0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 10.2446 7.88043 7.45262 13.2247 12.2333 9.36807 5.44992 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 6.36911 6.06176 12.3097 8.80762 6.96586 13.2247 12.2333 9.36807 4.74523 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 9.36807 10.515 5.44992 5.72491 7.45262 13.2247 10.5461 6.36911 10.2446 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 7.63133 5.47769 5.94084 10.454 6.56335 11.6017 6.92781 12.5273 7.03948 16.8689 numMergedOcc 0
4 mol 16 unq 1 iso 0 dist 7.63133 5.47769 5.94084 10.454 6.56335 11.6017 5.32694 5.46498 6.58035 6.70071 numMergedOcc 0
5 mol 16 unq 2 iso 0 dist 5.46498 6.58035 5.94084 6.70071 6.56335 11.6017 10.7015 12.5273 7.03948 16.8689 numMergedOcc 0
6 mol 16 unq 3 iso 0 dist 5.46498 6.58035 5.94084 6.70071 6.56335 11.6017 5.32694 7.63133 5.47769 10.454 numMergedOcc 0
7 mol 16 unq 4 iso 0 dist 5.46498 8.41862 6.73355 6.70071 6.56335 7.40724 5.74188 8.71745 8.16785 4.50891 numMergedOcc 0
8 mol 16 unq 5 iso 0 dist 8.71745 8.16785 6.73355 4.50891 6.56335 7.40724 5.74188 5.46498 8.41862 6.70071 numMergedOcc 0
9 mol 19 unq 0 iso 0 dist 7.20519 9.80108 5.5841 12.3486 6.92532 11.2198 7.07775 6.864 8.58657 9.47529 numMergedOcc 0
10 mol 19 unq 1 iso 0 dist 6.864 8.58657 5.5841 9.47529 6.92532 11.2198 7.07775 7.20519 9.80108 12.3486 numMergedOcc 0
11 mol 26 unq 0 iso 0 dist 8.34347 9.16962 11.887 13.2876 8.44506 19.4863 13.2136 18.9645 8.82012 26.0707 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 6.19965 9.47876 11.6116 7.91778 7.33422 16.0288 6.9948 7.66905 7.22293 10.121 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 7.66905 7.22293 11.6116 10.121 7.33422 16.0288 6.9948 6.19965 9.47876 7.91778 numMergedOcc 0
14 mol 100 unq 0 iso 0 dist 7.47343 7.75343 15.209 14.9392 9.00544 22.2111 5.88134 12.0662 6.58204 18.942 numMergedOcc 0
15 mol 100 unq 1 iso 0 dist 7.47343 7.75343 15.209 12.6602 7.12017 19.9317 5.88134 12.0662 6.58204 14.8903 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 6.11741 9.66954 4.61908 6.08806 5.74857 9.62857 7.69052 7.88312 8.66155 7.21418 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 7.88312 8.66155 4.61908 7.21418 5.74857 9.62857 7.69052 6.11741 9.66954 6.08806 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 4.91132 8.56342 5.85818 11.6667 16.7981 7.39889 9.3046 numMergedOcc 0
19 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 4.91132 8.56342 5.85818 12.4603 12.6489 7.44174 7.61939 numMergedOcc 0
20 mol 119 unq 2 iso 0 dist 8.73993 9.63176 10.6679 6.08167 6.37542 13.4689 11.6667 16.7981 7.39889 17.3493 numMergedOcc 0
21 mol 119 unq 3 iso 0 dist 8.73993 9.63176 10.6679 6.08167 6.37542 13.4689 12.4603 12.6489 7.44174 14.8299 numMergedOcc 0
22 mol 119 unq 4 iso 0 dist 9.87172 6.19042 6.35763 7.61939 7.99857 9.87025 9.22558 10.1813 8.43904 10.326 numMergedOcc 0
23 mol 119 unq 5 iso 0 dist 9.87172 7.44174 7.36192 7.61939 7.99857 5.85818 11.3169 14.5183 7.39889 9.3046 numMergedOcc 0
24 mol 119 unq 6 iso 0 dist 9.87172 7.44174 7.36192 7.61939 7.99857 5.85818 12.4603 10.3704 9.63176 4.91132 numMergedOcc 0
25 mol 130 unq 0 iso 0 dist 8.70949 6.89257 8.84655 5.97111 8.33077 6.42785 6.83397 13.7544 6.79146 7.55374 numMergedOcc 0
26 mol 130 unq 1 iso 0 dist 8.70949 6.89257 8.84655 5.97111 8.33077 6.42785 7.50049 13.572 7.66168 11.576 numMergedOcc 0
27 mol 130 unq 2 iso 0 dist 8.70949 8.74308 6.76754 5.97111 8.33077 10.3718 7.50049 13.572 9.12581 11.576 numMergedOcc 0
28 mol 214 unq 0 iso 0 dist 8.85478 7.46831 6.67959 5.63388 6.38157 5.10114 10.3105 11.9355 8.60247 6.214 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 10.5813 8.03442 7.1372 5.22356 8.65997 6.95902 7.22396 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 8.65997 6.95902 6.43754 7.22396 8.03442 7.1372 5.22356 7.22101 8.17891 10.5813 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 6.22714 7.49471 5.17471 10.216 5.64181 6.44735 5.34096 7.31233 7.19008 7.83352 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 7.31233 6.55759 10.4664 7.83352 5.64181 8.6597 5.42006 10.0756 5.38637 11.1167 numMergedOcc 0
33 mol 238 unq 2 iso 0 dist 7.31233 7.02475 11.2717 7.83352 5.64181 7.47235 12.9854 12.4767 8.96531 7.69482 numMergedOcc 0
34 mol 238 unq 3 iso 0 dist 7.31233 7.19008 5.17471 7.83352 5.64181 6.44735 5.34096 6.22714 7.49471 10.216 numMergedOcc 0
35 mol 259 unq 0 iso 0 dist 7.46176 7.48005 5.79468 5.60748 8.55558 6.39918 12.5353 11.858 8.37865 7.31951 numMergedOcc 0
36 mol 259 unq 1 iso 0 dist 5.30224 8.37865 5.31048 7.31951 8.59697 6.39918 12.5353 12.0576 7.48005 5.60748 numMergedOcc 0
37 mol 272 unq 0 iso 0 dist 9.97651 9.09992 10.841 4.86504 9.64269 11.7075 5.40809 13.2494 6.73206 8.7909 numMergedOcc 0
38 mol 272 unq 1 iso 0 dist 8.33638 6.73206 5.63139 8.7909 8.46061 11.7075 5.40809 8.46116 9.09992 4.86504 numMergedOcc 0
39 mol 272 unq 2 iso 0 dist 8.46116 9.09992 5.63139 4.86504 8.46061 11.7075 5.40809 8.33638 6.73206 8.7909 numMergedOcc 0
