0 mol 7 unq 0 iso 0 dist 9.60499 6.7985 6.55304 9.0379 10.6581 9.68596 11.8206 16.999 14.3521 6.81066 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.20519 7.75618 4.96411 7.67038 10.4091 8.40416 10.8897 9.50443 8.6996 6.10339 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 8.4674 8.40416 9.74255 7.67038 4.54938 7.75618 10.7864 10.2774 5.46754 6.50337 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 4.54938 7.75618 9.74255 7.67038 8.4674 8.40416 10.8897 9.71584 8.6996 6.10339 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 4.51865 8.40416 7.08342 7.67038 6.864 7.75618 10.7864 10.3465 5.46754 6.50337 numMergedOcc 0
5 mol 19 unq 4 iso 0 dist 6.864 7.75618 7.08342 7.67038 4.51865 8.40416 10.8897 4.13497 8.6996 6.10339 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 6.86014 7.29868 8.52463 15.5315 15.5324 8.4051 9.11809 9.9259 3.4435 8.80127 numMergedOcc 0
7 mol 24 unq 1 iso 0 dist 6.86014 7.29868 8.52463 10.0952 8.86116 8.60554 10.0889 5.86882 11.3314 6.07553 numMergedOcc 0
8 mol 24 unq 2 iso 0 dist 6.86014 7.29868 8.52463 10.0952 8.86116 8.60554 9.11809 9.9259 3.4435 6.48457 numMergedOcc 0
9 mol 24 unq 3 iso 0 dist 8.86116 8.60554 8.52463 14.6259 15.5324 8.4051 6.48457 9.9259 3.4435 8.80127 numMergedOcc 0
10 mol 24 unq 4 iso 0 dist 8.86116 9.44691 13.4893 14.6259 15.5324 8.75662 6.48457 9.9259 7.63657 8.80127 numMergedOcc 0
11 mol 24 unq 5 iso 0 dist 8.38394 8.60554 12.3994 14.6259 17.8264 8.4051 6.48457 12.2071 3.4435 8.80127 numMergedOcc 0
12 mol 24 unq 6 iso 0 dist 8.38394 9.44691 12.505 14.6259 17.8264 8.75662 6.48457 12.2071 7.63657 8.80127 numMergedOcc 0
13 mol 24 unq 7 iso 0 dist 5.54419 8.4051 5.11617 14.6259 13.2433 8.60554 18.0802 15.3861 11.3314 6.07553 numMergedOcc 0
14 mol 24 unq 8 iso 0 dist 5.54419 8.4051 5.11617 14.6259 13.2433 8.60554 8.80127 7.6222 3.4435 6.48457 numMergedOcc 0
15 mol 24 unq 9 iso 0 dist 5.54419 8.75662 10.8238 14.6259 13.2433 9.44691 18.0802 15.3861 13.1723 6.07553 numMergedOcc 0
16 mol 24 unq 10 iso 0 dist 5.54419 8.75662 10.8238 14.6259 13.2433 9.44691 8.80127 7.6222 7.63657 6.48457 numMergedOcc 0
17 mol 24 unq 11 iso 0 dist 7.36323 8.4051 13.2229 14.6259 15.5296 8.60554 18.0802 19.7633 11.3314 6.07553 numMergedOcc 0
18 mol 24 unq 12 iso 0 dist 7.36323 8.4051 13.2229 14.6259 15.5296 8.60554 8.80127 11.7026 3.4435 6.48457 numMergedOcc 0
19 mol 24 unq 13 iso 0 dist 7.36323 8.75662 6.7828 14.6259 15.5296 9.44691 18.0802 19.7633 13.1723 6.07553 numMergedOcc 0
20 mol 24 unq 14 iso 0 dist 7.36323 8.75662 6.7828 14.6259 15.5296 9.44691 8.80127 11.7026 7.63657 6.48457 numMergedOcc 0
21 mol 85 unq 0 iso 0 dist 5.73196 9.39864 4.65335 10.1164 7.66905 7.54568 13.821 11.3211 13.2941 8.81824 numMergedOcc 0
22 mol 100 unq 0 iso 0 dist 8.87449 7.80975 7.97897 10.8586 10.9461 7.10378 9.06726 3.44801 5.53567 7.98814 numMergedOcc 0
23 mol 100 unq 1 iso 0 dist 7.17106 7.10378 10.6848 10.8586 10.1489 7.80975 15.2628 15.6285 8.86956 7.69401 numMergedOcc 0
24 mol 100 unq 2 iso 0 dist 7.17106 7.10378 10.6848 10.8586 10.1489 7.80975 13.3653 8.77492 11.7384 6.92671 numMergedOcc 0
25 mol 133 unq 0 iso 0 dist 6.29155 6.16242 4.54648 7.81217 6.80239 5.87634 10.6168 5.58281 5.21958 8.75049 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 7.54065 8.73217 11.7429 14.5862 16.3985 7.76163 15.1675 14.8858 7.65999 6.02579 numMergedOcc 0
27 mol 206 unq 0 iso 0 dist 8.02137 7.75885 12.7604 5.63422 11.1804 6.16414 6.11803 7.25848 7.87274 9.73419 numMergedOcc 0
28 mol 206 unq 1 iso 0 dist 8.02137 7.75885 12.7604 5.63422 11.1804 6.16414 13.6535 18.8969 6.55611 9.99824 numMergedOcc 0
29 mol 206 unq 2 iso 0 dist 7.7366 6.16414 6.45859 5.63422 9.774 7.75885 9.73419 8.77621 7.87274 6.11803 numMergedOcc 0
30 mol 206 unq 3 iso 0 dist 9.774 7.75885 6.45859 5.63422 7.7366 6.16414 6.11803 8.77621 7.87274 9.73419 numMergedOcc 0
31 mol 206 unq 4 iso 0 dist 9.774 7.75885 6.45859 5.63422 7.7366 6.16414 13.6535 10.2691 6.55611 9.99824 numMergedOcc 0
32 mol 227 unq 0 iso 0 dist 9.34734 7.43071 6.00424 4.39704 10.4905 6.02296 9.68793 10.2987 5.78036 6.40086 numMergedOcc 0
33 mol 227 unq 1 iso 0 dist 7.22101 7.43071 6.35849 4.39704 7.09863 6.02296 9.68793 6.16261 5.78036 6.40086 numMergedOcc 0
34 mol 227 unq 2 iso 0 dist 8.65997 7.43071 10.204 4.39704 10.8157 6.02296 9.68793 11.3848 5.78036 6.40086 numMergedOcc 0
35 mol 227 unq 3 iso 0 dist 7.56888 7.43071 9.76735 4.39704 11.0431 6.02296 9.68793 14.5919 5.78036 6.40086 numMergedOcc 0
36 mol 227 unq 4 iso 0 dist 7.55216 7.43071 9.32448 4.39704 10.0334 6.02296 9.68793 14.3995 5.78036 6.40086 numMergedOcc 0
37 mol 231 unq 0 iso 0 dist 8.40182 6.54852 6.37275 4.06055 7.37839 6.98875 10.1674 6.58152 6.90849 7.31553 numMergedOcc 0
38 mol 278 unq 0 iso 0 dist 8.44326 8.00673 4.97614 8.29447 10.6095 6.62841 11.5093 9.93707 7.27472 5.77089 numMergedOcc 0
