0 mol 46 unq 0 iso 0 dist 8.78474 3.89419 8.55031 4.81634 5.2568 6.54685 numMergedOcc 0
1 mol 46 unq 1 iso 0 dist 8.24314 10.1729 8.55031 6.99019 5.2568 6.54685 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.54374 17.5231 9.78545 9.33289 8.14547 13.1304 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.54374 15.2861 9.97998 9.33289 8.14547 7.76917 numMergedOcc 0
4 mol 147 unq 0 iso 0 dist 8.64606 10.581 5.82034 4.8693 8.62135 10.5092 numMergedOcc 0
5 mol 147 unq 1 iso 0 dist 8.64606 11.7424 6.56854 4.8693 8.62135 9.7319 numMergedOcc 0
6 mol 183 unq 0 iso 0 dist 9.84306 9.24396 9.92635 9.50462 8.58178 5.27311 numMergedOcc 0
7 mol 183 unq 1 iso 0 dist 9.84306 9.24396 9.92635 10.3782 4.77438 6.58331 numMergedOcc 0
8 mol 183 unq 2 iso 0 dist 9.84306 9.24396 9.92635 14.7123 5.73344 12.5326 numMergedOcc 0
9 mol 183 unq 3 iso 0 dist 9.84306 6.29417 7.85507 9.50462 8.58178 3.84394 numMergedOcc 0
10 mol 183 unq 4 iso 0 dist 9.84306 6.29417 7.85507 10.3782 4.77438 5.46887 numMergedOcc 0
11 mol 183 unq 5 iso 0 dist 9.84306 6.29417 7.85507 14.7123 5.73344 11.1336 numMergedOcc 0
12 mol 185 unq 0 iso 0 dist 8.93886 4.85027 5.40655 6.31855 4.91046 3.82689 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 8.67145 8.64161 5.79753 5.78087 7.06868 3.70636 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 8.67145 5.68443 7.56537 5.78087 7.06868 8.82321 numMergedOcc 0
15 mol 199 unq 0 iso 0 dist 7.28311 4.91787 8.22146 4.09813 7.49503 3.78464 numMergedOcc 0
16 mol 199 unq 1 iso 0 dist 6.33787 4.91787 7.16849 4.09813 9.2815 3.78464 numMergedOcc 0
17 mol 211 unq 0 iso 0 dist 7.79873 6.83095 7.38723 4.80737 8.13147 3.56019 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 9.4155 5.48066 8.38742 6.55971 9.2653 9.98235 numMergedOcc 0
19 mol 244 unq 0 iso 0 dist 8.5122 5.92707 9.91271 7.91694 9.32492 3.29359 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 6.54658 4.1826 9.86356 9.71159 7.75936 12.5696 numMergedOcc 0
