0 mol 0 unq 0 iso 0 dist 7.55723 8.82652 5.56852 4.18909 6.80636 5.88757 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.55723 8.82652 5.56852 12.7194 13.3498 8.66548 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 6.22892 9.96415 6.88805 5.13744 6.36911 8.81608 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 8.62669 8.79235 10.4432 7.13443 13.7513 7.11695 numMergedOcc 0
4 mol 53 unq 1 iso 0 dist 8.62669 8.79235 10.4432 4.94089 11.569 7.58093 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 9.58468 6.88243 6.24991 12.0778 12.6241 7.03126 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 9.58468 6.88243 6.24991 6.39539 12.1316 9.68228 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 6.46655 7.80026 6.08003 14.6616 10.3148 8.35444 numMergedOcc 0
8 mol 67 unq 0 iso 0 dist 7.9572 6.44825 9.25732 13.1761 17.6487 8.96498 numMergedOcc 0
9 mol 67 unq 1 iso 0 dist 8.64208 6.44825 13.625 13.1761 21.662 8.96498 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 8.90592 9.70788 11.903 4.85796 7.7056 7.05845 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 8.90592 9.70788 11.903 13.1446 17.4028 8.18023 numMergedOcc 0
12 mol 144 unq 0 iso 0 dist 8.11591 9.08956 8.65006 12.42 16.376 9.09684 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 8.66709 5.55218 7.10286 5.49358 11.5473 7.29911 numMergedOcc 0
14 mol 155 unq 1 iso 0 dist 8.66709 5.55218 7.10286 7.00069 7.39644 5.36254 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 8.84671 6.95244 7.73027 8.94838 14.2756 8.62366 numMergedOcc 0
16 mol 173 unq 1 iso 0 dist 8.84671 6.11224 8.97627 8.94838 14.2756 6.52508 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.63295 8.39573 5.93724 11.4382 10.1232 6.76746 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 9.4835 6.0155 8.52282 12.5858 12.3623 9.58372 numMergedOcc 0
19 mol 217 unq 0 iso 0 dist 5.10683 6.58871 4.64118 5.56523 10.0092 9.59084 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 7.04127 5.36326 5.13732 9.20195 8.19953 5.73591 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 7.04127 5.36326 5.13732 9.72892 11.5717 8.55345 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 8.82094 5.38409 5.12237 10.6582 7.67853 8.84523 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 9.80332 8.45524 5.12237 5.96784 7.67853 8.84523 numMergedOcc 0
24 mol 272 unq 2 iso 0 dist 9.80332 9.66055 5.41667 5.96784 7.67853 6.95241 numMergedOcc 0
25 mol 273 unq 0 iso 0 dist 6.54753 6.95569 12.634 10.5519 16.8596 9.06937 numMergedOcc 0
