0 mol 1 unq 0 iso 0 dist 5.55208 7.48521 8.3673 6.79192 8.83387 9.67796 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 8.43134 12.2207 9.77719 11.9747 6.76158 16.4255 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 8.43134 12.2207 9.77719 14.3271 7.423 16.0765 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 8.43134 12.2207 9.77719 12.8218 5.89257 13.6412 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.09741 9.91837 7.15918 10.7721 7.30934 5.4118 numMergedOcc 0
5 mol 169 unq 0 iso 0 dist 7.642 5.68862 5.87263 5.73931 6.18165 3.18152 numMergedOcc 0
6 mol 220 unq 0 iso 0 dist 7.30288 12.1153 9.72819 5.11797 9.54857 13.6485 numMergedOcc 0
7 mol 220 unq 1 iso 0 dist 7.30288 12.1153 9.72819 5.32983 8.73456 10.687 numMergedOcc 0
8 mol 243 unq 0 iso 0 dist 6.30075 5.76716 7.42359 10.6784 8.35328 7.66826 numMergedOcc 0
9 mol 243 unq 1 iso 0 dist 9.7462 9.67191 7.42359 15.977 8.35328 7.66826 numMergedOcc 0
10 mol 257 unq 0 iso 0 dist 6.19814 5.06649 7.57749 5.83544 8.71617 9.9335 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 7.5129 15.3558 7.97307 12.1108 7.13397 8.04546 numMergedOcc 0
12 mol 260 unq 1 iso 0 dist 7.5129 15.3558 7.97307 12.7836 5.33278 3.68866 numMergedOcc 0
13 mol 260 unq 2 iso 0 dist 7.5129 9.31424 8.52702 12.1108 7.13397 15.6308 numMergedOcc 0
14 mol 260 unq 3 iso 0 dist 7.5129 9.31424 8.52702 12.7836 5.33278 10.6938 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 6.55498 4.88543 7.95196 13.5711 8.88717 11.9635 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 7.38219 4.88543 6.759 13.5711 9.84651 11.9635 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 9.1299 4.38471 7.37164 11.9069 7.96707 7.98095 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 9.1299 4.38471 7.37164 11.9069 7.96707 7.98095 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 9.1299 4.38471 7.37164 11.9069 7.96707 7.98095 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 6.59906 13.5359 8.51266 6.13654 7.61675 12.6536 numMergedOcc 0
