0 mol 9 unq 0 iso 0 dist 8.72522 9.56646 11.4502 11.0121 6.85412 15.7249 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.72522 9.56646 11.4502 6.35665 6.33889 10.6397 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.13365 8.12171 6.66749 10.7829 9.75144 13.2857 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.47617 9.9451 13.5667 10.7814 9.83618 20.2082 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.13476 6.54052 4.29856 6.2425 5.02241 6.30987 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 7.63534 9.2958 6.45686 4.35757 8.97793 11.1148 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 7.63534 9.2958 6.45686 6.55474 8.19682 7.03226 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 7.63534 8.23534 4.3931 4.35757 8.97793 10.8997 numMergedOcc 0
8 mol 76 unq 3 iso 0 dist 7.63534 8.23534 4.3931 6.55474 8.19682 11.4594 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 5.22628 9.19273 6.40494 9.16391 9.66954 14.9181 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 5.22628 9.19273 6.40494 5.26498 7.64585 7.52142 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 8.94909 9.68996 17.3514 11.1266 7.92688 16.7175 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 9.09857 6.07708 5.70743 9.00192 8.31897 6.64779 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.50454 5.87853 6.29863 10.9336 6.93764 9.93639 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 7.15963 5.87853 5.6044 9.09192 6.94688 10.3766 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 7.15963 5.87853 5.6044 12.1848 6.71012 10.7723 numMergedOcc 0
16 mol 181 unq 3 iso 0 dist 6.43406 9.0234 7.77758 4.56814 4.93785 7.05653 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 6.73266 9.639 5.86489 6.67807 5.90931 11.641 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 4.91961 9.33455 10.0059 12.2893 9.5707 7.43663 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 4.91961 9.33455 10.0059 11.1927 7.85175 10.0212 numMergedOcc 0
20 mol 234 unq 2 iso 0 dist 7.14333 9.33455 5.08515 10.3017 9.39181 7.94068 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 5.99137 7.87572 13.1168 4.47231 5.34718 12.0937 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.51823 6.62283 10.4017 9.28896 6.77463 8.90076 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 6.51823 6.62283 10.4017 6.04481 7.2766 8.09718 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 6.51823 8.60978 7.95232 9.28896 6.77463 6.62002 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 6.51823 8.60978 7.95232 6.04481 7.2766 6.73446 numMergedOcc 0
26 mol 241 unq 0 iso 0 dist 6.97756 9.36895 4.90279 8.28913 6.83797 8.00537 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 9.64889 9.7625 7.70529 10.971 9.41725 14.3284 numMergedOcc 0
28 mol 282 unq 0 iso 0 dist 7.12228 9.88071 6.6348 7.00729 7.32347 6.8972 numMergedOcc 0
