 1 1 41 20 11 o 5.555000 1.006000  5.809000 0.9942000 5.300000 1.748000  0.5086000      2.011000  
1 1 1 41 20 13 o 2.805000 0.8184000 2.639000 1.114000  2.971000 1.199000  -0.3314000     1.637000  
1 1 1 41 20 15 o 4.630000 0.8948000 4.533000 1.236000  4.726000 1.294000  -0.1928000     1.790000  
1 1 1 41 20 17 o 2.614000 0.7902000 3.168000 1.237000  2.061000 0.9834000 1.108000       1.580000  
1 1 1 41 20 19 o 6.661000 0.7459000 7.466000 1.014000  5.855000 1.094000  1.611000       1.492000  
1 1 1 41 20 21 o 4.311000 1.170000  5.029000 1.775000  3.593000 1.524000  1.436000       2.340000  
1 1 1 41 20 23 f 3.681000 1.049000  2.953000 1.398000  4.410000 1.565000  -1.457000      2.099000  
1 1 1 41 20 25 f 2.797000 0.8847000 2.814000 1.252000  2.779000 1.250000  0.3478000E-01  1.769000  
1 1 1 41 21 0  o 3.169000 1.228000  3.169000 1.228000  3.169000 1.228000  0.000000       0.000000  
1 1 1 41 21 2  o 2.918000 0.8426000 3.148000 1.220000  2.688000 1.163000  0.4598000      1.685000  
1 1 1 41 21 4  o 6.105000 0.6950000 6.795000 0.9076000 5.415000 1.053000  1.380000       1.390000  
1 1 1 41 21 6  o 4.121000 0.9316000 3.895000 1.298000  4.348000 1.336000  -0.4535000     1.863000  
1 1 1 41 21 8  o 3.957000 0.9391000 4.552000 1.216000  3.363000 1.432000  1.189000       1.878000  
1 1 1 41 21 10 o 4.468000 0.8526000 4.996000 1.247000  3.941000 1.163000  1.055000       1.705000  
1 1 1 41 21 12 o 6.778000 0.6077000 7.549000 0.7726000 6.008000 0.9383000 1.541000       1.215000  
1 1 1 41 21 14 o 8.661000 0.5567000 8.828000 0.8858000 8.495000 0.6746000 0.3331000      1.113000  
1 1 1 41 21 16 o 11.95000 0.4810000 11.56000 0.6586000 12.34000 0.7013000 -0.7778000     0.9621000 
1 1 1 41 21 18 o 6.979000 0.8703000 8.925000 0.7803000 5.033000 1.556000  3.892000       1.741000  
1 1 1 41 21 20 o 5.866000 0.9837000 5.624000 1.369000  6.107000 1.413000  -0.4823000     1.967000  
1 1 1 41 21 22 o 4.294000 0.9841000 4.817000 1.389000  3.771000 1.395000  1.046000       1.968000  
1 1 1 41 21 24 o 6.018000 1.128000  6.675000 1.658000  5.362000 1.530000  1.313000       2.256000  
1 1 1 41 22 1  o 6.844000 0.6355000 7.128000 0.8173000 6.559000 0.9734000 0.5686000      1.271000  
1 1 1 41 22 3  o 3.649000 0.8615000 4.557000 1.243000  2.742000 1.193000  1.815000       1.723000  
1 1 1 41 22 5  o 3.587000 0.9050000 4.129000 1.306000  3.045000 1.254000  1.084000       1.810000  
1 1 1 41 22 7  o 4.568000 1.029000  4.067000 1.202000  5.069000 1.670000  -1.002000      2.058000  
1 1 1 41 22 9  o 6.687000 0.6376000 6.449000 0.9903000 6.925000 0.8034000 -0.4756000     1.275000  
1 1 1 41 22 11 o 5.287000 1.154000  5.083000 2.082000  5.492000 0.9972000 -0.4094000     2.309000  
1 1 1 41 22 13 o 3.056000 0.9082000 3.860000 1.499000  2.251000 1.026000  1.609000       1.816000  
1 1 1 41 22 15 o 4.830000 0.9198000 5.380000 1.200000  4.280000 1.394000  1.100000       1.840000  
1 1 1 41 22 17 o 4.495000 1.020000  4.271000 1.424000  4.719000 1.460000  -0.4480000     2.040000  
1 1 1 41 22 19 o 6.156000 0.9096000 7.244000 1.119000  5.068000 1.434000  2.176000       1.819000  
1 1 1 41 22 21 o 3.624000 0.9910000 4.130000 1.456000  3.118000 1.345000  1.012000       1.982000  
1 1 1 41 22 23 o 7.385000 0.9542000 6.845000 1.464000  7.925000 1.224000  -1.081000      1.908000  
1 1 1 41 23 0  o 5.508000 1.164000  5.508000 1.164000  5.508000 1.164000  0.000000       0.000000  
1 1 1 41 23 2  o 8.380000 0.5298000 8.416000 0.7912000 8.344000 0.7049000 0.7177000E-01  1.060000  
1 1 1 41 23 4  o 3.205000 0.8927000 3.254000 1.303000  3.155000 1.220000  0.9894000E-01  1.785000  
1 1 1 41 23 6  o 4.870000 0.8480000 5.858000 1.192000  3.881000 1.207000  1.977000       1.696000  
1 1 1 41 23 8  o 8.474000 0.5763000 8.512000 0.7655000 8.435000 0.8615000 0.7762000E-01  1.153000  
1 1 1 41 23 10 o 7.741000 0.7013000 8.567000 1.098000  6.914000 0.8729000 1.653000       1.403000  
1 1 1 41 23 12 o 3.002000 0.8461000 3.421000 1.237000  2.582000 1.154000  0.8390000      1.692000  
1 1 1 41 23 14 f 4.632000 1.028000  4.063000 1.444000  5.202000 1.464000  -1.139000      2.057000  
1 1 1 41 23 16 o 3.031000 0.9061000 3.232000 1.347000  2.829000 1.213000  0.4026000      1.812000  
1 1 1 41 23 18 o 7.992000 0.8334000 9.859000 0.8976000 6.125000 1.405000  3.734000       1.667000  
1 1 1 41 23 20 o 3.651000 1.065000  3.807000 1.571000  3.496000 1.438000  0.3110000      2.130000  
1 1 1 41 23 22 o 4.436000 1.168000  5.307000 1.746000  3.566000 1.553000  1.741000       2.336000  
1 1 1 41 24 1  o 2.761000 0.8151000 2.357000 1.078000  3.165000 1.223000  -0.8078000     1.630000  
1 1 1 41 24 3  o 2.445000 0.7770000 2.392000 1.073000  2.498000 1.124000  -0.1059000     1.554000  
1 1 1 41 24 5  o 5.902000 0.8013000 6.170000 1.105000  5.634000 1.161000  0.5363000      1.603000  
1 1 1 41 24 7  o 2.690000 0.8345000 2.749000 1.223000  2.631000 1.135000  0.1175000      1.669000  
1 1 1 41 24 9  o 4.869000 0.7671000 6.499000 0.8680000 3.239000 1.265000  3.259000       1.534000  
1 1 1 41 24 11 o 6.661000 0.9071000 7.528000 1.121000  5.794000 1.427000  1.734000       1.814000  
1 1 1 41 24 13 o 4.454000 1.003000  4.323000 1.433000  4.586000 1.404000  -0.2632000     2.006000  
1 1 1 41 24 15 o 2.730000 0.8710000 2.160000 1.046000  3.301000 1.393000  -1.141000      1.742000  
1 1 1 41 24 17 o 11.40000 0.6484000 11.91000 0.9179000 10.88000 0.9160000 1.024000       1.297000  
1 1 1 41 24 19 o 4.034000 1.069000  4.554000 1.574000  3.515000 1.446000  1.038000       2.137000  
1 1 1 41 24 21 o 3.355000 1.599000  ?        ?         3.355000 1.599000  ?              ?         
1 1 1 41 25 0  o 3.017000 1.209000  3.017000 1.209000  3.017000 1.209000  0.000000       0.000000  
1 1 1 41 25 2  o 6.839000 0.6941000 5.893000 1.024000  7.784000 0.9374000 -1.891000      1.388000  
1 1 1 41 25 4  f 5.253000 0.8254000 4.505000 1.305000  6.000000 1.011000  -1.495000      1.651000  
1 1 1 41 25 6  o 2.930000 0.8892000 3.293000 1.377000  2.568000 1.125000  0.7245000      1.778000  
1 1 1 41 25 8  o 6.719000 0.6618000 6.586000 0.8466000 6.852000 1.017000  -0.2661000     1.324000  
1 1 1 41 25 10 o 6.441000 0.9947000 8.051000 0.9767000 4.830000 1.733000  3.221000       1.989000  
1 1 1 41 25 12 o 6.047000 0.9890000 4.798000 1.666000  7.296000 1.066000  -2.499000      1.978000  
1 1 1 41 25 14 o 9.422000 0.7151000 10.03000 0.8601000 8.814000 1.143000  1.216000       1.430000  
1 1 1 41 25 16 o 11.21000 0.5720000 11.88000 0.8029000 10.54000 0.8147000 1.342000       1.144000  
1 1 1 41 25 18 o 9.850000 0.6810000 10.33000 0.9488000 9.366000 0.9771000 0.9680000      1.362000  
1 1 1 41 25 20 o 5.568000 2.170000  ?        ?         5.568000 2.170000  ?              ?         
1 1 1 41 26 1  o 3.597000 0.9152000 3.605000 1.233000  3.590000 1.353000  0.1542000E-01  1.830000  
1 1 1 41 26 3  o 5.207000 0.7924000 5.085000 1.124000  5.330000 1.118000  -0.2452000     1.585000  
1 1 1 41 26 5  o 2.668000 0.8298000 2.634000 1.209000  2.703000 1.136000  -0.6831000E-01 1.660000  
1 1 1 41 26 7  o 4.097000 0.9825000 4.598000 1.362000  3.595000 1.416000  1.003000       1.965000  
1 1 1 41 26 9  o 3.817000 0.9809000 4.321000 1.458000  3.313000 1.312000  1.008000       1.962000  
1 1 1 41 26 11 o 8.093000 0.7286000 9.119000 0.8978000 7.067000 1.148000  2.053000       1.457000  
1 1 1 41 26 13 o 6.891000 1.067000  7.670000 1.712000  6.111000 1.275000  1.559000       2.135000  
1 1 1 41 26 15 o 3.642000 0.9999000 3.824000 1.388000  3.460000 1.439000  0.3643000      2.000000  
1 1 1 41 26 17 o 6.651000 0.8892000 6.172000 1.374000  7.129000 1.129000  -0.9577000     1.778000  
1 1 1 41 27 0  o 3.226000 1.289000  3.226000 1.289000  3.226000 1.289000  0.000000       0.000000  
1 1 1 41 27 2  o 5.921000 0.7036000 5.168000 1.128000  6.674000 0.8417000 -1.507000      1.407000  
1 1 1 41 27 4  o 4.999000 0.8562000 4.271000 1.093000  5.727000 1.318000  -1.456000      1.712000  
1 1 1 41 27 6  o 4.698000 0.9343000 4.238000 1.318000  5.159000 1.325000  -0.9210000     1.869000  
1 1 1 41 27 8  o 8.375000 0.7237000 9.863000 0.8462000 6.886000 1.174000  2.977000       1.447000  
1 1 1 41 27 10 o 3.226000 1.015000  2.943000 1.306000  3.509000 1.555000  -0.5663000     2.030000  
1 1 1 41 27 12 o 3.560000 0.9970000 3.840000 1.475000  3.280000 1.341000  0.5601000      1.994000  
1 1 1 41 27 14 o 4.321000 1.015000  4.120000 1.448000  4.521000 1.423000  -0.4013000     2.030000  
1 1 1 41 27 16 o 6.717000 1.800000  ?        ?         6.717000 1.800000  ?              ?         
1 1 1 41 28 1  o 4.559000 0.9592000 5.000000 1.334000  4.119000 1.379000  0.8812000      1.918000  
1 1 1 41 28 3  o 3.991000 0.8845000 4.622000 1.155000  3.359000 1.340000  1.263000       1.769000  
1 1 1 41 28 5  o 4.876000 1.000000  4.573000 1.482000  5.179000 1.344000  -0.6059000     2.000000  
1 1 1 41 28 7  o 3.602000 1.003000  3.679000 1.421000  3.525000 1.415000  0.1539000      2.005000  
1 1 1 41 28 9  o 3.526000 0.9737000 3.169000 1.293000  3.882000 1.457000  -0.7129000     1.947000  
1 1 1 41 28 11 o 4.296000 1.041000  4.983000 1.456000  3.608000 1.489000  1.374000       2.082000  
1 1 1 41 28 13 o 5.344000 1.008000  5.065000 1.460000  5.623000 1.390000  -0.5580000     2.016000  
1 1 1 41 29 0  f 6.463000 1.861000  6.463000 1.861000  6.463000 1.861000  0.000000       0.000000  
1 1 1 41 29 2  o 4.491000 1.096000  4.973000 1.686000  4.010000 1.402000  0.9623000      2.192000  
1 1 1 41 29 4  o 4.498000 1.106000  3.648000 1.469000  5.348000 1.655000  -1.700000      2.213000  
1 1 1 41 29 6  o 5.684000 0.9325000 5.111000 1.483000  6.257000 1.132000  -1.146000      1.865000  
1 1 1 41 29 8  o 11.99000 0.6322000 13.16000 0.6644000 10.82000 1.076000  2.346000       1.264000  
1 1 1 41 29 10 o 7.693000 0.7304000 8.460000 0.9054000 6.926000 1.146000  1.535000       1.461000  
1 1 1 41 30 1  o 4.295000 1.189000  4.724000 1.733000  3.867000 1.629000  0.8578000      2.379000  
1 1 1 41 30 3  o 6.278000 1.438000  5.951000 2.182000  6.604000 1.875000  -0.6530000     2.877000  
1 1 1 41 30 5  o 5.456000 1.230000  5.617000 1.631000  5.295000 1.841000  0.3217000      2.460000  
1 1 1 41 30 7  o 2.691000 1.186000  ?        ?         2.691000 1.186000  ?              ?         
1 1 1 42 0  0  o 20.03000 0.6443000 20.03000 0.6443000 20.03000 0.6443000 0.000000       0.000000  
1 1 1 42 0  2  o 2.485000 1.113000  2.485000 1.113000  2.485000 1.113000  0.000000       0.000000  
1 1 1 42 0  4  o 2.539000 1.156000  2.539000 1.156000  2.539000 1.156000  0.000000       0.000000  
1 1 1 42 0  6  o 3.119000 1.230000  3.119000 1.230000  3.119000 1.230000  0.000000       0.000000  
1 1 1 42 0  8  o 5.524000 1.562000  5.524000 1.562000  5.524000 1.562000  0.000000       0.000000  
1 1 1 42 0  10 o 5.216000 1.286000  5.216000 1.286000  5.216000 1.286000  0.000000       0.000000  
1 1 1 42 0  12 o 5.956000 1.128000  5.956000 1.128000  5.956000 1.128000  0.000000       0.000000  
1 1 1 42 0  14 f 6.626000 0.9175000 6.626000 0.9175000 6.626000 0.9175000 0.000000       0.000000  
1 1 1 42 0  16 o 12.55000 0.5563000 12.55000 0.5563000 12.55000 0.5563000 0.000000       0.000000  
1 1 1 42 0  18 o 17.35000 0.4861000 17.35000 0.4861000 17.35000 0.4861000 0.000000       0.000000  
1 1 1 42 0  20 o 8.423000 0.7137000 8.423000 0.7137000 8.423000 0.7137000 0.000000       0.000000  
1 1 1 42 0  22 o 2.832000 1.179000  2.832000 1.179000  2.832000 1.179000  0.000000       0.000000  
1 1 1 42 0  24 o 4.067000 1.277000  4.067000 1.277000  4.067000 1.277000  0.000000       0.000000  
1 1 1 42 0  26 o 2.834000 1.229000  2.834000 1.229000  2.834000 1.229000  0.000000       0.000000  
1 1 1 42 0  28 o 3.034000 1.284000  3.034000 1.284000  3.034000 1.284000  0.000000       0.000000  
1 1 1 42 0  30 o 4.022000 1.457000  4.022000 1.457000  4.022000 1.457000  0.000000       0.000000  
1 1 1 42 1  1  o 6.569000 0.7239000 6.343000 1.121000  6.794000 0.9161000 -0.4509000     1.448000  
1 1 1 42 1  3  o 6.223000 0.7421000 5.991000 1.177000  6.456000 0.9047000 -0.4651000     1.484000  
1 1 1 42 1  5  o 9.144000 0.5948000 8.887000 0.7024000 9.402000 0.9600000 -0.5149000     1.190000  
1 1 1 42 1  7  o 3.240000 0.8644000 2.919000 1.192000  3.561000 1.253000  -0.6422000     1.729000  
1 1 1 42 1  9  o 4.933000 0.9072000 4.626000 1.221000  5.240000 1.342000  -0.6141000     1.814000  
1 1 1 42 1  11 o 8.322000 0.6786000 8.438000 0.8976000 8.207000 1.018000  0.2311000      1.357000  
1 1 1 42 1  13 o 3.601000 0.8654000 3.232000 1.231000  3.970000 1.217000  -0.7377000     1.731000  
1 1 1 42 1  15 o 4.061000 0.8906000 4.195000 1.268000  3.928000 1.251000  0.2676000      1.781000  
1 1 1 42 1  17 o 9.941000 0.4827000 10.01000 0.6973000 9.875000 0.6678000 0.1313000      0.9655000 
1 1 1 42 1  19 o 13.82000 0.3671000 13.80000 0.5274000 13.85000 0.5107000 -0.5210000E-01 0.7341000 
1 1 1 42 1  21 o 7.298000 0.5840000 7.340000 0.8008000 7.256000 0.8503000 0.8377000E-01  1.168000  
1 1 1 42 1  23 o 8.805000 0.5778000 7.894000 0.8273000 9.717000 0.8067000 -1.823000      1.156000  
1 1 1 42 1  25 o 3.148000 0.8789000 3.525000 1.310000  2.771000 1.172000  0.7541000      1.758000  
1 1 1 42 1  27 o 3.052000 0.9080000 2.397000 1.105000  3.707000 1.441000  -1.310000      1.816000  
1 1 1 42 1  29 o 3.239000 0.9244000 3.121000 1.316000  3.357000 1.298000  -0.2355000     1.849000  
1 1 1 42 2  0  o 18.55000 0.5327000 18.55000 0.5327000 18.55000 0.5327000 0.000000       0.000000  
1 1 1 42 2  2  o 3.370000 0.8392000 4.372000 1.268000  2.368000 1.100000  2.004000       1.678000  
1 1 1 42 2  4  o 3.078000 0.8880000 3.530000 1.353000  2.625000 1.150000  0.9055000      1.776000  
1 1 1 42 2  6  o 3.357000 0.8964000 3.165000 1.252000  3.550000 1.284000  -0.3849000     1.793000  
1 1 1 42 2  8  f 4.210000 0.9992000 4.397000 1.283000  4.023000 1.532000  0.3738000      1.998000  
1 1 1 42 2  10 f 3.028000 0.8423000 3.617000 1.272000  2.440000 1.104000  1.177000       1.685000  
1 1 1 42 2  12 o 7.449000 0.7931000 7.196000 1.163000  7.701000 1.078000  -0.5049000     1.586000  
1 1 1 42 2  14 o 3.642000 0.8825000 3.741000 1.226000  3.542000 1.270000  0.1985000      1.765000  
1 1 1 42 2  16 o 2.410000 0.7576000 2.071000 0.9775000 2.750000 1.158000  -0.6782000     1.515000  
1 1 1 42 2  18 o 3.214000 0.8639000 3.245000 1.228000  3.183000 1.215000  0.6259000E-01  1.728000  
1 1 1 42 2  20 o 11.32000 0.4158000 11.12000 0.5860000 11.51000 0.5901000 -0.3941000     0.8316000 
1 1 1 42 2  22 o 4.884000 0.7847000 5.279000 1.138000  4.489000 1.080000  0.7897000      1.569000  
1 1 1 42 2  24 o 4.208000 0.9437000 4.731000 1.304000  3.685000 1.365000  1.046000       1.887000  
1 1 1 42 2  26 o 3.763000 0.9036000 3.036000 1.220000  4.489000 1.334000  -1.453000      1.807000  
1 1 1 42 2  28 o 4.770000 0.8648000 5.626000 1.133000  3.914000 1.307000  1.711000       1.730000  
1 1 1 42 2  30 o 7.517000 0.6518000 7.772000 0.8867000 7.262000 0.9556000 0.5105000      1.304000  
1 1 1 42 3  1  o 15.48000 0.3942000 15.74000 0.5593000 15.22000 0.5557000 0.5161000      0.7884000 
1 1 1 42 3  3  o 8.946000 0.5028000 8.320000 0.6744000 9.572000 0.7460000 -1.252000      1.006000  
1 1 1 42 3  5  o 15.47000 0.4459000 15.13000 0.5262000 15.81000 0.7200000 -0.6799000     0.8917000 
1 1 1 42 3  7  o 7.004000 0.7624000 7.437000 0.9284000 6.572000 1.209000  0.8648000      1.525000  
