0 mol 24 unq 0 iso 0 dist 8.86116 6.72502 6.58998 5.11636 7.95042 8.24948 8.60554 8.52463 6.99746 5.80953 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.38394 6.72502 6.59374 5.11636 10.9819 8.24948 8.60554 12.3994 6.99746 5.80953 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.34347 8.44506 13.2876 7.11305 14.8317 6.38243 11.9684 17.4462 5.66783 6.81793 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.34347 5.69955 10.6756 8.25132 13.6027 6.73167 10.177 15.5 5.30297 6.07276 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.33898 6.61823 6.08245 5.31547 10.9241 6.98037 9.75237 9.44576 8.67827 6.59716 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.33898 6.61823 6.08245 4.3481 7.06939 6.9223 9.75237 9.44576 8.67827 6.87506 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 9.33898 6.49956 6.86728 4.3481 7.06939 7.0561 9.75237 9.44576 13.0818 6.87506 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 9.64443 6.61823 7.24315 5.31547 9.36001 6.98037 9.75237 13.9524 8.67827 6.59716 numMergedOcc 0
8 mol 92 unq 4 iso 0 dist 9.64443 6.61823 7.24315 4.3481 12.4681 6.9223 9.75237 13.9524 8.67827 6.87506 numMergedOcc 0
9 mol 92 unq 5 iso 0 dist 9.64443 6.49956 12.163 4.3481 12.4681 7.0561 9.75237 13.9524 13.0818 6.87506 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 5.08437 7.26086 7.32662 3.9764 5.10496 8.75597 11.3043 7.94178 8.02554 9.84703 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 5.08437 7.26086 7.32662 3.9764 5.10496 8.75597 6.65501 4.4057 11.2092 4.62494 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 6.48948 7.26086 13.4985 3.9764 5.92242 8.75597 11.3043 15.7178 8.02554 9.84703 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 6.48948 7.26086 13.4985 3.9764 5.92242 8.75597 6.65501 7.42446 11.2092 4.62494 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 6.10456 7.26086 6.934 3.9764 5.2571 8.75597 11.3043 9.85543 8.02554 9.84703 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 6.10456 7.26086 6.934 3.9764 5.2571 8.75597 6.65501 9.67482 11.2092 4.62494 numMergedOcc 0
16 mol 112 unq 0 iso 0 dist 7.71338 6.43433 8.56707 10.5563 13.5845 5.43933 11.5768 11.8396 5.91698 7.67238 numMergedOcc 0
17 mol 112 unq 1 iso 0 dist 7.71338 6.43433 8.56707 6.75738 13.1243 7.44041 12.9739 18.0868 15.0784 8.72725 numMergedOcc 0
18 mol 112 unq 2 iso 0 dist 9.60462 9.92283 17.3924 12.6108 19.476 5.43933 14.3677 19.5039 5.91698 7.67238 numMergedOcc 0
19 mol 112 unq 3 iso 0 dist 9.60462 9.92283 17.3924 5.43385 10.2348 7.44041 10.1861 5.39346 15.0784 8.72725 numMergedOcc 0
20 mol 119 unq 0 iso 0 dist 8.73993 7.77116 3.78311 9.68677 7.64052 9.57341 17.8739 12.0175 14.8901 8.67537 numMergedOcc 0
21 mol 131 unq 0 iso 0 dist 7.12972 6.92648 9.32969 8.57203 14.4508 6.78801 11.8964 14.3406 5.66194 7.75314 numMergedOcc 0
22 mol 131 unq 1 iso 0 dist 6.85062 9.29384 9.32969 12.6005 14.4508 6.78801 14.9021 14.3406 5.66194 7.75314 numMergedOcc 0
23 mol 143 unq 0 iso 0 dist 5.99315 7.25673 9.23795 4.78563 5.37047 8.612 7.78652 6.48978 6.60479 5.06564 numMergedOcc 0
