0 mol 73 unq 0 iso 0 dist 8.93939 6.04163 4.60412 7.88286 12.9794 8.88953 numMergedOcc 0
1 mol 81 unq 0 iso 0 dist 8.53662 8.07716 7.3895 7.16417 8.16146 5.78829 numMergedOcc 0
2 mol 81 unq 1 iso 0 dist 8.16146 5.78829 7.3895 7.16417 8.53662 8.07716 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 9.11115 8.27456 12.0894 11.4493 18.9084 9.17862 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 9.25941 6.19867 13.3443 10.3248 16.9306 8.35452 numMergedOcc 0
5 mol 96 unq 1 iso 0 dist 8.40684 8.35452 11.1777 10.3248 16.0406 6.19867 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 6.25968 8.75736 12.0992 5.08237 9.31167 6.76166 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 6.25968 6.32178 4.8408 5.08237 9.31167 7.2977 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 9.16949 6.40792 9.7827 5.13431 11.4118 7.81701 numMergedOcc 0
9 mol 140 unq 1 iso 0 dist 8.65294 6.40792 5.80354 5.13431 10.2342 7.81701 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 7.90753 8.80581 5.32364 14.4101 10.6164 9.50454 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 6.23903 9.09322 8.16006 11.3698 12.1454 9.60723 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.83024 5.5581 6.21569 6.46748 10.6475 9.66975 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 8.82741 8.69557 14.0902 9.51432 16.8131 4.89168 numMergedOcc 0
14 mol 243 unq 1 iso 0 dist 8.82741 9.39147 7.07529 5.35679 4.88105 7.70059 numMergedOcc 0
15 mol 243 unq 2 iso 0 dist 4.88105 7.70059 7.07529 5.35679 8.82741 9.39147 numMergedOcc 0
16 mol 243 unq 3 iso 0 dist 9.01318 7.70059 4.67674 5.35679 11.8047 9.39147 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 6.64109 5.89409 6.86214 3.62968 8.57593 7.45719 numMergedOcc 0
18 mol 265 unq 1 iso 0 dist 8.57593 7.45719 6.86214 3.62968 6.64109 5.89409 numMergedOcc 0
19 mol 267 unq 0 iso 0 dist 9.70756 6.19138 5.09878 4.47183 11.1695 6.54381 numMergedOcc 0
20 mol 267 unq 1 iso 0 dist 7.21009 6.54381 7.22349 4.47183 10.5847 6.19138 numMergedOcc 0
21 mol 280 unq 0 iso 0 dist 8.71581 7.1704 11.4271 6.62546 9.79817 5.59626 numMergedOcc 0
22 mol 280 unq 1 iso 0 dist 9.79817 5.59626 11.4271 6.62546 8.71581 7.1704 numMergedOcc 0
