0 mol 18 unq 0 iso 0 dist 9.4649 8.24155 6.8812 8.95573 10.3579 12.2849 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.45965 8.24155 12.421 8.95573 5.867 12.2849 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.2794 7.68652 15.844 8.06918 11.9871 14.4842 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 9.2794 7.68652 15.844 7.52623 9.5704 14.7467 numMergedOcc 0
4 mol 70 unq 2 iso 0 dist 9.2794 7.68652 15.844 5.62294 10.9277 5.93792 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 7.32868 8.58504 14.4048 9.62702 4.47011 17.3321 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 7.32868 8.58504 14.4048 6.97484 11.9916 11.406 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 8.3907 9.71402 11.1283 9.55337 5.73775 7.82677 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.63173 6.56224 5.91102 9.59094 6.2062 12.1124 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.49649 9.16832 5.04704 5.98435 11.5532 12.7653 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.49649 9.16832 5.04704 8.80672 14.5276 12.6285 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 8.47476 7.19168 7.05228 9.55297 5.65619 5.10902 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 8.47476 7.19168 7.05228 7.447 14.1869 11.7069 numMergedOcc 0
13 mol 141 unq 2 iso 0 dist 8.47476 7.19168 7.05228 6.59782 8.66026 9.22967 numMergedOcc 0
14 mol 141 unq 3 iso 0 dist 6.74947 7.19168 12.5558 9.55297 15.8344 5.10902 numMergedOcc 0
15 mol 141 unq 4 iso 0 dist 6.74947 7.19168 12.5558 7.447 5.25586 11.7069 numMergedOcc 0
16 mol 141 unq 5 iso 0 dist 6.74947 7.19168 12.5558 6.59782 10.1908 9.22967 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.95136 6.23909 13.3124 6.37411 15.2718 5.33564 numMergedOcc 0
18 mol 209 unq 0 iso 0 dist 6.3344 7.95916 10.1835 5.20111 4.45815 6.18167 numMergedOcc 0
19 mol 212 unq 0 iso 0 dist 7.11204 7.54319 8.88018 6.11919 6.91212 4.91427 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 5.65943 7.94402 9.42563 7.54327 4.21173 10.1743 numMergedOcc 0
