0 mol 7 unq 0 iso 0 dist 9.8603 13.8384 5.72491 16.6461 9.67164 8.0744 20.3971 12.2041 7.88043 5.99459 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 10.3237 7.88043 4.7739 5.99459 8.0744 13.5184 12.2041 5.72491 9.67164 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.51421 13 8.80762 4.7739 5.99459 11.7002 13.5184 12.2041 9.67579 9.67164 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 8.40051 13.0772 6.90155 13.591 9.48085 13.7717 8.6396 10.9391 17.3821 9.49421 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 8.6396 13.3963 6.6492 13.591 9.49421 11.7199 8.40051 10.9391 16.357 9.48085 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.18305 11.4574 8.73253 5.65986 7.4369 7.8972 11.0671 5.4148 7.04044 9.73086 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.06168 9.33688 5.16364 10.8798 5.61588 5.50891 15.4463 8.07446 8.85586 5.5087 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 8.06168 9.33688 5.16364 13.7267 7.83244 4.75954 15.4463 8.07446 8.85586 6.08682 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 8.67532 13.4716 5.16364 10.8441 5.61588 5.50891 12.1964 8.07446 8.85586 5.5087 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 8.67532 13.4716 5.16364 15.2203 7.83244 4.75954 12.1964 8.07446 8.85586 6.08682 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 8.58841 5.25697 4.79949 16.3337 9.85905 11.0792 17.86 10.2879 13.187 6.72869 numMergedOcc 0
11 mol 76 unq 1 iso 0 dist 8.58841 10.7962 7.27693 16.3337 9.85905 6.48293 17.86 10.2879 11.2278 6.72869 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 5.02717 4.92962 5.72642 12.6105 9.42082 10.5109 12.5189 7.69052 10.9734 6.39384 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 8.44385 9.79485 7.99857 5.92411 6.99446 6.29394 6.18763 10.9871 14.6439 8.95212 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 8.44385 9.79485 7.99857 5.92411 6.99446 6.29394 5.63005 4.85907 8.56342 7.64052 numMergedOcc 0
15 mol 119 unq 2 iso 0 dist 5.63005 9.79485 8.56342 5.92411 7.64052 6.29394 6.18763 9.93257 14.6439 8.95212 numMergedOcc 0
16 mol 119 unq 3 iso 0 dist 5.63005 9.79485 8.56342 5.92411 7.64052 6.29394 8.44385 4.85907 7.99857 6.99446 numMergedOcc 0
17 mol 119 unq 4 iso 0 dist 5.63005 6.81112 6.37542 5.92411 7.64052 9.64502 6.18763 9.93257 12.8836 8.95212 numMergedOcc 0
18 mol 119 unq 5 iso 0 dist 5.63005 6.81112 6.37542 5.92411 7.64052 9.64502 8.44385 4.85907 10.4631 6.99446 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 9.92932 8.2282 8.20836 3.76211 7.21868 4.935 13.0095 5.62899 7.36779 9.66543 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 9.92932 8.2282 8.20836 3.76211 7.21868 4.935 9.60411 5.49782 10.873 7.93372 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 9.60369 4.02705 7.36779 4.63732 9.66543 4.935 9.55556 5.62899 8.20836 7.21868 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 9.60369 4.02705 7.36779 4.63732 9.66543 4.935 12.1043 10.7144 10.873 7.93372 numMergedOcc 0
23 mol 134 unq 4 iso 0 dist 9.55556 4.02705 8.20836 4.63732 7.21868 4.935 9.60369 5.62899 7.36779 9.66543 numMergedOcc 0
24 mol 134 unq 5 iso 0 dist 9.55556 4.02705 8.20836 4.63732 7.21868 4.935 12.1043 5.49782 10.873 7.93372 numMergedOcc 0
25 mol 207 unq 0 iso 0 dist 9.18896 9.17928 8.85547 5.10056 6.0563 5.34897 10.3876 5.99308 14.1583 9.98372 numMergedOcc 0
26 mol 207 unq 1 iso 0 dist 9.18896 9.17928 8.85547 3.94578 8.1244 9.86978 10.3876 5.99308 14.1583 9.1528 numMergedOcc 0
27 mol 207 unq 2 iso 0 dist 9.18896 12.5598 7.96797 5.10056 6.0563 7.64813 10.3876 5.99308 13.9435 9.98372 numMergedOcc 0
