0 mol 5 unq 0 iso 0 dist 9.89017 8.97274 15.8913 11.3755 19.09 9.22027 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.73111 8.97274 12.7521 11.3755 17.48 9.22027 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 7.28761 9.78134 6.0516 11.1943 6.34665 5.09702 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.90701 8.21247 9.05723 15.2071 14.7271 8.34145 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 6.05264 5.63499 3.9531 7.73958 8.63132 5.40489 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.15885 9.23105 6.3122 3.54989 8.66216 7.53964 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 8.15885 6.14494 3.69782 3.54989 8.66216 5.76961 numMergedOcc 0
7 mol 56 unq 2 iso 0 dist 8.15885 6.14494 3.69782 4.67834 10.1802 9.47401 numMergedOcc 0
8 mol 56 unq 3 iso 0 dist 7.43523 9.23105 8.96639 3.54989 9.42328 7.53964 numMergedOcc 0
9 mol 56 unq 4 iso 0 dist 7.43523 6.14494 5.54735 3.54989 9.42328 5.76961 numMergedOcc 0
10 mol 56 unq 5 iso 0 dist 7.43523 6.14494 5.54735 4.67834 9.52578 9.47401 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 9.71134 5.58681 6.23263 4.21899 12.511 8.16401 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 8.79758 9.1854 9.88034 5.47558 13.0773 9.10671 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.60727 7.99441 10.308 6.4817 14.277 8.14294 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 8.60727 6.71817 10.9701 6.4817 14.277 5.72 numMergedOcc 0
15 mol 222 unq 2 iso 0 dist 8.60727 8.41524 12.8672 6.4817 14.277 6.84052 numMergedOcc 0
16 mol 222 unq 3 iso 0 dist 8.60727 8.41524 12.8672 8.05936 16.2837 9.58086 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 9.49142 8.76745 13.4488 8.30723 10.2685 6.09335 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 8.20035 9.34023 5.11253 5.92282 9.37214 8.85955 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 8.20035 5.77762 3.31397 5.92282 9.37214 6.09335 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 8.62356 8.75172 9.95991 4.58625 10.3631 8.93212 numMergedOcc 0
