0 mol 8 unq 0 iso 0 dist 6.82379 6.56356 8.64248 6.94408 6.24978 11.865 10.9495 10.6335 9.01112 11.4134 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.82379 6.56356 8.64248 6.94408 6.24978 11.865 8.09332 11.7258 7.62333 11.0684 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 6.82379 6.56356 8.64248 11.2508 9.66439 14.7257 10.9495 10.6335 9.01112 10.4705 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 6.82379 6.56356 8.64248 11.2508 9.66439 14.7257 8.09332 11.7258 7.62333 11.8672 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 6.82379 6.56356 8.64248 12.4076 7.3915 12.536 10.9495 10.6335 9.01112 8.4069 numMergedOcc 0
5 mol 8 unq 5 iso 0 dist 6.82379 6.56356 8.64248 12.4076 7.3915 12.536 8.09332 11.7258 7.62333 12.9016 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 6.90155 9.48085 13.7717 10.6808 5.81959 17.8732 10.9391 17.3821 9.49421 21.6105 numMergedOcc 0
7 mol 60 unq 0 iso 0 dist 7.55695 8.4312 5.71764 7.29309 9.96399 12.8147 5.67502 10.0962 7.57295 10.1562 numMergedOcc 0
8 mol 60 unq 1 iso 0 dist 7.55695 8.4312 5.71764 7.29309 9.96399 12.8147 5.00018 8.82176 7.48086 12.2509 numMergedOcc 0
9 mol 60 unq 2 iso 0 dist 7.55695 8.4312 5.71764 5.00018 8.82176 7.48086 5.67502 10.0962 7.57295 6.54743 numMergedOcc 0
10 mol 60 unq 3 iso 0 dist 8.82176 7.48086 5.71764 12.2509 9.96399 12.8147 6.54743 10.0962 7.57295 10.1562 numMergedOcc 0
11 mol 60 unq 4 iso 0 dist 8.82176 7.48086 5.71764 12.2509 9.96399 12.8147 5.00018 7.55695 8.4312 7.29309 numMergedOcc 0
12 mol 60 unq 5 iso 0 dist 8.82176 7.48086 5.71764 5.00018 7.55695 8.4312 6.54743 10.0962 7.57295 5.67502 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 8.67766 9.77497 9.03468 6.48636 8.0831 13.3828 17.2949 15.7097 7.86666 21.2081 numMergedOcc 0
14 mol 109 unq 1 iso 0 dist 8.0831 9.89083 11.0597 6.48636 8.67766 12.448 7.15843 13.8663 8.52024 10.4404 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 7.99857 6.99446 6.29394 4.85907 8.56342 7.64052 10.9871 14.6439 8.95212 9.93257 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 8.56342 7.64052 6.29394 4.85907 7.99857 6.99446 9.93257 14.6439 8.95212 10.9871 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 7.36779 9.66543 4.935 5.62899 8.20836 7.21868 10.7144 10.873 7.93372 5.49782 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 8.20836 7.21868 4.935 5.62899 7.36779 9.66543 5.49782 10.873 7.93372 10.7144 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 7.20574 6.61112 8.58039 5.74635 6.85302 11.456 7.09479 12.6244 8.90571 10.3628 numMergedOcc 0
20 mol 207 unq 0 iso 0 dist 7.96797 6.0563 7.64813 11.0921 8.32218 10.8457 5.99308 13.9435 9.98372 15.4459 numMergedOcc 0
21 mol 207 unq 1 iso 0 dist 7.96797 8.1244 11.9725 11.0921 8.32218 12.7815 5.99308 13.9435 9.1528 15.4459 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 6.29367 8.75536 6.57708 4.72474 5.76954 7.33709 6.17651 9.20961 6.67404 5.61978 numMergedOcc 0
23 mol 218 unq 1 iso 0 dist 6.29367 8.75536 6.57708 6.17651 9.20961 6.67404 4.72474 5.76954 7.33709 5.61978 numMergedOcc 0
24 mol 218 unq 2 iso 0 dist 8.86175 8.75536 13.4147 4.72474 6.29511 7.33709 6.17651 9.91544 6.67404 5.61978 numMergedOcc 0
