0 mol 46 unq 0 iso 0 dist 9.31292 8.55031 13.8587 11.9729 20.1357 8.16059 6.54685 14.4104 5.2568 5.83277 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.09675 6.70925 7.78899 4.71695 12.8026 9.94312 8.22845 4.8983 6.8173 12.3047 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.02753 8.95756 7.78899 7.02797 12.8026 9.94312 6.96897 4.8983 6.8173 12.3047 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 5.53726 9.88184 7.30364 13.3931 9.46036 4.85152 11.0283 6.34669 9.22123 7.81379 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 5.53726 9.88184 7.30364 13.3931 9.46036 4.85152 16.6198 13.6006 7.36335 4.65469 numMergedOcc 0
5 mol 101 unq 0 iso 0 dist 7.22737 5.5199 6.63446 5.2394 9.78643 5.51185 9.54415 12.1836 8.91685 4.80201 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 9.22651 8.07962 6.43211 7.92108 4.84683 9.61113 10.0473 9.51771 9.61193 11.0943 numMergedOcc 0
7 mol 102 unq 1 iso 0 dist 9.22651 8.07962 6.43211 4.9259 11.9011 7.73836 10.0473 9.51771 9.61193 11.9665 numMergedOcc 0
8 mol 102 unq 2 iso 0 dist 5.32892 7.58908 6.43211 4.51114 4.84683 9.61113 7.08749 9.51771 9.61193 11.0943 numMergedOcc 0
9 mol 102 unq 3 iso 0 dist 5.32892 7.58908 6.43211 9.29865 11.9011 7.73836 7.08749 9.51771 9.61193 11.9665 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 9.09918 8.89412 4.1643 10.3282 7.56704 7.8034 5.78374 7.75833 6.94015 5.0614 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 9.15795 9.92635 6.08414 15.7519 13.1461 9.81282 5.27311 11.0859 8.58178 13.7825 numMergedOcc 0
12 mol 183 unq 1 iso 0 dist 9.15795 9.92635 6.08414 15.7519 13.1461 9.81282 6.58331 7.80268 4.77438 9.83347 numMergedOcc 0
13 mol 183 unq 2 iso 0 dist 9.15795 9.92635 6.08414 15.7519 13.1461 9.81282 12.5326 10.7359 5.73344 5.14341 numMergedOcc 0
14 mol 183 unq 3 iso 0 dist 8.72128 7.85507 6.08414 15.2905 13.1461 9.81282 3.84394 11.0859 8.58178 13.7825 numMergedOcc 0
15 mol 183 unq 4 iso 0 dist 8.72128 7.85507 6.08414 15.2905 13.1461 9.81282 5.46887 7.80268 4.77438 9.83347 numMergedOcc 0
16 mol 183 unq 5 iso 0 dist 8.72128 7.85507 6.08414 15.2905 13.1461 9.81282 11.1336 10.7359 5.73344 5.14341 numMergedOcc 0
17 mol 185 unq 0 iso 0 dist 7.64068 5.40655 4.81985 8.51 10.876 6.11382 3.82689 9.11629 4.91046 4.96002 numMergedOcc 0
18 mol 199 unq 0 iso 0 dist 9.86694 7.16849 5.88171 4.98653 12.3093 7.29716 3.78464 11.469 9.2815 6.58405 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 9.81689 6.98812 5.57706 7.40176 9.35563 8.19772 13.0312 9.92016 6.80043 11.5884 numMergedOcc 0