24 mol 143 unq 1 iso 0 dist 5.99315 7.25673 9.23795 4.78563 5.37047 8.612 8.91301 5.20762 7.54337 7.5373 numMergedOcc 0
25 mol 170 unq 0 iso 0 dist 9.76807 8.15099 7.72147 4.78249 9.51256 5.13268 6.35982 4.34698 7.29587 6.47164 numMergedOcc 0
26 mol 170 unq 1 iso 0 dist 9.76807 8.15099 7.72147 4.78249 9.51256 5.13268 7.51126 5.75144 8.73585 9.65126 numMergedOcc 0
27 mol 224 unq 0 iso 0 dist 9.40098 8.37597 6.77927 5.13732 11.2501 8.54702 10.0553 13.9547 10.0385 5.05368 numMergedOcc 0
28 mol 224 unq 1 iso 0 dist 6.61986 8.37597 4.59567 5.13732 8.08349 8.54702 10.0553 10.7174 10.0385 5.05368 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 9.34734 8.03442 10.2525 5.0317 10.7855 9.43618 7.43071 6.00424 12.8075 9.18728 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 9.34734 8.03442 10.2525 5.0317 10.7855 9.43618 5.41321 10.7656 4.59123 8.91971 numMergedOcc 0
31 mol 227 unq 2 iso 0 dist 7.22101 8.03442 10.5813 5.0317 5.23634 9.43618 7.43071 6.35849 12.8075 9.18728 numMergedOcc 0
32 mol 227 unq 3 iso 0 dist 7.22101 8.03442 10.5813 5.0317 5.23634 9.43618 5.41321 10.9607 4.59123 8.91971 numMergedOcc 0
33 mol 227 unq 4 iso 0 dist 8.65997 8.03442 7.22396 5.0317 6.91318 9.43618 7.43071 10.204 12.8075 9.18728 numMergedOcc 0
34 mol 227 unq 5 iso 0 dist 8.65997 8.03442 7.22396 5.0317 6.91318 9.43618 5.41321 9.72615 4.59123 8.91971 numMergedOcc 0
35 mol 227 unq 6 iso 0 dist 7.56888 8.03442 6.10296 5.0317 11.2661 9.43618 7.43071 9.76735 12.8075 9.18728 numMergedOcc 0
36 mol 227 unq 7 iso 0 dist 7.56888 8.03442 6.10296 5.0317 11.2661 9.43618 5.41321 5.10635 4.59123 8.91971 numMergedOcc 0
37 mol 227 unq 8 iso 0 dist 7.55216 8.03442 9.69537 5.0317 12.3663 9.43618 7.43071 9.32448 12.8075 9.18728 numMergedOcc 0
38 mol 227 unq 9 iso 0 dist 7.55216 8.03442 9.69537 5.0317 12.3663 9.43618 5.41321 6.48027 4.59123 8.91971 numMergedOcc 0
39 mol 236 unq 0 iso 0 dist 9.81562 8.50331 7.22918 11.5307 16.0783 9.14068 12.6259 12.8922 5.92456 6.15635 numMergedOcc 0
40 mol 236 unq 1 iso 0 dist 7.68742 8.50331 9.05842 11.5307 16.07 9.14068 12.6259 14.822 5.92456 6.15635 numMergedOcc 0
41 mol 236 unq 2 iso 0 dist 6.27581 8.50331 7.00028 11.5307 10.0129 9.14068 12.6259 9.52712 5.92456 6.15635 numMergedOcc 0
42 mol 252 unq 0 iso 0 dist 8.1148 6.11473 9.32326 5.6214 13.1298 9.39658 12.9597 19.1145 17.2823 8.09509 numMergedOcc 0
43 mol 252 unq 1 iso 0 dist 8.1148 6.53679 11.056 5.6214 13.1298 5.9974 12.9597 19.1145 12.0545 8.09509 numMergedOcc 0
44 mol 252 unq 2 iso 0 dist 8.1715 6.11473 5.72783 5.6214 10.5687 9.39658 12.9597 16.9237 17.2823 8.09509 numMergedOcc 0
45 mol 252 unq 3 iso 0 dist 8.1715 6.53679 5.23748 5.6214 10.5687 5.9974 12.9597 16.9237 12.0545 8.09509 numMergedOcc 0
46 mol 252 unq 4 iso 0 dist 8.33025 7.50201 11.056 7.40852 13.1298 5.9974 11.0831 19.1145 12.0545 8.09509 numMergedOcc 0
47 mol 252 unq 5 iso 0 dist 9.2288 7.50201 5.23748 7.40852 10.5687 5.9974 11.0831 16.9237 12.0545 8.09509 numMergedOcc 0
48 mol 252 unq 6 iso 0 dist 7.19638 7.50201 7.63376 7.40852 7.15764 5.9974 11.0831 6.35641 12.0545 8.09509 numMergedOcc 0
