0 mol 79 unq 0 iso 0 dist 8.40399 6.29267 7.3779 4.98967 11.0858 5.25027 numMergedOcc 0
1 mol 81 unq 0 iso 0 dist 8.68497 4.95504 12.9904 4.35132 10.5038 5.51927 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.66549 9.27814 7.41484 13.4816 11.847 9.01812 numMergedOcc 0
3 mol 110 unq 0 iso 0 dist 8.36172 7.59747 6.88119 5.33778 9.73174 9.10911 numMergedOcc 0
4 mol 147 unq 0 iso 0 dist 5.70772 8.94352 10.5092 6.97147 10.7523 6.73617 numMergedOcc 0
5 mol 181 unq 0 iso 0 dist 5.08796 7.24832 3.59953 10.9813 9.84952 8.29467 numMergedOcc 0
6 mol 181 unq 1 iso 0 dist 5.93515 7.24832 9.61614 10.9813 10.8641 8.29467 numMergedOcc 0
7 mol 218 unq 0 iso 0 dist 7.38022 9.08818 6.03974 6.75711 8.5119 6.1896 numMergedOcc 0
8 mol 225 unq 0 iso 0 dist 9.58385 5.65735 7.3107 4.41663 13.4957 8.40074 numMergedOcc 0
9 mol 225 unq 1 iso 0 dist 6.83539 5.65735 6.9328 4.41663 9.86371 8.40074 numMergedOcc 0
10 mol 225 unq 2 iso 0 dist 6.22747 5.65735 3.90226 4.41663 9.13552 8.40074 numMergedOcc 0
11 mol 225 unq 3 iso 0 dist 9.21404 5.65735 6.59432 4.41663 10.0918 8.40074 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 9.96682 5.77565 7.72539 4.68199 8.49076 8.12739 numMergedOcc 0
13 mol 274 unq 1 iso 0 dist 9.96682 6.32853 8.78528 4.68199 8.49076 6.09853 numMergedOcc 0
14 mol 294 unq 0 iso 0 dist 8.74181 5.18334 12.3645 9.07177 17.6556 7.56669 numMergedOcc 0
15 mol 294 unq 1 iso 0 dist 8.96987 5.18334 11.3568 9.07177 15.9391 7.56669 numMergedOcc 0
