0 mol 46 unq 0 iso 0 dist 6.47185 9.72136 13.7886 4.38299 5.81662 13.6147 numMergedOcc 0
1 mol 46 unq 1 iso 0 dist 6.47185 4.61355 8.70524 4.38299 5.81662 5.4713 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 9.09269 5.92285 8.03921 7.49995 7.49792 8.93807 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 9.09269 8.38687 3.83635 7.49995 7.49792 9.7316 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.61203 6.22498 4.13643 8.0664 7.31881 9.14801 numMergedOcc 0
5 mol 110 unq 0 iso 0 dist 5.33139 8.27843 4.10689 3.32173 7.59747 9.25023 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 9.61215 7.91608 10.518 8.3346 8.09682 14.1569 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 9.61215 7.91608 10.518 10.1291 8.35926 13.6856 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 9.61215 7.91608 10.518 14.6702 7.41568 17.1418 numMergedOcc 0
9 mol 157 unq 0 iso 0 dist 7.78927 4.20542 6.17631 4.15636 8.97914 7.91458 numMergedOcc 0
10 mol 157 unq 1 iso 0 dist 7.78927 8.40948 3.80096 4.15636 8.97914 10.9863 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.48737 9.15431 3.97751 7.18168 8.78251 10.8716 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 6.43416 5.92364 3.85734 8.95992 9.08818 10.7766 numMergedOcc 0
13 mol 218 unq 1 iso 0 dist 6.43416 5.92364 3.85734 10.3622 8.5163 12.014 numMergedOcc 0
14 mol 255 unq 0 iso 0 dist 5.83014 8.08403 4.04928 3.53487 8.66655 11.4091 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 7.02347 9.45605 6.32315 6.25559 5.28746 10.2716 numMergedOcc 0
16 mol 284 unq 0 iso 0 dist 7.41633 6.52085 11.6034 3.39008 5.2862 9.65177 numMergedOcc 0
17 mol 284 unq 1 iso 0 dist 7.41633 9.84174 14.3977 3.39008 5.2862 11.1965 numMergedOcc 0
18 mol 284 unq 2 iso 0 dist 5.52837 6.52085 8.17165 3.39008 5.31097 9.65177 numMergedOcc 0
19 mol 284 unq 3 iso 0 dist 5.52837 9.84174 11.148 3.39008 5.31097 11.1965 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 6.81636 7.74312 8.93497 6.1158 8.4625 4.93516 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 6.81636 7.74312 8.93497 6.1158 8.4625 4.93516 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 6.81636 7.74312 8.93497 6.1158 8.4625 4.93516 numMergedOcc 0
