0 mol 15 unq 0 iso 0 dist 6.82505 9.97507 5.17568 7.12903 5.51916 5.90976 4.13564 7.88714 11.371 10.4006 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 4.51865 6.864 7.67038 8.58657 6.74265 5.5841 4.13497 6.10339 10.8897 11.4234 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 6.864 4.51865 7.67038 8.58657 5.5841 6.74265 10.3465 6.50337 10.7864 5.64498 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.80331 6.20293 8.13395 9.83618 10.4442 9.49077 14.0634 9.89546 14.792 19.9325 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 6.20293 8.80331 8.13395 9.83618 9.49077 10.4442 6.09486 9.07906 14.1869 10.3911 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 7.2846 7.58835 8.81358 6.34173 4.71384 5.67689 4.91588 7.742 11.975 9.32294 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 9.5589 6.83299 5.08001 5.02241 6.91765 5.06052 15.2053 8.41018 11.78 14.6455 numMergedOcc 0
7 mol 54 unq 1 iso 0 dist 9.5589 8.10861 16.3192 5.02241 6.91765 10.1332 15.2053 8.41018 22.4204 14.6455 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.96708 9.78528 8.24309 7.321 9.0131 6.11922 11.8198 4.69674 10.2718 12.7304 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 7.97049 6.19965 5.42586 9.47876 7.98917 11.6116 5.46695 8.77199 8.81824 10.5122 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 7.47541 7.66905 5.42586 7.22293 7.98917 11.6116 11.3211 8.77199 8.81824 10.5122 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 7.47541 5.73196 6.87425 7.22293 7.98917 6.47779 11.3211 8.77199 13.821 10.5122 numMergedOcc 0
12 mol 85 unq 3 iso 0 dist 6.19965 7.97049 5.42586 9.47876 11.6116 7.98917 5.46695 8.81824 8.77199 10.5122 numMergedOcc 0
13 mol 85 unq 4 iso 0 dist 7.66905 7.47541 5.42586 7.22293 11.6116 7.98917 11.3211 8.81824 8.77199 10.5122 numMergedOcc 0
14 mol 85 unq 5 iso 0 dist 7.66905 5.73196 10.1164 7.22293 11.6116 6.47779 11.3211 8.81824 13.821 10.5122 numMergedOcc 0
15 mol 100 unq 0 iso 0 dist 7.17106 9.60661 11.5403 6.58204 5.01145 10.9608 8.07597 7.98814 15.4133 11.247 numMergedOcc 0
16 mol 100 unq 1 iso 0 dist 7.17106 9.35224 8.87654 6.58204 5.01145 5.69137 8.07597 7.98814 15.5327 11.247 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 6.70283 8.56324 7.65448 9.13561 8.25411 5.99333 5.97115 8.86966 13.4958 11.7604 numMergedOcc 0
18 mol 152 unq 1 iso 0 dist 6.70283 7.16148 5.49936 9.13561 8.25411 7.89109 5.97115 8.86966 5.7527 11.7604 numMergedOcc 0
19 mol 152 unq 2 iso 0 dist 7.16148 8.56324 10.6875 9.13561 7.89109 5.99333 5.97115 5.7527 13.4958 11.7604 numMergedOcc 0
20 mol 152 unq 3 iso 0 dist 7.16148 6.70283 5.49936 9.13561 7.89109 8.25411 5.97115 5.7527 8.86966 11.7604 numMergedOcc 0
21 mol 155 unq 0 iso 0 dist 6.43582 7.46303 7.66392 9.14392 12.1814 6.3845 4.47054 6.89245 10.3868 13.3925 numMergedOcc 0
22 mol 155 unq 1 iso 0 dist 6.43582 7.46303 7.66392 7.51198 6.34186 5.86939 4.47054 6.89245 10.3868 10.9101 numMergedOcc 0
23 mol 178 unq 0 iso 0 dist 6.69288 6.43573 5.34677 8.96511 10.5783 5.96647 4.43082 8.4173 9.70181 13.1757 numMergedOcc 0
24 mol 178 unq 1 iso 0 dist 6.69288 7.17202 11.7381 8.96511 10.5783 12.075 4.43082 8.4173 6.55543 13.1757 numMergedOcc 0
25 mol 178 unq 2 iso 0 dist 6.69288 8.81551 14.0703 8.96511 10.5783 9.92132 4.43082 8.4173 10.2965 13.1757 numMergedOcc 0
26 mol 178 unq 3 iso 0 dist 7.17202 6.69288 11.7381 8.96511 12.075 10.5783 4.43082 6.55543 8.4173 13.1757 numMergedOcc 0
27 mol 178 unq 4 iso 0 dist 7.17202 6.43573 9.89739 8.96511 12.075 5.96647 4.43082 6.55543 9.70181 13.1757 numMergedOcc 0
28 mol 178 unq 5 iso 0 dist 7.17202 8.81551 5.18005 8.96511 12.075 9.92132 4.43082 6.55543 10.2965 13.1757 numMergedOcc 0
29 mol 224 unq 0 iso 0 dist 6.61986 9.40098 9.54151 8.19953 10.7113 8.64911 4.32714 7.80754 11.7286 12.4783 numMergedOcc 0
30 mol 224 unq 1 iso 0 dist 6.61986 9.40098 9.54151 8.19953 10.7113 8.64911 8.95149 8.20295 12.3058 16.1425 numMergedOcc 0
31 mol 227 unq 0 iso 0 dist 7.09863 7.22101 4.39704 8.17891 9.13836 6.43754 6.16261 6.40086 9.68793 12.6208 numMergedOcc 0
32 mol 249 unq 0 iso 0 dist 6.18582 7.57994 5.01979 8.83735 7.38675 5.23473 5.40456 7.27415 10.3622 13.1241 numMergedOcc 0
33 mol 252 unq 0 iso 0 dist 8.33025 8.1148 6.0987 7.66365 9.37715 4.23801 12.9824 6.38733 10.5963 14.5568 numMergedOcc 0
34 mol 252 unq 1 iso 0 dist 8.33025 8.1148 6.0987 7.66365 9.37715 4.23801 15.2956 9.64349 14.1962 17.9984 numMergedOcc 0
35 mol 261 unq 0 iso 0 dist 9.14619 8.45658 7.00201 7.47164 7.49174 5.22253 15.4874 9.00426 14.9571 16.4241 numMergedOcc 0
36 mol 261 unq 1 iso 0 dist 9.14619 8.45658 7.00201 7.47164 7.49174 5.22253 13.3429 8.19348 12.6716 15.0524 numMergedOcc 0
37 mol 264 unq 0 iso 0 dist 6.24356 9.361 10.3202 9.0012 5.12409 9.74238 14.5632 8.48407 15.0114 7.26094 numMergedOcc 0
38 mol 264 unq 1 iso 0 dist 6.24356 9.361 10.3202 9.5784 9.67998 9.85579 14.5632 8.48407 15.0114 13.1775 numMergedOcc 0
