0 mol 18 unq 0 iso 0 dist 6.41856 8.35401 3.96312 4.66547 8.69189 10.6818 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 7.88429 6.29808 7.08873 9.49416 9.93488 13.4621 numMergedOcc 0
2 mol 21 unq 1 iso 0 dist 7.88429 7.46409 10.6154 9.49416 9.93488 16.6038 numMergedOcc 0
3 mol 21 unq 2 iso 0 dist 7.88429 8.99131 9.29249 9.49416 9.93488 15.1256 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 8.55238 9.83419 4.93864 9.71545 9.85406 12.9292 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 8.55238 9.83419 4.93864 8.67638 5.76199 10.3811 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 9.17862 9.77082 3.94537 11.4493 8.27456 8.0675 numMergedOcc 0
7 mol 95 unq 3 iso 0 dist 8.27456 8.0675 3.94537 11.4493 9.17862 9.77082 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 6.76166 9.13631 11.5407 5.08237 8.75736 10.2034 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 7.2977 9.13631 5.91192 5.08237 6.32178 10.2034 numMergedOcc 0
10 mol 140 unq 0 iso 0 dist 7.81701 9.62309 4.91618 5.13431 6.40792 10.4837 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 7.14849 5.4647 6.42973 13.329 8.63718 14.8114 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 9.50454 9.19831 4.61184 14.4101 8.80581 12.3555 numMergedOcc 0
13 mol 183 unq 0 iso 0 dist 9.09322 9.3066 6.2342 11.3698 9.60723 14.4922 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 7.23126 4.48862 11.5807 8.17025 7.82805 10.3795 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 5.5581 9.04035 11.3125 6.46748 9.66975 8.73525 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 9.66975 8.73525 11.3125 6.46748 5.5581 9.04035 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 6.15754 6.39499 5.53885 6.13759 6.6281 10.6663 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 8.9413 6.39499 3.95629 13.4027 4.91961 8.6243 numMergedOcc 0
19 mol 243 unq 0 iso 0 dist 8.69557 8.8602 5.71505 9.51432 4.89168 9.49016 numMergedOcc 0
20 mol 243 unq 1 iso 0 dist 4.89168 9.49016 5.71505 9.51432 8.69557 8.8602 numMergedOcc 0
21 mol 243 unq 2 iso 0 dist 4.89168 8.92798 4.81639 9.51432 8.69557 12.76 numMergedOcc 0
22 mol 243 unq 3 iso 0 dist 9.39147 8.8602 11.8376 5.35679 7.70059 12.6562 numMergedOcc 0
