0 mol 73 unq 0 iso 0 dist 9.3387 16.114 9.69315 5.8562 8.39326 12.9678 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 9.3387 16.114 9.69315 7.08619 6.33741 11.2643 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 9.3387 11.2218 8.96327 5.8562 8.39326 13.9739 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 9.3387 11.2218 8.96327 7.08619 6.33741 5.47207 numMergedOcc 0
4 mol 105 unq 0 iso 0 dist 6.09256 9.33221 6.21457 10.7812 7.09806 6.08999 numMergedOcc 0
5 mol 105 unq 1 iso 0 dist 8.40598 11.2509 6.21457 6.50376 7.09806 6.08999 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 8.55826 12.387 5.32751 14.5505 9.35942 11.064 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 8.55826 12.387 5.32751 4.43177 7.42482 10.1476 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.81111 17.5717 9.03842 4.88633 6.73983 14.5524 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 8.81111 17.5717 9.03842 9.46307 8.6387 14.0071 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 8.29782 13.3578 6.73995 11.1711 7.32555 5.76368 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 8.29782 13.4083 8.619 11.1711 7.32555 10.8584 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 6.58212 4.79495 7.89312 9.8972 5.45675 8.54772 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 9.0515 6.55142 9.80811 8.47605 9.76411 5.18755 numMergedOcc 0
14 mol 247 unq 0 iso 0 dist 8.54404 7.86053 7.21548 15.4602 9.84493 16.3349 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 9.35976 5.57624 9.04531 14.2523 7.85414 10.4785 numMergedOcc 0
16 mol 282 unq 0 iso 0 dist 7.85295 6.20754 9.87988 6.47044 8.67489 5.50344 numMergedOcc 0
