0 mol 7 unq 0 iso 0 dist 9.8603 16.6461 9.67164 20.3971 12.2041 5.99459 13.8384 5.72491 8.0744 7.88043 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.8603 16.6461 9.67164 20.3971 12.2041 5.99459 17.8433 9.67579 11.7002 8.80762 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.51421 4.7739 5.99459 13.5184 12.2041 9.67164 10.3237 7.88043 8.0744 5.72491 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 9.91301 13.8883 9.01112 16.9088 10.9495 6.56356 17.7859 13.6835 4.69349 7.92414 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 9.91301 13.8883 9.01112 16.9088 10.9495 6.56356 12.3138 10.6335 8.64248 6.82379 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 8.40051 13.591 9.48085 8.6396 10.9391 9.49421 13.3963 16.357 11.7199 6.6492 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 8.6396 13.591 9.49421 8.40051 10.9391 9.48085 13.0772 17.3821 13.7717 6.90155 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 6.18305 5.65986 7.4369 11.0671 5.4148 9.73086 11.4574 8.73253 7.8972 7.04044 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.06168 10.8798 5.61588 15.4463 8.07446 5.5087 9.33688 5.16364 5.50891 8.85586 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 8.06168 10.8798 5.61588 15.4463 8.07446 5.5087 16.9521 11.2874 7.50869 7.11 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 8.06168 13.7267 7.83244 15.4463 8.07446 6.08682 9.33688 5.16364 4.75954 8.85586 numMergedOcc 0
11 mol 73 unq 4 iso 0 dist 8.06168 13.7267 7.83244 15.4463 8.07446 6.08682 16.9521 11.2874 3.6807 7.11 numMergedOcc 0
12 mol 73 unq 5 iso 0 dist 8.67532 10.8441 5.61588 12.1964 8.07446 5.5087 13.4716 5.16364 5.50891 8.85586 numMergedOcc 0
13 mol 73 unq 6 iso 0 dist 8.67532 10.8441 5.61588 12.1964 8.07446 5.5087 17.8772 11.2874 7.50869 7.11 numMergedOcc 0
14 mol 73 unq 7 iso 0 dist 8.67532 15.2203 7.83244 12.1964 8.07446 6.08682 13.4716 5.16364 4.75954 8.85586 numMergedOcc 0
15 mol 73 unq 8 iso 0 dist 8.67532 15.2203 7.83244 12.1964 8.07446 6.08682 17.8772 11.2874 3.6807 7.11 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 6.18763 5.92411 8.95212 8.44385 10.9871 6.99446 9.79485 14.6439 6.29394 7.99857 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 6.18763 5.92411 8.95212 5.63005 9.93257 7.64052 9.79485 14.6439 6.29394 8.56342 numMergedOcc 0
18 mol 119 unq 2 iso 0 dist 6.18763 5.92411 8.95212 5.63005 9.93257 7.64052 6.81112 12.8836 9.64502 6.37542 numMergedOcc 0
19 mol 119 unq 3 iso 0 dist 8.44385 5.92411 6.99446 5.63005 4.85907 7.64052 9.79485 7.99857 6.29394 8.56342 numMergedOcc 0
20 mol 119 unq 4 iso 0 dist 8.44385 5.92411 6.99446 5.63005 4.85907 7.64052 6.81112 10.4631 9.64502 6.37542 numMergedOcc 0
21 mol 119 unq 5 iso 0 dist 5.63005 5.92411 7.64052 8.44385 4.85907 6.99446 9.79485 8.56342 6.29394 7.99857 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 9.92932 3.76211 7.21868 13.0095 5.62899 9.66543 8.2282 8.20836 4.935 7.36779 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 9.60411 3.76211 7.93372 13.0095 10.7144 9.66543 8.2282 10.873 4.935 7.36779 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 9.60411 3.76211 7.93372 9.92932 5.49782 7.21868 8.2282 10.873 4.935 8.20836 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 9.60369 4.63732 9.66543 9.55556 5.62899 7.21868 4.02705 7.36779 4.935 8.20836 numMergedOcc 0
