0 mol 21 unq 0 iso 0 dist 6.08338 5.93898 4.28381 10.6971 6.93185 6.28263 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 8.89374 8.96727 14.6599 5.49591 9.11258 9.01564 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 8.89374 8.01308 9.47022 5.49591 9.11258 7.11065 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.70133 9.73086 6.15714 5.11416 7.10439 6.14542 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 4.65521 8.68662 6.10063 6.56633 7.10439 8.96616 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 4.65521 7.4369 6.15714 6.56633 7.10439 6.14542 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.21982 6.72869 4.00608 4.85247 7.03226 7.46095 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.19682 9.85905 4.00608 6.45686 7.03226 7.46095 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.79571 7.21868 5.67107 4.57832 8.73604 9.0176 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 5.42582 7.93372 5.67107 5.29786 8.73604 9.0176 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 8.94837 9.00918 5.58312 14.2198 6.93279 7.83568 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 6.93652 8.07097 4.22522 7.42649 5.26989 5.29898 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 9.14392 8.97626 12.0485 6.89781 9.0529 9.24038 numMergedOcc 0
13 mol 155 unq 1 iso 0 dist 7.51198 8.97626 4.48516 5.50031 9.80845 9.16358 numMergedOcc 0
14 mol 155 unq 2 iso 0 dist 7.51198 8.97626 4.48516 6.89781 7.55196 9.24038 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 7.98142 6.64173 4.48306 5.63555 5.97685 8.12266 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 7.98142 9.55105 10.2172 5.63555 5.97685 9.43306 numMergedOcc 0
17 mol 181 unq 2 iso 0 dist 7.37327 6.64173 4.88823 5.63555 8.9289 8.12266 numMergedOcc 0
18 mol 181 unq 3 iso 0 dist 7.37327 9.55105 14.2334 5.63555 8.9289 9.43306 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 8.17891 5.23634 4.09934 10.9607 7.57454 8.91971 numMergedOcc 0
20 mol 227 unq 1 iso 0 dist 6.95902 6.91318 4.09934 9.72615 7.57454 8.91971 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 9.5707 7.81215 11.8229 10.0059 7.43663 7.77911 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 9.39181 5.64285 6.45373 5.08515 7.94068 7.77911 numMergedOcc 0
23 mol 235 unq 0 iso 0 dist 6.98084 8.19317 4.47008 6.82855 7.31773 8.97952 numMergedOcc 0
24 mol 235 unq 1 iso 0 dist 7.32211 5.1823 4.47008 6.46722 7.31773 8.97952 numMergedOcc 0
