0 mol 16 unq 0 iso 0 dist 8.60935 6.04965 5.05215 6.32791 10.2338 9.99279 numMergedOcc 0
1 mol 16 unq 0 iso 1 dist 8.60935 6.32791 10.2338 6.04965 5.05215 9.99279 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 9.19217 9.82536 7.52257 8.77998 4.33061 5.59383 numMergedOcc 0
3 mol 42 unq 0 iso 1 dist 9.19217 8.77998 4.33061 9.82536 7.52257 5.59383 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.96016 9.58693 12.7375 9.48388 8.49566 17.7405 numMergedOcc 0
5 mol 98 unq 0 iso 1 dist 8.96016 9.48388 8.49566 9.58693 12.7375 17.7405 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 8.48829 5.79411 6.59891 9.9404 4.36536 5.49089 numMergedOcc 0
7 mol 102 unq 0 iso 1 dist 8.48829 9.9404 4.36536 5.79411 6.59891 5.49089 numMergedOcc 0
8 mol 229 unq 0 iso 0 dist 8.12807 9.48923 4.20878 9.67544 5.91886 5.46031 numMergedOcc 0
9 mol 229 unq 0 iso 1 dist 8.12807 9.67544 5.91886 9.48923 4.20878 5.46031 numMergedOcc 0
10 mol 249 unq 0 iso 0 dist 5.98732 9.0157 6.45919 9.14351 8.71871 8.34718 numMergedOcc 0
11 mol 249 unq 0 iso 1 dist 5.98732 9.14351 8.71871 9.0157 6.45919 8.34718 numMergedOcc 0
12 mol 259 unq 0 iso 0 dist 8.91236 8.70852 6.08432 9.89728 10.3156 7.64658 numMergedOcc 0
13 mol 259 unq 0 iso 1 dist 8.91236 9.89728 10.3156 8.70852 6.08432 7.64658 numMergedOcc 0
14 mol 259 unq 1 iso 0 dist 8.91236 8.70852 6.08432 6.42437 9.55719 5.87173 numMergedOcc 0
15 mol 259 unq 1 iso 1 dist 8.91236 6.42437 9.55719 8.70852 6.08432 5.87173 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 8.91236 9.89728 10.3156 6.42437 9.55719 10.5239 numMergedOcc 0
17 mol 259 unq 1 iso 1 dist 8.91236 6.42437 9.55719 9.89728 10.3156 10.5239 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 6.14231 8.43682 6.67602 6.20796 5.7052 4.92077 numMergedOcc 0
19 mol 264 unq 0 iso 1 dist 6.14231 6.20796 5.7052 8.43682 6.67602 4.92077 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.22261 5.22392 4.627 8.20217 8.52993 7.69449 numMergedOcc 0
21 mol 277 unq 0 iso 1 dist 8.22261 8.20217 8.52993 5.22392 4.627 7.69449 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 5.70701 5.22392 5.07427 8.20217 10.2752 7.69449 numMergedOcc 0
23 mol 277 unq 1 iso 1 dist 5.70701 8.20217 10.2752 5.22392 5.07427 7.69449 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 8.20213 8.62414 7.25786 6.23184 11.0893 8.29447 numMergedOcc 0
25 mol 278 unq 0 iso 1 dist 8.20213 6.23184 11.0893 8.62414 7.25786 8.29447 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 9.03579 5.71661 9.41638 8.98536 13.9089 4.84782 numMergedOcc 0
27 mol 294 unq 0 iso 1 dist 9.03579 8.98536 13.9089 5.71661 9.41638 4.84782 numMergedOcc 0
