0 mol 19 unq 0 iso 0 dist 8.82056 4.07239 6.00439 10.2449 4.23427 6.38574 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 6.04163 11.4785 5.64598 6.16745 3.85805 7.78587 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.88953 12.0993 5.64598 11.8357 3.85805 7.78587 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 8.96262 4.79472 6.33365 11.4295 7.30118 7.30467 numMergedOcc 0
4 mol 75 unq 1 iso 0 dist 8.64872 4.79472 5.15851 11.4295 4.74027 7.30467 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.32453 12.9327 9.49449 8.63792 3.69293 8.90522 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 4.75701 8.43244 8.39016 6.02596 4.79453 6.18681 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 4.75701 8.43244 8.39016 10.6786 7.5298 9.33288 numMergedOcc 0
8 mol 90 unq 2 iso 0 dist 9.89618 12.4268 8.39016 8.17454 4.79453 6.18681 numMergedOcc 0
9 mol 90 unq 3 iso 0 dist 9.89618 12.4268 8.39016 11.7811 7.5298 9.33288 numMergedOcc 0
10 mol 127 unq 0 iso 0 dist 8.09965 9.46933 8.59981 18.3288 14.8455 9.70065 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 7.15963 12.1848 6.71012 16.4827 11.618 7.61421 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 6.43406 4.56814 4.93785 7.24832 6.13927 6.91878 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 9.14737 7.69844 8.99696 16.3285 11.9685 9.77656 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 9.14737 7.69844 8.99696 16.1559 16.9912 9.6071 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 6.20646 6.27504 5.90931 11.1558 6.49075 9.58537 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 6.73266 6.67807 5.90931 12.0034 6.49075 9.58537 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 7.22234 10.6066 6.0965 11.793 4.67313 6.8984 numMergedOcc 0
18 mol 213 unq 1 iso 0 dist 7.22234 15.6607 9.59129 11.793 4.67313 7.77553 numMergedOcc 0
19 mol 213 unq 2 iso 0 dist 5.86501 5.56276 6.0965 9.59581 4.67313 6.8984 numMergedOcc 0
20 mol 213 unq 3 iso 0 dist 5.86501 10.1617 9.59129 9.59581 4.67313 7.77553 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 6.15754 4.48571 6.25105 11.0172 13.8525 7.91374 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 6.6281 5.91466 6.25105 12.865 13.8525 7.91374 numMergedOcc 0
23 mol 234 unq 2 iso 0 dist 8.9413 6.40261 9.5707 11.0172 12.7879 5.69634 numMergedOcc 0
24 mol 234 unq 3 iso 0 dist 8.9413 4.48571 7.85175 11.0172 12.7879 7.91374 numMergedOcc 0
25 mol 234 unq 4 iso 0 dist 4.91961 12.2893 9.5707 13.8357 12.7879 5.69634 numMergedOcc 0
26 mol 234 unq 5 iso 0 dist 4.91961 11.1927 7.85175 13.8357 12.7879 7.91374 numMergedOcc 0
27 mol 234 unq 6 iso 0 dist 7.14333 10.3017 9.39181 13.8357 11.1346 6.81195 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 6.51823 9.28896 6.77463 9.31268 5.7648 8.71877 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 6.20344 12.9748 7.48005 11.0634 6.65799 9.28024 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 9.64889 10.971 9.41725 14.1815 7.75371 9.62597 numMergedOcc 0
