0 mol 4 unq 0 iso 0 dist 7.00324 10.5475 8.24634 9.62716 10.6506 9.16617 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 7.00324 10.5475 8.24634 14.1903 11.7391 8.87255 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 9.62716 10.5475 9.16617 7.00324 10.6506 8.24634 numMergedOcc 0
3 mol 4 unq 3 iso 0 dist 9.62716 10.5475 9.16617 14.1903 6.49264 8.87255 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 6.29581 3.78339 7.51452 8.39179 6.92904 6.03547 numMergedOcc 0
5 mol 20 unq 1 iso 0 dist 6.29581 14.473 9.20198 9.51885 6.05053 6.09764 numMergedOcc 0
6 mol 20 unq 2 iso 0 dist 8.39179 3.78339 6.03547 6.29581 6.92904 7.51452 numMergedOcc 0
7 mol 20 unq 3 iso 0 dist 5.21143 6.18887 7.51452 5.75338 6.92904 6.03547 numMergedOcc 0
8 mol 20 unq 4 iso 0 dist 5.21143 12.502 9.20198 9.97919 6.05053 6.09764 numMergedOcc 0
9 mol 20 unq 5 iso 0 dist 5.75338 6.18887 6.03547 5.21143 6.92904 7.51452 numMergedOcc 0
10 mol 24 unq 0 iso 0 dist 8.56483 8.23069 8.70827 13.3777 15.0804 6.73939 numMergedOcc 0
11 mol 54 unq 0 iso 0 dist 9.46449 5.40129 7.23317 10.6943 4.69259 7.07339 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 4.76028 4.85247 7.02927 10.5446 10.6137 6.60933 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 9.88541 15.8326 6.60933 20.4596 10.6137 7.02927 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 8.49444 12.9469 8.8822 5.55446 4.09459 9.66219 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 5.55446 12.9469 9.66219 8.49444 4.09459 8.8822 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 8.91143 13.9854 9.22232 21.5053 18.2432 9.22661 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 8.91143 13.9854 9.22232 16.6379 15.4484 7.56378 numMergedOcc 0
18 mol 135 unq 0 iso 0 dist 5.95344 5.52034 5.62052 11.4163 6.35752 7.90563 numMergedOcc 0
19 mol 135 unq 1 iso 0 dist 5.95344 9.8859 7.85645 11.4163 6.35752 8.97655 numMergedOcc 0
20 mol 135 unq 2 iso 0 dist 7.8687 9.8231 5.62052 14.1151 6.35752 7.90563 numMergedOcc 0
21 mol 135 unq 3 iso 0 dist 7.8687 10.955 7.85645 14.1151 6.35752 8.97655 numMergedOcc 0
22 mol 156 unq 0 iso 0 dist 6.01599 4.88441 9.47433 13.5457 16.7026 9.44367 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 9.01017 10.5409 6.46704 13.585 9.87773 6.59025 numMergedOcc 0
24 mol 181 unq 1 iso 0 dist 9.54437 8.70038 6.46704 14.8629 9.87773 6.59025 numMergedOcc 0
25 mol 195 unq 0 iso 0 dist 5.0778 4.98231 6.95086 11.3628 9.90317 7.36683 numMergedOcc 0
26 mol 206 unq 0 iso 0 dist 9.24801 9.48802 8.0871 15.1627 9.9892 6.16414 numMergedOcc 0
27 mol 206 unq 1 iso 0 dist 9.24801 9.48802 8.0871 12.4976 4.38701 7.33701 numMergedOcc 0
28 mol 213 unq 0 iso 0 dist 9.65238 7.18317 7.37798 12.009 13.2902 7.73322 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 5.74541 5.28657 6.30154 12.0552 10.0708 7.32499 numMergedOcc 0
30 mol 235 unq 0 iso 0 dist 4.46919 5.06584 6.95126 10.4836 10.2834 6.21292 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 6.97527 11.1632 7.57812 12.3648 6.25098 8.69104 numMergedOcc 0
32 mol 243 unq 0 iso 0 dist 7.30188 5.8297 8.76935 9.75388 4.52689 8.47652 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 6.74022 6.45522 6.39866 15.227 10.7637 9.45514 numMergedOcc 0
