0 mol 54 unq 0 iso 0 dist 6.50287 7.51978 11.6633 7.18148 6.10172 13.8618 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 5.3931 6.27528 6.08842 7.07055 3.69583 5.54818 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 6.17698 7.28711 3.5994 8.47126 7.53537 9.80027 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 5.09936 5.94478 6.17691 7.85115 5.99213 8.02001 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 4.31989 6.7319 4.76513 8.72521 7.81193 10.9086 numMergedOcc 0
5 mol 143 unq 1 iso 0 dist 4.31989 6.7319 4.76513 8.19373 6.26235 7.02542 numMergedOcc 0
6 mol 153 unq 0 iso 0 dist 6.81821 9.56587 10.0643 5.17415 9.7864 6.14894 numMergedOcc 0
7 mol 153 unq 1 iso 0 dist 6.81821 9.56587 10.0643 8.379 9.70774 4.15597 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 5.78397 6.64164 5.89138 9.5648 15.1021 12.8624 numMergedOcc 0
9 mol 167 unq 1 iso 0 dist 5.36359 4.93984 6.7811 7.33483 4.0116 6.13061 numMergedOcc 0
10 mol 213 unq 0 iso 0 dist 8.17498 4.71403 7.21368 6.19516 7.73082 5.99437 numMergedOcc 0
11 mol 249 unq 0 iso 0 dist 9.87896 6.93507 7.61942 6.32658 11.6107 5.57138 numMergedOcc 0
12 mol 249 unq 1 iso 0 dist 9.87896 6.42827 5.09262 6.32658 11.6107 10.3504 numMergedOcc 0
13 mol 272 unq 0 iso 0 dist 5.32891 9.54236 12.7098 8.54895 5.88095 12.0416 numMergedOcc 0
14 mol 276 unq 0 iso 0 dist 8.02433 7.11272 13.0895 9.97709 16.5235 9.89329 numMergedOcc 0
15 mol 276 unq 1 iso 0 dist 8.02433 6.24808 5.95336 9.97709 16.5235 12.1499 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.39418 7.28096 6.27066 6.17759 4.73745 7.83168 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 7.39418 7.28096 6.27066 8.20391 4.16431 10.0322 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.39418 7.28096 6.27066 6.17759 4.73745 7.83168 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 7.39418 7.28096 6.27066 8.20391 4.16431 10.0322 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.39418 7.28096 6.27066 6.17759 4.73745 7.83168 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 7.39418 7.28096 6.27066 8.20391 4.16431 10.0322 numMergedOcc 0
