0 mol 25 unq 0 iso 0 dist 9.48085 4.79873 12.7147 12.1492 8.53931 15.056 17.793 9.2325 20.1802 9.75219 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 9.49421 7.52933 16.0628 4.70708 8.53931 11.598 11.26 9.2325 15.4158 9.75219 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 9.49421 6.55597 12.1732 4.70708 8.53931 11.1095 11.26 9.2325 14.868 9.75219 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 9.49421 9.71956 8.99147 4.70708 8.53931 11.6083 11.26 9.2325 8.1632 9.75219 numMergedOcc 0
4 mol 25 unq 4 iso 0 dist 9.49421 7.07751 9.54872 4.70708 8.53931 10.1706 11.26 9.2325 9.89578 9.75219 numMergedOcc 0
5 mol 25 unq 5 iso 0 dist 9.49421 8.23761 14.6175 4.70708 8.53931 11.6932 11.26 9.2325 12.2688 9.75219 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 6.85523 5.77326 8.2592 4.92509 5.47706 8.07568 7.91148 6.99884 4.75637 7.03887 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 6.85523 5.77326 8.2592 4.92509 5.47706 8.07568 6.59794 3.75261 5.62063 5.36451 numMergedOcc 0
8 mol 78 unq 2 iso 0 dist 6.85523 5.77326 8.2592 4.92509 5.47706 8.07568 8.34957 10.6388 3.81575 9.28354 numMergedOcc 0
9 mol 78 unq 3 iso 0 dist 8.65848 7.25801 7.95975 5.22036 5.47706 8.89842 12.2138 6.99884 14.1409 7.03887 numMergedOcc 0
10 mol 78 unq 4 iso 0 dist 8.65848 7.25801 7.95975 5.22036 5.47706 8.89842 10.167 3.75261 11.1725 5.36451 numMergedOcc 0
11 mol 78 unq 5 iso 0 dist 8.65848 7.25801 7.95975 5.22036 5.47706 8.89842 13.9695 10.6388 17.572 9.28354 numMergedOcc 0
12 mol 78 unq 6 iso 0 dist 7.25801 8.65848 7.95975 5.22036 8.89842 5.47706 12.2138 14.1409 6.99884 7.03887 numMergedOcc 0
13 mol 78 unq 7 iso 0 dist 7.25801 8.65848 7.95975 5.22036 8.89842 5.47706 10.167 11.1725 3.75261 5.36451 numMergedOcc 0
14 mol 78 unq 8 iso 0 dist 7.25801 8.65848 7.95975 5.22036 8.89842 5.47706 13.9695 17.572 10.6388 9.28354 numMergedOcc 0
15 mol 78 unq 9 iso 0 dist 5.77326 6.85523 8.2592 4.92509 8.07568 5.47706 7.91148 4.75637 6.99884 7.03887 numMergedOcc 0
16 mol 78 unq 10 iso 0 dist 5.77326 6.85523 8.2592 4.92509 8.07568 5.47706 6.59794 5.62063 3.75261 5.36451 numMergedOcc 0
17 mol 78 unq 11 iso 0 dist 5.77326 6.85523 8.2592 4.92509 8.07568 5.47706 8.34957 3.81575 10.6388 9.28354 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 7.36975 5.40637 10.1474 5.44503 8.18023 7.46803 8.99891 14.4074 5.94217 8.08798 numMergedOcc 0