1 1 1 42 3  9  o 4.867000 0.9508000 4.442000 1.252000  5.292000 1.431000  -0.8501000     1.902000  
1 1 1 42 3  11 o 8.914000 0.5594000 9.764000 0.7175000 8.063000 0.8585000 1.701000       1.119000  
1 1 1 42 3  13 o 8.093000 0.5871000 7.996000 0.8156000 8.189000 0.8446000 -0.1928000     1.174000  
1 1 1 42 3  15 o 7.690000 0.6303000 7.398000 0.8442000 7.983000 0.9362000 -0.5849000     1.261000  
1 1 1 42 3  17 o 3.915000 0.9377000 3.436000 1.252000  4.393000 1.396000  -0.9565000     1.875000  
1 1 1 42 3  19 o 6.354000 0.6923000 5.940000 0.9722000 6.768000 0.9858000 -0.8278000     1.385000  
1 1 1 42 3  21 o 4.453000 0.9145000 4.248000 1.256000  4.658000 1.329000  -0.4098000     1.829000  
1 1 1 42 3  23 o 4.231000 0.8684000 3.478000 1.310000  4.985000 1.140000  -1.507000      1.737000  
1 1 1 42 3  25 o 4.533000 0.9043000 4.109000 1.306000  4.956000 1.251000  -0.8474000     1.809000  
1 1 1 42 3  27 o 2.557000 0.8079000 2.313000 1.066000  2.800000 1.214000  -0.4872000     1.616000  
1 1 1 42 3  29 o 3.556000 0.9832000 3.384000 1.462000  3.727000 1.316000  -0.3428000     1.966000  
1 1 1 42 4  0  o 5.781000 1.021000  5.781000 1.021000  5.781000 1.021000  0.000000       0.000000  
1 1 1 42 4  2  o 3.468000 0.9191000 3.586000 1.296000  3.351000 1.304000  0.2352000      1.838000  
1 1 1 42 4  4  o 7.776000 0.5840000 7.669000 0.7633000 7.884000 0.8841000 -0.2142000     1.168000  
1 1 1 42 4  6  o 8.558000 0.5854000 7.636000 0.7730000 9.479000 0.8793000 -1.843000      1.171000  
1 1 1 42 4  8  o 3.725000 0.9416000 2.914000 1.224000  4.537000 1.431000  -1.624000      1.883000  
1 1 1 42 4  10 o 6.907000 0.9405000 8.437000 0.7676000 5.377000 1.717000  3.060000       1.881000  
1 1 1 42 4  12 o 14.89000 0.4367000 14.02000 0.5180000 15.75000 0.7032000 -1.737000      0.8734000 
1 1 1 42 4  14 o 11.71000 0.5008000 12.58000 0.5971000 10.83000 0.8040000 1.756000       1.002000  
1 1 1 42 4  16 o 7.653000 0.6694000 7.703000 0.9520000 7.604000 0.9414000 0.9934000E-01  1.339000  
1 1 1 42 4  18 o 5.106000 0.7799000 4.724000 1.211000  5.489000 0.9828000 -0.7645000     1.560000  
1 1 1 42 4  20 o 5.019000 0.8215000 5.427000 1.066000  4.612000 1.250000  0.8148000      1.643000  
1 1 1 42 4  22 o 8.008000 0.5740000 8.964000 0.8051000 7.052000 0.8182000 1.912000       1.148000  
1 1 1 42 4  24 o 3.490000 0.8725000 2.704000 1.155000  4.276000 1.308000  -1.572000      1.745000  
1 1 1 42 4  26 o 3.365000 0.9107000 2.691000 1.217000  4.039000 1.355000  -1.347000      1.821000  
1 1 1 42 4  28 o 3.536000 0.9680000 3.871000 1.455000  3.201000 1.277000  0.6698000      1.936000  
1 1 1 42 4  30 o 3.987000 0.9456000 3.724000 1.374000  4.250000 1.299000  -0.5261000     1.891000  
1 1 1 42 5  1  o 16.14000 0.3856000 15.85000 0.5548000 16.43000 0.5357000 -0.5752000     0.7712000 
1 1 1 42 5  3  o 8.420000 0.5375000 8.300000 0.7294000 8.539000 0.7897000 -0.2385000     1.075000  
1 1 1 42 5  5  o 11.00000 0.4233000 10.54000 0.6139000 11.47000 0.5831000 -0.9368000     0.8467000 
1 1 1 42 5  7  o 4.531000 0.8808000 4.309000 1.282000  4.753000 1.208000  -0.4447000     1.762000  
1 1 1 42 5  9  o 11.98000 0.4335000 12.50000 0.6293000 11.46000 0.5963000 1.043000       0.8669000 
1 1 1 42 5  11 o 17.93000 0.5426000 17.20000 0.5282000 18.65000 0.9479000 -1.452000      1.085000  
1 1 1 42 5  13 f 3.889000 0.8855000 4.418000 1.209000  3.360000 1.294000  1.057000       1.771000  
1 1 1 42 5  15 o 16.79000 0.3845000 16.79000 0.5530000 16.79000 0.5343000 0.3448000E-02  0.7689000 
1 1 1 42 5  17 o 5.078000 0.7896000 4.758000 1.104000  5.399000 1.130000  -0.6407000     1.579000  
1 1 1 42 5  19 o 5.214000 0.7771000 5.491000 1.095000  4.938000 1.103000  0.5528000      1.554000  
1 1 1 42 5  21 o 9.370000 0.4907000 10.07000 0.7021000 8.671000 0.6858000 1.396000       0.9814000 
1 1 1 42 5  23 o 3.572000 0.9354000 3.300000 1.345000  3.844000 1.300000  -0.5438000     1.871000  
1 1 1 42 5  25 o 10.49000 0.5514000 11.47000 0.7198000 9.514000 0.8354000 1.955000       1.103000  
1 1 1 42 5  27 o 4.089000 0.9269000 4.428000 1.297000  3.751000 1.325000  0.6767000      1.854000  
1 1 1 42 5  29 o 3.364000 0.8274000 2.245000 1.064000  4.482000 1.267000  -2.237000      1.655000  
1 1 1 42 6  0  o 10.94000 0.6327000 10.94000 0.6327000 10.94000 0.6327000 0.000000       0.000000  
1 1 1 42 6  2  o 4.502000 0.8435000 3.870000 1.304000  5.133000 1.071000  -1.263000      1.687000  
1 1 1 42 6  4  o 5.966000 0.7742000 5.515000 1.212000  6.417000 0.9644000 -0.9023000     1.548000  
1 1 1 42 6  6  o 7.002000 0.7029000 6.925000 0.9245000 7.079000 1.059000  -0.1537000     1.406000  
1 1 1 42 6  8  o 11.84000 0.4434000 11.37000 0.6628000 12.30000 0.5892000 -0.9236000     0.8868000 
1 1 1 42 6  10 o 3.509000 0.8865000 2.834000 1.178000  4.184000 1.325000  -1.350000      1.773000  
1 1 1 42 6  12 o 6.210000 0.7744000 6.326000 0.8636000 6.094000 1.286000  0.2325000      1.549000  
1 1 1 42 6  14 o 17.20000 0.3867000 16.92000 0.5634000 17.49000 0.5299000 -0.5674000     0.7734000 
1 1 1 42 6  16 o 4.751000 0.8687000 4.594000 1.259000  4.908000 1.198000  -0.3132000     1.737000  
1 1 1 42 6  18 o 3.738000 0.8935000 3.989000 1.320000  3.487000 1.204000  0.5027000      1.787000  
1 1 1 42 6  20 o 3.756000 0.9624000 4.034000 1.370000  3.478000 1.352000  0.5561000      1.925000  
1 1 1 42 6  22 f 10.44000 0.4989000 10.53000 0.6623000 10.35000 0.7463000 0.1847000      0.9978000 
1 1 1 42 6  24 o 3.809000 0.8786000 4.606000 1.216000  3.012000 1.268000  1.594000       1.757000  
1 1 1 42 6  26 o 2.949000 0.8610000 3.104000 1.232000  2.794000 1.203000  0.3095000      1.722000  
1 1 1 42 6  28 o 3.931000 0.8720000 2.786000 1.185000  5.077000 1.279000  -2.291000      1.744000  
1 1 1 42 7  1  o 11.70000 0.4083000 11.71000 0.5788000 11.69000 0.5760000 0.2476000E-01  0.8165000 
1 1 1 42 7  3  o 8.706000 0.4895000 8.655000 0.6847000 8.758000 0.6996000 -0.1030000     0.9789000 
1 1 1 42 7  5  o 6.383000 0.6759000 6.011000 1.031000  6.755000 0.8740000 -0.7444000     1.352000  
1 1 1 42 7  7  o 5.364000 0.8488000 5.586000 1.245000  5.142000 1.154000  0.4435000      1.698000  
1 1 1 42 7  9  o 3.330000 0.9209000 3.565000 1.374000  3.094000 1.226000  0.4711000      1.842000  
1 1 1 42 7  11 o 2.313000 0.7586000 2.171000 1.023000  2.455000 1.120000  -0.2837000     1.517000  
1 1 1 42 7  13 o 6.981000 0.7977000 6.639000 0.8904000 7.324000 1.324000  -0.6855000     1.595000  
1 1 1 42 7  15 o 5.952000 0.8435000 6.728000 1.001000  5.175000 1.358000  1.554000       1.687000  
1 1 1 42 7  17 o 4.424000 0.9410000 5.104000 1.296000  3.744000 1.365000  1.361000       1.882000  
1 1 1 42 7  19 o 5.205000 0.8425000 5.311000 1.093000  5.099000 1.282000  0.2120000      1.685000  
1 1 1 42 7  21 o 15.37000 0.4649000 15.42000 0.7160000 15.32000 0.5930000 0.9663000E-01  0.9297000 
1 1 1 42 7  23 o 3.511000 0.9255000 3.763000 1.310000  3.258000 1.307000  0.5049000      1.851000  
1 1 1 42 7  25 o 3.879000 0.8738000 4.528000 1.203000  3.231000 1.268000  1.297000       1.748000  
1 1 1 42 7  27 o 3.587000 0.9109000 3.729000 1.307000  3.445000 1.269000  0.2836000      1.822000  
1 1 1 42 7  29 o 5.656000 0.8177000 5.057000 1.237000  6.256000 1.069000  -1.199000      1.635000  
1 1 1 42 8  0  o 5.808000 0.9787000 5.808000 0.9787000 5.808000 0.9787000 0.000000       0.000000  
1 1 1 42 8  2  o 10.86000 0.4120000 11.01000 0.5865000 10.71000 0.5789000 0.2964000      0.8240000 
1 1 1 42 8  4  o 8.977000 0.4887000 8.657000 0.7118000 9.297000 0.6696000 -0.6402000     0.9773000 
1 1 1 42 8  6  o 4.130000 0.9179000 3.658000 1.298000  4.602000 1.298000  -0.9443000     1.836000  
1 1 1 42 8  8  o 3.566000 0.9093000 2.815000 1.170000  4.317000 1.393000  -1.502000      1.819000  
1 1 1 42 8  10 o 3.024000 0.8586000 3.286000 1.210000  2.763000 1.219000  0.5230000      1.717000  
1 1 1 42 8  12 o 10.45000 0.6219000 11.05000 0.6731000 9.850000 1.046000  1.202000       1.244000  
1 1 1 42 8  14 o 12.98000 0.5228000 12.35000 0.5422000 13.61000 0.8941000 -1.260000      1.046000  
1 1 1 42 8  16 o 10.32000 0.4273000 11.33000 0.5550000 9.311000 0.6498000 2.018000       0.8545000 
1 1 1 42 8  18 o 5.402000 0.7611000 5.302000 1.168000  5.502000 0.9762000 -0.2001000     1.522000  
1 1 1 42 8  20 o 4.600000 0.9496000 3.834000 1.322000  5.366000 1.363000  -1.532000      1.899000  
1 1 1 42 8  22 o 2.947000 0.9125000 2.738000 1.173000  3.156000 1.398000  -0.4180000     1.825000  
1 1 1 42 8  24 o 3.935000 0.8638000 5.145000 1.188000  2.725000 1.254000  2.420000       1.728000  
1 1 1 42 8  26 o 3.507000 0.9598000 2.941000 1.209000  4.073000 1.491000  -1.132000      1.920000  
1 1 1 42 8  28 o 4.762000 0.8765000 4.978000 1.237000  4.547000 1.242000  0.4310000      1.753000  
1 1 1 42 9  1  o 12.16000 0.3776000 11.87000 0.5465000 12.44000 0.5211000 -0.5674000     0.7552000 
1 1 1 42 9  3  o 12.48000 0.3809000 12.66000 0.5283000 12.31000 0.5487000 0.3468000      0.7617000 
1 1 1 42 9  5  o 13.44000 0.4050000 13.34000 0.5491000 13.53000 0.5955000 -0.1949000     0.8101000 
1 1 1 42 9  7  o 6.569000 0.7406000 6.736000 0.9765000 6.403000 1.114000  0.3332000      1.481000  
1 1 1 42 9  9  o 7.131000 0.6162000 6.917000 0.9119000 7.345000 0.8289000 -0.4285000     1.232000  
1 1 1 42 9  11 o 8.791000 0.5383000 9.091000 0.6587000 8.492000 0.8515000 0.5997000      1.077000  
1 1 1 42 9  13 f 6.910000 0.6454000 6.989000 0.8527000 6.831000 0.9692000 0.1581000      1.291000  
1 1 1 42 9  15 o 7.445000 0.6382000 7.608000 0.7889000 7.282000 1.004000  0.3262000      1.276000  
1 1 1 42 9  17 o 7.878000 0.6399000 7.726000 0.8739000 8.029000 0.9349000 -0.3038000     1.280000  
1 1 1 42 9  19 o 10.09000 0.5091000 9.568000 0.7715000 10.62000 0.6644000 -1.049000      1.018000  
1 1 1 42 9  21 o 13.74000 0.4856000 13.79000 0.5588000 13.69000 0.7943000 0.1061000      0.9711000 
1 1 1 42 9  23 o 3.494000 0.9012000 3.664000 1.303000  3.325000 1.245000  0.3388000      1.802000  
1 1 1 42 9  25 o 5.066000 1.007000  5.597000 1.276000  4.534000 1.559000  1.062000       2.014000  
1 1 1 42 9  27 f 5.807000 0.8850000 5.245000 1.197000  6.370000 1.304000  -1.126000      1.770000  
1 1 1 42 9  29 o 4.483000 1.637000  4.483000 1.637000  ?        ?         ?              ?         
1 1 1 42 10 0  o 9.154000 0.6953000 9.154000 0.6953000 9.154000 0.6953000 0.000000       0.000000  
1 1 1 42 10 2  o 5.873000 0.7282000 6.310000 0.9623000 5.437000 1.093000  0.8725000      1.456000  
1 1 1 42 10 4  o 2.904000 0.8540000 2.774000 1.183000  3.033000 1.232000  -0.2588000     1.708000  
1 1 1 42 10 6  o 8.989000 0.5186000 9.091000 0.7507000 8.887000 0.7156000 0.2033000      1.037000  
1 1 1 42 10 8  o 5.526000 0.8067000 6.782000 0.9769000 4.269000 1.284000  2.513000       1.613000  
1 1 1 42 10 10 o 13.90000 0.3881000 13.61000 0.5405000 14.20000 0.5571000 -0.5902000     0.7762000 
1 1 1 42 10 12 o 10.89000 0.4380000 11.22000 0.5724000 10.57000 0.6633000 0.6556000      0.8761000 
1 1 1 42 10 14 o 9.884000 0.5058000 10.52000 0.6859000 9.249000 0.7434000 1.272000       1.012000  
1 1 1 42 10 16 o 11.83000 0.5170000 12.34000 0.8126000 11.32000 0.6395000 1.021000       1.034000  
1 1 1 42 10 18 o 4.180000 1.113000  5.250000 1.838000  3.110000 1.257000  2.139000       2.227000  
1 1 1 42 10 20 o 5.728000 0.9016000 7.227000 1.303000  4.228000 1.247000  2.998000       1.803000  
1 1 1 42 10 22 o 6.939000 0.7130000 7.829000 1.031000  6.049000 0.9848000 1.780000       1.426000  
1 1 1 42 10 24 o 6.254000 0.7273000 5.916000 1.077000  6.593000 0.9780000 -0.6771000     1.455000  
1 1 1 42 10 26 o 4.267000 0.9992000 4.413000 1.422000  4.121000 1.404000  0.2918000      1.998000  
1 1 1 42 10 28 o 4.524000 0.8692000 5.345000 1.166000  3.703000 1.289000  1.642000       1.738000  
1 1 1 42 11 1  o 15.97000 0.3569000 16.02000 0.4492000 15.92000 0.5548000 0.1002000      0.7139000 
1 1 1 42 11 3  o 14.42000 0.3916000 14.64000 0.4875000 14.19000 0.6130000 0.4503000      0.7833000 
1 1 1 42 11 5  o 2.765000 0.8423000 2.932000 1.240000  2.598000 1.140000  0.3341000      1.685000  
1 1 1 42 11 7  o 3.226000 0.8738000 2.722000 1.176000  3.730000 1.293000  -1.008000      1.748000  
1 1 1 42 11 9  o 2.672000 0.8091000 2.988000 1.228000  2.355000 1.054000  0.6337000      1.618000  
1 1 1 42 11 11 o 8.124000 0.5800000 8.230000 0.8629000 8.018000 0.7752000 0.2118000      1.160000  
1 1 1 42 11 13 o 7.391000 0.6819000 7.885000 0.9654000 6.897000 0.9633000 0.9875000      1.364000  
1 1 1 42 11 15 o 3.284000 0.8947000 2.826000 1.155000  3.743000 1.366000  -0.9176000     1.789000  
1 1 1 42 11 17 o 7.121000 0.5896000 6.764000 0.8285000 7.478000 0.8392000 -0.7138000     1.179000  
1 1 1 42 11 19 o 8.744000 0.6143000 8.189000 0.9264000 9.300000 0.8071000 -1.111000      1.229000  
1 1 1 42 11 21 o 2.858000 0.7976000 2.277000 1.036000  3.439000 1.213000  -1.163000      1.595000  
1 1 1 42 11 23 o 4.227000 0.9899000 3.628000 1.469000  4.827000 1.327000  -1.200000      1.980000  
1 1 1 42 11 25 o 4.528000 0.9885000 3.632000 1.494000  5.423000 1.294000  -1.792000      1.977000  
1 1 1 42 11 27 o 3.195000 0.8490000 2.414000 1.148000  3.976000 1.251000  -1.562000      1.698000  
1 1 1 42 12 0  o 2.732000 1.174000  2.732000 1.174000  2.732000 1.174000  0.000000       0.000000  
1 1 1 42 12 2  o 9.031000 0.4764000 9.103000 0.6841000 8.959000 0.6633000 0.1445000      0.9528000 
1 1 1 42 12 4  o 19.27000 0.3193000 19.50000 0.4611000 19.05000 0.4419000 0.4503000      0.6387000 
1 1 1 42 12 6  o 9.719000 0.5394000 9.194000 0.8617000 10.24000 0.6492000 -1.050000      1.079000  
1 1 1 42 12 8  o 5.349000 0.9060000 4.837000 1.458000  5.862000 1.076000  -1.025000      1.812000  
1 1 1 42 12 10 o 3.148000 0.8506000 2.712000 1.134000  3.585000 1.268000  -0.8729000     1.701000  
1 1 1 42 12 12 o 7.065000 0.5803000 6.829000 0.8553000 7.302000 0.7846000 -0.4731000     1.161000  
1 1 1 42 12 14 o 3.700000 0.8710000 2.952000 1.200000  4.448000 1.263000  -1.496000      1.742000  
1 1 1 42 12 16 o 7.316000 0.6592000 6.784000 0.9222000 7.849000 0.9422000 -1.066000      1.318000  
1 1 1 42 12 18 o 7.562000 0.5827000 8.111000 0.7904000 7.013000 0.8564000 1.098000       1.165000  
1 1 1 42 12 20 o 3.715000 0.8118000 4.794000 1.147000  2.636000 1.150000  2.158000       1.624000  
1 1 1 42 12 22 o 3.216000 0.8370000 3.829000 1.219000  2.603000 1.148000  1.225000       1.674000  
1 1 1 42 12 24 o 3.130000 0.8706000 2.735000 1.191000  3.525000 1.271000  -0.7894000     1.741000  
1 1 1 42 12 26 o 7.088000 0.6791000 6.360000 1.093000  7.816000 0.8069000 -1.456000      1.358000  
1 1 1 42 13 1  o 8.443000 0.5493000 8.905000 0.7668000 7.982000 0.7866000 0.9228000      1.099000  
1 1 1 42 13 3  o 11.67000 0.4052000 11.96000 0.5534000 11.39000 0.5920000 0.5752000      0.8104000 
1 1 1 42 13 5  o 11.09000 0.5327000 9.974000 0.9013000 12.21000 0.5680000 -2.234000      1.065000  
1 1 1 42 13 7  o 14.13000 0.4050000 13.80000 0.6170000 14.46000 0.5247000 -0.6575000     0.8099000 
1 1 1 42 13 9  o 7.526000 0.5499000 7.297000 0.7630000 7.756000 0.7920000 -0.4583000     1.100000  
1 1 1 42 13 11 o 4.816000 0.8253000 4.367000 1.216000  5.264000 1.117000  -0.8975000     1.651000  
1 1 1 42 13 13 o 5.841000 0.7796000 7.027000 0.8918000 4.656000 1.279000  2.371000       1.559000  
1 1 1 42 13 15 o 6.546000 0.6334000 6.520000 0.8950000 6.571000 0.8964000 -0.5061000E-01 1.267000  