25 mol 218 unq 3 iso 0 dist 5.76954 7.33709 6.57708 4.72474 6.29367 8.75536 5.61978 9.20961 6.67404 6.17651 numMergedOcc 0
26 mol 218 unq 4 iso 0 dist 5.76954 7.33709 6.57708 5.61978 9.20961 6.67404 4.72474 6.29367 8.75536 6.17651 numMergedOcc 0
27 mol 218 unq 5 iso 0 dist 6.29511 7.33709 13.4147 4.72474 8.86175 8.75536 5.61978 9.91544 6.67404 6.17651 numMergedOcc 0
28 mol 218 unq 6 iso 0 dist 9.20961 6.67404 6.57708 6.17651 6.29367 8.75536 5.61978 5.76954 7.33709 4.72474 numMergedOcc 0
29 mol 218 unq 7 iso 0 dist 9.20961 6.67404 6.57708 5.61978 5.76954 7.33709 6.17651 6.29367 8.75536 4.72474 numMergedOcc 0
30 mol 229 unq 0 iso 0 dist 8.92743 7.27993 6.93188 6.94172 8.08082 11.0297 5.1556 11.2687 9.51168 6.91244 numMergedOcc 0
31 mol 229 unq 1 iso 0 dist 8.92743 7.27993 6.93188 6.94172 8.08082 11.0297 7.0298 5.77318 6.95201 5.5729 numMergedOcc 0
32 mol 229 unq 2 iso 0 dist 8.92743 7.27993 6.93188 7.0298 5.77318 6.95201 5.1556 11.2687 9.51168 6.54885 numMergedOcc 0
33 mol 229 unq 3 iso 0 dist 8.92743 7.27993 6.93188 15.7694 8.19603 14.1436 5.1556 11.2687 9.51168 16.1442 numMergedOcc 0
34 mol 229 unq 4 iso 0 dist 8.92743 7.27993 6.93188 15.7694 8.19603 14.1436 7.0298 5.77318 6.95201 9.96077 numMergedOcc 0
35 mol 229 unq 5 iso 0 dist 5.77318 6.95201 6.93188 7.0298 8.92743 7.27993 6.54885 11.2687 9.51168 5.1556 numMergedOcc 0
36 mol 229 unq 6 iso 0 dist 5.77318 6.95201 6.93188 5.5729 8.08082 11.0297 7.0298 8.92743 7.27993 6.94172 numMergedOcc 0
37 mol 229 unq 7 iso 0 dist 5.77318 6.95201 6.93188 5.5729 8.08082 11.0297 6.54885 11.2687 9.51168 6.91244 numMergedOcc 0
38 mol 229 unq 8 iso 0 dist 5.77318 6.95201 6.93188 9.96077 8.19603 14.1436 7.0298 8.92743 7.27993 15.7694 numMergedOcc 0
39 mol 229 unq 9 iso 0 dist 5.77318 6.95201 6.93188 9.96077 8.19603 14.1436 6.54885 11.2687 9.51168 16.1442 numMergedOcc 0
40 mol 234 unq 0 iso 0 dist 7.5366 7.81215 11.0592 9.82284 7.56091 16.672 10.2693 15.2927 5.64285 19.7176 numMergedOcc 0
41 mol 234 unq 1 iso 0 dist 7.5366 7.81215 11.0592 5.88703 8.24186 11.6391 10.2693 15.2927 5.64285 15.2225 numMergedOcc 0
42 mol 238 unq 0 iso 0 dist 7.32982 9.72188 13.0611 10.0191 6.66971 14.4013 15.7907 17.2012 9.12776 20.8128 numMergedOcc 0
43 mol 238 unq 1 iso 0 dist 7.32982 9.72188 13.0611 10.1648 6.4398 11.1002 15.7907 17.2012 9.12776 16.2992 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 5.64181 9.08509 6.94907 6.85126 7.61393 11.9549 10.1813 11.589 6.99888 15.2869 numMergedOcc 0
45 mol 259 unq 0 iso 0 dist 8.55558 6.95511 9.55426 9.98105 8.59697 10.4017 6.96053 10.5803 9.46361 15.8535 numMergedOcc 0
46 mol 264 unq 0 iso 0 dist 7.52281 5.90924 7.36132 8.96144 6.42588 9.58916 7.07277 12.2392 5.90058 14.3597 numMergedOcc 0
47 mol 264 unq 1 iso 0 dist 6.42588 9.58916 7.36132 8.96144 7.52281 5.90924 14.3597 12.2392 5.90058 7.07277 numMergedOcc 0
48 mol 277 unq 0 iso 0 dist 6.57903 9.57499 14.6871 6.59123 9.65707 10.4733 7.69449 11.5506 5.46926 5.91131 numMergedOcc 0
49 mol 277 unq 1 iso 0 dist 6.57903 9.57499 14.6871 6.59123 9.65707 10.4733 11.8268 12.7237 8.9682 11.6656 numMergedOcc 0
