0 mol 43 unq 0 iso 0 dist 9.30432 8.76177 10.3417 10.8436 7.32913 16.1817 numMergedOcc 0
1 mol 140 unq 0 iso 0 dist 8.72216 8.6371 5.00766 4.46614 7.60956 6.55217 numMergedOcc 0
2 mol 140 unq 1 iso 0 dist 8.72216 8.6371 5.00766 4.74205 9.9171 7.21686 numMergedOcc 0
3 mol 165 unq 0 iso 0 dist 8.19939 6.62466 6.27901 7.20315 7.21397 7.8052 numMergedOcc 0
4 mol 203 unq 0 iso 0 dist 9.44579 8.02341 10.6436 8.95399 6.84619 11.4468 numMergedOcc 0
5 mol 229 unq 0 iso 0 dist 9.79447 9.69083 6.40216 6.60289 6.28935 9.42877 numMergedOcc 0
6 mol 229 unq 1 iso 0 dist 9.79447 9.69083 6.40216 7.70905 8.4208 12.8298 numMergedOcc 0
7 mol 232 unq 0 iso 0 dist 8.63323 8.24059 13.3705 6.22887 6.77822 12.5937 numMergedOcc 0
8 mol 252 unq 0 iso 0 dist 8.85493 8.09155 9.43814 5.07471 8.19645 12.0056 numMergedOcc 0
9 mol 255 unq 0 iso 0 dist 5.84157 8.17286 12.1115 4.52659 7.57779 7.16286 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 8.88518 7.96325 16.1624 14.5913 8.10903 21.4236 numMergedOcc 0
11 mol 258 unq 1 iso 0 dist 8.88518 7.96325 16.1624 14.3641 7.25618 22.099 numMergedOcc 0
12 mol 258 unq 2 iso 0 dist 8.88518 6.81635 11.1086 14.5913 8.10903 18.7825 numMergedOcc 0
13 mol 258 unq 3 iso 0 dist 8.88518 6.81635 11.1086 14.3641 7.25618 17.1978 numMergedOcc 0
14 mol 280 unq 0 iso 0 dist 7.60676 7.11605 5.846 7.87626 4.45141 6.38295 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 9.04355 8.72085 7.43524 5.05806 6.96774 9.84741 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 9.04355 8.72085 7.43524 11.1974 7.14859 13.972 numMergedOcc 0
17 mol 287 unq 2 iso 0 dist 8.50508 8.72085 13.312 10.478 8.40726 18.5384 numMergedOcc 0
18 mol 287 unq 3 iso 0 dist 8.50508 8.72085 13.312 8.049 5.15923 14.8378 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.04355 8.72085 7.43524 5.05806 6.96774 9.84741 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 9.04355 8.72085 7.43524 11.1974 7.14859 13.972 numMergedOcc 0
21 mol 288 unq 2 iso 0 dist 8.50508 8.72085 13.312 10.478 8.40726 18.5384 numMergedOcc 0
22 mol 288 unq 3 iso 0 dist 8.50508 8.72085 13.312 8.049 5.15923 14.8378 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.04355 8.72085 7.43524 5.05806 6.96774 9.84741 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 9.04355 8.72085 7.43524 11.1974 7.14859 13.972 numMergedOcc 0
25 mol 289 unq 2 iso 0 dist 8.50508 8.72085 13.312 10.478 8.40726 18.5384 numMergedOcc 0
26 mol 289 unq 3 iso 0 dist 8.50508 8.72085 13.312 8.049 5.15923 14.8378 numMergedOcc 0