1 1 1 42 13 17 o 3.800000 0.9226000 3.059000 1.182000  4.542000 1.417000  -1.482000      1.845000  
1 1 1 42 13 19 o 5.691000 0.7654000 5.838000 1.100000  5.543000 1.065000  0.2945000      1.531000  
1 1 1 42 13 21 o 2.791000 0.8231000 2.823000 1.166000  2.759000 1.162000  0.6406000E-01  1.646000  
1 1 1 42 13 23 o 4.259000 0.7652000 5.700000 0.9679000 2.817000 1.185000  2.883000       1.530000  
1 1 1 42 13 25 o 4.885000 0.9083000 4.222000 1.322000  5.548000 1.245000  -1.326000      1.817000  
1 1 1 42 13 27 o 3.244000 0.8792000 3.690000 1.317000  2.798000 1.166000  0.8918000      1.758000  
1 1 1 42 14 0  o 12.85000 0.5502000 12.85000 0.5502000 12.85000 0.5502000 0.000000       0.000000  
1 1 1 42 14 2  o 4.604000 0.9672000 4.442000 1.539000  4.765000 1.171000  -0.3233000     1.934000  
1 1 1 42 14 4  o 14.33000 0.4212000 14.53000 0.6616000 14.13000 0.5217000 0.4001000      0.8425000 
1 1 1 42 14 6  o 2.898000 0.8472000 3.049000 1.218000  2.746000 1.178000  0.3032000      1.694000  
1 1 1 42 14 8  o 11.06000 0.4666000 11.29000 0.6978000 10.84000 0.6197000 0.4535000      0.9333000 
1 1 1 42 14 10 o 11.94000 0.4064000 11.52000 0.6043000 12.36000 0.5437000 -0.8382000     0.8129000 
1 1 1 42 14 12 o 10.44000 0.4451000 10.76000 0.6083000 10.12000 0.6499000 0.6427000      0.8902000 
1 1 1 42 14 14 o 5.044000 0.8102000 5.109000 1.048000  4.979000 1.236000  0.1291000      1.620000  
1 1 1 42 14 16 o 4.854000 0.8034000 4.304000 1.217000  5.403000 1.049000  -1.099000      1.607000  
1 1 1 42 14 18 o 2.953000 0.8471000 3.003000 1.212000  2.903000 1.184000  0.9986000E-01  1.694000  
1 1 1 42 14 20 o 3.004000 0.8624000 2.963000 1.225000  3.044000 1.214000  -0.8129000E-01 1.725000  
1 1 1 42 14 22 o 3.834000 0.8812000 4.223000 1.244000  3.446000 1.249000  0.7766000      1.762000  
1 1 1 42 14 24 o 3.860000 0.8952000 3.433000 1.264000  4.287000 1.268000  -0.8545000     1.790000  
1 1 1 42 14 26 o 3.706000 0.8798000 3.948000 1.283000  3.463000 1.205000  0.4848000      1.760000  
1 1 1 42 15 1  o 8.851000 0.5377000 9.800000 0.7584000 7.902000 0.7626000 1.897000       1.075000  
1 1 1 42 15 3  o 8.903000 0.5282000 8.939000 0.8001000 8.868000 0.6899000 0.7038000E-01  1.056000  
1 1 1 42 15 5  o 7.201000 0.6181000 6.714000 0.9646000 7.688000 0.7732000 -0.9739000     1.236000  
1 1 1 42 15 7  o 9.385000 0.5086000 8.463000 0.7801000 10.31000 0.6529000 -1.844000      1.017000  
1 1 1 42 15 9  f 6.717000 0.6623000 6.922000 0.9264000 6.513000 0.9468000 0.4097000      1.325000  
1 1 1 42 15 11 o 13.94000 0.3677000 13.87000 0.5123000 14.02000 0.5276000 -0.1462000     0.7354000 
1 1 1 42 15 13 o 11.78000 0.3872000 12.02000 0.5510000 11.55000 0.5440000 0.4700000      0.7744000 
1 1 1 42 15 15 o 5.372000 0.8042000 5.082000 1.115000  5.663000 1.159000  -0.5810000     1.608000  
1 1 1 42 15 17 o 4.131000 0.8453000 4.010000 1.221000  4.252000 1.170000  -0.2428000     1.691000  
1 1 1 42 15 19 f 6.858000 0.7016000 8.687000 0.7113000 5.029000 1.210000  3.658000       1.403000  
1 1 1 42 15 21 o 5.408000 0.7934000 6.640000 0.9823000 4.175000 1.246000  2.465000       1.587000  
1 1 1 42 15 23 o 7.037000 0.5907000 6.976000 0.8484000 7.099000 0.8221000 -0.1231000     1.181000  
1 1 1 42 15 25 o 3.993000 0.9321000 3.405000 1.281000  4.581000 1.354000  -1.176000      1.864000  
1 1 1 42 16 0  o 2.850000 1.230000  2.850000 1.230000  2.850000 1.230000  0.000000       0.000000  
1 1 1 42 16 2  o 9.486000 0.4748000 9.470000 0.6756000 9.502000 0.6671000 -0.3248000E-01 0.9495000 
1 1 1 42 16 4  o 4.277000 0.9250000 3.968000 1.379000  4.586000 1.233000  -0.6174000     1.850000  
1 1 1 42 16 6  o 8.242000 0.6236000 8.434000 0.9339000 8.050000 0.8267000 0.3844000      1.247000  
1 1 1 42 16 8  o 2.634000 0.7944000 2.263000 1.061000  3.006000 1.183000  -0.7440000     1.589000  
1 1 1 42 16 10 o 7.039000 0.6304000 7.088000 0.8855000 6.990000 0.8974000 0.9755000E-01  1.261000  
1 1 1 42 16 12 o 5.490000 0.8186000 6.189000 0.9550000 4.791000 1.330000  1.398000       1.637000  
1 1 1 42 16 14 o 5.155000 0.7926000 5.021000 1.101000  5.289000 1.140000  -0.2683000     1.585000  
1 1 1 42 16 16 o 6.942000 0.6433000 7.380000 0.8288000 6.505000 0.9841000 0.8754000      1.287000  
1 1 1 42 16 18 o 5.649000 0.7917000 6.724000 0.9261000 4.573000 1.284000  2.152000       1.583000  
1 1 1 42 16 20 o 6.661000 0.6761000 8.044000 0.7487000 5.278000 1.126000  2.766000       1.352000  
1 1 1 42 16 22 o 4.715000 0.8586000 5.351000 1.075000  4.079000 1.339000  1.272000       1.717000  
1 1 1 42 16 24 o 7.327000 0.7789000 7.309000 0.8658000 7.345000 1.295000  -0.3634000E-01 1.558000  
1 1 1 42 17 1  o 8.892000 0.5560000 8.968000 0.6857000 8.816000 0.8754000 0.1514000      1.112000  
1 1 1 42 17 3  o 3.577000 0.9242000 3.464000 1.348000  3.691000 1.264000  -0.2277000     1.848000  
1 1 1 42 17 5  o 3.355000 0.9007000 3.193000 1.296000  3.517000 1.251000  -0.3242000     1.801000  
1 1 1 42 17 7  o 3.417000 0.9051000 3.596000 1.319000  3.238000 1.240000  0.3583000      1.810000  
1 1 1 42 17 9  o 8.132000 0.5368000 7.937000 0.7620000 8.328000 0.7563000 -0.3916000     1.074000  
1 1 1 42 17 11 o 9.824000 0.4735000 10.17000 0.6079000 9.474000 0.7261000 0.7011000      0.9470000 
1 1 1 42 17 13 o 11.38000 0.4250000 11.22000 0.5955000 11.55000 0.6066000 -0.3353000     0.8501000 
1 1 1 42 17 15 o 5.217000 0.7498000 4.998000 1.112000  5.435000 1.006000  -0.4369000     1.500000  
1 1 1 42 17 17 o 4.582000 0.8910000 4.837000 1.172000  4.328000 1.342000  0.5097000      1.782000  
1 1 1 42 17 19 f 6.627000 0.8576000 8.733000 0.6973000 4.521000 1.567000  4.212000       1.715000  
1 1 1 42 17 21 o 5.194000 0.8278000 4.842000 1.186000  5.547000 1.155000  -0.7054000     1.656000  
1 1 1 42 17 23 o 6.128000 0.8973000 6.023000 1.253000  6.233000 1.285000  -0.2098000     1.795000  
1 1 1 42 18 0  o 2.702000 1.205000  2.702000 1.205000  2.702000 1.205000  0.000000       0.000000  
1 1 1 42 18 2  o 3.488000 0.9496000 3.022000 1.269000  3.955000 1.413000  -0.9334000     1.899000  
1 1 1 42 18 4  o 5.310000 0.8296000 4.329000 1.267000  6.291000 1.071000  -1.962000      1.659000  
1 1 1 42 18 6  o 8.064000 0.6627000 7.161000 0.9970000 8.966000 0.8733000 -1.805000      1.325000  
1 1 1 42 18 8  o 4.609000 0.9288000 4.704000 1.142000  4.513000 1.465000  0.1909000      1.858000  
1 1 1 42 18 10 o 4.108000 0.9238000 4.512000 1.211000  3.705000 1.396000  0.8070000      1.848000  
1 1 1 42 18 12 o 3.723000 0.9212000 4.059000 1.260000  3.386000 1.344000  0.6739000      1.842000  
1 1 1 42 18 14 o 3.573000 0.9104000 3.710000 1.260000  3.436000 1.315000  0.2732000      1.821000  
1 1 1 42 18 16 o 8.345000 0.5912000 9.058000 0.7077000 7.632000 0.9471000 1.426000       1.182000  
1 1 1 42 18 18 o 6.070000 0.7568000 8.335000 0.7536000 3.804000 1.313000  4.531000       1.514000  
1 1 1 42 18 20 f 10.02000 0.4594000 10.76000 0.5953000 9.286000 0.7000000 1.474000       0.9189000 
1 1 1 42 18 22 o 5.989000 1.372000  6.644000 2.300000  5.334000 1.496000  1.310000       2.744000  
1 1 1 42 19 1  o 5.320000 0.7783000 5.766000 1.056000  4.873000 1.144000  0.8933000      1.557000  
1 1 1 42 19 3  o 3.485000 0.9682000 3.321000 1.261000  3.650000 1.469000  -0.3285000     1.936000  
1 1 1 42 19 5  o 3.430000 0.9480000 3.268000 1.229000  3.592000 1.444000  -0.3242000     1.896000  
1 1 1 42 19 7  o 4.503000 0.9971000 3.473000 1.319000  5.534000 1.496000  -2.061000      1.994000  
1 1 1 42 19 9  o 3.721000 0.9110000 4.103000 1.219000  3.339000 1.354000  0.7631000      1.822000  
1 1 1 42 19 11 f 4.597000 0.8599000 4.377000 1.186000  4.817000 1.246000  -0.4399000     1.720000  
1 1 1 42 19 13 o 5.608000 0.7327000 6.470000 0.9453000 4.745000 1.120000  1.725000       1.465000  
1 1 1 42 19 15 o 9.885000 0.5070000 9.931000 0.6769000 9.840000 0.7551000 0.9088000E-01  1.014000  
1 1 1 42 19 17 o 7.064000 0.7149000 8.200000 0.7425000 5.927000 1.222000  2.274000       1.430000  
1 1 1 42 19 19 o 6.953000 0.9749000 9.148000 0.8572000 4.758000 1.751000  4.390000       1.950000  
1 1 1 42 19 21 o 9.683000 0.9662000 10.98000 1.675000  8.383000 0.9637000 2.600000       1.932000  
1 1 1 42 19 23 o 4.028000 1.876000  ?        ?         4.028000 1.876000  ?              ?         
1 1 1 42 20 0  o 3.864000 1.368000  3.864000 1.368000  3.864000 1.368000  0.000000       0.000000  
1 1 1 42 20 2  o 3.094000 0.8895000 2.988000 1.213000  3.199000 1.301000  -0.2102000     1.779000  
1 1 1 42 20 4  o 5.085000 0.9173000 4.832000 1.248000  5.338000 1.344000  -0.5059000     1.835000  
1 1 1 42 20 6  o 5.175000 0.8895000 5.472000 1.169000  4.877000 1.341000  0.5945000      1.779000  
1 1 1 42 20 8  f 9.237000 0.5218000 8.927000 0.7620000 9.546000 0.7130000 -0.6190000     1.044000  
1 1 1 42 20 10 o 14.39000 0.3498000 14.88000 0.4751000 13.90000 0.5137000 0.9795000      0.6997000 
1 1 1 42 20 12 o 8.516000 0.5060000 9.469000 0.6300000 7.564000 0.7921000 1.905000       1.012000  
1 1 1 42 20 14 o 5.576000 0.8607000 6.096000 1.081000  5.056000 1.339000  1.039000       1.721000  
1 1 1 42 20 16 o 5.164000 0.8406000 6.285000 1.107000  4.044000 1.265000  2.241000       1.681000  
1 1 1 42 20 18 o 3.459000 1.011000  3.751000 1.529000  3.168000 1.323000  0.5830000      2.022000  
1 1 1 42 20 20 o 3.916000 0.9972000 4.576000 1.315000  3.257000 1.499000  1.319000       1.994000  
1 1 1 42 20 22 o 3.393000 1.616000  ?        ?         3.393000 1.616000  ?              ?         
1 1 1 42 21 1  o 5.819000 0.7593000 6.050000 1.101000  5.588000 1.046000  0.4617000      1.519000  
1 1 1 42 21 3  o 6.982000 0.6546000 7.294000 0.9384000 6.671000 0.9130000 0.6224000      1.309000  
1 1 1 42 21 5  o 4.463000 0.9798000 3.807000 1.358000  5.118000 1.412000  -1.312000      1.960000  
1 1 1 42 21 7  o 6.886000 0.6935000 7.015000 0.9956000 6.758000 0.9656000 0.2572000      1.387000  
1 1 1 42 21 9  o 8.968000 0.5800000 9.084000 0.9420000 8.851000 0.6770000 0.2328000      1.160000  
1 1 1 42 21 11 o 2.863000 0.8658000 2.929000 1.220000  2.797000 1.229000  0.1319000      1.732000  
1 1 1 42 21 13 o 12.88000 0.4076000 13.44000 0.5901000 12.32000 0.5625000 1.116000       0.8152000 
1 1 1 42 21 15 o 6.766000 0.7680000 6.930000 0.9425000 6.601000 1.213000  0.3296000      1.536000  
1 1 1 42 21 17 o 6.180000 0.9404000 6.521000 1.270000  5.839000 1.387000  0.6817000      1.881000  
1 1 1 42 21 19 o 3.168000 0.9383000 3.020000 1.291000  3.317000 1.362000  -0.2971000     1.877000  
1 1 1 42 21 21 o 3.836000 1.775000  ?        ?         3.836000 1.775000  ?              ?         
1 1 1 42 22 0  o 2.361000 1.080000  2.361000 1.080000  2.361000 1.080000  0.000000       0.000000  
1 1 1 42 22 2  o 3.825000 0.9106000 4.031000 1.297000  3.618000 1.279000  0.4131000      1.821000  
1 1 1 42 22 4  o 3.982000 0.8775000 3.191000 1.262000  4.773000 1.220000  -1.582000      1.755000  
1 1 1 42 22 6  o 3.114000 0.8965000 2.950000 1.223000  3.278000 1.311000  -0.3282000     1.793000  
1 1 1 42 22 8  o 3.880000 0.9631000 3.562000 1.264000  4.198000 1.454000  -0.6357000     1.926000  
1 1 1 42 22 10 o 5.480000 0.7515000 5.873000 0.9700000 5.087000 1.148000  0.7858000      1.503000  
1 1 1 42 22 12 o 10.32000 0.4361000 10.97000 0.6021000 9.675000 0.6312000 1.290000       0.8723000 
1 1 1 42 22 14 o 6.321000 0.9560000 6.311000 1.325000  6.331000 1.379000  -0.2056000E-01 1.912000  
1 1 1 42 22 16 o 12.09000 0.5166000 12.00000 0.7463000 12.18000 0.7144000 -0.1717000     1.033000  
1 1 1 42 22 18 o 6.156000 0.9761000 7.260000 1.241000  5.052000 1.507000  2.209000       1.952000  
1 1 1 42 23 1  o 3.156000 0.8856000 3.092000 1.249000  3.220000 1.256000  -0.1284000     1.771000  
1 1 1 42 23 3  o 4.558000 0.8400000 4.268000 1.233000  4.849000 1.141000  -0.5807000     1.680000  
1 1 1 42 23 5  o 2.913000 0.8594000 2.813000 1.201000  3.013000 1.229000  -0.1997000     1.719000  
1 1 1 42 23 7  o 3.520000 0.9733000 3.459000 1.220000  3.581000 1.517000  -0.1226000     1.947000  
1 1 1 42 23 9  o 8.892000 0.4971000 9.353000 0.6785000 8.431000 0.7266000 0.9218000      0.9941000 
1 1 1 42 23 11 o 3.452000 0.9733000 3.719000 1.382000  3.185000 1.370000  0.5339000      1.947000  
1 1 1 42 23 13 o 4.198000 0.9891000 3.456000 1.412000  4.940000 1.385000  -1.483000      1.978000  
1 1 1 42 23 15 o 5.836000 0.9775000 5.950000 1.336000  5.722000 1.427000  0.2282000      1.955000  
1 1 1 42 23 17 o 4.704000 1.030000  4.622000 1.474000  4.785000 1.439000  -0.1626000     2.060000  
1 1 1 42 24 0  o 3.409000 1.254000  3.409000 1.254000  3.409000 1.254000  0.000000       0.000000  
1 1 1 42 24 2  o 3.476000 0.8421000 4.201000 1.224000  2.751000 1.157000  1.450000       1.684000  
1 1 1 42 24 4  o 3.225000 0.8864000 3.090000 1.252000  3.360000 1.255000  -0.2698000     1.773000  
1 1 1 42 24 6  o 3.325000 0.8942000 3.505000 1.290000  3.146000 1.239000  0.3584000      1.788000  
1 1 1 42 24 8  o 3.547000 0.9293000 4.091000 1.270000  3.002000 1.357000  1.089000       1.859000  
1 1 1 42 24 10 o 5.315000 1.114000  5.872000 1.665000  4.757000 1.480000  1.114000       2.227000  
1 1 1 42 24 12 o 2.476000 0.8159000 2.464000 1.150000  2.488000 1.158000  -0.2308000E-01 1.632000  
1 1 1 42 24 14 o 5.373000 0.9751000 6.562000 1.237000  4.183000 1.507000  2.379000       1.950000  
1 1 1 42 24 16 o 5.686000 1.639000  ?        ?         5.686000 1.639000  ?              ?         
1 1 1 42 25 1  o 3.316000 0.8750000 3.094000 1.233000  3.537000 1.242000  -0.4435000     1.750000  
1 1 1 42 25 3  f 5.574000 0.7838000 5.377000 1.172000  5.772000 1.041000  -0.3954000     1.568000  
1 1 1 42 25 5  o 3.820000 0.9535000 3.799000 1.428000  3.842000 1.264000  -0.4278000E-01 1.907000  
1 1 1 42 25 7  o 4.530000 0.9217000 3.035000 1.313000  6.024000 1.294000  -2.989000      1.843000  
1 1 1 42 25 9  o 7.941000 0.7015000 8.993000 0.9543000 6.889000 1.028000  2.104000       1.403000  
1 1 1 42 25 11 o 4.409000 1.025000  5.541000 1.553000  3.277000 1.339000  2.264000       2.051000  
1 1 1 42 25 13 o 6.686000 0.8604000 7.831000 1.029000  5.540000 1.380000  2.291000       1.721000  
1 1 1 42 26 0  o 5.470000 1.129000  5.470000 1.129000  5.470000 1.129000  0.000000       0.000000  
1 1 1 42 26 2  o 3.016000 0.8571000 3.424000 1.263000  2.608000 1.159000  0.8161000      1.714000  
1 1 1 42 26 4  o 4.514000 0.9735000 3.579000 1.415000  5.449000 1.338000  -1.870000      1.947000  
1 1 1 42 26 6  o 3.507000 0.9367000 2.706000 1.239000  4.308000 1.405000  -1.602000      1.873000  
1 1 1 42 26 8  o 3.110000 0.9329000 3.116000 1.314000  3.105000 1.325000  0.1126000E-01  1.866000  
1 1 1 42 26 10 o 6.695000 0.8220000 6.877000 1.145000  6.513000 1.180000  0.3638000      1.644000  
1 1 1 42 27 1  o 4.702000 1.228000  3.745000 1.623000  5.660000 1.844000  -1.915000      2.456000  
1 1 1 42 27 3  o 3.559000 0.9462000 4.231000 1.423000  2.886000 1.248000  1.345000       1.892000  
1 1 1 42 27 5  o 3.051000 0.9350000 2.962000 1.314000  3.141000 1.331000  -0.1794000     1.870000  
1 1 1 42 27 7  o 4.379000 0.9528000 3.756000 1.367000  5.002000 1.328000  -1.247000      1.906000  
1 1 1 42 28 0  o 3.696000 1.619000  3.696000 1.619000  3.696000 1.619000  0.000000       0.000000  
1 1 1 42 28 2  o 5.053000 1.294000  4.563000 1.655000  5.544000 1.990000  -0.9811000     2.588000  
1 1 1 42 28 4  o 6.539000 2.092000  6.539000 2.092000  ?        ?         ?              ?         
