0 mol 34 unq 0 iso 0 dist 9.75011 5.41061 8.82122 15.4758 8.55901 15.3157 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 9.64602 4.33272 7.63645 5.41668 7.17699 4.68181 numMergedOcc 0
2 mol 45 unq 0 iso 0 dist 7.61402 4.80098 6.94727 13.4742 8.13782 11.5096 numMergedOcc 0
3 mol 140 unq 0 iso 0 dist 6.29125 7.24224 7.79467 5.35291 5.63811 5.36419 numMergedOcc 0
4 mol 156 unq 0 iso 0 dist 9.40225 10.9123 8.47477 11.9162 6.90155 5.74389 numMergedOcc 0
5 mol 156 unq 1 iso 0 dist 9.40225 14.4184 8.57453 11.9162 6.90155 4.95416 numMergedOcc 0
6 mol 156 unq 2 iso 0 dist 7.49255 5.83458 8.47477 9.42317 6.90155 5.74389 numMergedOcc 0
7 mol 156 unq 3 iso 0 dist 7.49255 9.42147 8.57453 9.42317 6.90155 4.95416 numMergedOcc 0
8 mol 156 unq 4 iso 0 dist 4.94012 3.53805 8.47477 4.71629 6.90155 5.74389 numMergedOcc 0
9 mol 156 unq 5 iso 0 dist 4.94012 5.21836 8.57453 4.71629 6.90155 4.95416 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 9.13913 7.72454 9.25763 5.21474 9.79554 5.56282 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 9.13913 10.9088 9.63102 5.21474 9.79554 7.17381 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 9.15536 5.0925 6.84347 10.9709 4.79852 8.65486 numMergedOcc 0
13 mol 228 unq 0 iso 0 dist 8.04854 12.4485 9.58356 13.7194 8.37287 10.3782 numMergedOcc 0
14 mol 228 unq 1 iso 0 dist 8.08612 12.5848 9.29522 13.6087 8.07174 10.3257 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 9.10967 14.2541 5.73804 7.1782 7.25543 9.73112 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 7.83632 6.74867 5.73804 5.88198 7.25543 9.73112 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 9.11168 9.93782 9.09553 5.70545 7.16259 5.28906 numMergedOcc 0
18 mol 286 unq 0 iso 0 dist 8.09156 5.45077 9.10103 9.39462 8.81794 11.1738 numMergedOcc 0
19 mol 286 unq 1 iso 0 dist 8.09156 4.95962 6.88301 9.39462 8.81794 5.6144 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 9.17225 15.0258 9.20616 10.7347 7.72845 5.9596 numMergedOcc 0
