0 mol 26 unq 0 iso 0 dist 9.15677 16.4682 8.34347 15.11 11.887 9.16962 14.7775 17.0926 17.7956 9.25649 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.15677 16.4682 8.34347 15.11 11.887 9.16962 13.1069 13.664 15.23 9.36104 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.61029 14.3476 8.34347 19.97 11.887 9.16962 25.5177 17.0926 17.7956 9.25649 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 9.61029 14.3476 8.34347 19.97 11.887 9.16962 19.2257 13.664 15.23 9.36104 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 7.15486 6.58144 6.64012 10.1107 5.24906 6.46761 15.1431 12.7784 11.3547 7.93481 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 7.15486 4.98107 9.4099 10.1107 5.24906 9.73139 15.1431 12.7784 11.9834 7.93481 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 8.52969 4.98107 9.55426 10.1107 13.1021 9.73139 15.1431 16.5181 11.9834 7.93481 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 5.89394 6.80709 7.4729 10.2494 6.99832 5.81965 10.423 12.3604 5.7134 9.28578 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 5.89394 6.20561 6.82344 10.2494 6.99832 9.70512 10.423 12.3604 10.7874 9.28578 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.59784 9.70986 8.73993 17.222 10.6679 9.63176 22.0533 17.7572 12.7179 9.05798 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 8.59784 9.70986 8.73993 17.222 10.6679 9.63176 12.9632 8.56342 4.91132 5.85818 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 6.96824 8.76337 7.63312 10.5414 9.60512 7.98142 8.90868 11.6558 9.92777 5.49808 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 6.96824 8.76337 7.63312 13.0459 13.3389 7.37327 8.90868 11.6558 9.92777 7.96291 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 9.25528 11.4901 5.98885 11.1264 5.4601 7.20046 6.09526 6.51749 5.93488 7.345 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 9.25528 11.4901 5.98885 15.1056 10.0524 7.13543 6.09526 6.51749 5.93488 9.52987 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 9.05666 5.64431 5.59424 8.15486 5.71262 8.36822 6.93447 7.24199 7.0057 8.53433 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 6.83122 6.75833 8.85478 6.74861 6.67959 7.46831 8.62938 6.38157 5.63388 5.10114 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.82174 10.4397 6.57393 6.54661 6.20606 5.38637 6.12311 13.7544 11.1167 8.6597 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.2521 12.8083 6.22714 12.0613 5.17471 7.49471 16.4985 11.9624 13.0113 6.89694 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 9.2521 12.8083 6.22714 12.0613 5.17471 7.49471 6.12311 5.64181 10.216 6.44735 numMergedOcc 0
20 mol 238 unq 3 iso 0 dist 9.2521 10.1821 7.31233 6.54661 10.4664 6.55759 6.12311 5.64181 7.83352 8.6597 numMergedOcc 0
21 mol 238 unq 4 iso 0 dist 9.2521 10.1821 7.31233 8.97261 11.2717 7.02475 6.12311 5.64181 7.83352 7.47235 numMergedOcc 0
22 mol 238 unq 5 iso 0 dist 9.2521 10.1821 7.31233 13.7887 12.6986 7.67322 16.4985 11.9624 11.0349 7.61203 numMergedOcc 0
23 mol 238 unq 6 iso 0 dist 9.2521 10.1821 7.31233 12.0613 5.17471 7.19008 16.4985 11.9624 11.0349 6.89694 numMergedOcc 0
24 mol 238 unq 7 iso 0 dist 9.2521 10.1821 7.31233 12.0613 5.17471 7.19008 6.12311 5.64181 7.83352 6.44735 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 8.49673 6.10412 7.00034 9.81195 6.26168 7.39747 10.9957 10.2163 5.66732 7.18771 numMergedOcc 0
26 mol 239 unq 1 iso 0 dist 8.49673 6.10412 7.00034 12.1393 5.39146 8.1777 10.9957 10.2163 5.66732 7.94894 numMergedOcc 0
27 mol 248 unq 0 iso 0 dist 8.34646 6.21372 8.2965 11.6569 9.29921 6.07192 10.7978 13.0539 5.99459 8.53148 numMergedOcc 0
28 mol 252 unq 0 iso 0 dist 9.78185 17.5012 8.33025 18.825 9.37715 7.66365 19.4946 10.7615 9.32326 6.57207 numMergedOcc 0
29 mol 252 unq 1 iso 0 dist 9.78185 17.5012 8.33025 18.825 9.37715 7.66365 21.8106 12.0482 5.89666 5.2361 numMergedOcc 0
30 mol 259 unq 0 iso 0 dist 6.49599 13.8605 7.88519 15.0738 11.6195 7.48005 15.3317 10.5803 5.60748 6.39918 numMergedOcc 0
31 mol 259 unq 1 iso 0 dist 9.34738 13.8605 7.84554 15.0738 11.8736 7.48005 15.3317 12.4037 5.60748 6.39918 numMergedOcc 0
32 mol 259 unq 2 iso 0 dist 9.47382 13.8605 7.46176 15.0738 5.79468 7.48005 15.3317 8.55558 5.60748 6.39918 numMergedOcc 0
