0 mol 68 unq 0 iso 0 dist 9.00217 14.427 5.44028 10.828 6.29218 8.80104 numMergedOcc 0
1 mol 107 unq 0 iso 0 dist 6.99676 8.38066 6.93417 9.31826 4.91158 8.13921 numMergedOcc 0
2 mol 107 unq 1 iso 0 dist 8.93032 11.458 5.9385 12.3491 6.01678 8.13921 numMergedOcc 0
3 mol 111 unq 0 iso 0 dist 9.01984 5.4197 6.98727 13.0607 4.98364 9.41723 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 7.43445 11.6071 8.81779 6.36583 4.15435 9.87025 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 7.43445 11.6071 8.81779 12.6501 9.54775 5.85818 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 7.82186 10.5555 9.32166 18.2982 13.8263 9.9016 numMergedOcc 0
7 mol 120 unq 1 iso 0 dist 5.85006 15.1558 9.32166 18.6285 13.8263 9.9016 numMergedOcc 0
8 mol 120 unq 2 iso 0 dist 6.28208 6.87987 9.23243 6.93009 4.07626 8.43028 numMergedOcc 0
9 mol 173 unq 0 iso 0 dist 7.90789 12.2526 9.27871 17.2688 10.6988 7.79505 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 9.93683 16.3538 9.85415 14.0312 4.13682 9.83885 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 9.93683 15.2206 6.61806 14.0312 4.13682 5.42696 numMergedOcc 0
12 mol 205 unq 2 iso 0 dist 9.49617 8.43505 5.96238 14.2755 10.0576 9.83885 numMergedOcc 0
13 mol 205 unq 3 iso 0 dist 9.49617 11.501 7.85966 14.2755 10.0576 5.42696 numMergedOcc 0
14 mol 205 unq 4 iso 0 dist 9.15508 6.01148 5.96238 13.0315 10.0576 9.83885 numMergedOcc 0
15 mol 205 unq 5 iso 0 dist 9.15508 8.17894 7.85966 13.0315 10.0576 5.42696 numMergedOcc 0
16 mol 205 unq 6 iso 0 dist 8.54088 6.01148 8.24405 13.0315 15.5169 9.83885 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 9.08316 4.08418 9.734 6.96139 7.71824 7.2498 numMergedOcc 0
18 mol 240 unq 0 iso 0 dist 6.40555 8.30926 7.35934 11.3647 9.47269 8.33853 numMergedOcc 0
19 mol 240 unq 1 iso 0 dist 6.40555 8.30926 7.35934 11.7406 7.29448 5.66537 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 7.7033 11.8444 9.96989 18.6617 18.5505 9.51311 numMergedOcc 0
21 mol 282 unq 0 iso 0 dist 6.268 7.42631 7.44686 16.0434 12.0022 9.96468 numMergedOcc 0
22 mol 282 unq 1 iso 0 dist 6.268 7.42631 7.44686 16.9102 14.6345 9.59817 numMergedOcc 0
23 mol 282 unq 2 iso 0 dist 4.96661 7.42631 9.82855 16.0434 15.6856 9.96468 numMergedOcc 0
24 mol 282 unq 3 iso 0 dist 4.96661 7.42631 9.82855 16.9102 18.1015 9.59817 numMergedOcc 0
25 mol 282 unq 4 iso 0 dist 7.93391 7.42631 8.62579 16.0434 12.0509 9.96468 numMergedOcc 0
26 mol 282 unq 5 iso 0 dist 7.93391 7.42631 8.62579 16.9102 14.8528 9.59817 numMergedOcc 0
