0 mol 1 unq 0 iso 0 dist 7.21349 7.81034 4.79345 4.93091 8.15672 9.21329 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.21349 9.19497 3.84685 4.93091 8.15672 8.54277 numMergedOcc 0
2 mol 2 unq 0 iso 0 dist 5.42021 6.47123 9.5866 4.00237 6.89072 8.3726 numMergedOcc 0
3 mol 2 unq 1 iso 0 dist 9.15006 6.47123 13.6302 4.00237 10.1005 8.3726 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 9.59131 6.51139 13.4526 3.84207 13.2808 7.16598 numMergedOcc 0
5 mol 41 unq 1 iso 0 dist 9.59131 6.51139 13.4526 5.6133 13.4594 7.42476 numMergedOcc 0
6 mol 41 unq 2 iso 0 dist 9.59131 6.91278 11.3802 3.84207 13.2808 9.14632 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 9.14996 5.02642 7.08886 9.83606 10.887 7.44805 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 6.72531 9.04514 4.91237 14.436 13.1965 8.52681 numMergedOcc 0
9 mol 48 unq 1 iso 0 dist 6.72531 9.04514 4.91237 12.7654 13.6682 9.98769 numMergedOcc 0
10 mol 81 unq 0 iso 0 dist 5.96486 9.80754 8.00722 5.82911 9.53663 8.57764 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.53731 8.79677 6.76815 6.83136 10.546 5.87382 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 7.10223 8.65008 3.82471 11.9194 6.12278 8.76245 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 9.76722 5.60956 4.65845 3.56227 8.97414 5.64732 numMergedOcc 0
14 mol 168 unq 1 iso 0 dist 9.76722 5.60956 4.65845 3.96437 10.1297 5.52214 numMergedOcc 0
15 mol 168 unq 2 iso 0 dist 9.76722 5.60956 4.65845 6.15982 8.00063 5.80055 numMergedOcc 0
16 mol 168 unq 3 iso 0 dist 9.76722 5.60956 4.65845 5.33789 10.8516 7.44481 numMergedOcc 0
17 mol 169 unq 0 iso 0 dist 8.44483 6.09291 11.8115 4.24401 7.78577 6.27378 numMergedOcc 0
18 mol 169 unq 1 iso 0 dist 9.79864 6.09291 12.8928 4.24401 12.4926 6.27378 numMergedOcc 0
19 mol 169 unq 2 iso 0 dist 9.73241 6.09291 11.3409 4.24401 13.7977 6.27378 numMergedOcc 0
20 mol 183 unq 0 iso 0 dist 8.15747 6.0782 3.94874 9.03854 6.2675 8.69656 numMergedOcc 0
21 mol 183 unq 1 iso 0 dist 8.74903 6.0782 4.44329 9.03854 9.52042 8.69656 numMergedOcc 0
22 mol 185 unq 0 iso 0 dist 9.56016 8.85182 4.63469 5.80135 8.07469 9.44685 numMergedOcc 0
23 mol 185 unq 1 iso 0 dist 7.92501 8.85182 9.22587 5.80135 12.7168 9.44685 numMergedOcc 0
24 mol 192 unq 0 iso 0 dist 9.80584 9.78743 19.1942 16.7863 26.0112 7.97601 numMergedOcc 0
25 mol 192 unq 1 iso 0 dist 7.95713 9.78743 16.5293 16.7863 23.9256 7.97601 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 5.29561 9.84479 11.4949 6.5573 11.5497 9.36462 numMergedOcc 0
27 mol 232 unq 1 iso 0 dist 5.29561 9.82645 11.8349 5.28999 9.4726 5.86945 numMergedOcc 0
28 mol 232 unq 2 iso 0 dist 9.16638 9.84479 14.347 6.5573 10.6541 9.36462 numMergedOcc 0
29 mol 232 unq 3 iso 0 dist 9.16638 9.82645 9.07946 5.28999 9.33969 5.86945 numMergedOcc 0
30 mol 233 unq 0 iso 0 dist 9.80133 7.20629 6.66728 5.33407 11.5016 9.8976 numMergedOcc 0
31 mol 233 unq 1 iso 0 dist 9.80133 7.20629 6.66728 9.06901 10.1933 7.97911 numMergedOcc 0
32 mol 233 unq 2 iso 0 dist 7.74693 9.44671 11.8011 10.6613 16.2141 9.8976 numMergedOcc 0
33 mol 233 unq 3 iso 0 dist 7.74693 9.44671 11.8011 4.45501 11.3962 7.97911 numMergedOcc 0
34 mol 233 unq 4 iso 0 dist 7.74693 7.21531 5.89828 7.70097 11.3528 8.70416 numMergedOcc 0
35 mol 233 unq 5 iso 0 dist 7.74693 7.21531 5.89828 10.2345 10.5697 8.18379 numMergedOcc 0
