0 mol 0 unq 0 iso 0 dist 9.6994 9.23213 5.08793 7.40865 9.11323 9.30151 12.9149 12.5416 8.66548 16.5244 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 9.23213 10.4498 7.40865 9.46298 9.30151 12.9149 15.8082 8.66548 16.5244 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 9.68596 14.7759 13.0969 6.88805 5.99459 8.81608 10.3333 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 8.57077 6.85412 8.27962 9.62394 9.5997 4.45625 5.84314 5.8245 9.71516 10.9352 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 8.57077 6.33889 11.4878 9.62394 9.5997 6.0397 5.84314 5.8245 9.81658 10.9352 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 6.81627 8.26899 5.98837 7.21955 7.09066 10.8421 6.20618 8.41778 7.60018 12.6602 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 6.81627 8.26899 5.98837 7.21955 7.09066 10.8421 5.61579 5.38524 7.03126 10.4354 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 7.32874 8.26899 4.55117 7.21955 7.12541 10.8421 6.20618 9.97819 7.60018 12.6602 numMergedOcc 0
8 mol 58 unq 3 iso 0 dist 7.32874 8.26899 4.55117 7.21955 7.12541 10.8421 5.61579 8.69057 7.03126 10.4354 numMergedOcc 0
9 mol 58 unq 4 iso 0 dist 9.55426 8.26899 10.3782 7.21955 5.74871 10.8421 6.20618 14.4477 7.60018 12.6602 numMergedOcc 0
10 mol 58 unq 5 iso 0 dist 9.55426 8.26899 10.3782 7.21955 5.74871 10.8421 5.61579 13.1897 7.03126 10.4354 numMergedOcc 0
11 mol 72 unq 0 iso 0 dist 8.8178 6.77912 12.0644 9.27838 15.434 4.67641 10.0679 16.89 9.37102 11.7561 numMergedOcc 0
12 mol 72 unq 1 iso 0 dist 8.8178 6.77912 12.0644 9.27838 15.434 4.67641 5.69391 13.6019 5.4605 7.58875 numMergedOcc 0
13 mol 72 unq 2 iso 0 dist 8.8178 6.77912 12.0644 9.27838 15.434 4.67641 4.03844 12.4827 6.53824 6.91169 numMergedOcc 0
14 mol 72 unq 3 iso 0 dist 9.96708 6.77912 7.11552 9.27838 11.6378 4.67641 10.0679 10.7102 9.37102 11.7561 numMergedOcc 0
15 mol 72 unq 4 iso 0 dist 9.96708 6.77912 7.11552 9.27838 11.6378 4.67641 5.69391 9.55118 5.4605 7.58875 numMergedOcc 0
16 mol 72 unq 5 iso 0 dist 9.96708 6.77912 7.11552 9.27838 11.6378 4.67641 4.03844 12.111 6.53824 6.91169 numMergedOcc 0
17 mol 109 unq 0 iso 0 dist 8.69985 5.87358 9.46098 7.80523 7.74599 6.89298 6.35679 14.6042 8.38791 10.5546 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 6.18601 8.43904 10.3457 6.73586 5.13589 7.39626 4.39676 8.95212 6.13374 8.67537 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 6.43582 9.38946 12.8482 7.92304 5.50031 9.50478 4.91785 8.97626 7.29911 9.16358 numMergedOcc 0
20 mol 155 unq 1 iso 0 dist 6.43582 7.36102 8.27726 7.92304 5.50031 5.50045 4.91785 8.97626 5.36254 9.16358 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 7.81386 4.93785 6.7991 9.39829 7.20191 7.30555 6.8757 6.64173 9.09234 12.6232 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 7.81386 4.93785 6.7991 9.39829 7.20191 7.30555 5.71898 9.01624 6.76746 5.99437 numMergedOcc 0
23 mol 181 unq 2 iso 0 dist 7.81386 4.93785 6.7991 9.39829 7.20191 7.30555 5.83796 9.55105 8.92098 8.4848 numMergedOcc 0
24 mol 182 unq 0 iso 0 dist 9.31746 6.73313 11.1088 6.73956 7.68794 5.8726 4.88992 13.5224 5.73635 8.62102 numMergedOcc 0
25 mol 182 unq 1 iso 0 dist 9.31746 6.73313 11.1088 7.09394 9.37404 10.7622 4.88992 13.5224 5.73635 10.0627 numMergedOcc 0
26 mol 197 unq 0 iso 0 dist 8.56633 8.99696 9.82139 7.50013 8.46623 11.1666 17.0276 12.8171 9.27218 17.3389 numMergedOcc 0
27 mol 197 unq 1 iso 0 dist 8.56633 8.99696 9.82139 5.81233 10.7305 13.3562 17.0276 12.8171 9.27218 20.8891 numMergedOcc 0
28 mol 197 unq 2 iso 0 dist 8.56633 8.99696 9.82139 6.92924 5.41996 4.59269 17.0276 12.8171 9.27218 10.228 numMergedOcc 0
29 mol 197 unq 3 iso 0 dist 8.56633 8.99696 9.82139 7.14306 6.64537 12.9766 17.0276 12.8171 9.27218 17.9946 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 9.40098 8.19953 8.64911 9.51597 4.98993 6.99977 5.13732 11.2501 5.73591 10.7847 numMergedOcc 0
31 mol 224 unq 1 iso 0 dist 6.61986 8.19953 10.7113 9.51597 12.4692 6.99977 5.13732 8.08349 5.73591 10.7847 numMergedOcc 0
32 mol 234 unq 0 iso 0 dist 8.34494 6.25105 10.3337 9.81425 4.3717 13.0631 5.53885 13.7549 7.36208 14.9726 numMergedOcc 0
33 mol 234 unq 1 iso 0 dist 6.56247 6.25105 11.216 9.81425 4.46561 13.0631 5.53885 11.1872 7.36208 14.9726 numMergedOcc 0
34 mol 234 unq 2 iso 0 dist 9.36357 6.25105 11.4315 9.81425 10.641 13.0631 5.53885 10.5689 7.36208 14.9726 numMergedOcc 0
35 mol 234 unq 3 iso 0 dist 8.41436 6.16063 11.3297 6.30154 7.44558 5.70413 13.1872 17.3846 9.11572 14.1037 numMergedOcc 0
36 mol 234 unq 4 iso 0 dist 8.41436 6.16063 11.3297 7.32499 10.7902 7.17691 13.1872 17.3846 9.11572 7.77911 numMergedOcc 0
37 mol 234 unq 5 iso 0 dist 8.92474 6.16063 10.2563 6.30154 10.9712 5.70413 13.1872 11.3419 9.11572 14.1037 numMergedOcc 0
38 mol 234 unq 6 iso 0 dist 8.92474 6.16063 10.2563 7.32499 4.4288 7.17691 13.1872 11.3419 9.11572 7.77911 numMergedOcc 0
39 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 9.55668 7.60081 13.128 13.7306 13.8176 7.02029 13.3153 numMergedOcc 0
