0 mol 5 unq 0 iso 0 dist 5.04052 8.59201 9.22027 8.35174 7.50453 3.14155 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.87863 15.8695 9.22027 15.05 7.50453 3.14155 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 6.46284 4.07888 4.98321 5.17677 7.74636 6.98653 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 7.12529 7.99753 7.53964 5.94532 6.51117 3.87762 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 7.12529 6.62656 5.76961 5.94532 6.51117 5.6003 numMergedOcc 0
5 mol 157 unq 0 iso 0 dist 4.20542 5.61367 8.40821 4.15636 7.91458 4.69348 numMergedOcc 0
6 mol 184 unq 0 iso 0 dist 8.32647 6.97246 4.61596 9.26049 7.25623 3.30691 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 9.43325 9.11496 8.36129 5.12831 9.4366 10.872 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 9.43325 9.49267 5.86483 5.12831 9.4366 11.366 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 9.42723 5.9839 9.91727 14.6341 9.75417 13.1522 numMergedOcc 0
10 mol 198 unq 1 iso 0 dist 7.70823 12.5506 9.91727 5.78548 9.75417 13.1522 numMergedOcc 0
11 mol 198 unq 2 iso 0 dist 8.16611 10.8876 9.91727 4.02569 9.75417 13.1522 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 8.9694 15.6849 9.43017 9.12568 8.7434 10.9158 numMergedOcc 0
13 mol 214 unq 1 iso 0 dist 8.83512 6.15628 9.43017 12.6104 8.7434 10.9158 numMergedOcc 0
14 mol 214 unq 2 iso 0 dist 8.02723 9.1215 9.43017 8.77167 8.7434 10.9158 numMergedOcc 0
15 mol 214 unq 3 iso 0 dist 8.70011 6.3054 4.85332 8.36583 7.70062 4.84709 numMergedOcc 0
16 mol 214 unq 4 iso 0 dist 8.70011 6.3054 4.85332 5.61704 7.66702 4.16963 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 5.01648 10.7302 9.37602 5.44069 6.19602 10.2731 numMergedOcc 0
18 mol 217 unq 1 iso 0 dist 5.01648 5.75957 8.26522 5.44069 6.19602 4.56185 numMergedOcc 0
19 mol 237 unq 0 iso 0 dist 6.16312 4.59989 9.86835 7.05389 9.50001 4.75995 numMergedOcc 0
20 mol 251 unq 0 iso 0 dist 6.96393 9.02132 9.02417 8.19568 7.72528 3.45567 numMergedOcc 0
