0 mol 43 unq 0 iso 0 dist 8.83248 9.15042 10.6711 5.82017 12.7067 6.6657 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 7.14979 9.84668 7.43519 11.8129 10.7324 6.65465 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.20839 6.27528 8.8408 7.65009 12.4932 9.37524 numMergedOcc 0
3 mol 122 unq 0 iso 0 dist 6.78551 5.09114 6.28781 11.2576 13.8995 8.054 numMergedOcc 0
4 mol 127 unq 0 iso 0 dist 9.57623 9.79448 8.89539 7.11155 13.2676 8.09965 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 7.48833 8.14071 5.99695 9.30769 11.2025 6.47346 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 7.14447 6.23573 5.77316 4.73274 5.52837 7.84864 numMergedOcc 0
7 mol 178 unq 0 iso 0 dist 7.33326 6.01118 5.84525 7.09944 10.5872 5.41229 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 8.98221 8.08787 9.13357 9.19336 15.1831 8.8508 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 7.83611 5.80867 11.3233 7.54337 8.73074 9.98332 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 7.00773 9.82174 9.4693 8.0362 11.4122 8.39522 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 7.00773 9.2521 13.931 8.0362 11.4122 5.99187 numMergedOcc 0
12 mol 238 unq 2 iso 0 dist 7.00773 8.51359 15.2654 8.0362 11.4122 9.93378 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 8.27377 7.0247 12.8819 11.3218 19.057 9.86979 numMergedOcc 0
14 mol 261 unq 0 iso 0 dist 9.0643 7.26647 6.80146 6.15322 12.4583 6.85589 numMergedOcc 0
15 mol 261 unq 1 iso 0 dist 9.0643 7.7309 9.00992 6.15322 12.4583 6.68878 numMergedOcc 0
16 mol 261 unq 2 iso 0 dist 7.4202 7.26647 12.9384 6.15322 12.431 6.85589 numMergedOcc 0
17 mol 261 unq 3 iso 0 dist 7.4202 7.7309 11.479 6.15322 12.431 6.68878 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.71938 8.27977 9.19671 11.9125 13.2766 7.63115 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 7.28238 7.70229 6.17747 5.9433 10.9983 7.34596 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 7.28238 7.90792 7.94567 5.9433 10.9983 7.12228 numMergedOcc 0
21 mol 282 unq 2 iso 0 dist 7.3389 7.70229 13.1327 5.9433 11.9641 7.34596 numMergedOcc 0
22 mol 282 unq 3 iso 0 dist 7.3389 7.90792 11.2762 5.9433 11.9641 7.12228 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 9.20553 6.8133 9.63504 10.1792 15.6099 8.99442 numMergedOcc 0
