0 mol 7 unq 0 iso 0 dist 9.8603 9.30196 7.15434 14.6665 7.10621 11.2706 16.2118 7.12508 13.6482 6.1206 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.8603 9.30196 7.15434 14.6665 7.10621 11.2706 18.9985 11.143 17.5841 7.67927 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.11056 8.95357 8.20058 10.4744 8.86116 16.6906 10.4056 5.11636 11.6434 7.95042 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 8.88413 5.30126 6.22122 5.59268 7.17969 4.96681 8.27137 11.4148 9.55662 4.79873 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 8.88413 5.30126 6.22122 5.59268 7.17969 4.96681 13.4236 5.68041 9.95169 9.48085 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.9747 11.1108 8.05602 4.75138 5.08437 12.0507 8.3505 3.9764 9.55337 5.10496 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.9747 11.1108 8.05602 10.4417 6.48948 4.72129 8.3505 3.9764 9.55337 5.92242 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.9747 11.1108 8.05602 10.4417 6.48948 4.72129 7.34638 7.03983 4.79891 7.02507 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 5.9747 11.1108 8.05602 11.3628 6.10456 12.0339 14.2657 10.4782 15.2414 7.54889 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 5.9747 11.1108 8.05602 11.3628 6.10456 12.0339 8.3505 3.9764 9.55337 5.2571 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 4.50572 9.17639 8.05602 6.88489 5.08437 12.0507 8.32269 3.9764 9.55337 5.10496 numMergedOcc 0
11 mol 98 unq 6 iso 0 dist 4.50572 9.17639 8.05602 9.63267 6.48948 4.72129 8.32269 3.9764 9.55337 5.92242 numMergedOcc 0
12 mol 98 unq 7 iso 0 dist 4.50572 9.17639 8.05602 9.63267 6.48948 4.72129 6.0995 7.03983 4.79891 7.02507 numMergedOcc 0
13 mol 98 unq 8 iso 0 dist 4.50572 9.17639 8.05602 9.82583 6.10456 12.0339 14.7607 10.4782 15.2414 7.54889 numMergedOcc 0
14 mol 98 unq 9 iso 0 dist 4.50572 9.17639 8.05602 9.82583 6.10456 12.0339 8.32269 3.9764 9.55337 5.2571 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 8.3164 7.12319 8.84523 11.5656 8.69985 14.7654 9.94704 5.00433 13.0202 8.52024 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 6.38163 8.56696 6.23966 10.0961 5.83384 6.65856 14.5306 9.00231 11.3401 5.58833 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 9.60411 13.5049 7.27598 10.5108 6.37586 6.50005 12.3555 10.8635 15.3301 9.33094 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 9.60411 13.5049 7.27598 6.20443 9.71307 12.0971 14.5777 15.0225 17.5459 9.1998 numMergedOcc 0
19 mol 134 unq 2 iso 0 dist 9.60411 13.5049 7.27598 6.20443 9.71307 12.0971 12.3555 10.8635 15.3301 8.69531 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 9.55777 14.056 5.47561 16.4881 7.21333 5.60111 15.2698 6.84862 8.51427 5.56538 numMergedOcc 0
21 mol 222 unq 1 iso 0 dist 9.55777 14.056 5.47561 16.4881 7.21333 5.60111 16.9252 9.53117 11.6182 7.48954 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 8.39002 4.61429 9.73411 5.72088 6.57273 9.81806 6.32334 7.05804 5.31916 8.79428 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 8.39002 4.61429 9.73411 6.51315 5.78342 5.99647 6.32334 7.05804 5.31916 6.8692 numMergedOcc 0
24 mol 224 unq 2 iso 0 dist 8.39002 11.1139 7.07564 5.72088 6.57273 10.8463 6.32334 7.05804 11.6723 8.79428 numMergedOcc 0
25 mol 224 unq 3 iso 0 dist 8.39002 11.1139 7.07564 6.51315 5.78342 5.44863 6.32334 7.05804 11.6723 6.8692 numMergedOcc 0
26 mol 224 unq 4 iso 0 dist 9.2053 4.61429 7.75485 6.51315 5.81334 5.99647 6.32334 4.54188 5.31916 6.8692 numMergedOcc 0
27 mol 224 unq 5 iso 0 dist 9.2053 11.1139 9.11052 6.51315 5.81334 5.44863 6.32334 4.54188 11.6723 6.8692 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 9.66555 5.12308 4.87108 12.2428 6.22714 7.45873 12.6412 12.7938 10.7584 9.08509 numMergedOcc 0
29 mol 238 unq 1 iso 0 dist 9.66555 9.76041 6.54455 12.2428 6.22714 5.17954 12.6412 12.7938 11.2947 9.08509 numMergedOcc 0
30 mol 238 unq 2 iso 0 dist 8.67205 4.29839 4.87108 8.66185 6.22714 7.45873 9.72795 12.7938 10.7584 9.08509 numMergedOcc 0
31 mol 238 unq 3 iso 0 dist 8.67205 5.68906 6.54455 8.66185 6.22714 5.17954 9.72795 12.7938 11.2947 9.08509 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 6.44212 10.5291 8.61729 7.97883 6.16342 7.02319 14.1679 10.6736 11.7534 6.73665 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 9.12507 8.46264 8.57619 5.59901 5.30224 5.43184 10.7775 4.04513 9.2885 8.03219 numMergedOcc 0
34 mol 259 unq 1 iso 0 dist 9.12507 8.46264 8.57619 5.59901 5.30224 5.43184 4.95855 7.09907 10.5384 6.9899 numMergedOcc 0