1 1 1 43 0  1  o 18.83000 0.6796000 18.83000 0.6796000 18.83000 0.6796000 0.000000       0.000000  
1 1 1 43 0  3  o 15.00000 0.5399000 15.00000 0.5399000 15.00000 0.5399000 0.000000       0.000000  
1 1 1 43 0  5  f 8.376000 0.9717000 8.376000 0.9717000 8.376000 0.9717000 0.000000       0.000000  
1 1 1 43 0  7  o 8.322000 0.9151000 8.322000 0.9151000 8.322000 0.9151000 0.000000       0.000000  
1 1 1 43 0  9  o 10.98000 0.7986000 10.98000 0.7986000 10.98000 0.7986000 0.000000       0.000000  
1 1 1 43 0  11 o 10.70000 0.6822000 10.70000 0.6822000 10.70000 0.6822000 0.000000       0.000000  
1 1 1 43 0  13 o 2.595000 1.160000  2.595000 1.160000  2.595000 1.160000  0.000000       0.000000  
1 1 1 43 0  15 o 10.08000 0.6956000 10.08000 0.6956000 10.08000 0.6956000 0.000000       0.000000  
1 1 1 43 0  17 o 2.569000 1.105000  2.569000 1.105000  2.569000 1.105000  0.000000       0.000000  
1 1 1 43 0  19 o 2.893000 1.182000  2.893000 1.182000  2.893000 1.182000  0.000000       0.000000  
1 1 1 43 0  21 o 4.007000 1.281000  4.007000 1.281000  4.007000 1.281000  0.000000       0.000000  
1 1 1 43 0  23 o 3.541000 1.332000  3.541000 1.332000  3.541000 1.332000  0.000000       0.000000  
1 1 1 43 0  25 o 4.016000 1.412000  4.016000 1.412000  4.016000 1.412000  0.000000       0.000000  
1 1 1 43 0  27 o 5.382000 1.432000  5.382000 1.432000  5.382000 1.432000  0.000000       0.000000  
1 1 1 43 1  0  o 9.549000 0.6796000 9.549000 0.6796000 9.549000 0.6796000 0.000000       0.000000  
1 1 1 43 1  2  o 6.607000 1.042000  7.928000 0.9113000 5.286000 1.873000  2.642000       2.083000  
1 1 1 43 1  4  o 6.187000 0.8925000 6.307000 0.9254000 6.068000 1.526000  0.2396000      1.785000  
1 1 1 43 1  6  o 3.459000 0.9543000 4.136000 1.385000  2.782000 1.313000  1.354000       1.909000  
1 1 1 43 1  8  o 4.081000 0.9322000 4.762000 1.355000  3.400000 1.280000  1.363000       1.864000  
1 1 1 43 1  10 f 2.894000 0.8726000 3.031000 1.263000  2.757000 1.204000  0.2736000      1.745000  
1 1 1 43 1  12 o 7.304000 0.6744000 7.015000 0.9551000 7.593000 0.9525000 -0.5780000     1.349000  
1 1 1 43 1  14 o 4.818000 0.8150000 5.923000 1.054000  3.713000 1.243000  2.210000       1.630000  
1 1 1 43 1  16 o 9.375000 0.4999000 9.523000 0.7135000 9.227000 0.7004000 0.2965000      0.9998000 
1 1 1 43 1  18 o 4.742000 0.8671000 5.013000 1.171000  4.470000 1.279000  0.5428000      1.734000  
1 1 1 43 1  20 o 10.20000 0.4891000 10.43000 0.6111000 9.972000 0.7639000 0.4597000      0.9782000 
1 1 1 43 1  22 o 6.787000 0.7689000 6.749000 1.014000  6.826000 1.156000  -0.7735000E-01 1.538000  
1 1 1 43 1  24 o 12.44000 0.7822000 12.42000 0.7878000 12.45000 1.351000  -0.3212000E-01 1.564000  
1 1 1 43 1  26 o 13.43000 0.5756000 13.03000 0.7007000 13.82000 0.9134000 -0.7933000     1.151000  
1 1 1 43 2  1  o 7.219000 0.7283000 7.489000 1.007000  6.950000 1.052000  0.5395000      1.457000  
1 1 1 43 2  3  o 10.22000 0.5761000 10.39000 0.6150000 10.06000 0.9743000 0.3351000      1.152000  
1 1 1 43 2  5  o 5.008000 0.8768000 5.440000 1.109000  4.577000 1.358000  0.8628000      1.754000  
1 1 1 43 2  7  o 3.675000 0.9425000 3.253000 1.251000  4.098000 1.410000  -0.8450000     1.885000  
1 1 1 43 2  9  o 6.207000 1.065000  6.599000 1.355000  5.815000 1.642000  0.7839000      2.129000  
1 1 1 43 2  11 o 12.94000 0.5283000 12.42000 0.6741000 13.46000 0.8135000 -1.038000      1.057000  
1 1 1 43 2  13 o 4.897000 0.9296000 4.624000 1.195000  5.170000 1.425000  -0.5452000     1.859000  
1 1 1 43 2  15 o 3.670000 0.8960000 4.277000 1.252000  3.063000 1.282000  1.214000       1.792000  
1 1 1 43 2  17 o 10.21000 0.5016000 10.07000 0.6789000 10.35000 0.7387000 -0.2802000     1.003000  
1 1 1 43 2  19 o 4.317000 0.9069000 4.599000 1.239000  4.034000 1.325000  0.5650000      1.814000  
1 1 1 43 2  21 o 7.960000 0.5473000 7.567000 0.8014000 8.352000 0.7455000 -0.7851000     1.095000  
1 1 1 43 2  23 o 5.361000 0.8167000 5.148000 1.184000  5.574000 1.126000  -0.4260000     1.633000  
1 1 1 43 2  25 o 4.178000 0.9442000 4.861000 1.273000  3.495000 1.395000  1.365000       1.888000  
1 1 1 43 2  27 o 3.670000 0.9330000 3.818000 1.322000  3.523000 1.317000  0.2951000      1.866000  
1 1 1 43 3  0  o 24.05000 0.5305000 24.05000 0.5305000 24.05000 0.5305000 0.000000       0.000000  
1 1 1 43 3  2  o 9.621000 0.5617000 9.283000 0.7223000 9.960000 0.8604000 -0.6770000     1.123000  
1 1 1 43 3  4  o 3.007000 0.8567000 3.191000 1.266000  2.822000 1.154000  0.3695000      1.713000  
1 1 1 43 3  6  o 7.228000 0.6752000 7.064000 0.8879000 7.392000 1.017000  -0.3275000     1.350000  
1 1 1 43 3  8  o 5.099000 0.8371000 5.647000 1.100000  4.551000 1.263000  1.096000       1.674000  
1 1 1 43 3  10 o 3.854000 0.9823000 4.645000 1.495000  3.063000 1.275000  1.582000       1.965000  
1 1 1 43 3  12 o 6.091000 0.8046000 6.158000 1.102000  6.023000 1.173000  0.1345000      1.609000  
1 1 1 43 3  14 o 3.143000 0.8760000 3.109000 1.220000  3.178000 1.258000  -0.6931000E-01 1.752000  
1 1 1 43 3  16 o 4.455000 0.8734000 4.086000 1.302000  4.824000 1.165000  -0.7372000     1.747000  
1 1 1 43 3  18 o 2.823000 0.8287000 3.035000 1.222000  2.612000 1.119000  0.4226000      1.657000  
1 1 1 43 3  20 o 7.240000 0.6073000 7.689000 0.8490000 6.792000 0.8687000 0.8972000      1.215000  
1 1 1 43 3  22 o 3.742000 0.9008000 3.172000 1.242000  4.312000 1.305000  -1.141000      1.802000  
1 1 1 43 3  24 o 8.438000 0.6779000 9.693000 0.8957000 7.184000 1.018000  2.509000       1.356000  
1 1 1 43 3  26 o 8.979000 0.6165000 9.207000 0.9573000 8.751000 0.7770000 0.4568000      1.233000  
1 1 1 43 4  1  o 11.59000 0.4424000 11.74000 0.6531000 11.44000 0.5970000 0.2953000      0.8848000 
1 1 1 43 4  3  o 6.991000 0.7337000 6.072000 1.251000  7.910000 0.7680000 -1.838000      1.467000  
1 1 1 43 4  5  o 6.780000 0.6645000 6.088000 0.9496000 7.473000 0.9297000 -1.385000      1.329000  
1 1 1 43 4  7  o 5.163000 0.9162000 4.427000 1.304000  5.899000 1.288000  -1.472000      1.832000  
1 1 1 43 4  9  o 6.121000 0.7067000 6.175000 0.9762000 6.066000 1.022000  0.1090000      1.413000  
1 1 1 43 4  11 o 10.85000 0.4968000 10.57000 0.7263000 11.13000 0.6780000 -0.5555000     0.9936000 
1 1 1 43 4  13 o 3.580000 0.9413000 3.429000 1.232000  3.730000 1.424000  -0.3010000     1.883000  
1 1 1 43 4  15 o 9.177000 0.5246000 9.449000 0.7006000 8.904000 0.7811000 0.5453000      1.049000  
1 1 1 43 4  17 o 5.957000 0.7358000 5.729000 1.068000  6.185000 1.013000  -0.4564000     1.472000  
1 1 1 43 4  19 o 5.609000 0.7179000 4.971000 1.098000  6.246000 0.9253000 -1.275000      1.436000  
1 1 1 43 4  21 o 6.245000 0.8557000 7.812000 1.193000  4.678000 1.227000  3.134000       1.711000  
1 1 1 43 4  23 o 11.58000 0.5866000 11.43000 0.7550000 11.72000 0.8980000 -0.2916000     1.173000  
1 1 1 43 4  25 o 5.348000 0.8185000 6.569000 1.025000  4.127000 1.277000  2.442000       1.637000  
1 1 1 43 4  27 o 3.238000 0.9939000 2.990000 1.356000  3.486000 1.454000  -0.4960000     1.988000  
1 1 1 43 5  0  o 27.25000 0.4542000 27.25000 0.4542000 27.25000 0.4542000 0.000000       0.000000  
1 1 1 43 5  2  o 12.20000 0.4147000 12.37000 0.5828000 12.02000 0.5902000 0.3507000      0.8294000 
1 1 1 43 5  4  o 4.777000 0.8757000 4.952000 1.255000  4.602000 1.222000  0.3502000      1.751000  
1 1 1 43 5  6  o 5.637000 0.8386000 6.131000 1.109000  5.144000 1.258000  0.9872000      1.677000  
1 1 1 43 5  8  o 3.410000 0.9060000 3.022000 1.260000  3.798000 1.302000  -0.7761000     1.812000  
1 1 1 43 5  10 o 5.607000 0.8742000 5.769000 1.232000  5.445000 1.241000  0.3241000      1.748000  
1 1 1 43 5  12 o 6.117000 0.8268000 6.717000 1.138000  5.517000 1.199000  1.201000       1.654000  
1 1 1 43 5  14 o 6.394000 0.7786000 5.898000 1.216000  6.890000 0.9732000 -0.9929000     1.557000  
1 1 1 43 5  16 o 6.222000 0.7714000 7.637000 0.9549000 4.806000 1.212000  2.831000       1.543000  
1 1 1 43 5  18 o 4.092000 0.8698000 3.425000 1.307000  4.760000 1.148000  -1.335000      1.740000  
1 1 1 43 5  20 o 5.691000 0.8195000 6.143000 1.172000  5.238000 1.146000  0.9044000      1.639000  
1 1 1 43 5  22 o 4.624000 0.8775000 5.093000 1.239000  4.155000 1.243000  0.9385000      1.755000  
1 1 1 43 5  24 f 4.531000 0.8966000 4.850000 1.285000  4.212000 1.251000  0.6372000      1.793000  
1 1 1 43 5  26 o 4.910000 0.9257000 4.289000 1.329000  5.531000 1.290000  -1.242000      1.851000  
1 1 1 43 6  1  o 5.958000 0.7615000 6.588000 0.9803000 5.327000 1.166000  1.261000       1.523000  
1 1 1 43 6  3  o 7.273000 0.5940000 6.514000 0.9434000 8.031000 0.7221000 -1.517000      1.188000  
1 1 1 43 6  5  o 3.361000 0.8733000 3.824000 1.274000  2.898000 1.194000  0.9253000      1.747000  
1 1 1 43 6  7  o 6.589000 0.6971000 6.367000 0.9761000 6.812000 0.9954000 -0.4456000     1.394000  
1 1 1 43 6  9  o 3.066000 0.8862000 3.118000 1.235000  3.014000 1.272000  0.1038000      1.772000  
1 1 1 43 6  11 o 5.951000 0.8459000 6.824000 0.9180000 5.078000 1.421000  1.746000       1.692000  
1 1 1 43 6  13 o 3.507000 0.8781000 2.894000 1.205000  4.120000 1.278000  -1.225000      1.756000  
1 1 1 43 6  15 o 9.142000 0.5250000 10.20000 0.6817000 8.088000 0.7986000 2.108000       1.050000  
1 1 1 43 6  17 o 9.898000 0.5217000 10.05000 0.6923000 9.750000 0.7806000 0.2958000      1.043000  
1 1 1 43 6  19 o 4.016000 0.9211000 4.232000 1.369000  3.799000 1.233000  0.4333000      1.842000  
1 1 1 43 6  21 o 9.559000 0.5056000 10.40000 0.7030000 8.722000 0.7269000 1.674000       1.011000  
1 1 1 43 6  23 o 3.520000 0.9180000 3.804000 1.350000  3.237000 1.245000  0.5668000      1.836000  
1 1 1 43 6  25 o 11.50000 0.5024000 12.34000 0.7637000 10.66000 0.6529000 1.679000       1.005000  
1 1 1 43 7  0  o 17.08000 0.4701000 17.08000 0.4701000 17.08000 0.4701000 0.000000       0.000000  
1 1 1 43 7  2  o 7.630000 0.5620000 7.298000 0.8113000 7.962000 0.7781000 -0.6640000     1.124000  
1 1 1 43 7  4  o 3.220000 0.8778000 3.260000 1.246000  3.180000 1.237000  0.8009000E-01  1.756000  
1 1 1 43 7  6  o 5.100000 0.8251000 4.971000 1.171000  5.229000 1.163000  -0.2582000     1.650000  
1 1 1 43 7  8  o 5.491000 0.7972000 5.740000 1.057000  5.242000 1.194000  0.4974000      1.594000  
1 1 1 43 7  10 o 17.88000 0.4084000 18.18000 0.6036000 17.58000 0.5504000 0.6035000      0.8168000 
1 1 1 43 7  12 o 12.76000 0.4183000 12.35000 0.5594000 13.16000 0.6221000 -0.8079000     0.8366000 
1 1 1 43 7  14 o 8.373000 0.6459000 9.239000 0.7893000 7.507000 1.023000  1.732000       1.292000  
1 1 1 43 7  16 o 6.755000 0.7149000 7.600000 0.9539000 5.910000 1.065000  1.690000       1.430000  
1 1 1 43 7  18 o 6.329000 0.8698000 5.987000 1.421000  6.671000 1.003000  -0.6840000     1.740000  
1 1 1 43 7  20 o 5.119000 0.8501000 5.031000 1.237000  5.206000 1.167000  -0.1748000     1.700000  
1 1 1 43 7  22 o 15.52000 0.4221000 14.68000 0.5595000 16.36000 0.6322000 -1.678000      0.8443000 
1 1 1 43 7  24 o 7.866000 0.6656000 8.666000 1.011000  7.067000 0.8666000 1.599000       1.331000  
1 1 1 43 7  26 o 6.449000 0.7367000 6.204000 1.048000  6.693000 1.036000  -0.4896000     1.473000  
1 1 1 43 8  1  o 10.64000 0.4413000 10.66000 0.6256000 10.62000 0.6227000 0.4380000E-01  0.8826000 
1 1 1 43 8  3  o 10.40000 0.4411000 10.60000 0.6015000 10.21000 0.6454000 0.3967000      0.8822000 
1 1 1 43 8  5  o 4.772000 0.8164000 4.369000 1.187000  5.174000 1.121000  -0.8049000     1.633000  
1 1 1 43 8  7  o 3.631000 0.8819000 4.315000 1.287000  2.947000 1.207000  1.367000       1.764000  
1 1 1 43 8  9  o 9.625000 0.5195000 9.024000 0.7794000 10.23000 0.6871000 -1.201000      1.039000  
1 1 1 43 8  11 o 3.225000 0.8845000 3.411000 1.220000  3.038000 1.281000  0.3737000      1.769000  
1 1 1 43 8  13 f 12.47000 0.4236000 12.86000 0.5442000 12.07000 0.6492000 0.7898000      0.8472000 
1 1 1 43 8  15 f 11.08000 0.4717000 11.12000 0.7060000 11.03000 0.6257000 0.9054000E-01  0.9433000 
1 1 1 43 8  17 o 6.736000 0.7573000 6.963000 1.057000  6.509000 1.085000  0.4544000      1.515000  
1 1 1 43 8  19 o 12.34000 0.4637000 11.71000 0.6983000 12.97000 0.6103000 -1.258000      0.9274000 
1 1 1 43 8  21 o 7.557000 0.5934000 8.083000 0.8162000 7.031000 0.8615000 1.052000       1.187000  
1 1 1 43 8  23 o 7.439000 0.6289000 7.944000 0.8737000 6.935000 0.9049000 1.009000       1.258000  
1 1 1 43 8  25 o 2.609000 0.8160000 2.793000 1.201000  2.425000 1.104000  0.3679000      1.632000  
1 1 1 43 9  0  o 2.041000 0.9653000 2.041000 0.9653000 2.041000 0.9653000 0.000000       0.000000  
1 1 1 43 9  2  o 6.160000 0.6937000 6.697000 0.9103000 5.623000 1.047000  1.075000       1.387000  
1 1 1 43 9  4  o 10.09000 0.4614000 10.21000 0.6283000 9.974000 0.6760000 0.2331000      0.9229000 
1 1 1 43 9  6  o 7.146000 0.6405000 6.438000 0.9474000 7.853000 0.8623000 -1.415000      1.281000  
1 1 1 43 9  8  o 5.361000 0.8108000 4.970000 1.187000  5.752000 1.105000  -0.7826000     1.622000  
1 1 1 43 9  10 o 5.522000 0.8246000 4.031000 1.303000  7.013000 1.011000  -2.982000      1.649000  
1 1 1 43 9  12 o 3.183000 0.8726000 3.899000 1.285000  2.468000 1.181000  1.431000       1.745000  
1 1 1 43 9  14 o 3.452000 0.8917000 3.744000 1.172000  3.160000 1.344000  0.5844000      1.783000  
1 1 1 43 9  16 o 3.936000 0.9496000 5.031000 1.412000  2.841000 1.271000  2.189000       1.899000  
1 1 1 43 9  18 o 6.253000 0.7981000 8.070000 0.8314000 4.435000 1.363000  3.635000       1.596000  
1 1 1 43 9  20 o 2.605000 0.8476000 2.537000 1.122000  2.673000 1.271000  -0.1360000     1.695000  
1 1 1 43 9  22 o 9.642000 0.8395000 8.020000 0.9579000 11.26000 1.379000  -3.245000      1.679000  
1 1 1 43 9  24 o 3.639000 0.9689000 3.189000 1.266000  4.088000 1.467000  -0.8997000     1.938000  
1 1 1 43 10 1  o 9.630000 0.4547000 9.095000 0.6707000 10.16000 0.6141000 -1.070000      0.9094000 
1 1 1 43 10 3  o 2.877000 0.8345000 2.622000 1.108000  3.132000 1.248000  -0.5100000     1.669000  
1 1 1 43 10 5  o 2.998000 0.8506000 2.701000 1.148000  3.295000 1.255000  -0.5939000     1.701000  
1 1 1 43 10 7  o 8.561000 0.5893000 7.974000 0.8778000 9.148000 0.7866000 -1.174000      1.179000  
1 1 1 43 10 9  f 12.54000 0.5084000 13.25000 0.7464000 11.82000 0.6905000 1.432000       1.017000  
1 1 1 43 10 11 o 10.89000 0.4319000 11.50000 0.5751000 10.28000 0.6444000 1.225000       0.8637000 
1 1 1 43 10 13 o 6.347000 0.7565000 7.378000 0.8447000 5.316000 1.255000  2.061000       1.513000  
1 1 1 43 10 15 o 4.327000 0.9182000 4.208000 1.291000  4.445000 1.306000  -0.2367000     1.836000  