28 mol 207 unq 3 iso 0 dist 9.18896 12.5598 7.96797 3.94578 8.1244 11.9725 10.3876 5.99308 13.9435 9.1528 numMergedOcc 0
29 mol 218 unq 0 iso 0 dist 7.0843 5.77167 6.29367 3.5359 8.75536 6.57708 7.73315 4.72474 5.76954 7.33709 numMergedOcc 0
30 mol 218 unq 1 iso 0 dist 7.0843 5.77167 6.29367 3.5359 8.75536 6.57708 6.9398 6.17651 9.20961 6.67404 numMergedOcc 0
31 mol 218 unq 2 iso 0 dist 7.0843 13.9605 8.86175 3.5359 8.75536 13.4147 7.73315 4.72474 6.29511 7.33709 numMergedOcc 0
32 mol 218 unq 3 iso 0 dist 7.0843 13.9605 8.86175 3.5359 8.75536 13.4147 6.9398 6.17651 9.91544 6.67404 numMergedOcc 0
33 mol 218 unq 4 iso 0 dist 7.73315 9.58139 8.06216 3.5359 7.33709 7.4492 7.0843 4.72474 11.565 8.75536 numMergedOcc 0
34 mol 218 unq 5 iso 0 dist 7.73315 9.58139 8.06216 3.5359 7.33709 7.4492 6.9398 5.61978 11.5105 6.67404 numMergedOcc 0
35 mol 218 unq 6 iso 0 dist 7.73315 5.77167 5.76954 3.5359 7.33709 6.57708 7.0843 4.72474 6.29367 8.75536 numMergedOcc 0
36 mol 218 unq 7 iso 0 dist 7.73315 5.77167 5.76954 3.5359 7.33709 6.57708 6.9398 5.61978 9.20961 6.67404 numMergedOcc 0
37 mol 218 unq 8 iso 0 dist 7.73315 13.9605 6.29511 3.5359 7.33709 13.4147 7.0843 4.72474 8.86175 8.75536 numMergedOcc 0
38 mol 218 unq 9 iso 0 dist 7.73315 13.9605 6.29511 3.5359 7.33709 13.4147 6.9398 5.61978 9.91544 6.67404 numMergedOcc 0
39 mol 218 unq 10 iso 0 dist 6.9398 5.77167 9.20961 3.5359 6.67404 6.57708 7.0843 6.17651 6.29367 8.75536 numMergedOcc 0
40 mol 218 unq 11 iso 0 dist 6.9398 5.77167 9.20961 3.5359 6.67404 6.57708 7.73315 5.61978 5.76954 7.33709 numMergedOcc 0
41 mol 229 unq 0 iso 0 dist 8.6537 7.78418 8.92743 3.72432 7.27993 6.93188 8.75374 5.1556 11.2687 9.51168 numMergedOcc 0
42 mol 229 unq 1 iso 0 dist 8.6537 7.78418 8.92743 3.72432 7.27993 6.93188 5.57702 7.0298 5.77318 6.95201 numMergedOcc 0
43 mol 229 unq 2 iso 0 dist 5.57702 7.78418 5.77318 3.72432 6.95201 6.93188 8.6537 7.0298 8.92743 7.27993 numMergedOcc 0
44 mol 229 unq 3 iso 0 dist 5.57702 7.78418 5.77318 3.72432 6.95201 6.93188 8.75374 6.54885 11.2687 9.51168 numMergedOcc 0
45 mol 234 unq 0 iso 0 dist 7.86368 6.83465 7.5366 9.8663 7.81215 11.0592 11.8838 10.2693 15.2927 5.64285 numMergedOcc 0
46 mol 257 unq 0 iso 0 dist 9.83721 11.6666 9.69696 14.007 7.81897 5.96144 15.3011 5.74182 10.8431 6.34915 numMergedOcc 0
47 mol 259 unq 0 iso 0 dist 9.54857 12.7168 8.55558 5.49348 5.85442 7.32929 9.56653 9.98105 8.59697 6.9899 numMergedOcc 0
48 mol 259 unq 1 iso 0 dist 9.54857 12.7168 8.55558 5.13138 6.95511 9.55426 14.0139 6.96053 10.5803 9.46361 numMergedOcc 0
49 mol 259 unq 2 iso 0 dist 6.42725 12.2782 8.59697 6.09466 6.9899 7.32929 9.73341 9.98105 8.55558 5.85442 numMergedOcc 0
50 mol 264 unq 0 iso 0 dist 7.36905 5.7394 7.52281 3.63202 5.90924 7.36132 9.43335 7.07277 12.2392 5.90058 numMergedOcc 0
51 mol 264 unq 1 iso 0 dist 7.36905 5.7394 7.52281 3.63202 5.90924 7.36132 6.83408 8.96144 6.42588 9.58916 numMergedOcc 0
52 mol 264 unq 2 iso 0 dist 6.83408 5.7394 6.42588 3.63202 9.58916 7.36132 7.36905 8.96144 7.52281 5.90924 numMergedOcc 0
53 mol 264 unq 3 iso 0 dist 6.83408 5.7394 6.42588 3.63202 9.58916 7.36132 9.43335 14.3597 12.2392 5.90058 numMergedOcc 0
54 mol 277 unq 0 iso 0 dist 9.77689 9.41779 6.57903 17.8399 9.57499 14.6871 17.2403 7.69449 11.5506 5.46926 numMergedOcc 0
55 mol 277 unq 1 iso 0 dist 9.77689 9.41779 6.57903 17.8399 9.57499 14.6871 19.3912 11.8268 12.7237 8.9682 numMergedOcc 0
56 mol 277 unq 2 iso 0 dist 8.51931 12.4389 6.57903 6.17642 9.57499 14.6871 8.96343 7.69449 11.5506 5.46926 numMergedOcc 0
57 mol 277 unq 3 iso 0 dist 8.51931 12.4389 6.57903 6.17642 9.57499 14.6871 9.71491 11.8268 12.7237 8.9682 numMergedOcc 0
