0 mol 10 unq 0 iso 0 dist 6.68744 5.30796 6.50154 9.06457 4.68389 6.02154 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 8.38129 5.48326 8.19827 7.61139 4.7579 5.9809 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 8.38129 5.48326 8.19827 6.54552 3.21365 5.83917 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.00784 4.93779 7.84204 10.2705 11.3766 5.84066 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 9.78668 6.82593 8.55712 11.6218 9.88975 8.13051 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 9.27633 6.64721 6.1847 5.9443 5.06277 5.28732 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 8.78439 10.4725 9.94534 12.7052 4.98191 9.09753 numMergedOcc 0
7 mol 135 unq 1 iso 0 dist 8.78439 10.4725 9.94534 11.5869 5.83178 7.6337 numMergedOcc 0
8 mol 197 unq 0 iso 0 dist 7.06868 10.1284 9.77656 17.3813 17.435 9.27218 numMergedOcc 0
9 mol 234 unq 0 iso 0 dist 9.8226 6.14528 5.69634 11.5526 12.9557 8.27411 numMergedOcc 0
10 mol 234 unq 1 iso 0 dist 9.8226 6.14528 5.69634 9.00657 4.70248 6.96257 numMergedOcc 0
11 mol 234 unq 2 iso 0 dist 9.8226 11.1481 7.91374 11.5526 12.9557 7.36208 numMergedOcc 0
12 mol 234 unq 3 iso 0 dist 9.8226 11.0167 7.35086 9.00657 4.70248 6.86569 numMergedOcc 0
13 mol 234 unq 4 iso 0 dist 9.2653 5.43106 5.69634 10.1846 12.9557 8.27411 numMergedOcc 0
14 mol 234 unq 5 iso 0 dist 9.2653 5.43106 5.69634 7.87591 4.70248 6.96257 numMergedOcc 0
15 mol 234 unq 6 iso 0 dist 9.2653 6.41546 7.91374 10.1846 12.9557 7.36208 numMergedOcc 0
16 mol 234 unq 7 iso 0 dist 9.2653 4.69096 7.35086 7.87591 4.70248 6.86569 numMergedOcc 0
17 mol 234 unq 8 iso 0 dist 8.33309 13.0843 5.69634 18.3615 12.9557 8.27411 numMergedOcc 0
18 mol 234 unq 9 iso 0 dist 8.33309 13.0843 5.69634 10.6204 4.70248 6.96257 numMergedOcc 0
19 mol 234 unq 10 iso 0 dist 8.33309 11.9483 7.91374 18.3615 12.9557 7.36208 numMergedOcc 0
20 mol 234 unq 11 iso 0 dist 8.33309 11.0142 7.35086 10.6204 4.70248 6.86569 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 5.39865 7.38226 7.23916 12.6192 8.8967 9.66641 numMergedOcc 0
22 mol 254 unq 1 iso 0 dist 5.39865 7.38226 7.23916 13.5562 9.42679 9.26575 numMergedOcc 0
23 mol 254 unq 2 iso 0 dist 5.0346 7.38226 6.12653 12.6192 10.929 9.66641 numMergedOcc 0
24 mol 254 unq 3 iso 0 dist 5.0346 7.38226 6.12653 13.5562 10.706 9.26575 numMergedOcc 0
25 mol 283 unq 0 iso 0 dist 7.15322 7.35639 9.66832 4.86946 3.34167 8.51504 numMergedOcc 0
26 mol 283 unq 1 iso 0 dist 8.91437 10.4634 7.83424 9.60873 3.12129 9.60574 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 9.78064 5.89971 7.77225 12.802 9.67163 8.59762 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 9.78064 5.89971 7.77225 12.802 9.67163 8.59762 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 9.78064 5.89971 7.77225 12.802 9.67163 8.59762 numMergedOcc 0
30 mol 292 unq 0 iso 0 dist 7.89784 7.32101 3.93401 6.79765 5.36842 6.1905 numMergedOcc 0
31 mol 292 unq 1 iso 0 dist 7.89784 7.32101 3.93401 6.13272 3.08474 5.84792 numMergedOcc 0
32 mol 292 unq 2 iso 0 dist 7.89784 7.32101 3.93401 7.02679 6.12546 8.73515 numMergedOcc 0
33 mol 292 unq 3 iso 0 dist 7.83983 5.737 3.93401 11.5098 5.36842 6.1905 numMergedOcc 0
34 mol 292 unq 4 iso 0 dist 7.83983 5.737 3.93401 10.5424 3.08474 5.84792 numMergedOcc 0
35 mol 292 unq 5 iso 0 dist 7.83983 5.737 3.93401 12.8158 6.12546 8.73515 numMergedOcc 0
