0 mol 68 unq 0 iso 0 dist 9.74289 5.37144 7.39665 10.4048 5.31976 9.90923 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.28058 9.77994 6.45841 9.92962 6.97502 7.69222 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 7.28058 10.8484 5.61588 9.92962 6.97502 5.82056 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 7.28058 14.7963 7.83244 9.92962 6.97502 9.09115 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.79714 9.4173 8.13108 8.09587 13.0619 8.12959 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 6.1421 3.82645 6.69691 10.2926 4.80675 9.31543 numMergedOcc 0
6 mol 129 unq 1 iso 0 dist 6.1421 5.75588 5.51197 10.2926 4.80675 8.85652 numMergedOcc 0
7 mol 129 unq 2 iso 0 dist 9.54663 5.71616 6.69691 9.83241 4.80675 9.31543 numMergedOcc 0
8 mol 129 unq 3 iso 0 dist 9.54663 11.0564 5.51197 9.83241 4.80675 8.85652 numMergedOcc 0
9 mol 144 unq 0 iso 0 dist 9.73668 8.35821 7.64028 16.2898 9.4361 9.08956 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 7.21035 4.16926 9.56028 7.67974 4.85077 8.8774 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 6.20985 5.74845 8.73533 8.62253 8.24478 6.49577 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 6.20985 5.74845 8.73533 11.8995 10.0248 9.76574 numMergedOcc 0
13 mol 186 unq 2 iso 0 dist 7.69466 5.60861 8.73533 10.6795 8.24478 6.49577 numMergedOcc 0
14 mol 186 unq 3 iso 0 dist 7.69466 5.60861 8.73533 8.86673 10.0248 9.76574 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 9.30186 6.38826 8.1945 12.264 17.0867 8.94981 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 6.67907 7.15922 8.23087 7.73969 5.52669 9.67162 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 9.13483 6.16483 6.34915 13.4014 5.54149 8.27649 numMergedOcc 0
18 mol 257 unq 1 iso 0 dist 6.44188 6.16483 7.81897 13.4014 10.8918 8.27649 numMergedOcc 0
19 mol 257 unq 2 iso 0 dist 5.16581 5.48725 6.34915 9.91996 5.54149 8.27649 numMergedOcc 0
20 mol 257 unq 3 iso 0 dist 5.13633 5.48725 7.81897 9.91996 10.8918 8.27649 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 9.89728 13.7396 5.85442 15.3515 6.18571 8.40328 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 9.89728 15.7491 6.95511 15.3515 6.18571 8.2518 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 6.86014 14.6762 8.9682 6.92271 5.77904 9.91103 numMergedOcc 0
24 mol 277 unq 1 iso 0 dist 6.86014 11.68 6.92711 6.92271 5.77904 7.0603 numMergedOcc 0
25 mol 277 unq 2 iso 0 dist 5.97073 11.3103 8.9682 8.62666 5.77904 9.91103 numMergedOcc 0
26 mol 277 unq 3 iso 0 dist 5.97073 10.5734 6.92711 8.62666 5.77904 7.0603 numMergedOcc 0
27 mol 277 unq 4 iso 0 dist 8.23147 6.40883 5.46926 8.41858 10.4297 9.91103 numMergedOcc 0
28 mol 277 unq 5 iso 0 dist 8.23147 6.79352 5.13913 8.41858 10.4297 7.0603 numMergedOcc 0
29 mol 277 unq 6 iso 0 dist 6.49176 6.40883 8.9682 8.41858 5.77904 9.91103 numMergedOcc 0
30 mol 277 unq 7 iso 0 dist 6.49176 6.79352 6.92711 8.41858 5.77904 7.0603 numMergedOcc 0
31 mol 277 unq 8 iso 0 dist 5.22392 6.68571 9.57499 14.5436 16.3552 9.91103 numMergedOcc 0
32 mol 277 unq 9 iso 0 dist 8.20217 6.68571 5.46926 14.5436 10.4297 9.91103 numMergedOcc 0
33 mol 277 unq 10 iso 0 dist 8.20217 9.44642 5.13913 14.5436 10.4297 7.0603 numMergedOcc 0