26 mol 134 unq 4 iso 0 dist 9.55556 4.63732 7.21868 9.60369 5.62899 9.66543 4.02705 8.20836 4.935 7.36779 numMergedOcc 0
27 mol 186 unq 0 iso 0 dist 8.96988 3.6848 8.90571 9.44405 7.09479 6.61112 11.5511 12.6244 8.58039 7.20574 numMergedOcc 0
28 mol 218 unq 0 iso 0 dist 7.0843 3.5359 8.75536 7.73315 4.72474 7.33709 9.58139 11.565 7.4492 8.06216 numMergedOcc 0
29 mol 218 unq 1 iso 0 dist 7.0843 3.5359 8.75536 7.73315 4.72474 7.33709 5.77167 6.29367 6.57708 5.76954 numMergedOcc 0
30 mol 218 unq 2 iso 0 dist 7.0843 3.5359 8.75536 7.73315 4.72474 7.33709 13.9605 8.86175 13.4147 6.29511 numMergedOcc 0
31 mol 218 unq 3 iso 0 dist 7.0843 3.5359 8.75536 6.9398 6.17651 6.67404 5.77167 6.29367 6.57708 9.20961 numMergedOcc 0
32 mol 218 unq 4 iso 0 dist 7.73315 3.5359 7.33709 7.0843 4.72474 8.75536 5.77167 5.76954 6.57708 6.29367 numMergedOcc 0
33 mol 218 unq 5 iso 0 dist 7.73315 3.5359 7.33709 7.0843 4.72474 8.75536 13.9605 6.29511 13.4147 8.86175 numMergedOcc 0
34 mol 218 unq 6 iso 0 dist 7.73315 3.5359 7.33709 6.9398 5.61978 6.67404 5.77167 5.76954 6.57708 9.20961 numMergedOcc 0
35 mol 218 unq 7 iso 0 dist 6.9398 3.5359 6.67404 7.0843 6.17651 8.75536 5.77167 9.20961 6.57708 6.29367 numMergedOcc 0
36 mol 218 unq 8 iso 0 dist 6.9398 3.5359 6.67404 7.0843 6.17651 8.75536 13.9605 9.91544 13.4147 8.86175 numMergedOcc 0
37 mol 218 unq 9 iso 0 dist 6.9398 3.5359 6.67404 7.73315 5.61978 7.33709 9.58139 11.5105 7.4492 8.06216 numMergedOcc 0
38 mol 218 unq 10 iso 0 dist 6.9398 3.5359 6.67404 7.73315 5.61978 7.33709 5.77167 9.20961 6.57708 5.76954 numMergedOcc 0
39 mol 218 unq 11 iso 0 dist 6.9398 3.5359 6.67404 7.73315 5.61978 7.33709 13.9605 9.91544 13.4147 6.29511 numMergedOcc 0
40 mol 229 unq 0 iso 0 dist 8.6537 3.72432 7.27993 5.57702 7.0298 6.95201 7.78418 8.92743 6.93188 5.77318 numMergedOcc 0
41 mol 229 unq 1 iso 0 dist 8.75374 3.72432 9.51168 8.6537 5.1556 7.27993 7.78418 11.2687 6.93188 8.92743 numMergedOcc 0
42 mol 229 unq 2 iso 0 dist 8.75374 3.72432 9.51168 5.57702 6.54885 6.95201 7.78418 11.2687 6.93188 5.77318 numMergedOcc 0
43 mol 229 unq 3 iso 0 dist 5.57702 3.72432 6.95201 8.6537 7.0298 7.27993 7.78418 5.77318 6.93188 8.92743 numMergedOcc 0
44 mol 259 unq 0 iso 0 dist 8.06771 9.0675 9.46361 11.1503 6.96053 6.95511 8.4973 10.5803 9.55426 8.55558 numMergedOcc 0
45 mol 259 unq 1 iso 0 dist 9.54857 5.49348 5.85442 9.56653 9.98105 6.9899 12.7168 8.55558 7.32929 8.59697 numMergedOcc 0
46 mol 259 unq 2 iso 0 dist 6.42725 6.09466 6.9899 9.73341 9.98105 5.85442 12.2782 8.59697 7.32929 8.55558 numMergedOcc 0
47 mol 264 unq 0 iso 0 dist 7.36905 3.63202 5.90924 6.83408 8.96144 9.58916 5.7394 7.52281 7.36132 6.42588 numMergedOcc 0
48 mol 264 unq 1 iso 0 dist 6.83408 3.63202 9.58916 7.36905 8.96144 5.90924 5.7394 6.42588 7.36132 7.52281 numMergedOcc 0
49 mol 277 unq 0 iso 0 dist 8.96343 6.17642 5.46926 8.51931 7.69449 9.57499 12.4389 11.5506 14.6871 6.57903 numMergedOcc 0
50 mol 277 unq 1 iso 0 dist 9.29635 12.2421 8.9682 17.8158 11.8268 9.57499 19.3363 12.7237 14.6871 6.57903 numMergedOcc 0
