0 mol 55 unq 0 iso 0 dist 8.67161 7.79829 8.34632 6.19827 5.62629 5.20168 numMergedOcc 0
1 mol 55 unq 0 iso 1 dist 8.67161 6.19827 5.62629 7.79829 8.34632 5.20168 numMergedOcc 0
2 mol 120 unq 0 iso 0 dist 8.98167 4.9227 8.86071 9.75758 9.82087 4.97169 numMergedOcc 0
3 mol 120 unq 0 iso 1 dist 8.98167 9.75758 9.82087 4.9227 8.86071 4.97169 numMergedOcc 0
4 mol 120 unq 1 iso 0 dist 6.74094 6.78986 8.86071 10.2685 9.82087 4.97169 numMergedOcc 0
5 mol 120 unq 1 iso 1 dist 6.74094 10.2685 9.82087 6.78986 8.86071 4.97169 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 8.72028 4.55126 5.34451 10.7501 9.74966 8.38946 numMergedOcc 0
7 mol 148 unq 0 iso 1 dist 8.72028 10.7501 9.74966 4.55126 5.34451 8.38946 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 8.83046 5.40743 6.6175 11.2265 9.87914 9.00126 numMergedOcc 0
9 mol 150 unq 0 iso 1 dist 8.83046 11.2265 9.87914 5.40743 6.6175 9.00126 numMergedOcc 0
10 mol 180 unq 0 iso 0 dist 9.85529 10.7068 8.86377 13.984 8.47156 10.1976 numMergedOcc 0
11 mol 180 unq 0 iso 1 dist 9.85529 13.984 8.47156 10.7068 8.86377 10.1976 numMergedOcc 0
12 mol 180 unq 1 iso 0 dist 8.6127 7.9151 8.86377 3.74384 8.47156 10.1976 numMergedOcc 0
13 mol 180 unq 1 iso 1 dist 8.6127 3.74384 8.47156 7.9151 8.86377 10.1976 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 8.8328 5.02351 4.35909 12.774 5.77393 8.67658 numMergedOcc 0
15 mol 181 unq 0 iso 1 dist 8.8328 12.774 5.77393 5.02351 4.35909 8.67658 numMergedOcc 0
16 mol 202 unq 0 iso 0 dist 5.91997 6.53133 9.86258 5.93479 9.39364 8.59331 numMergedOcc 0
17 mol 202 unq 0 iso 1 dist 5.91997 5.93479 9.39364 6.53133 9.86258 8.59331 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 9.95731 9.55761 7.0166 15.3908 8.75468 9.1793 numMergedOcc 0
19 mol 220 unq 0 iso 1 dist 9.95731 15.3908 8.75468 9.55761 7.0166 9.1793 numMergedOcc 0
20 mol 260 unq 0 iso 0 dist 8.69185 16.4987 8.66784 15.5171 8.3298 5.54154 numMergedOcc 0
21 mol 260 unq 0 iso 1 dist 8.69185 15.5171 8.3298 16.4987 8.66784 5.54154 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 6.89781 11.0263 9.96645 13.0361 9.29005 19.0649 numMergedOcc 0
23 mol 274 unq 0 iso 1 dist 6.89781 13.0361 9.29005 11.0263 9.96645 19.0649 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 6.89781 11.0263 9.96645 9.7346 8.16746 17.8293 numMergedOcc 0
25 mol 274 unq 1 iso 1 dist 6.89781 9.7346 8.16746 11.0263 9.96645 17.8293 numMergedOcc 0
26 mol 274 unq 1 iso 0 dist 6.89781 13.0361 9.29005 9.7346 8.16746 5.09461 numMergedOcc 0
27 mol 274 unq 1 iso 1 dist 6.89781 9.7346 8.16746 13.0361 9.29005 5.09461 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 7.47768 5.86409 8.76889 10.6288 6.37469 11.9542 numMergedOcc 0
29 mol 279 unq 0 iso 1 dist 7.47768 10.6288 6.37469 5.86409 8.76889 11.9542 numMergedOcc 0
30 mol 280 unq 0 iso 0 dist 7.53963 7.07259 9.047 14.7434 9.9227 11.5166 numMergedOcc 0
31 mol 280 unq 0 iso 1 dist 7.53963 14.7434 9.9227 7.07259 9.047 11.5166 numMergedOcc 0
32 mol 285 unq 0 iso 0 dist 9.20713 11.3632 8.78148 5.56783 8.33415 14.0317 numMergedOcc 0
33 mol 285 unq 0 iso 1 dist 9.20713 5.56783 8.33415 11.3632 8.78148 14.0317 numMergedOcc 0