1 1 1 43 10 17 o 8.369000 0.5725000 9.354000 0.6975000 7.384000 0.9081000 1.970000       1.145000  
1 1 1 43 10 19 o 6.397000 0.7305000 6.073000 1.072000  6.722000 0.9925000 -0.6490000     1.461000  
1 1 1 43 10 21 o 2.539000 0.7864000 2.911000 1.194000  2.167000 1.023000  0.7432000      1.573000  
1 1 1 43 10 23 o 3.027000 0.9091000 3.554000 1.405000  2.500000 1.154000  1.053000       1.818000  
1 1 1 43 10 25 o 2.346000 0.7641000 2.653000 1.163000  2.039000 0.9909000 0.6143000      1.528000  
1 1 1 43 11 0  o 3.803000 1.219000  3.803000 1.219000  3.803000 1.219000  0.000000       0.000000  
1 1 1 43 11 2  o 7.463000 0.5729000 6.866000 0.8812000 8.061000 0.7324000 -1.195000      1.146000  
1 1 1 43 11 4  o 11.17000 0.4213000 10.94000 0.6222000 11.40000 0.5683000 -0.4618000     0.8426000 
1 1 1 43 11 6  o 7.386000 0.6750000 7.100000 0.8915000 7.671000 1.014000  -0.5713000     1.350000  
1 1 1 43 11 8  o 5.554000 0.8466000 5.755000 1.143000  5.352000 1.249000  0.4031000      1.693000  
1 1 1 43 11 10 o 8.268000 0.5587000 7.727000 0.8435000 8.810000 0.7329000 -1.083000      1.117000  
1 1 1 43 11 12 o 7.620000 0.6110000 8.182000 0.8632000 7.057000 0.8650000 1.125000       1.222000  
1 1 1 43 11 14 o 7.382000 0.6648000 7.911000 0.7845000 6.854000 1.073000  1.057000       1.330000  
1 1 1 43 11 16 o 5.084000 0.8221000 4.894000 1.169000  5.274000 1.157000  -0.3803000     1.644000  
1 1 1 43 11 18 o 9.945000 0.5001000 10.44000 0.6048000 9.454000 0.7966000 0.9809000      1.000000  
1 1 1 43 11 20 o 4.660000 0.8409000 4.427000 1.147000  4.893000 1.230000  -0.4656000     1.682000  
1 1 1 43 11 22 o 3.049000 0.8524000 2.669000 1.155000  3.429000 1.254000  -0.7597000     1.705000  
1 1 1 43 11 24 o 3.450000 0.8575000 2.611000 1.171000  4.288000 1.254000  -1.677000      1.715000  
1 1 1 43 12 1  o 8.322000 0.5350000 8.239000 0.7411000 8.405000 0.7717000 -0.1656000     1.070000  
1 1 1 43 12 3  o 10.97000 0.4615000 11.22000 0.5745000 10.71000 0.7225000 0.5138000      0.9230000 
1 1 1 43 12 5  o 8.365000 0.5243000 7.800000 0.8234000 8.930000 0.6493000 -1.129000      1.049000  
1 1 1 43 12 7  o 5.178000 0.8104000 3.944000 1.296000  6.412000 0.9735000 -2.468000      1.621000  
1 1 1 43 12 9  o 10.99000 0.4539000 11.16000 0.6358000 10.81000 0.6480000 0.3446000      0.9079000 
1 1 1 43 12 11 o 5.175000 0.9299000 4.944000 1.478000  5.406000 1.128000  -0.4616000     1.860000  
1 1 1 43 12 13 o 3.077000 0.8692000 3.791000 1.382000  2.362000 1.054000  1.429000       1.738000  
1 1 1 43 12 15 o 3.326000 0.9409000 3.621000 1.396000  3.031000 1.262000  0.5896000      1.882000  
1 1 1 43 12 17 o 5.491000 0.9759000 5.313000 1.610000  5.669000 1.104000  -0.3566000     1.952000  
1 1 1 43 12 19 o 6.733000 0.6681000 6.605000 0.8616000 6.861000 1.021000  -0.2563000     1.336000  
1 1 1 43 12 21 o 6.933000 0.7061000 7.524000 1.025000  6.342000 0.9714000 1.181000       1.412000  
1 1 1 43 12 23 o 7.879000 0.6659000 8.040000 1.079000  7.717000 0.7799000 0.3230000      1.332000  
1 1 1 43 13 0  o 6.722000 0.8362000 6.722000 0.8362000 6.722000 0.8362000 0.000000       0.000000  
1 1 1 43 13 2  o 3.646000 0.9140000 3.353000 1.257000  3.939000 1.327000  -0.5866000     1.828000  
1 1 1 43 13 4  o 3.787000 0.8860000 4.529000 1.280000  3.044000 1.226000  1.484000       1.772000  
1 1 1 43 13 6  o 3.414000 0.8882000 3.046000 1.219000  3.782000 1.292000  -0.7356000     1.776000  
1 1 1 43 13 8  o 6.092000 0.8828000 4.199000 1.587000  7.986000 0.7746000 -3.787000      1.766000  
1 1 1 43 13 10 o 11.94000 0.4889000 12.09000 0.7732000 11.79000 0.5985000 0.3001000      0.9777000 
1 1 1 43 13 12 o 5.151000 0.7961000 5.514000 1.041000  4.788000 1.204000  0.7260000      1.592000  
1 1 1 43 13 14 o 3.754000 0.8868000 3.687000 1.242000  3.822000 1.266000  -0.1350000     1.774000  
1 1 1 43 13 16 o 3.784000 0.9019000 3.615000 1.245000  3.953000 1.306000  -0.3380000     1.804000  
1 1 1 43 13 18 o 3.948000 0.9325000 4.139000 1.355000  3.756000 1.282000  0.3830000      1.865000  
1 1 1 43 13 20 o 6.464000 0.7317000 7.596000 0.9437000 5.333000 1.118000  2.263000       1.463000  
1 1 1 43 13 22 o 2.883000 0.7846000 3.858000 1.271000  1.909000 0.9199000 1.949000       1.569000  
1 1 1 43 14 1  o 5.418000 0.8619000 4.360000 1.363000  6.475000 1.055000  -2.115000      1.724000  
1 1 1 43 14 3  o 11.05000 0.4263000 11.17000 0.5914000 10.93000 0.6140000 0.2337000      0.8525000 
1 1 1 43 14 5  o 2.774000 0.8512000 2.628000 1.200000  2.920000 1.208000  -0.2926000     1.702000  
1 1 1 43 14 7  o 3.791000 0.9921000 4.789000 1.594000  2.793000 1.181000  1.996000       1.984000  
1 1 1 43 14 9  o 2.685000 0.8091000 2.808000 1.146000  2.563000 1.142000  0.2451000      1.618000  
1 1 1 43 14 11 o 2.606000 0.7851000 2.432000 1.069000  2.780000 1.150000  -0.3480000     1.570000  
1 1 1 43 14 13 o 5.112000 0.8347000 5.350000 1.105000  4.873000 1.251000  0.4764000      1.669000  
1 1 1 43 14 15 o 7.718000 0.6206000 7.283000 0.8359000 8.152000 0.9174000 -0.8691000     1.241000  
1 1 1 43 14 17 o 8.148000 0.5471000 8.492000 0.7607000 7.805000 0.7865000 0.6870000      1.094000  
1 1 1 43 14 19 o 11.06000 0.6002000 12.22000 0.7059000 9.899000 0.9709000 2.325000       1.200000  
1 1 1 43 14 21 o 8.338000 0.6333000 8.890000 0.7061000 7.786000 1.051000  1.104000       1.267000  
1 1 1 43 14 23 o 5.047000 1.324000  6.751000 2.254000  3.343000 1.390000  3.408000       2.648000  
1 1 1 43 15 0  o 4.471000 1.177000  4.471000 1.177000  4.471000 1.177000  0.000000       0.000000  
1 1 1 43 15 2  f 6.789000 0.7728000 7.021000 1.179000  6.557000 0.9989000 0.4642000      1.546000  
1 1 1 43 15 4  o 12.21000 0.5256000 11.86000 0.8733000 12.57000 0.5852000 -0.7119000     1.051000  
1 1 1 43 15 6  o 4.238000 0.9055000 4.039000 1.302000  4.436000 1.259000  -0.3967000     1.811000  
1 1 1 43 15 8  o 2.950000 0.8602000 3.030000 1.252000  2.869000 1.180000  0.1610000      1.720000  
1 1 1 43 15 10 o 3.776000 0.9196000 3.290000 1.246000  4.262000 1.352000  -0.9716000     1.839000  
1 1 1 43 15 12 o 6.058000 0.7344000 5.784000 1.027000  6.331000 1.050000  -0.5462000     1.469000  
1 1 1 43 15 14 o 7.609000 0.5828000 8.465000 0.7577000 6.753000 0.8858000 1.712000       1.166000  
1 1 1 43 15 16 o 3.287000 0.8714000 2.620000 1.144000  3.954000 1.315000  -1.334000      1.743000  
1 1 1 43 15 18 o 2.871000 0.8550000 2.916000 1.192000  2.825000 1.226000  0.9141000E-01  1.710000  
1 1 1 43 15 20 o 3.998000 0.8549000 5.139000 1.184000  2.857000 1.234000  2.282000       1.710000  
1 1 1 43 15 22 o 4.976000 1.170000  3.758000 1.758000  6.194000 1.545000  -2.436000      2.340000  
1 1 1 43 16 1  o 7.034000 0.7812000 5.687000 1.303000  8.381000 0.8614000 -2.694000      1.562000  
1 1 1 43 16 3  o 4.409000 1.033000  4.814000 1.574000  4.005000 1.337000  0.8089000      2.065000  
1 1 1 43 16 5  o 6.159000 0.7500000 5.647000 1.191000  6.672000 0.9115000 -1.025000      1.500000  
1 1 1 43 16 7  o 8.902000 0.5140000 9.085000 0.7180000 8.719000 0.7358000 0.3666000      1.028000  
1 1 1 43 16 9  o 6.220000 0.6946000 7.111000 0.8509000 5.329000 1.098000  1.782000       1.389000  
1 1 1 43 16 11 o 4.542000 0.9214000 4.700000 1.189000  4.384000 1.408000  0.3162000      1.843000  
1 1 1 43 16 13 o 3.057000 0.8704000 2.350000 1.080000  3.765000 1.366000  -1.415000      1.741000  
1 1 1 43 16 15 o 3.467000 0.8847000 2.675000 1.150000  4.259000 1.344000  -1.583000      1.769000  
1 1 1 43 16 17 o 3.107000 0.8322000 4.058000 1.299000  2.155000 1.041000  1.903000       1.664000  
1 1 1 43 16 19 o 3.428000 0.8816000 4.439000 1.397000  2.417000 1.075000  2.021000       1.763000  
1 1 1 43 16 21 o 2.862000 0.8954000 2.304000 1.041000  3.419000 1.457000  -1.116000      1.791000  
1 1 1 43 17 0  o 4.811000 1.318000  4.811000 1.318000  4.811000 1.318000  0.000000       0.000000  
1 1 1 43 17 2  o 4.178000 0.9317000 3.866000 1.293000  4.491000 1.342000  -0.6245000     1.863000  
1 1 1 43 17 4  o 4.109000 0.9413000 3.263000 1.356000  4.955000 1.306000  -1.692000      1.883000  
1 1 1 43 17 6  o 4.297000 1.006000  4.181000 1.314000  4.413000 1.523000  -0.2328000     2.012000  
1 1 1 43 17 8  o 3.835000 0.9192000 3.206000 1.260000  4.463000 1.339000  -1.257000      1.838000  
1 1 1 43 17 10 o 6.069000 0.7940000 5.961000 1.056000  6.177000 1.186000  -0.2158000     1.588000  
1 1 1 43 17 12 o 8.907000 0.5509000 9.115000 0.6907000 8.700000 0.8583000 0.4155000      1.102000  
1 1 1 43 17 14 o 3.186000 0.8695000 3.539000 1.259000  2.833000 1.200000  0.7051000      1.739000  
1 1 1 43 17 16 o 2.491000 0.7814000 2.518000 1.116000  2.464000 1.094000  0.5432000E-01  1.563000  
1 1 1 43 17 18 o 5.672000 0.7642000 6.954000 0.8790000 4.391000 1.250000  2.563000       1.528000  
1 1 1 43 17 20 o 5.616000 1.331000  5.787000 2.258000  5.445000 1.408000  0.3423000      2.661000  
1 1 1 43 18 1  o 6.545000 0.7843000 6.644000 0.9313000 6.447000 1.262000  0.1975000      1.569000  
1 1 1 43 18 3  o 10.60000 0.4779000 10.08000 0.6647000 11.12000 0.6867000 -1.045000      0.9557000 
1 1 1 43 18 5  o 6.283000 0.8256000 6.212000 1.107000  6.353000 1.225000  -0.1412000     1.651000  
1 1 1 43 18 7  o 3.949000 0.9005000 3.487000 1.299000  4.412000 1.248000  -0.9244000     1.801000  
1 1 1 43 18 9  o 4.495000 0.8984000 3.959000 1.247000  5.031000 1.294000  -1.072000      1.797000  
1 1 1 43 18 11 f 2.381000 0.7640000 2.178000 1.006000  2.585000 1.150000  -0.4070000     1.528000  
1 1 1 43 18 13 o 3.227000 0.8621000 3.414000 1.255000  3.039000 1.182000  0.3746000      1.724000  
1 1 1 43 18 15 o 5.903000 0.8124000 5.740000 1.226000  6.067000 1.067000  -0.3270000     1.625000  
1 1 1 43 18 17 o 3.783000 0.9921000 4.352000 1.535000  3.214000 1.257000  1.138000       1.984000  
1 1 1 43 18 19 o 3.586000 1.037000  3.074000 1.389000  4.097000 1.539000  -1.023000      2.073000  
1 1 1 43 19 0  o 6.017000 1.169000  6.017000 1.169000  6.017000 1.169000  0.000000       0.000000  
1 1 1 43 19 2  o 4.447000 0.9697000 3.936000 1.310000  4.958000 1.430000  -1.023000      1.939000  
1 1 1 43 19 4  o 5.410000 0.8351000 6.490000 1.091000  4.331000 1.264000  2.159000       1.670000  
1 1 1 43 19 6  o 4.681000 1.026000  4.775000 1.569000  4.586000 1.323000  0.1894000      2.052000  
1 1 1 43 19 8  o 6.875000 0.7010000 6.890000 1.046000  6.860000 0.9340000 0.2916000E-01  1.402000  
1 1 1 43 19 10 o 9.871000 0.4942000 9.641000 0.7345000 10.10000 0.6615000 -0.4591000     0.9885000 
1 1 1 43 19 12 o 6.620000 0.7410000 6.500000 1.096000  6.741000 0.9973000 -0.2410000     1.482000  
1 1 1 43 19 14 o 12.64000 0.4228000 13.01000 0.6167000 12.28000 0.5785000 0.7333000      0.8456000 
1 1 1 43 19 16 o 3.118000 0.9070000 3.788000 1.387000  2.448000 1.169000  1.340000       1.814000  
1 1 1 43 19 18 f 4.468000 1.274000  5.755000 2.124000  3.180000 1.408000  2.575000       2.548000  
1 1 1 43 20 1  o 5.469000 0.7919000 5.100000 1.228000  5.839000 0.9999000 -0.7389000     1.584000  
1 1 1 43 20 3  o 9.196000 0.5709000 8.802000 0.7871000 9.591000 0.8272000 -0.7892000     1.142000  
1 1 1 43 20 5  o 2.345000 0.7665000 2.572000 1.153000  2.118000 1.011000  0.4547000      1.533000  
1 1 1 43 20 7  o 6.805000 0.7357000 6.461000 1.131000  7.148000 0.9416000 -0.6872000     1.471000  
1 1 1 43 20 9  o 6.648000 0.6994000 6.226000 1.025000  7.070000 0.9517000 -0.8437000     1.399000  
1 1 1 43 20 11 o 10.73000 0.4437000 10.84000 0.6124000 10.62000 0.6422000 0.2221000      0.8874000 
1 1 1 43 20 13 o 5.885000 0.8321000 6.122000 1.269000  5.647000 1.076000  0.4752000      1.664000  
1 1 1 43 20 15 o 6.596000 0.8743000 7.210000 1.134000  5.983000 1.331000  1.227000       1.749000  
1 1 1 43 21 0  o 5.026000 1.243000  5.026000 1.243000  5.026000 1.243000  0.000000       0.000000  
1 1 1 43 21 2  o 6.704000 0.6775000 6.431000 1.015000  6.977000 0.8972000 -0.5465000     1.355000  
1 1 1 43 21 4  o 3.785000 0.9376000 4.021000 1.253000  3.550000 1.395000  0.4713000      1.875000  
1 1 1 43 21 6  o 13.06000 0.4935000 14.05000 0.7674000 12.06000 0.6207000 1.995000       0.9870000 
1 1 1 43 21 8  o 9.346000 0.5786000 9.288000 0.8711000 9.403000 0.7619000 -0.1149000     1.157000  
1 1 1 43 21 10 o 8.188000 0.5698000 8.590000 0.7412000 7.786000 0.8655000 0.8042000      1.140000  
1 1 1 43 21 12 o 5.417000 0.8334000 4.793000 1.105000  6.040000 1.248000  -1.247000      1.667000  
1 1 1 43 21 14 o 4.972000 1.035000  5.469000 1.392000  4.474000 1.534000  0.9952000      2.071000  
1 1 1 43 22 1  o 4.318000 0.9298000 5.000000 1.292000  3.635000 1.338000  1.365000       1.860000  
1 1 1 43 22 3  o 3.338000 0.8669000 2.623000 1.156000  4.053000 1.292000  -1.430000      1.734000  
1 1 1 43 22 5  o 5.410000 0.9581000 4.744000 1.324000  6.076000 1.385000  -1.331000      1.916000  
1 1 1 43 22 7  f 3.297000 0.9017000 3.005000 1.219000  3.588000 1.329000  -0.5825000     1.803000  
1 1 1 43 22 9  o 8.359000 0.6526000 8.887000 0.7632000 7.830000 1.059000  1.057000       1.305000  
1 1 1 43 22 11 o 8.054000 0.7553000 7.456000 1.123000  8.652000 1.010000  -1.196000      1.511000  
1 1 1 43 22 13 o 3.705000 0.9741000 3.963000 1.402000  3.447000 1.353000  0.5161000      1.948000  
1 1 1 43 23 0  f 4.785000 1.249000  4.785000 1.249000  4.785000 1.249000  0.000000       0.000000  
1 1 1 43 23 2  o 3.155000 0.8892000 2.861000 1.214000  3.450000 1.299000  -0.5890000     1.778000  
1 1 1 43 23 4  f 3.022000 0.8764000 3.483000 1.309000  2.560000 1.166000  0.9227000      1.753000  
1 1 1 43 23 6  o 2.433000 0.8128000 2.723000 1.241000  2.142000 1.050000  0.5813000      1.626000  
1 1 1 43 23 8  o 2.862000 0.8891000 3.029000 1.296000  2.695000 1.218000  0.3337000      1.778000  
1 1 1 43 23 10 o 3.429000 0.9812000 3.416000 1.359000  3.442000 1.416000  -0.2675000E-01 1.962000  
1 1 1 43 24 1  o 2.940000 0.8564000 3.120000 1.241000  2.759000 1.180000  0.3608000      1.713000  
1 1 1 43 24 3  o 9.761000 0.6463000 10.19000 0.9117000 9.327000 0.9164000 0.8675000      1.293000  
1 1 1 43 24 5  o 3.858000 1.017000  3.831000 1.471000  3.884000 1.404000  -0.5337000E-01 2.034000  
1 1 1 43 24 7  o 4.219000 1.028000  3.798000 1.509000  4.639000 1.396000  -0.8406000     2.056000  
1 1 1 43 25 0  o 5.105000 1.524000  5.105000 1.524000  5.105000 1.524000  0.000000       0.000000  
1 1 1 43 25 2  o 3.477000 1.019000  3.456000 1.519000  3.498000 1.360000  -0.4165000E-01 2.038000  
1 1 1 43 25 4  o 3.612000 0.9969000 2.519000 1.197000  4.706000 1.594000  -2.187000      1.994000  
1 1 1 43 25 6  o 3.052000 1.463000  3.052000 1.463000  ?        ?         ?              ?         
