0 mol 7 unq 0 iso 0 dist 9.20552 15.1647 8.41585 15.6999 7.15287 6.22892 14.3372 6.8464 5.0893 7.38748 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.64855 15.5387 9.58196 16.2784 7.95811 6.30573 20.9861 14.8819 5.55214 9.42387 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 8.64855 15.5387 9.58196 16.2784 7.95811 6.30573 15.2658 9.95397 4.75873 7.59564 numMergedOcc 0
3 mol 14 unq 2 iso 0 dist 8.64855 15.5387 9.58196 16.2784 7.95811 6.30573 9.79416 5.36937 6.03847 8.10957 numMergedOcc 0
4 mol 14 unq 3 iso 0 dist 7.94714 11.2303 9.04767 12.1294 6.24146 6.30573 15.5284 13.9071 5.55214 9.42387 numMergedOcc 0
5 mol 14 unq 4 iso 0 dist 7.94714 11.2303 9.04767 12.1294 6.24146 6.30573 7.06234 7.73217 4.75873 7.59564 numMergedOcc 0
6 mol 14 unq 5 iso 0 dist 7.94714 11.2303 9.04767 12.1294 6.24146 6.30573 7.83211 5.99703 6.03847 8.10957 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 7.40392 8.59466 7.36323 10.2518 5.75653 5.87895 13.5454 13.3202 6.7228 9.22152 numMergedOcc 0
8 mol 64 unq 0 iso 0 dist 9.56181 7.70414 9.67592 8.71324 9.73304 9.10915 10.7791 16.8033 14.8927 8.86433 numMergedOcc 0
9 mol 64 unq 1 iso 0 dist 9.56181 7.70414 9.67592 9.5663 5.59762 5.54343 12.0987 9.21546 5.9853 5.66803 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 8.64107 4.82909 4.99221 9.18707 5.74878 6.09472 10.4327 9.70616 6.80053 8.80824 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 8.64107 4.82909 4.99221 9.18707 5.74878 6.09472 5.31483 9.28214 4.45342 9.67606 numMergedOcc 0
12 mol 115 unq 2 iso 0 dist 8.64107 4.82909 4.99221 5.91786 7.09627 6.20658 5.31483 9.28214 4.45342 9.41083 numMergedOcc 0
13 mol 115 unq 3 iso 0 dist 9.50575 6.68557 5.11551 5.91786 7.10772 7.83568 5.31483 14.3348 11.8582 9.41083 numMergedOcc 0
14 mol 115 unq 4 iso 0 dist 8.43116 4.96719 5.11551 12.4366 7.10772 7.83568 15.8831 14.3348 11.8582 9.41083 numMergedOcc 0
15 mol 115 unq 5 iso 0 dist 6.23645 4.96719 7.11972 12.4366 11.3906 7.83568 15.8831 18.1828 11.8582 9.41083 numMergedOcc 0
16 mol 143 unq 0 iso 0 dist 7.73769 7.36837 5.99315 10.4073 5.11989 7.5984 10.9088 9.35213 9.02772 5.40826 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 7.94344 7.31014 8.82096 15.8652 14.5108 9.4835 19.1675 19.5839 13.1789 5.86911 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 7.94344 7.31014 8.82096 15.8652 14.5108 9.4835 15.1637 17.6894 10.1543 7.89258 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 5.77925 10.5925 8.35971 10.5189 5.27568 6.73134 14.2335 9.13551 7.41812 4.71683 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 8.95071 18.4732 9.99038 14.2393 10.2557 9.97357 5.81446 5.90804 13.6195 8.63249 numMergedOcc 0
21 mol 236 unq 2 iso 0 dist 8.95071 12.8358 6.27581 14.2393 10.2557 6.36941 5.81446 5.90804 7.45579 8.63249 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 8.82778 11.4665 6.16342 10.7456 12.1502 9.27989 13.7531 17.0305 13.3838 8.48545 numMergedOcc 0
23 mol 241 unq 0 iso 0 dist 8.23536 5.50714 7.4631 11.0484 7.93809 6.40592 12.6981 12.8359 7.3737 7.26758 numMergedOcc 0
24 mol 241 unq 1 iso 0 dist 6.90245 5.3674 7.4631 7.16232 7.93809 6.40592 7.52886 12.8359 7.3737 7.26758 numMergedOcc 0
25 mol 261 unq 0 iso 0 dist 9.80409 6.39263 8.45658 6.93654 13.3163 8.50313 4.95392 13.5435 6.88989 7.58385 numMergedOcc 0
26 mol 261 unq 1 iso 0 dist 9.80409 6.39263 8.45658 6.93654 13.3163 8.50313 6.94755 12.1908 4.25662 6.0437 numMergedOcc 0
27 mol 261 unq 2 iso 0 dist 9.80409 6.39263 8.45658 9.66298 13.6041 7.6414 6.94755 12.1908 4.25662 4.85199 numMergedOcc 0
28 mol 261 unq 3 iso 0 dist 9.80409 6.39263 8.45658 9.66298 13.6041 7.6414 17.3605 20.1172 12.864 9.72159 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 7.23956 15.6875 9.7748 12.3059 5.77904 8.35794 10.2688 4.81916 7.94155 8.15119 numMergedOcc 0