19 mol 143 unq 1 iso 0 dist 5.40637 7.36975 10.1474 5.44503 7.46803 8.18023 8.99891 5.94217 14.4074 8.08798 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 6.64173 9.01624 11.196 6.7991 9.09234 6.76746 8.29467 5.09584 11.4645 6.91878 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 6.64173 9.55105 10.1041 6.7991 9.09234 8.92098 8.29467 5.09584 11.5807 6.91878 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 9.01624 6.64173 11.196 6.7991 6.76746 9.09234 8.29467 11.4645 5.09584 6.91878 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 9.01624 9.55105 3.55187 6.7991 6.76746 8.92098 8.29467 11.4645 11.5807 6.91878 numMergedOcc 0
24 mol 181 unq 4 iso 0 dist 9.55105 6.64173 10.1041 6.7991 8.92098 9.09234 8.29467 11.5807 5.09584 6.91878 numMergedOcc 0
25 mol 181 unq 5 iso 0 dist 9.55105 9.01624 3.55187 6.7991 8.92098 6.76746 8.29467 11.5807 11.4645 6.91878 numMergedOcc 0
26 mol 184 unq 0 iso 0 dist 6.73504 9.90822 9.88527 6.47974 7.59939 10.9394 15.1746 11.8486 16.1163 9.46392 numMergedOcc 0
27 mol 197 unq 0 iso 0 dist 9.10817 9.73548 16.8666 5.2908 9.27218 11.3514 9.76879 13.3283 6.44391 9.6071 numMergedOcc 0
28 mol 197 unq 1 iso 0 dist 9.10817 9.73548 16.8666 5.2908 9.27218 11.3514 9.23086 17.435 4.91041 9.77656 numMergedOcc 0
29 mol 225 unq 0 iso 0 dist 6.50998 9.09424 8.05944 8.69249 8.91356 11.0655 13.8828 14.9585 11.0065 9.27079 numMergedOcc 0
30 mol 225 unq 1 iso 0 dist 6.50998 8.14831 13.7858 8.69249 8.91356 13.9144 13.8828 14.9585 14.16 9.27079 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 5.85442 6.95511 3.51848 5.79468 6.23661 9.43105 11.9533 11.169 13.3062 9.28024 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 8.03219 6.9899 8.0048 5.31048 8.84648 6.23661 11.1801 6.12744 11.169 9.28024 numMergedOcc 0
33 mol 259 unq 2 iso 0 dist 6.9899 8.03219 8.0048 5.31048 6.23661 8.84648 11.1801 11.169 6.12744 9.28024 numMergedOcc 0
34 mol 274 unq 0 iso 0 dist 6.4611 9.30212 13.5848 5.31116 6.66172 12.703 13.2967 10.6981 16.3841 9.85661 numMergedOcc 0
35 mol 292 unq 0 iso 0 dist 9.46442 7.30758 3.57128 12.1551 5.84792 8.73515 9.96374 3.08474 6.12546 3.93401 numMergedOcc 0
36 mol 292 unq 1 iso 0 dist 9.46442 9.5785 11.3907 12.1551 5.84792 15.8988 9.96374 3.08474 12.0714 3.93401 numMergedOcc 0
37 mol 292 unq 2 iso 0 dist 9.46442 9.76319 13.609 12.1551 5.84792 15.8206 9.96374 3.08474 12.7236 3.93401 numMergedOcc 0
38 mol 292 unq 3 iso 0 dist 9.9182 8.9221 9.43063 18.0293 8.73515 15.6627 15.9302 6.12546 14.4257 3.93401 numMergedOcc 0
39 mol 292 unq 4 iso 0 dist 7.30758 9.46442 3.57128 12.1551 8.73515 5.84792 9.96374 6.12546 3.08474 3.93401 numMergedOcc 0
40 mol 292 unq 5 iso 0 dist 7.30758 9.5785 10.0941 12.1551 8.73515 15.8988 9.96374 6.12546 12.0714 3.93401 numMergedOcc 0
41 mol 292 unq 6 iso 0 dist 7.30758 9.76319 13.2166 12.1551 8.73515 15.8206 9.96374 6.12546 12.7236 3.93401 numMergedOcc 0
42 mol 292 unq 7 iso 0 dist 9.10788 8.85064 9.43063 10.8709 8.73515 15.6627 11.6796 6.12546 14.4257 3.93401 numMergedOcc 0
