0 mol 7 unq 0 iso 0 dist 7.13259 9.20552 4.78012 5.26458 7.13214 5.99972 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.81257 8.90024 12.092 13.2914 17.3778 8.95682 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 8.74797 9.26438 9.25015 5.26309 10.1847 7.80523 numMergedOcc 0
3 mol 122 unq 0 iso 0 dist 6.12598 8.47907 11.4252 6.9595 12.7482 9.23819 numMergedOcc 0
4 mol 122 unq 1 iso 0 dist 6.12598 8.47907 11.4252 10.577 15.5022 8.88537 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 9.08158 6.71293 6.27128 5.76663 7.55095 6.96281 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.86332 8.95433 8.27211 13.7968 11.3218 9.22232 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.86332 8.95433 8.27211 12.0166 11.8818 9.22661 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 8.86332 8.95433 8.27211 5.14992 9.93823 7.56378 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.17599 5.79157 7.18189 12.2847 11.7753 9.94764 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.78704 5.79157 5.87684 12.2847 15.6038 9.94764 numMergedOcc 0
11 mol 188 unq 0 iso 0 dist 9.63715 7.24099 6.33907 6.5476 10.1528 7.14503 numMergedOcc 0
12 mol 188 unq 1 iso 0 dist 9.63715 7.24099 6.33907 5.54913 6.1338 8.10214 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 8.24466 9.36732 7.08535 9.71153 6.67699 6.86319 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 8.41937 7.70631 8.75322 14.5203 14.4919 7.50013 numMergedOcc 0
15 mol 197 unq 1 iso 0 dist 8.41937 7.70631 8.75322 11.199 10.2009 5.81233 numMergedOcc 0
16 mol 197 unq 2 iso 0 dist 8.41937 7.70631 8.75322 12.0358 15.1055 6.92924 numMergedOcc 0
17 mol 197 unq 3 iso 0 dist 8.41937 7.70631 8.75322 7.10431 13.3338 7.14306 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 9.55401 8.23536 4.99503 4.45211 10.8747 7.89524 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 9.03526 9.91518 11.4295 11.8916 9.58671 8.00673 numMergedOcc 0
20 mol 278 unq 1 iso 0 dist 8.03252 9.91518 17.5675 11.8916 18.0886 8.00673 numMergedOcc 0