1 1 1 44 0  2  f 3.508000 1.364000  3.508000 1.364000  3.508000 1.364000  0.000000       0.000000  
1 1 1 44 0  4  o 2.585000 1.150000  2.585000 1.150000  2.585000 1.150000  0.000000       0.000000  
1 1 1 44 0  6  f 5.942000 1.186000  5.942000 1.186000  5.942000 1.186000  0.000000       0.000000  
1 1 1 44 0  8  f 3.716000 1.434000  3.716000 1.434000  3.716000 1.434000  0.000000       0.000000  
1 1 1 44 0  10 o 5.779000 1.508000  5.779000 1.508000  5.779000 1.508000  0.000000       0.000000  
1 1 1 44 0  12 o 12.14000 0.8451000 12.14000 0.8451000 12.14000 0.8451000 0.000000       0.000000  
1 1 1 44 0  14 o 2.801000 1.264000  2.801000 1.264000  2.801000 1.264000  0.000000       0.000000  
1 1 1 44 0  16 o 4.249000 1.215000  4.249000 1.215000  4.249000 1.215000  0.000000       0.000000  
1 1 1 44 0  18 o 4.453000 1.303000  4.453000 1.303000  4.453000 1.303000  0.000000       0.000000  
1 1 1 44 0  20 o 4.413000 1.438000  4.413000 1.438000  4.413000 1.438000  0.000000       0.000000  
1 1 1 44 0  22 o 2.630000 1.172000  2.630000 1.172000  2.630000 1.172000  0.000000       0.000000  
1 1 1 44 0  24 o 3.029000 1.377000  3.029000 1.377000  3.029000 1.377000  0.000000       0.000000  
1 1 1 44 1  1  o 15.82000 0.4294000 15.21000 0.6299000 16.42000 0.5838000 -1.207000      0.8589000 
1 1 1 44 1  3  o 9.071000 0.6527000 9.459000 0.9493000 8.682000 0.8962000 0.7770000      1.305000  
1 1 1 44 1  5  o 6.604000 0.8458000 8.124000 1.215000  5.085000 1.177000  3.039000       1.692000  
1 1 1 44 1  7  o 9.175000 0.5148000 9.254000 0.6793000 9.095000 0.7736000 0.1588000      1.030000  
1 1 1 44 1  9  o 18.41000 0.3879000 18.11000 0.5896000 18.71000 0.5044000 -0.6014000     0.7759000 
1 1 1 44 1  11 o 17.13000 0.4673000 16.42000 0.6144000 17.84000 0.7042000 -1.419000      0.9346000 
1 1 1 44 1  13 o 3.163000 0.9179000 3.410000 1.299000  2.916000 1.297000  0.4941000      1.836000  
1 1 1 44 1  15 o 7.019000 0.7377000 8.240000 0.7679000 5.798000 1.260000  2.442000       1.475000  
1 1 1 44 1  17 o 3.822000 0.9485000 3.572000 1.285000  4.072000 1.395000  -0.5002000     1.897000  
1 1 1 44 1  19 o 3.736000 0.8947000 3.856000 1.239000  3.616000 1.291000  0.2403000      1.789000  
1 1 1 44 1  21 o 4.616000 0.8445000 3.535000 1.325000  5.697000 1.048000  -2.162000      1.689000  
1 1 1 44 1  23 o 11.12000 0.7170000 11.62000 0.9838000 10.61000 1.043000  1.015000       1.434000  
1 1 1 44 2  0  o 3.795000 1.334000  3.795000 1.334000  3.795000 1.334000  0.000000       0.000000  
1 1 1 44 2  2  o 11.33000 0.5224000 11.35000 0.8374000 11.31000 0.6247000 0.3391000E-01  1.045000  
1 1 1 44 2  4  o 12.31000 0.4871000 12.96000 0.6619000 11.66000 0.7147000 1.302000       0.9742000 
1 1 1 44 2  6  o 11.88000 0.5284000 12.05000 0.8199000 11.71000 0.6667000 0.3417000      1.057000  
1 1 1 44 2  8  o 2.984000 0.8478000 3.303000 1.225000  2.665000 1.172000  0.6383000      1.696000  
1 1 1 44 2  10 o 4.824000 0.9262000 4.897000 1.301000  4.752000 1.319000  0.1455000      1.852000  
1 1 1 44 2  12 o 2.708000 0.8352000 3.081000 1.272000  2.336000 1.083000  0.7446000      1.670000  
1 1 1 44 2  14 o 3.935000 0.9221000 3.497000 1.255000  4.373000 1.351000  -0.8756000     1.844000  
1 1 1 44 2  16 o 2.427000 0.7691000 2.309000 1.047000  2.545000 1.127000  -0.2360000     1.538000  
1 1 1 44 2  18 o 4.125000 0.8742000 3.326000 1.283000  4.924000 1.187000  -1.598000      1.748000  
1 1 1 44 2  20 o 8.347000 0.5970000 8.492000 0.8949000 8.203000 0.7906000 0.2885000      1.194000  
1 1 1 44 2  22 o 7.242000 1.062000  8.271000 1.101000  6.214000 1.815000  2.056000       2.123000  
1 1 1 44 2  24 o 3.438000 1.529000  ?        ?         3.438000 1.529000  ?              ?         
1 1 1 44 3  1  f 7.326000 0.6834000 7.364000 0.8682000 7.288000 1.056000  0.7567000E-01  1.367000  
1 1 1 44 3  3  o 12.39000 0.3992000 12.90000 0.5570000 11.88000 0.5719000 1.020000       0.7984000 
1 1 1 44 3  5  o 5.276000 0.8958000 4.845000 1.371000  5.706000 1.154000  -0.8617000     1.792000  
1 1 1 44 3  7  o 5.516000 1.065000  5.522000 1.501000  5.511000 1.512000  0.1105000E-01  2.131000  
1 1 1 44 3  9  o 7.159000 0.7404000 7.050000 1.151000  7.268000 0.9322000 -0.2178000     1.481000  
1 1 1 44 3  11 o 13.87000 0.4840000 14.42000 0.6944000 13.33000 0.6744000 1.089000       0.9680000 
1 1 1 44 3  13 o 2.647000 0.8343000 2.589000 1.174000  2.705000 1.186000  -0.1162000     1.669000  
1 1 1 44 3  15 o 4.788000 0.9403000 4.941000 1.360000  4.635000 1.299000  0.3064000      1.881000  
1 1 1 44 3  17 o 4.480000 0.8701000 3.576000 1.346000  5.383000 1.102000  -1.807000      1.740000  
1 1 1 44 3  19 o 3.118000 0.8834000 4.355000 1.507000  1.882000 0.9218000 2.473000       1.767000  
1 1 1 44 3  21 o 5.267000 0.9172000 4.952000 1.471000  5.582000 1.096000  -0.6300000     1.834000  
1 1 1 44 3  23 o 6.742000 0.7295000 7.380000 0.9407000 6.103000 1.115000  1.277000       1.459000  
1 1 1 44 4  0  f 2.889000 1.190000  2.889000 1.190000  2.889000 1.190000  0.000000       0.000000  
1 1 1 44 4  2  o 3.775000 0.8651000 4.390000 1.254000  3.160000 1.192000  1.229000       1.730000  
1 1 1 44 4  4  o 4.374000 0.9100000 3.995000 1.291000  4.753000 1.283000  -0.7585000     1.820000  
1 1 1 44 4  6  o 14.17000 0.4188000 15.15000 0.5762000 13.19000 0.6080000 1.956000       0.8377000 
1 1 1 44 4  8  o 7.122000 0.7012000 7.054000 1.029000  7.190000 0.9525000 -0.1364000     1.402000  
1 1 1 44 4  10 o 5.045000 1.048000  5.129000 1.533000  4.961000 1.431000  0.1681000      2.097000  
1 1 1 44 4  12 o 3.811000 0.9424000 4.170000 1.332000  3.451000 1.333000  0.7194000      1.885000  
1 1 1 44 4  14 o 7.170000 0.6924000 7.810000 0.9253000 6.529000 1.030000  1.281000       1.385000  
1 1 1 44 4  16 o 6.091000 0.7848000 7.362000 0.8950000 4.819000 1.289000  2.543000       1.570000  
1 1 1 44 4  18 o 2.971000 0.8742000 3.378000 1.330000  2.565000 1.135000  0.8134000      1.748000  
1 1 1 44 4  20 o 6.609000 0.7222000 5.916000 1.163000  7.302000 0.8563000 -1.386000      1.444000  
1 1 1 44 4  22 o 14.63000 0.4515000 14.17000 0.5849000 15.09000 0.6880000 -0.9167000     0.9030000 
1 1 1 44 5  1  o 3.621000 0.8563000 3.773000 1.232000  3.469000 1.190000  0.3043000      1.713000  
1 1 1 44 5  3  o 9.641000 0.4879000 9.971000 0.6625000 9.310000 0.7165000 0.6610000      0.9759000 
1 1 1 44 5  5  o 5.181000 0.9317000 5.278000 1.252000  5.084000 1.380000  0.1940000      1.863000  
1 1 1 44 5  7  o 6.269000 0.7261000 6.670000 0.9266000 5.867000 1.118000  0.8024000      1.452000  
1 1 1 44 5  9  o 16.10000 0.4663000 16.52000 0.6921000 15.69000 0.6252000 0.8322000      0.9326000 
1 1 1 44 5  11 o 16.16000 0.5551000 15.92000 0.7652000 16.40000 0.8045000 -0.4726000     1.110000  
1 1 1 44 5  13 o 4.005000 0.9637000 4.230000 1.295000  3.780000 1.428000  0.4501000      1.927000  
1 1 1 44 5  15 o 5.291000 0.8785000 4.852000 1.303000  5.730000 1.179000  -0.8785000     1.757000  
1 1 1 44 5  17 o 3.300000 0.8776000 3.868000 1.334000  2.733000 1.140000  1.135000       1.755000  
1 1 1 44 5  19 o 6.949000 0.6614000 7.332000 0.9184000 6.567000 0.9520000 0.7649000      1.323000  
1 1 1 44 5  21 o 5.181000 0.9159000 5.672000 1.247000  4.690000 1.342000  0.9816000      1.832000  
1 1 1 44 5  23 o 3.606000 0.9202000 3.939000 1.337000  3.274000 1.264000  0.6654000      1.840000  
1 1 1 44 6  0  f 5.555000 1.074000  5.555000 1.074000  5.555000 1.074000  0.000000       0.000000  
1 1 1 44 6  2  o 10.16000 0.4655000 10.59000 0.6193000 9.720000 0.6951000 0.8734000      0.9310000 
1 1 1 44 6  4  o 3.187000 0.8776000 3.070000 1.238000  3.304000 1.244000  -0.2335000     1.755000  
1 1 1 44 6  6  o 5.953000 0.8245000 6.239000 1.059000  5.667000 1.264000  0.5723000      1.649000  
1 1 1 44 6  8  o 3.557000 0.9111000 4.152000 1.330000  2.962000 1.246000  1.190000       1.822000  
1 1 1 44 6  10 o 12.93000 0.4513000 12.87000 0.6712000 12.98000 0.6035000 -0.1074000     0.9026000 
1 1 1 44 6  12 o 3.981000 1.042000  4.067000 1.578000  3.895000 1.360000  0.1715000      2.083000  
1 1 1 44 6  14 o 3.348000 0.8994000 3.018000 1.248000  3.678000 1.295000  -0.6607000     1.799000  
1 1 1 44 6  16 o 3.586000 0.9486000 3.688000 1.334000  3.483000 1.349000  0.2045000      1.897000  
1 1 1 44 6  18 o 3.621000 0.9682000 3.876000 1.446000  3.367000 1.288000  0.5091000      1.936000  
1 1 1 44 6  20 o 6.732000 0.7366000 6.630000 1.047000  6.835000 1.037000  -0.2054000     1.473000  
1 1 1 44 6  22 o 13.75000 0.4896000 13.12000 0.6598000 14.38000 0.7234000 -1.263000      0.9791000 
1 1 1 44 7  1  o 6.084000 0.7180000 5.955000 1.044000  6.213000 0.9861000 -0.2581000     1.436000  
1 1 1 44 7  3  o 11.26000 0.4256000 11.12000 0.6150000 11.40000 0.5885000 -0.2865000     0.8512000 
1 1 1 44 7  5  o 6.894000 0.6650000 6.899000 0.8744000 6.888000 1.002000  0.1049000E-01  1.330000  
1 1 1 44 7  7  o 7.403000 0.7642000 8.898000 0.8180000 5.908000 1.291000  2.990000       1.528000  
1 1 1 44 7  9  o 16.12000 0.4839000 16.57000 0.7183000 15.67000 0.6486000 0.9019000      0.9678000 
1 1 1 44 7  11 o 6.985000 0.7202000 5.857000 1.205000  8.113000 0.7898000 -2.255000      1.440000  
1 1 1 44 7  13 o 11.11000 0.4975000 11.97000 0.6099000 10.24000 0.7861000 1.739000       0.9950000 
1 1 1 44 7  15 o 3.985000 1.010000  4.537000 1.459000  3.433000 1.399000  1.105000       2.021000  
1 1 1 44 7  17 o 3.552000 0.9034000 3.846000 1.302000  3.259000 1.253000  0.5870000      1.807000  
1 1 1 44 7  19 o 4.071000 0.9833000 3.691000 1.349000  4.450000 1.431000  -0.7586000     1.967000  
1 1 1 44 7  21 o 5.009000 0.9124000 6.344000 1.238000  3.674000 1.341000  2.671000       1.825000  
1 1 1 44 8  0  o 2.717000 1.143000  2.717000 1.143000  2.717000 1.143000  0.000000       0.000000  
1 1 1 44 8  2  o 4.591000 0.8480000 5.208000 1.136000  3.973000 1.260000  1.235000       1.696000  
1 1 1 44 8  4  o 6.712000 0.6791000 6.560000 0.9687000 6.863000 0.9520000 -0.3027000     1.358000  
1 1 1 44 8  6  o 4.151000 0.9226000 4.397000 1.266000  3.905000 1.342000  0.4914000      1.845000  
1 1 1 44 8  8  o 5.081000 0.8928000 4.631000 1.274000  5.531000 1.251000  -0.8999000     1.786000  
1 1 1 44 8  10 o 6.898000 0.7112000 6.843000 1.039000  6.953000 0.9716000 -0.1100000     1.422000  
1 1 1 44 8  12 o 14.76000 0.4826000 14.93000 0.7271000 14.59000 0.6348000 0.3421000      0.9652000 
1 1 1 44 8  14 o 10.53000 0.5053000 10.93000 0.7343000 10.13000 0.6942000 0.7939000      1.011000  
1 1 1 44 8  16 o 5.481000 0.8756000 5.993000 1.217000  4.969000 1.259000  1.023000       1.751000  
1 1 1 44 8  18 o 9.970000 0.5518000 10.65000 0.6927000 9.294000 0.8591000 1.353000       1.104000  
1 1 1 44 8  20 o 3.740000 0.8888000 3.794000 1.297000  3.687000 1.216000  0.1070000      1.778000  
1 1 1 44 8  22 o 2.891000 0.8663000 2.825000 1.228000  2.958000 1.222000  -0.1324000     1.733000  
1 1 1 44 9  1  o 3.884000 0.8448000 3.180000 1.199000  4.588000 1.191000  -1.407000      1.690000  
1 1 1 44 9  3  o 5.646000 0.7351000 5.399000 1.123000  5.894000 0.9494000 -0.4957000     1.470000  
1 1 1 44 9  5  o 5.362000 0.7950000 6.027000 0.9816000 4.698000 1.251000  1.329000       1.590000  
1 1 1 44 9  7  o 12.95000 0.4765000 12.82000 0.6894000 13.08000 0.6579000 -0.2590000     0.9529000 
1 1 1 44 9  9  f 6.199000 0.8151000 5.586000 1.194000  6.813000 1.110000  -1.227000      1.630000  
1 1 1 44 9  11 o 5.799000 0.8428000 5.436000 1.325000  6.162000 1.042000  -0.7263000     1.686000  
1 1 1 44 9  13 o 3.957000 0.8973000 4.955000 1.305000  2.959000 1.232000  1.996000       1.795000  
1 1 1 44 9  15 o 7.688000 0.6261000 7.776000 0.8403000 7.600000 0.9283000 0.1763000      1.252000  
1 1 1 44 9  17 o 6.397000 0.7561000 6.257000 1.059000  6.536000 1.080000  -0.2791000     1.512000  
1 1 1 44 9  19 o 5.849000 0.8494000 6.013000 1.091000  5.684000 1.302000  0.3293000      1.699000  
1 1 1 44 9  21 o 3.417000 0.8766000 4.035000 1.300000  2.799000 1.176000  1.236000       1.753000  
1 1 1 44 10 0  o 6.019000 0.9535000 6.019000 0.9535000 6.019000 0.9535000 0.000000       0.000000  
1 1 1 44 10 2  o 2.619000 0.8119000 2.617000 1.157000  2.621000 1.140000  -0.3819000E-02 1.624000  
1 1 1 44 10 4  o 5.993000 0.7512000 5.817000 1.087000  6.170000 1.037000  -0.3532000     1.502000  
1 1 1 44 10 6  o 9.702000 0.5667000 10.37000 0.7979000 9.038000 0.8051000 1.327000       1.133000  
1 1 1 44 10 8  o 2.787000 0.8331000 2.869000 1.197000  2.705000 1.159000  0.1636000      1.666000  
1 1 1 44 10 10 o 10.41000 0.5818000 10.84000 0.8574000 9.989000 0.7867000 0.8500000      1.164000  
1 1 1 44 10 12 o 6.377000 0.6762000 6.186000 0.9195000 6.567000 0.9917000 -0.3814000     1.352000  
1 1 1 44 10 14 o 4.311000 0.9464000 4.912000 1.276000  3.709000 1.398000  1.204000       1.893000  
1 1 1 44 10 16 o 4.064000 1.053000  3.219000 1.252000  4.908000 1.694000  -1.689000      2.107000  
1 1 1 44 10 18 o 7.865000 0.7641000 8.396000 0.8005000 7.335000 1.302000  1.060000       1.528000  
1 1 1 44 10 20 o 4.076000 1.087000  3.730000 1.407000  4.422000 1.658000  -0.6925000     2.174000  
1 1 1 44 11 1  o 7.332000 0.6546000 7.786000 0.8441000 6.877000 1.001000  0.9093000      1.309000  
1 1 1 44 11 3  o 4.851000 0.8565000 4.792000 1.222000  4.910000 1.201000  -0.1183000     1.713000  
1 1 1 44 11 5  o 4.084000 0.9356000 4.162000 1.334000  4.006000 1.312000  0.1562000      1.871000  
1 1 1 44 11 7  o 3.751000 0.9282000 3.247000 1.330000  4.255000 1.295000  -1.007000      1.856000  
1 1 1 44 11 9  o 3.175000 0.9158000 3.507000 1.345000  2.842000 1.243000  0.6655000      1.832000  
1 1 1 44 11 11 o 4.863000 0.9704000 4.966000 1.173000  4.760000 1.546000  0.2059000      1.941000  
1 1 1 44 11 13 o 7.605000 0.7574000 7.800000 0.7925000 7.409000 1.291000  0.3913000      1.515000  
1 1 1 44 11 15 o 2.590000 0.8250000 2.851000 1.234000  2.328000 1.096000  0.5238000      1.650000  
1 1 1 44 11 17 o 6.917000 0.7065000 7.811000 0.8752000 6.024000 1.109000  1.787000       1.413000  
1 1 1 44 11 19 o 11.71000 0.4771000 12.49000 0.6275000 10.93000 0.7187000 1.554000       0.9541000 
1 1 1 44 11 21 o 3.205000 1.372000  ?        ?         3.205000 1.372000  ?              ?         
