0 mol 25 unq 0 iso 0 dist 8.23292 6.80822 4.70708 6.39668 9.01548 6.63839 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 4.68793 6.59367 5.0364 12.5752 11.6539 6.73801 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 4.68793 6.59367 5.0364 8.68242 8.51663 6.42834 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 5.36645 8.80334 4.84988 14.2257 11.8552 7.34031 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.05547 8.10708 14.134 9.98108 13.6427 9.43355 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 9.05547 8.10708 14.134 12.8035 20.6305 7.9327 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 9.57498 6.0026 7.2495 5.70312 9.91958 6.0652 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 7.21902 6.26422 6.01663 5.11595 12.2057 9.62236 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 7.21902 6.26422 6.01663 9.37324 9.72053 6.90634 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.96061 6.61636 12.8483 10.745 18.6474 6.51868 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 8.96061 6.61636 12.8483 11.3682 16.4619 7.34698 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.5984 8.57285 5.44503 8.28318 9.14266 9.30424 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 6.53758 8.54318 5.77564 11.765 10.8572 9.0529 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 8.58946 9.72291 11.206 7.33075 13.7242 7.80054 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 8.70197 7.33162 13.5291 4.67407 13.1713 8.41245 numMergedOcc 0
15 mol 173 unq 1 iso 0 dist 8.70197 7.33162 13.5291 6.34062 12.1236 6.64779 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 6.73365 7.77669 10.3111 10.3139 14.1487 6.26365 numMergedOcc 0
17 mol 175 unq 1 iso 0 dist 6.73365 7.77669 10.3111 7.04147 12.1542 7.04177 numMergedOcc 0
18 mol 175 unq 2 iso 0 dist 9.45659 7.77669 10.6973 10.3139 16.2084 6.26365 numMergedOcc 0
19 mol 175 unq 3 iso 0 dist 9.45659 7.77669 10.6973 7.04147 14.966 7.04177 numMergedOcc 0
20 mol 175 unq 4 iso 0 dist 9.44856 7.77669 6.27043 10.3139 12.5221 6.26365 numMergedOcc 0
21 mol 175 unq 5 iso 0 dist 9.44856 7.77669 6.27043 7.04147 12.4656 7.04177 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 6.54753 6.59786 4.89568 7.10817 8.83865 8.68913 numMergedOcc 0
23 mol 273 unq 1 iso 0 dist 6.54753 7.96519 11.5447 4.30863 10.7715 8.85779 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.32567 8.91712 5.59555 numMergedOcc 0
25 mol 287 unq 1 iso 0 dist 9.22306 9.11967 4.62998 7.04567 8.91712 5.59555 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.32567 8.91712 5.59555 numMergedOcc 0
27 mol 288 unq 1 iso 0 dist 9.22306 9.11967 4.62998 7.04567 8.91712 5.59555 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.32567 8.91712 5.59555 numMergedOcc 0
29 mol 289 unq 1 iso 0 dist 9.22306 9.11967 4.62998 7.04567 8.91712 5.59555 numMergedOcc 0
