0 mol 5 unq 0 iso 0 dist 6.40459 7.06929 7.89217 13.7636 10.0436 8.4435 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.58084 13.0288 7.89217 17.0982 10.0436 8.4435 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 9.8143 6.89121 8.81964 5.63583 7.05332 9.75695 numMergedOcc 0
3 mol 36 unq 0 iso 0 dist 6.9099 6.16108 6.63518 9.78957 9.64155 9.14828 numMergedOcc 0
4 mol 36 unq 1 iso 0 dist 7.23823 6.73215 6.63518 4.10339 9.64155 9.14828 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.50028 12.1332 6.85356 17.9613 10.5032 6.73832 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 8.98949 5.7687 6.45169 8.95717 10.4812 7.56704 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 9.13917 5.08182 5.92836 9.89671 5.25819 8.79837 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 9.13917 5.08182 5.92836 11.3268 5.86018 8.33117 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 6.53862 7.587 9.82274 10.7883 10.9506 9.03873 numMergedOcc 0
10 mol 133 unq 3 iso 0 dist 6.53862 7.587 9.82274 4.46578 8.13581 9.31413 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 7.75233 5.784 9.08686 6.45502 8.35641 8.36163 numMergedOcc 0
12 mol 158 unq 1 iso 0 dist 7.75233 5.784 9.08686 10.1997 5.08554 9.62348 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 8.68755 10.0585 8.44321 13.0244 11.5983 6.03275 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 9.92349 5.4891 9.57625 5.2376 7.38726 8.92113 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 9.70779 5.4891 8.08702 5.2376 10.0087 8.92113 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 9.99717 10.9092 7.0412 12.4148 4.37243 9.10325 numMergedOcc 0
17 mol 254 unq 0 iso 0 dist 9.61808 12.6476 9.60855 9.73281 5.64395 9.47137 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 7.7368 4.64631 7.58907 10.6904 10.1749 8.50964 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.7368 4.64631 7.58907 10.6904 10.1749 8.50964 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.7368 4.64631 7.58907 10.6904 10.1749 8.50964 numMergedOcc 0