1 1 1 44 12 0  o 6.755000 0.8783000 6.755000 0.8783000 6.755000 0.8783000 0.000000       0.000000  
1 1 1 44 12 2  o 6.451000 0.6934000 6.823000 0.9446000 6.078000 1.015000  0.7454000      1.387000  
1 1 1 44 12 4  o 3.439000 0.8860000 2.930000 1.243000  3.947000 1.263000  -1.017000      1.772000  
1 1 1 44 12 6  o 3.590000 0.9586000 3.539000 1.345000  3.641000 1.366000  -0.1013000     1.917000  
1 1 1 44 12 8  o 3.157000 0.8871000 2.515000 1.135000  3.800000 1.363000  -1.285000      1.774000  
1 1 1 44 12 10 o 2.895000 0.8707000 3.033000 1.263000  2.758000 1.198000  0.2759000      1.741000  
1 1 1 44 12 12 o 3.295000 0.9233000 3.331000 1.245000  3.259000 1.364000  0.7218000E-01  1.847000  
1 1 1 44 12 14 o 4.733000 0.8809000 4.333000 1.296000  5.133000 1.193000  -0.8004000     1.762000  
1 1 1 44 12 16 o 3.121000 0.9247000 3.311000 1.373000  2.931000 1.238000  0.3799000      1.849000  
1 1 1 44 12 18 o 4.379000 0.8477000 5.625000 1.164000  3.133000 1.233000  2.491000       1.695000  
1 1 1 44 12 20 o 4.560000 1.298000  6.062000 2.242000  3.058000 1.307000  3.004000       2.595000  
1 1 1 44 13 1  o 3.108000 0.8662000 2.726000 1.157000  3.489000 1.289000  -0.7632000     1.732000  
1 1 1 44 13 3  o 3.860000 0.9392000 4.453000 1.427000  3.266000 1.221000  1.187000       1.878000  
1 1 1 44 13 5  o 4.314000 1.006000  4.491000 1.393000  4.137000 1.451000  0.3543000      2.012000  
1 1 1 44 13 7  o 2.574000 0.8158000 2.965000 1.257000  2.184000 1.040000  0.7818000      1.632000  
1 1 1 44 13 9  o 8.868000 0.5472000 9.516000 0.8024000 8.220000 0.7442000 1.296000       1.094000  
1 1 1 44 13 11 f 3.642000 0.9194000 3.281000 1.239000  4.002000 1.358000  -0.7210000     1.839000  
1 1 1 44 13 13 o 9.364000 0.6071000 9.786000 0.8352000 8.943000 0.8813000 0.8425000      1.214000  
1 1 1 44 13 15 o 3.984000 0.9316000 3.976000 1.372000  3.991000 1.261000  -0.1530000E-01 1.863000  
1 1 1 44 13 17 o 4.662000 0.9778000 5.546000 1.423000  3.779000 1.341000  1.767000       1.956000  
1 1 1 44 13 19 o 4.300000 0.9255000 5.132000 1.441000  3.467000 1.162000  1.665000       1.851000  
1 1 1 44 14 0  o 3.727000 1.350000  3.727000 1.350000  3.727000 1.350000  0.000000       0.000000  
1 1 1 44 14 2  o 8.034000 0.7406000 7.501000 0.9375000 8.567000 1.147000  -1.066000      1.481000  
1 1 1 44 14 4  o 3.620000 0.9379000 3.591000 1.297000  3.649000 1.356000  -0.5777000E-01 1.876000  
1 1 1 44 14 6  o 2.708000 0.8340000 2.900000 1.229000  2.517000 1.128000  0.3830000      1.668000  
1 1 1 44 14 8  o 3.981000 0.9495000 4.198000 1.299000  3.764000 1.386000  0.4341000      1.899000  
1 1 1 44 14 10 o 7.008000 0.7924000 5.047000 1.372000  8.969000 0.7934000 -3.922000      1.585000  
1 1 1 44 14 12 o 7.044000 0.6862000 7.837000 0.9300000 6.251000 1.009000  1.586000       1.372000  
1 1 1 44 14 14 o 3.642000 0.9550000 3.951000 1.324000  3.333000 1.376000  0.6185000      1.910000  
1 1 1 44 14 16 o 9.821000 0.5335000 9.651000 0.6855000 9.990000 0.8177000 -0.3393000     1.067000  
1 1 1 44 14 18 o 3.707000 0.9015000 4.333000 1.290000  3.081000 1.260000  1.252000       1.803000  
1 1 1 44 15 1  o 3.097000 0.9067000 3.225000 1.276000  2.970000 1.288000  0.2546000      1.813000  
1 1 1 44 15 3  o 10.39000 0.5297000 10.15000 0.7225000 10.64000 0.7747000 -0.4856000     1.059000  
1 1 1 44 15 5  o 7.204000 0.8002000 6.321000 1.059000  8.086000 1.200000  -1.765000      1.600000  
1 1 1 44 15 7  o 4.012000 1.059000  3.654000 1.438000  4.371000 1.554000  -0.7168000     2.117000  
1 1 1 44 15 9  o 2.701000 0.8460000 2.422000 1.080000  2.980000 1.302000  -0.5573000     1.692000  
1 1 1 44 15 11 o 3.131000 0.8680000 2.309000 1.076000  3.953000 1.363000  -1.645000      1.736000  
1 1 1 44 15 13 o 8.612000 0.5851000 8.446000 0.7603000 8.778000 0.8897000 -0.3320000     1.170000  
1 1 1 44 15 15 o 3.177000 0.8219000 4.053000 1.242000  2.302000 1.076000  1.752000       1.644000  
1 1 1 44 15 17 o 7.592000 0.6564000 8.823000 0.8857000 6.362000 0.9691000 2.461000       1.313000  
1 1 1 44 16 0  o 3.653000 1.297000  3.653000 1.297000  3.653000 1.297000  0.000000       0.000000  
1 1 1 44 16 2  o 7.096000 0.6655000 7.013000 0.8567000 7.180000 1.019000  -0.1670000     1.331000  
1 1 1 44 16 4  o 4.477000 0.9222000 3.357000 1.377000  5.596000 1.227000  -2.239000      1.844000  
1 1 1 44 16 6  o 4.531000 1.005000  4.811000 1.498000  4.251000 1.341000  0.5600000      2.011000  
1 1 1 44 16 8  o 3.183000 0.8924000 3.080000 1.253000  3.287000 1.271000  -0.2070000     1.785000  
1 1 1 44 16 10 o 9.967000 0.5662000 9.782000 0.9039000 10.15000 0.6822000 -0.3699000     1.132000  
1 1 1 44 16 12 o 4.376000 0.9226000 4.698000 1.268000  4.054000 1.340000  0.6441000      1.845000  
1 1 1 44 16 14 o 6.131000 0.7337000 7.185000 0.9146000 5.077000 1.148000  2.108000       1.467000  
1 1 1 44 16 16 o 4.617000 0.8520000 4.103000 1.249000  5.131000 1.159000  -1.028000      1.704000  
1 1 1 44 17 1  o 6.266000 0.9173000 6.112000 1.510000  6.420000 1.042000  -0.3078000     1.835000  
1 1 1 44 17 3  o 11.39000 0.5645000 11.33000 0.9312000 11.44000 0.6384000 -0.1114000     1.129000  
1 1 1 44 17 5  o 2.727000 0.8348000 3.143000 1.267000  2.310000 1.087000  0.8326000      1.670000  
1 1 1 44 17 7  o 3.775000 0.9530000 3.482000 1.406000  4.069000 1.287000  -0.5871000     1.906000  
1 1 1 44 17 9  o 5.755000 0.8941000 7.319000 1.133000  4.190000 1.384000  3.130000       1.788000  
1 1 1 44 17 11 o 3.913000 0.8990000 4.847000 1.321000  2.979000 1.220000  1.867000       1.798000  
1 1 1 44 17 13 o 5.777000 0.8214000 6.283000 1.126000  5.270000 1.196000  1.013000       1.643000  
1 1 1 44 17 15 o 5.457000 1.312000  4.610000 1.347000  6.304000 2.252000  -1.694000      2.624000  
1 1 1 44 18 0  o 2.676000 1.178000  2.676000 1.178000  2.676000 1.178000  0.000000       0.000000  
1 1 1 44 18 2  o 3.075000 0.9548000 4.113000 1.632000  2.037000 0.9923000 2.076000       1.910000  
1 1 1 44 18 4  o 3.241000 0.9038000 3.565000 1.357000  2.918000 1.195000  0.6479000      1.808000  
1 1 1 44 18 6  o 3.878000 1.003000  3.869000 1.449000  3.887000 1.388000  -0.1742000E-01 2.006000  
1 1 1 44 18 8  o 3.571000 0.9429000 3.451000 1.367000  3.691000 1.299000  -0.2409000     1.886000  
1 1 1 44 18 10 o 3.261000 0.8812000 3.459000 1.262000  3.063000 1.231000  0.3958000      1.762000  
1 1 1 44 18 12 o 5.003000 0.8115000 6.179000 0.9507000 3.828000 1.315000  2.352000       1.623000  
1 1 1 44 18 14 o 4.673000 1.702000  4.673000 1.702000  ?        ?         ?              ?         
1 1 1 44 19 1  o 4.507000 0.9679000 4.863000 1.449000  4.151000 1.284000  0.7113000      1.936000  
1 1 1 44 19 3  o 4.935000 0.8297000 3.469000 1.276000  6.400000 1.061000  -2.931000      1.659000  
1 1 1 44 19 5  o 4.552000 0.9569000 4.456000 1.360000  4.647000 1.347000  -0.1911000     1.914000  
1 1 1 44 19 7  o 5.159000 0.8968000 4.466000 1.372000  5.851000 1.155000  -1.386000      1.794000  
1 1 1 44 19 9  f 4.723000 0.8737000 3.842000 1.356000  5.603000 1.102000  -1.761000      1.747000  
1 1 1 44 19 11 o 6.614000 0.8162000 6.644000 0.9426000 6.584000 1.333000  0.6043000E-01  1.632000  
1 1 1 44 20 0  o 3.487000 1.300000  3.487000 1.300000  3.487000 1.300000  0.000000       0.000000  
1 1 1 44 20 2  o 4.268000 0.9176000 4.098000 1.313000  4.437000 1.282000  -0.3393000     1.835000  
1 1 1 44 20 4  o 3.845000 0.8267000 4.824000 1.080000  2.866000 1.252000  1.959000       1.653000  
1 1 1 44 20 6  o 5.374000 0.8672000 5.763000 1.203000  4.985000 1.249000  0.7779000      1.734000  
1 1 1 44 20 8  o 3.209000 0.9713000 3.016000 1.246000  3.402000 1.490000  -0.3857000     1.943000  
1 1 1 44 20 10 o 3.970000 1.121000  4.869000 1.751000  3.070000 1.401000  1.799000       2.242000  
1 1 1 44 21 1  o 4.058000 0.9056000 3.113000 1.287000  5.003000 1.275000  -1.891000      1.811000  
1 1 1 44 21 3  o 5.752000 0.7856000 6.320000 1.074000  5.184000 1.147000  1.135000       1.571000  
1 1 1 44 21 5  o 5.196000 0.9993000 6.025000 1.295000  4.368000 1.522000  1.657000       1.999000  
1 1 1 44 21 7  o 5.313000 1.142000  4.340000 1.865000  6.286000 1.320000  -1.946000      2.284000  
1 1 1 44 22 0  o 7.166000 1.004000  7.166000 1.004000  7.166000 1.004000  0.000000       0.000000  
1 1 1 44 22 2  o 3.551000 1.060000  3.076000 1.404000  4.026000 1.589000  -0.9502000     2.121000  
1 1 1 45 0  1  o 3.463000 1.417000  3.463000 1.417000  3.463000 1.417000  0.000000       0.000000  
1 1 1 45 0  3  o 4.979000 1.427000  4.979000 1.427000  4.979000 1.427000  0.000000       0.000000  
1 1 1 45 0  5  o 4.491000 1.533000  4.491000 1.533000  4.491000 1.533000  0.000000       0.000000  
1 1 1 45 0  7  o 2.990000 1.247000  2.990000 1.247000  2.990000 1.247000  0.000000       0.000000  
1 1 1 45 0  9  o 11.52000 0.6303000 11.52000 0.6303000 11.52000 0.6303000 0.000000       0.000000  
1 1 1 45 0  11 o 15.37000 0.6373000 15.37000 0.6373000 15.37000 0.6373000 0.000000       0.000000  
1 1 1 45 0  13 o 2.929000 1.235000  2.929000 1.235000  2.929000 1.235000  0.000000       0.000000  
1 1 1 45 0  15 o 6.255000 1.134000  6.255000 1.134000  6.255000 1.134000  0.000000       0.000000  
1 1 1 45 0  17 o 2.936000 1.232000  2.936000 1.232000  2.936000 1.232000  0.000000       0.000000  
1 1 1 45 0  19 o 2.838000 1.227000  2.838000 1.227000  2.838000 1.227000  0.000000       0.000000  
1 1 1 45 1  0  o 4.905000 1.470000  4.905000 1.470000  4.905000 1.470000  0.000000       0.000000  
1 1 1 45 1  2  o 7.757000 0.7520000 7.792000 1.036000  7.723000 1.091000  0.6918000E-01  1.504000  
1 1 1 45 1  4  o 3.093000 0.9074000 3.353000 1.345000  2.833000 1.218000  0.5206000      1.815000  
1 1 1 45 1  6  o 4.536000 1.026000  5.289000 1.473000  3.784000 1.428000  1.506000       2.052000  
1 1 1 45 1  8  o 8.806000 0.9434000 9.355000 1.679000  8.257000 0.8607000 1.098000       1.887000  
1 1 1 45 1  10 o 4.979000 0.9626000 4.367000 1.434000  5.590000 1.285000  -1.223000      1.925000  
1 1 1 45 1  12 o 3.594000 0.9784000 4.199000 1.492000  2.989000 1.266000  1.210000       1.957000  
1 1 1 45 1  14 o 4.145000 1.005000  3.819000 1.470000  4.470000 1.370000  -0.6511000     2.009000  
1 1 1 45 1  16 o 6.939000 0.7246000 7.222000 1.062000  6.656000 0.9863000 0.5653000      1.449000  
1 1 1 45 1  18 o 3.264000 0.8994000 2.914000 1.223000  3.614000 1.319000  -0.7006000     1.799000  
1 1 1 45 2  1  o 7.155000 0.7882000 5.967000 1.194000  8.344000 1.029000  -2.377000      1.576000  
1 1 1 45 2  3  o 5.361000 0.9445000 5.268000 1.435000  5.453000 1.228000  -0.1846000     1.889000  
1 1 1 45 2  5  o 4.032000 0.9971000 3.656000 1.444000  4.408000 1.376000  -0.7523000     1.994000  
1 1 1 45 2  7  o 3.294000 0.9718000 4.548000 1.673000  2.041000 0.9896000 2.506000       1.944000  
1 1 1 45 2  9  o 4.043000 1.080000  4.729000 1.673000  3.358000 1.366000  1.371000       2.159000  
1 1 1 45 2  11 o 6.679000 0.7995000 6.886000 1.135000  6.472000 1.127000  0.4145000      1.599000  
1 1 1 45 2  13 o 4.233000 0.9699000 3.931000 1.462000  4.534000 1.275000  -0.6028000     1.940000  
1 1 1 45 2  15 o 3.168000 0.9235000 2.888000 1.287000  3.449000 1.325000  -0.5607000     1.847000  
1 1 1 45 2  17 o 3.683000 0.9799000 3.393000 1.415000  3.973000 1.356000  -0.5800000     1.960000  
1 1 1 45 2  19 o 5.232000 0.8636000 5.656000 1.214000  4.808000 1.229000  0.8487000      1.727000  
1 1 1 45 3  0  o 10.73000 0.6805000 10.73000 0.6805000 10.73000 0.6805000 0.000000       0.000000  
1 1 1 45 3  2  o 6.897000 0.8920000 7.288000 1.447000  6.506000 1.043000  0.7826000      1.784000  
1 1 1 45 3  4  o 8.322000 0.8027000 8.959000 1.327000  7.686000 0.9032000 1.273000       1.605000  
1 1 1 45 3  6  o 3.314000 0.9081000 3.034000 1.253000  3.593000 1.314000  -0.5592000     1.816000  
1 1 1 45 3  8  o 5.293000 0.8611000 5.338000 1.206000  5.248000 1.229000  0.8991000E-01  1.722000  
1 1 1 45 3  10 o 7.781000 0.6593000 7.001000 1.044000  8.560000 0.8053000 -1.559000      1.319000  
1 1 1 45 3  12 o 3.693000 0.9598000 3.617000 1.274000  3.768000 1.435000  -0.1514000     1.920000  
1 1 1 45 3  14 o 2.966000 0.8921000 3.487000 1.374000  2.445000 1.139000  1.042000       1.784000  
1 1 1 45 3  16 o 3.096000 0.9039000 3.451000 1.335000  2.742000 1.219000  0.7093000      1.808000  
1 1 1 45 3  18 o 6.309000 0.7458000 5.507000 1.163000  7.110000 0.9346000 -1.603000      1.492000  
1 1 1 45 4  1  o 6.280000 0.7882000 6.014000 1.254000  6.546000 0.9548000 -0.5317000     1.576000  
1 1 1 45 4  3  o 7.086000 0.7064000 8.499000 0.7972000 5.673000 1.166000  2.827000       1.413000  
1 1 1 45 4  5  o 4.195000 0.9979000 5.429000 1.508000  2.960000 1.307000  2.469000       1.996000  
1 1 1 45 4  7  o 6.584000 0.7480000 6.029000 1.118000  7.139000 0.9936000 -1.110000      1.496000  
1 1 1 45 4  9  o 6.751000 0.8233000 5.708000 1.366000  7.794000 0.9194000 -2.086000      1.647000  
1 1 1 45 4  11 o 6.117000 0.8282000 6.097000 1.209000  6.137000 1.132000  -0.3943000E-01 1.656000  
1 1 1 45 4  13 o 4.532000 0.9612000 5.134000 1.305000  3.930000 1.412000  1.204000       1.922000  
1 1 1 45 4  15 o 4.343000 0.9475000 3.681000 1.334000  5.004000 1.346000  -1.323000      1.895000  
1 1 1 45 4  17 f 4.001000 0.9471000 3.008000 1.299000  4.994000 1.378000  -1.985000      1.894000  
1 1 1 45 4  19 o 3.840000 1.191000  3.434000 1.454000  4.246000 1.886000  -0.8120000     2.382000  
1 1 1 45 5  0  o 4.124000 1.314000  4.124000 1.314000  4.124000 1.314000  0.000000       0.000000  
1 1 1 45 5  2  o 6.853000 0.7042000 6.982000 0.8922000 6.725000 1.090000  0.2564000      1.408000  
1 1 1 45 5  4  o 5.600000 0.8194000 6.476000 1.021000  4.723000 1.282000  1.754000       1.639000  
1 1 1 45 5  6  o 2.906000 0.8444000 2.289000 1.044000  3.522000 1.328000  -1.233000      1.689000  
1 1 1 45 5  8  o 6.575000 0.8448000 6.658000 1.129000  6.493000 1.257000  0.1647000      1.690000  
1 1 1 45 5  10 o 7.713000 0.6388000 8.296000 0.8233000 7.130000 0.9771000 1.166000       1.278000  
1 1 1 45 5  12 o 4.849000 0.8985000 3.752000 1.383000  5.946000 1.148000  -2.193000      1.797000  
1 1 1 45 5  14 o 4.610000 0.9752000 5.106000 1.391000  4.115000 1.367000  0.9913000      1.950000  
1 1 1 45 5  16 o 5.827000 0.8175000 6.820000 0.9107000 4.833000 1.358000  1.987000       1.635000  
1 1 1 45 5  18 o 4.482000 0.9254000 3.825000 1.308000  5.140000 1.309000  -1.315000      1.851000  
1 1 1 45 6  1  f 2.811000 0.8428000 2.861000 1.200000  2.761000 1.184000  0.9995000E-01  1.686000  
1 1 1 45 6  3  o 10.53000 0.5254000 10.94000 0.6434000 10.13000 0.8307000 0.8111000      1.051000  
1 1 1 45 6  5  o 9.078000 0.5499000 9.097000 0.7556000 9.059000 0.7990000 0.3820000E-01  1.100000  
1 1 1 45 6  7  o 3.518000 0.9048000 3.842000 1.286000  3.193000 1.273000  0.6496000      1.810000  
1 1 1 45 6  9  o 3.319000 0.9514000 4.358000 1.560000  2.281000 1.090000  2.076000       1.903000  
1 1 1 45 6  11 o 9.290000 0.5864000 10.13000 0.8301000 8.455000 0.8286000 1.670000       1.173000  
1 1 1 45 6  13 o 5.241000 0.9563000 4.975000 1.398000  5.506000 1.305000  -0.5309000     1.913000  
1 1 1 45 6  15 o 3.992000 0.9435000 4.527000 1.354000  3.458000 1.314000  1.069000       1.887000  
1 1 1 45 6  17 o 5.496000 0.8960000 4.988000 1.216000  6.005000 1.316000  -1.017000      1.792000  
1 1 1 45 7  0  f 3.128000 1.251000  3.128000 1.251000  3.128000 1.251000  0.000000       0.000000  
1 1 1 45 7  2  o 5.473000 0.7984000 6.014000 1.016000  4.933000 1.232000  1.081000       1.597000  
1 1 1 45 7  4  o 2.602000 0.8109000 2.192000 1.035000  3.012000 1.249000  -0.8197000     1.622000  
1 1 1 45 7  6  f 3.948000 0.9177000 3.638000 1.319000  4.258000 1.276000  -0.6201000     1.835000  
1 1 1 45 7  8  o 8.454000 0.6197000 8.454000 0.9051000 8.455000 0.8467000 -0.1021000E-02 1.239000  
1 1 1 45 7  10 o 7.555000 0.6901000 7.132000 1.054000  7.978000 0.8914000 -0.8453000     1.380000  
1 1 1 45 7  12 o 7.771000 0.8349000 8.918000 1.047000  6.624000 1.300000  2.294000       1.670000  
1 1 1 45 7  14 o 3.408000 0.8921000 4.078000 1.312000  2.737000 1.210000  1.341000       1.784000  
1 1 1 45 7  16 o 4.382000 0.9343000 5.164000 1.206000  3.601000 1.427000  1.562000       1.869000  
1 1 1 45 7  18 o 5.774000 1.384000  5.484000 2.056000  6.064000 1.852000  -0.5799000     2.767000  
1 1 1 45 8  1  o 3.852000 0.8853000 3.101000 1.272000  4.604000 1.231000  -1.503000      1.771000  
1 1 1 45 8  3  o 4.690000 0.8865000 4.565000 1.298000  4.814000 1.207000  -0.2492000     1.773000  
1 1 1 45 8  5  o 3.713000 0.8655000 2.774000 1.176000  4.651000 1.270000  -1.878000      1.731000  
1 1 1 45 8  7  o 8.230000 0.5865000 8.261000 0.8513000 8.199000 0.8069000 0.6232000E-01  1.173000  
1 1 1 45 8  9  o 3.897000 0.8691000 2.745000 1.230000  5.049000 1.228000  -2.304000      1.738000  
1 1 1 45 8  11 o 5.391000 0.9031000 4.931000 1.352000  5.850000 1.197000  -0.9186000     1.806000  
1 1 1 45 8  13 o 5.631000 1.020000  5.080000 1.496000  6.181000 1.386000  -1.101000      2.039000  
1 1 1 45 8  15 o 10.85000 0.5121000 10.45000 0.7120000 11.25000 0.7363000 -0.8007000     1.024000  
1 1 1 45 8  17 o 4.159000 0.9242000 4.457000 1.271000  3.861000 1.342000  0.5952000      1.848000  
1 1 1 45 9  0  o 3.327000 1.267000  3.327000 1.267000  3.327000 1.267000  0.000000       0.000000  
1 1 1 45 9  2  o 3.246000 0.8886000 2.927000 1.209000  3.564000 1.302000  -0.6372000     1.777000  
1 1 1 45 9  4  o 2.651000 0.8351000 2.617000 1.175000  2.686000 1.186000  -0.6859000E-01 1.670000  
1 1 1 45 9  6  o 4.992000 0.8731000 4.927000 1.284000  5.056000 1.183000  -0.1290000     1.746000  
1 1 1 45 9  8  o 3.338000 0.9126000 3.353000 1.361000  3.324000 1.216000  0.2911000E-01  1.825000  
1 1 1 45 9  10 o 4.818000 0.9314000 4.924000 1.319000  4.712000 1.315000  0.2117000      1.863000  
1 1 1 45 9  12 o 3.829000 0.9839000 4.118000 1.420000  3.541000 1.363000  0.5762000      1.968000  
1 1 1 45 9  14 o 4.388000 1.005000  4.148000 1.433000  4.627000 1.408000  -0.4789000     2.009000  
1 1 1 45 9  16 f 4.536000 0.9355000 4.200000 1.332000  4.872000 1.314000  -0.6720000     1.871000  
1 1 1 45 10 1  o 3.440000 0.9109000 3.679000 1.319000  3.202000 1.257000  0.4770000      1.822000  
1 1 1 45 10 3  o 3.914000 0.9091000 3.590000 1.305000  4.238000 1.266000  -0.6478000     1.818000  
1 1 1 45 10 5  o 5.160000 0.9519000 5.170000 1.445000  5.150000 1.239000  0.2036000E-01  1.904000  
1 1 1 45 10 7  o 4.254000 0.9541000 4.709000 1.387000  3.800000 1.311000  0.9083000      1.908000  
1 1 1 45 10 9  o 4.304000 0.9445000 4.490000 1.271000  4.117000 1.398000  0.3734000      1.889000  
1 1 1 45 10 11 o 4.273000 0.9846000 4.126000 1.361000  4.420000 1.423000  -0.2933000     1.969000  
1 1 1 45 10 13 o 12.63000 0.4308000 12.98000 0.5742000 12.29000 0.6423000 0.6863000      0.8615000 
1 1 1 45 10 15 o 7.307000 0.6482000 7.378000 0.8651000 7.237000 0.9655000 0.1409000      1.296000  
1 1 1 45 10 17 o 5.206000 2.149000  ?        ?         5.206000 2.149000  ?              ?         
