0 mol 43 unq 0 iso 0 dist 7.81257 6.84521 7.23774 7.84444 6.2885 8.01951 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 7.81257 8.90024 12.092 7.84444 6.2885 12.2025 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 7.81257 6.78532 10.7423 7.84444 6.2885 7.68348 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 9.28709 6.77833 6.95018 8.06918 10.7301 6.65811 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 9.28709 6.77833 6.95018 7.52623 11.7565 5.47516 numMergedOcc 0
5 mol 70 unq 2 iso 0 dist 9.28709 6.77833 6.95018 5.62294 12.3296 11.0952 numMergedOcc 0
6 mol 94 unq 0 iso 0 dist 7.98923 8.01724 9.41429 5.80964 12.5853 8.20144 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 9.92308 7.2443 6.20962 8.94447 14.6319 8.69934 numMergedOcc 0
8 mol 122 unq 0 iso 0 dist 6.12598 8.47907 11.4252 9.55337 11.1873 5.41882 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.86332 8.95433 8.27211 9.59094 6.27514 4.68409 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 9.17599 8.31276 10.1166 5.98435 6.19899 5.31077 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 9.17599 8.31276 10.1166 8.80672 14.2573 14.0644 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 9.17599 5.79157 7.18189 5.98435 6.19899 6.74887 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 9.17599 5.79157 7.18189 8.80672 14.2573 12.6989 numMergedOcc 0
14 mol 134 unq 4 iso 0 dist 9.17599 5.50687 12.935 5.98435 6.19899 10.9715 numMergedOcc 0
15 mol 134 unq 5 iso 0 dist 9.17599 5.50687 12.935 8.80672 14.2573 8.96357 numMergedOcc 0
16 mol 134 unq 6 iso 0 dist 9.17599 7.30919 10.3773 5.98435 6.19899 11.4638 numMergedOcc 0
17 mol 134 unq 7 iso 0 dist 9.17599 7.30919 10.3773 8.80672 14.2573 5.9915 numMergedOcc 0
18 mol 134 unq 8 iso 0 dist 8.78704 8.31276 15.4311 5.98435 11.2567 5.31077 numMergedOcc 0
19 mol 134 unq 9 iso 0 dist 8.78704 8.31276 15.4311 8.80672 11.0666 14.0644 numMergedOcc 0
20 mol 134 unq 10 iso 0 dist 8.78704 5.79157 5.87684 5.98435 11.2567 6.74887 numMergedOcc 0
21 mol 134 unq 11 iso 0 dist 8.78704 5.79157 5.87684 8.80672 11.0666 12.6989 numMergedOcc 0
22 mol 134 unq 12 iso 0 dist 8.78704 5.50687 8.05964 5.98435 11.2567 10.9715 numMergedOcc 0
23 mol 134 unq 13 iso 0 dist 8.78704 5.50687 8.05964 8.80672 11.0666 8.96357 numMergedOcc 0
24 mol 134 unq 14 iso 0 dist 8.78704 7.30919 5.11977 5.98435 11.2567 11.4638 numMergedOcc 0
25 mol 134 unq 15 iso 0 dist 8.78704 7.30919 5.11977 8.80672 11.0666 5.9915 numMergedOcc 0
26 mol 167 unq 0 iso 0 dist 5.7126 7.9895 5.08837 9.4422 7.76836 6.06723 numMergedOcc 0
27 mol 167 unq 1 iso 0 dist 5.7126 6.53913 9.26656 9.4422 7.76836 6.58937 numMergedOcc 0
28 mol 248 unq 0 iso 0 dist 8.2748 7.40475 6.21372 7.96942 12.3766 10.1857 numMergedOcc 0
29 mol 266 unq 0 iso 0 dist 4.74121 6.95233 10.6075 9.15288 13.5612 4.27792 numMergedOcc 0
30 mol 266 unq 1 iso 0 dist 4.74121 6.95233 10.6075 6.11795 5.04115 11.5523 numMergedOcc 0
31 mol 266 unq 2 iso 0 dist 4.74121 9.61741 11.4012 9.15288 13.5612 14.2479 numMergedOcc 0
32 mol 266 unq 3 iso 0 dist 4.74121 9.61741 11.4012 6.11795 5.04115 6.98866 numMergedOcc 0
33 mol 266 unq 4 iso 0 dist 4.74121 5.61056 7.43125 9.15288 13.5612 10.5058 numMergedOcc 0
34 mol 266 unq 5 iso 0 dist 4.74121 5.61056 7.43125 6.11795 5.04115 5.19574 numMergedOcc 0
