0 mol 8 unq 0 iso 0 dist 8.99126 5.02333 8.94096 12.2927 12.7056 8.77457 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 6.33889 11.0722 9.82483 9.62394 6.0397 8.076 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.87449 7.51034 8.22285 12.7732 10.5584 9.3523 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 9.75144 6.00575 8.62284 7.33768 5.90981 9.69752 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 9.75144 6.00575 8.62284 7.29868 13.719 9.36461 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 6.99408 6.18811 7.95778 9.49841 6.39184 8.80014 numMergedOcc 0
6 mol 45 unq 1 iso 0 dist 9.3403 6.67086 7.95778 13.505 6.39184 8.80014 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 8.39016 8.89062 7.54496 11.4614 4.48233 7.31784 numMergedOcc 0
8 mol 90 unq 1 iso 0 dist 6.99355 10.1287 7.54496 11.1527 4.48233 7.31784 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 6.73814 5.6074 8.11094 9.39063 6.76585 9.17466 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 6.79146 9.44878 6.82089 7.88805 6.08911 9.13191 numMergedOcc 0
11 mol 130 unq 1 iso 0 dist 6.79146 9.44878 6.82089 15.7868 11.562 6.95405 numMergedOcc 0
12 mol 130 unq 2 iso 0 dist 7.66168 4.28797 6.82089 7.90048 6.08911 9.13191 numMergedOcc 0
13 mol 130 unq 3 iso 0 dist 7.66168 4.28797 6.82089 9.99802 11.562 6.95405 numMergedOcc 0
14 mol 130 unq 4 iso 0 dist 6.89257 6.97875 6.82089 11.5527 6.08911 9.13191 numMergedOcc 0
15 mol 130 unq 5 iso 0 dist 6.89257 6.97875 6.82089 13.6341 11.562 6.95405 numMergedOcc 0
16 mol 130 unq 6 iso 0 dist 9.12581 4.28797 5.38314 7.90048 10.0581 9.13191 numMergedOcc 0
17 mol 130 unq 7 iso 0 dist 9.12581 4.28797 5.38314 9.99802 7.20197 6.95405 numMergedOcc 0
18 mol 130 unq 8 iso 0 dist 8.74308 6.97875 5.38314 11.5527 10.0581 9.13191 numMergedOcc 0
19 mol 130 unq 9 iso 0 dist 8.74308 6.97875 5.38314 13.6341 7.20197 6.95405 numMergedOcc 0
20 mol 147 unq 0 iso 0 dist 8.33261 12.6979 7.01133 10.3047 7.66774 7.25644 numMergedOcc 0
21 mol 163 unq 0 iso 0 dist 9.19209 3.89889 5.92747 9.69121 6.84883 7.8639 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 9.31887 13.9336 7.01126 10.4182 4.30489 5.89564 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 9.31887 13.9336 7.01126 13.5281 4.57622 5.60528 numMergedOcc 0
24 mol 175 unq 2 iso 0 dist 9.31887 11.873 6.58434 13.5281 4.57622 5.5995 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 7.20046 5.93488 7.345 9.72611 9.87435 7.11785 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 7.13543 5.93488 9.52987 9.72611 14.6648 7.11785 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 7.98142 9.92777 5.49808 11.3743 4.46559 9.26796 numMergedOcc 0
28 mol 181 unq 3 iso 0 dist 7.37327 9.92777 7.96291 11.3743 9.08227 9.26796 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 9.19704 5.54129 9.83885 9.53629 11.8917 5.95375 numMergedOcc 0
30 mol 205 unq 1 iso 0 dist 9.19704 5.28092 5.42696 9.53629 11.8917 9.17946 numMergedOcc 0
31 mol 213 unq 0 iso 0 dist 4.26212 5.84474 7.37935 11.8631 9.84448 8.42053 numMergedOcc 0
32 mol 218 unq 0 iso 0 dist 7.18041 5.7776 6.86795 9.71337 5.89482 8.3087 numMergedOcc 0
33 mol 218 unq 1 iso 0 dist 7.17547 5.7776 6.61099 9.71337 6.65167 8.3087 numMergedOcc 0
34 mol 218 unq 2 iso 0 dist 7.13323 9.97783 6.61099 13.4119 6.65167 8.3087 numMergedOcc 0
35 mol 239 unq 0 iso 0 dist 7.39747 5.66732 7.18771 9.01021 5.2908 5.0804 numMergedOcc 0
36 mol 239 unq 1 iso 0 dist 8.1777 5.66732 7.94894 9.01021 5.91881 5.0804 numMergedOcc 0
37 mol 243 unq 0 iso 0 dist 8.61104 6.34358 6.01071 10.0978 4.78857 7.44706 numMergedOcc 0
38 mol 261 unq 0 iso 0 dist 7.47164 6.04016 9.24121 10.7876 10.0785 8.61563 numMergedOcc 0
39 mol 272 unq 0 iso 0 dist 6.16449 4.86504 7.55161 12.0724 12.015 9.18635 numMergedOcc 0
40 mol 278 unq 0 iso 0 dist 6.35287 6.54009 9.48589 8.00673 7.83538 7.21972 numMergedOcc 0
41 mol 284 unq 0 iso 0 dist 8.41504 6.4399 8.27054 7.8343 5.39591 9.63007 numMergedOcc 0