1 1 1 45 11 0  o 5.628000 1.029000  5.628000 1.029000  5.628000 1.029000  0.000000       0.000000  
1 1 1 45 11 2  o 6.713000 0.7222000 7.136000 1.004000  6.290000 1.039000  0.8463000      1.444000  
1 1 1 45 11 4  o 8.112000 0.6648000 8.523000 0.9750000 7.701000 0.9040000 0.8220000      1.330000  
1 1 1 45 11 6  o 13.86000 0.4216000 13.77000 0.5869000 13.95000 0.6055000 -0.1845000     0.8433000 
1 1 1 45 11 8  o 3.865000 0.9434000 3.561000 1.308000  4.170000 1.360000  -0.6093000     1.887000  
1 1 1 45 11 10 o 7.013000 0.8558000 6.153000 1.139000  7.872000 1.277000  -1.719000      1.712000  
1 1 1 45 11 12 o 5.122000 0.8277000 3.856000 1.288000  6.388000 1.040000  -2.532000      1.655000  
1 1 1 45 11 14 o 4.945000 0.9022000 5.159000 1.221000  4.731000 1.328000  0.4284000      1.804000  
1 1 1 45 11 16 o 3.603000 1.688000  ?        ?         3.603000 1.688000  ?              ?         
1 1 1 45 12 1  o 4.213000 1.006000  4.079000 1.441000  4.347000 1.405000  -0.2683000     2.013000  
1 1 1 45 12 3  f 3.172000 0.8714000 2.068000 1.000000  4.277000 1.427000  -2.209000      1.743000  
1 1 1 45 12 5  o 3.390000 0.9413000 3.201000 1.282000  3.579000 1.379000  -0.3785000     1.883000  
1 1 1 45 12 7  o 3.615000 0.9618000 2.957000 1.270000  4.273000 1.445000  -1.316000      1.924000  
1 1 1 45 12 9  o 3.739000 0.9599000 3.769000 1.328000  3.709000 1.386000  0.5954000E-01  1.920000  
1 1 1 45 12 11 o 8.579000 0.6466000 8.140000 0.8985000 9.018000 0.9302000 -0.8783000     1.293000  
1 1 1 45 12 13 o 12.44000 0.5302000 12.26000 0.7270000 12.62000 0.7720000 -0.3590000     1.060000  
1 1 1 45 12 15 f 3.808000 1.750000  ?        ?         3.808000 1.750000  ?              ?         
1 1 1 45 13 0  o 2.868000 1.226000  2.868000 1.226000  2.868000 1.226000  0.000000       0.000000  
1 1 1 45 13 2  o 10.20000 0.5702000 9.374000 0.7889000 11.03000 0.8236000 -1.657000      1.140000  
1 1 1 45 13 4  o 5.709000 0.9952000 5.070000 1.324000  6.348000 1.486000  -1.277000      1.990000  
1 1 1 45 13 6  o 6.854000 0.9176000 7.379000 0.9294000 6.330000 1.582000  1.048000       1.835000  
1 1 1 45 13 8  o 4.253000 1.084000  3.426000 1.349000  5.080000 1.697000  -1.654000      2.168000  
1 1 1 45 13 10 o 6.840000 1.173000  7.019000 1.664000  6.661000 1.654000  0.3579000      2.346000  
1 1 1 45 13 12 o 7.779000 0.6380000 7.941000 0.7877000 7.617000 1.004000  0.3239000      1.276000  
1 1 1 45 14 1  o 5.644000 0.8887000 6.024000 1.182000  5.263000 1.327000  0.7610000      1.777000  
1 1 1 45 14 3  o 14.84000 0.4548000 14.35000 0.6357000 15.34000 0.6505000 -0.9941000     0.9095000 
1 1 1 45 14 5  o 12.12000 0.5245000 12.03000 0.6703000 12.21000 0.8069000 -0.1777000     1.049000  
1 1 1 45 14 7  o 4.209000 0.9045000 3.927000 1.349000  4.490000 1.206000  -0.5632000     1.809000  
1 1 1 45 14 9  o 3.718000 0.9352000 4.000000 1.322000  3.436000 1.323000  0.5647000      1.870000  
1 1 1 45 14 11 o 3.348000 0.8823000 2.655000 1.171000  4.042000 1.320000  -1.387000      1.765000  
1 1 1 45 15 0  o 2.936000 1.291000  2.936000 1.291000  2.936000 1.291000  0.000000       0.000000  
1 1 1 45 15 2  o 4.185000 0.9678000 3.681000 1.376000  4.689000 1.361000  -1.008000      1.936000  
1 1 1 45 15 4  o 4.545000 1.012000  3.795000 1.427000  5.294000 1.436000  -1.499000      2.025000  
1 1 1 45 15 6  o 3.222000 0.8559000 4.006000 1.284000  2.438000 1.132000  1.569000       1.712000  
1 1 1 45 15 8  o 3.808000 0.9314000 3.815000 1.306000  3.801000 1.329000  0.1328000E-01  1.863000  
1 1 1 45 15 10 o 4.043000 1.095000  4.025000 1.694000  4.061000 1.388000  -0.3623000E-01 2.190000  
1 1 1 45 16 1  o 3.603000 0.9383000 4.061000 1.380000  3.146000 1.272000  0.9152000      1.877000  
1 1 1 45 16 3  o 3.955000 1.010000  3.168000 1.326000  4.743000 1.525000  -1.575000      2.020000  
1 1 1 45 16 5  f 2.918000 0.8897000 3.003000 1.282000  2.834000 1.234000  0.1691000      1.779000  
1 1 1 45 16 7  o 2.975000 0.9230000 2.995000 1.383000  2.955000 1.223000  0.3973000E-01  1.846000  
1 1 1 45 16 9  o 4.803000 1.238000  4.138000 1.829000  5.468000 1.668000  -1.330000      2.475000  
1 1 1 45 17 0  o 3.825000 1.491000  3.825000 1.491000  3.825000 1.491000  0.000000       0.000000  
1 1 1 45 17 2  o 5.542000 0.8072000 5.566000 1.207000  5.518000 1.073000  0.4857000E-01  1.614000  
1 1 1 45 17 4  o 2.526000 0.8124000 2.378000 1.108000  2.675000 1.188000  -0.2973000     1.625000  
1 1 1 45 17 6  o 2.918000 0.9232000 2.982000 1.362000  2.854000 1.247000  0.1286000      1.846000  
1 1 1 45 17 8  o 3.688000 1.710000  3.688000 1.710000  ?        ?         ?              ?         
1 1 1 45 18 1  f 5.506000 1.261000  4.523000 1.807000  6.489000 1.759000  -1.966000      2.522000  
1 1 1 45 18 3  o 2.700000 1.252000  2.700000 1.252000  ?        ?         ?              ?         
1 1 1 46 0  0  o 14.59000 0.8226000 14.59000 0.8226000 14.59000 0.8226000 0.000000       0.000000  
1 1 1 46 0  2  o 15.92000 0.5771000 15.92000 0.5771000 15.92000 0.5771000 0.000000       0.000000  
1 1 1 46 0  4  o 3.121000 1.321000  3.121000 1.321000  3.121000 1.321000  0.000000       0.000000  
1 1 1 46 0  6  o 2.536000 1.161000  2.536000 1.161000  2.536000 1.161000  0.000000       0.000000  
1 1 1 46 0  8  o 5.223000 1.484000  5.223000 1.484000  5.223000 1.484000  0.000000       0.000000  
1 1 1 46 0  10 o 4.989000 1.808000  4.989000 1.808000  4.989000 1.808000  0.000000       0.000000  
1 1 1 46 0  12 o 3.104000 1.361000  3.104000 1.361000  3.104000 1.361000  0.000000       0.000000  
1 1 1 46 0  14 o 3.757000 1.761000  3.757000 1.761000  3.757000 1.761000  0.000000       0.000000  
1 1 1 46 1  1  o 4.124000 0.9848000 3.938000 1.387000  4.309000 1.399000  -0.3703000     1.970000  
1 1 1 46 1  3  o 5.006000 0.9329000 4.714000 1.363000  5.298000 1.275000  -0.5838000     1.866000  
1 1 1 46 1  5  o 9.547000 0.6392000 8.206000 0.9696000 10.89000 0.8332000 -2.681000      1.278000  
1 1 1 46 1  7  o 4.748000 1.101000  4.051000 1.470000  5.445000 1.641000  -1.394000      2.203000  
1 1 1 46 1  9  o 3.765000 0.9664000 3.795000 1.365000  3.735000 1.369000  0.6070000E-01  1.933000  
1 1 1 46 1  11 o 5.516000 0.9538000 5.701000 1.201000  5.331000 1.482000  0.3698000      1.908000  
1 1 1 46 1  13 o 3.154000 0.9505000 2.751000 1.248000  3.557000 1.434000  -0.8062000     1.901000  
1 1 1 46 2  0  o 5.515000 1.326000  5.515000 1.326000  5.515000 1.326000  0.000000       0.000000  
1 1 1 46 2  2  o 8.247000 0.7239000 6.800000 1.095000  9.693000 0.9475000 -2.893000      1.448000  
1 1 1 46 2  4  o 7.849000 0.7179000 9.547000 0.8727000 6.152000 1.140000  3.395000       1.436000  
1 1 1 46 2  6  o 7.203000 0.7551000 6.534000 1.124000  7.872000 1.008000  -1.338000      1.510000  
1 1 1 46 2  8  o 4.438000 0.9370000 4.967000 1.265000  3.910000 1.383000  1.056000       1.874000  
1 1 1 46 2  10 o 6.702000 0.8055000 5.986000 1.238000  7.418000 1.030000  -1.433000      1.611000  
1 1 1 46 2  12 o 5.507000 0.8827000 6.417000 1.095000  4.598000 1.384000  1.819000       1.765000  
1 1 1 46 2  14 o 3.992000 1.283000  3.378000 1.636000  4.606000 1.978000  -1.228000      2.567000  
1 1 1 46 3  1  o 7.997000 0.8741000 8.624000 1.245000  7.369000 1.228000  1.255000       1.748000  
1 1 1 46 3  3  o 5.761000 0.8475000 5.327000 1.290000  6.194000 1.100000  -0.8669000     1.695000  
1 1 1 46 3  5  f 3.238000 0.9327000 3.462000 1.313000  3.015000 1.325000  0.4473000      1.865000  
1 1 1 46 3  7  f 8.137000 0.6312000 8.240000 0.8149000 8.033000 0.9641000 0.2068000      1.262000  
1 1 1 46 3  9  o 6.855000 0.7924000 6.213000 1.263000  7.497000 0.9579000 -1.284000      1.585000  
1 1 1 46 3  11 o 5.489000 0.9651000 4.500000 1.560000  6.478000 1.137000  -1.978000      1.930000  
1 1 1 46 3  13 o 3.815000 1.058000  4.146000 1.617000  3.485000 1.364000  0.6608000      2.116000  
1 1 1 46 4  0  o 4.103000 1.385000  4.103000 1.385000  4.103000 1.385000  0.000000       0.000000  
1 1 1 46 4  2  o 3.074000 0.8946000 2.422000 1.149000  3.726000 1.371000  -1.305000      1.789000  
1 1 1 46 4  4  o 8.532000 0.7099000 8.643000 1.042000  8.420000 0.9640000 0.2225000      1.420000  
1 1 1 46 4  6  o 3.439000 0.9725000 3.387000 1.375000  3.492000 1.376000  -0.1050000     1.945000  
1 1 1 46 4  8  o 4.014000 0.9023000 4.605000 1.254000  3.422000 1.298000  1.183000       1.805000  
1 1 1 46 4  10 o 3.468000 0.9545000 3.379000 1.328000  3.558000 1.371000  -0.1794000     1.909000  
1 1 1 46 4  12 f 7.739000 0.7523000 7.748000 1.115000  7.730000 1.011000  0.1766000E-01  1.505000  
1 1 1 46 4  14 f 5.508000 1.538000  5.513000 2.136000  5.503000 2.212000  0.9883000E-02  3.075000  
1 1 1 46 5  1  o 4.759000 0.9010000 4.169000 1.273000  5.348000 1.275000  -1.179000      1.802000  
1 1 1 46 5  3  o 5.905000 1.284000  6.467000 2.162000  5.342000 1.386000  1.125000       2.568000  
1 1 1 46 5  5  o 3.366000 0.9131000 3.635000 1.301000  3.097000 1.281000  0.5385000      1.826000  
1 1 1 46 5  7  o 5.983000 0.8437000 7.546000 0.9180000 4.419000 1.416000  3.126000       1.687000  
1 1 1 46 5  9  o 2.887000 0.9047000 2.880000 1.221000  2.895000 1.335000  -0.1521000E-01 1.809000  
1 1 1 46 5  11 o 14.35000 0.4920000 14.65000 0.7656000 14.06000 0.6181000 0.5901000      0.9840000 
1 1 1 46 5  13 o 4.381000 1.363000  3.866000 1.779000  4.896000 2.066000  -1.030000      2.726000  
1 1 1 46 6  0  o 4.631000 1.482000  4.631000 1.482000  4.631000 1.482000  0.000000       0.000000  
1 1 1 46 6  2  o 3.478000 0.9127000 2.958000 1.227000  3.998000 1.351000  -1.040000      1.825000  
1 1 1 46 6  4  f 3.202000 0.9086000 2.839000 1.215000  3.564000 1.351000  -0.7244000     1.817000  
1 1 1 46 6  6  o 4.354000 1.062000  3.964000 1.459000  4.743000 1.544000  -0.7785000     2.124000  
1 1 1 46 6  8  o 3.544000 0.9339000 3.097000 1.299000  3.990000 1.342000  -0.8928000     1.868000  
1 1 1 46 6  10 o 4.194000 0.9983000 4.401000 1.443000  3.987000 1.380000  0.4145000      1.997000  
1 1 1 46 6  12 o 6.167000 1.191000  5.762000 1.837000  6.572000 1.516000  -0.8109000     2.382000  
1 1 1 46 7  1  o 3.124000 0.9214000 2.856000 1.223000  3.392000 1.379000  -0.5362000     1.843000  
1 1 1 46 7  3  o 4.046000 0.9766000 4.311000 1.402000  3.781000 1.360000  0.5299000      1.953000  
1 1 1 46 7  5  o 4.286000 0.9646000 4.644000 1.310000  3.929000 1.417000  0.7149000      1.929000  
1 1 1 46 7  7  o 4.621000 1.135000  4.774000 1.740000  4.467000 1.457000  0.3070000      2.269000  
1 1 1 46 7  9  o 4.790000 0.9446000 4.457000 1.358000  5.123000 1.314000  -0.6659000     1.889000  
1 1 1 46 7  11 o 8.567000 0.6754000 8.679000 1.001000  8.456000 0.9064000 0.2235000      1.351000  
1 1 1 46 8  0  o 4.427000 1.348000  4.427000 1.348000  4.427000 1.348000  0.000000       0.000000  
1 1 1 46 8  2  o 4.301000 0.9402000 5.252000 1.259000  3.349000 1.397000  1.903000       1.880000  
1 1 1 46 8  4  o 4.026000 0.9758000 3.297000 1.378000  4.755000 1.382000  -1.458000      1.952000  
1 1 1 46 8  6  o 3.815000 0.9738000 3.635000 1.397000  3.994000 1.357000  -0.3592000     1.948000  
1 1 1 46 8  8  o 3.718000 0.9713000 3.871000 1.395000  3.565000 1.352000  0.3064000      1.943000  
1 1 1 46 8  10 f 5.169000 1.053000  4.519000 1.363000  5.819000 1.605000  -1.300000      2.106000  
1 1 1 46 9  1  o 2.692000 0.8387000 3.087000 1.299000  2.297000 1.061000  0.7897000      1.677000  
1 1 1 46 9  3  o 4.335000 0.9827000 3.808000 1.449000  4.863000 1.327000  -1.055000      1.965000  
1 1 1 46 9  5  o 5.907000 0.9511000 6.410000 1.059000  5.404000 1.580000  1.006000       1.902000  
1 1 1 46 9  7  o 6.043000 0.8213000 7.310000 0.9751000 4.776000 1.322000  2.534000       1.643000  
1 1 1 46 9  9  o 6.535000 0.8766000 5.281000 1.412000  7.790000 1.040000  -2.509000      1.753000  
1 1 1 46 9  11 o 5.963000 2.124000  5.963000 2.124000  ?        ?         ?              ?         
1 1 1 46 10 0  o 3.009000 1.307000  3.009000 1.307000  3.009000 1.307000  0.000000       0.000000  
1 1 1 46 10 2  o 3.569000 0.9988000 3.663000 1.424000  3.476000 1.401000  0.1869000      1.998000  
1 1 1 46 10 4  o 4.534000 0.9621000 4.674000 1.375000  4.394000 1.346000  0.2794000      1.924000  
1 1 1 46 10 6  o 6.961000 0.9046000 7.428000 0.9677000 6.494000 1.529000  0.9348000      1.809000  
1 1 1 46 10 8  o 2.989000 0.8939000 2.899000 1.220000  3.079000 1.307000  -0.1798000     1.788000  
1 1 1 46 11 1  o 9.485000 0.5641000 9.358000 0.8288000 9.613000 0.7655000 -0.2557000     1.128000  
1 1 1 46 11 3  o 6.990000 0.7847000 7.342000 1.014000  6.639000 1.198000  0.7027000      1.569000  
1 1 1 46 11 5  o 3.697000 1.049000  3.161000 1.276000  4.233000 1.665000  -1.072000      2.098000  
1 1 1 46 11 7  o 4.459000 1.257000  5.305000 1.884000  3.613000 1.664000  1.692000       2.514000  
1 1 1 46 12 0  o 7.389000 1.138000  7.389000 1.138000  7.389000 1.138000  0.000000       0.000000  
1 1 1 46 12 2  o 13.23000 0.4799000 12.48000 0.6414000 13.98000 0.7139000 -1.498000      0.9597000 
1 1 1 46 12 4  o 6.620000 1.160000  6.217000 1.309000  7.022000 1.915000  -0.8055000     2.319000  
# 
#END OF REFLECTIONS
