0 mol 27 unq 0 iso 0 dist 7.4379 8.46092 7.41235 10.6296 5.33296 8.57157 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 5.87251 5.34976 5.19462 6.00504 5.15224 8.03914 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 5.87251 5.34976 5.19462 7.82362 8.07402 9.04174 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 7.81257 6.59001 5.19462 10.2097 5.15224 8.03914 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 7.81257 6.59001 5.19462 14.3249 8.07402 9.04174 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 9.57343 12.7344 9.72136 12.4428 9.89704 8.16183 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 9.28709 15.9426 8.55467 15.9505 6.73368 5.80074 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 9.36937 12.3984 7.56557 12.976 3.82306 9.41929 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 9.36937 9.02609 4.93016 12.976 3.82306 7.9883 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.54996 13.555 7.20083 12.3976 5.49686 4.33805 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 6.44701 5.13506 6.02506 14.2157 9.7362 9.93912 numMergedOcc 0
11 mol 148 unq 1 iso 0 dist 6.44701 5.13506 6.02506 9.74552 6.33907 8.3656 numMergedOcc 0
12 mol 148 unq 2 iso 0 dist 7.33878 5.13506 9.8506 14.2157 17.0927 9.93912 numMergedOcc 0
13 mol 148 unq 3 iso 0 dist 7.33878 5.13506 9.8506 9.74552 7.50382 8.3656 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 6.49658 5.16426 6.07854 9.86146 6.43607 8.44633 numMergedOcc 0
15 mol 150 unq 1 iso 0 dist 7.48646 5.16426 9.91991 9.86146 7.48524 8.44633 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 8.61758 10.6488 8.9694 14.4224 9.59563 5.79617 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 6.2587 9.8719 7.74312 11.4341 5.44878 9.94851 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 6.2587 9.8719 7.74312 11.4341 5.44878 9.94851 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 6.2587 9.8719 7.74312 11.4341 5.44878 9.94851 numMergedOcc 0
