0 mol 7 unq 0 iso 0 dist 8.41173 7.38748 10.1841 7.15287 13.8674 6.8464 6.22892 6.3027 5.0893 8.41585 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 15.4665 12.2258 8.75668 15.3102 10.9566 7.26966 9.67592 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 7.24183 5.41357 7.05519 9.95527 12.2258 8.75668 12.3873 10.9566 7.26966 9.67592 numMergedOcc 0
3 mol 129 unq 0 iso 0 dist 7.07421 7.6453 5.06265 4.80675 6.29026 8.00624 10.1938 11.5533 15.4586 8.54584 numMergedOcc 0
4 mol 129 unq 1 iso 0 dist 8.34427 9.52061 7.12885 5.99695 11.5151 8.59695 10.482 12.2044 6.13737 5.83384 numMergedOcc 0
5 mol 204 unq 0 iso 0 dist 7.00683 9.52029 8.61406 18.5654 15.2431 9.44947 16.9329 11.9072 10.5243 7.10633 numMergedOcc 0
6 mol 204 unq 1 iso 0 dist 7.00683 9.52029 8.61406 18.5654 15.2431 9.44947 17.8571 13.6031 10.2677 8.51516 numMergedOcc 0
7 mol 220 unq 0 iso 0 dist 7.57712 5.25149 10.1832 6.19375 7.31105 5.39218 15.0279 14.6296 13.3213 9.23153 numMergedOcc 0
8 mol 220 unq 1 iso 0 dist 7.57712 5.25149 10.1832 6.19375 7.31105 5.39218 13.2107 9.52692 11.4842 8.24498 numMergedOcc 0
9 mol 220 unq 2 iso 0 dist 7.20255 5.25149 9.96224 6.19375 10.2676 5.39218 15.0279 19.1028 13.3213 9.23153 numMergedOcc 0
10 mol 220 unq 3 iso 0 dist 7.20255 5.25149 9.96224 6.19375 10.2676 5.39218 13.2107 13.0368 11.4842 8.24498 numMergedOcc 0
11 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 6.87755 6.23882 7.49783 12.2287 15.0038 12.8561 8.95269 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 9.13126 4.71683 8.3795 5.52669 9.10613 9.44496 6.73134 6.0258 7.41812 8.04248 numMergedOcc 0
13 mol 236 unq 1 iso 0 dist 9.13126 4.71683 8.3795 7.77821 15.1991 7.87233 12.96 19.8998 15.6279 9.81562 numMergedOcc 0
14 mol 236 unq 2 iso 0 dist 9.13126 4.71683 8.3795 7.77821 15.1991 7.87233 10.8312 19.4534 13.7246 7.68742 numMergedOcc 0
15 mol 236 unq 3 iso 0 dist 9.13126 4.71683 8.3795 7.77821 15.1991 7.87233 11.2195 15.6894 10.5269 6.27581 numMergedOcc 0
16 mol 236 unq 4 iso 0 dist 7.6402 7.74348 13.5224 6.49831 13.61 5.90804 16.3801 23.3543 13.6195 9.99038 numMergedOcc 0
17 mol 236 unq 5 iso 0 dist 7.6402 7.74348 13.5224 6.49831 13.61 5.90804 12.2331 18.5325 7.45579 6.27581 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 6.08181 8.10903 10.8957 9.78068 15.2652 9.04358 14.0712 18.663 8.81588 6.60405 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 6.08181 8.10903 10.8957 9.78068 15.2652 9.04358 8.81059 13.8694 5.90131 6.42289 numMergedOcc 0
20 mol 258 unq 2 iso 0 dist 8.57305 6.33567 5.00751 6.51074 5.81927 7.69358 10.3219 9.49027 9.80642 6.97229 numMergedOcc 0
21 mol 258 unq 3 iso 0 dist 7.70189 8.10903 5.27718 9.78068 8.58088 9.04358 14.0712 10.221 8.81588 6.60405 numMergedOcc 0
22 mol 258 unq 4 iso 0 dist 7.70189 8.10903 5.27718 9.78068 8.58088 9.04358 8.81059 9.22664 5.90131 6.42289 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 6.41477 8.88741 10.1876 6.5875 10.2386 7.30472 7.15785 4.50761 6.43209 8.02547 numMergedOcc 0
24 mol 261 unq 1 iso 0 dist 6.41477 8.88741 10.1876 6.5875 10.2386 7.30472 13.1629 12.8629 11.6843 8.43057 numMergedOcc 0
25 mol 261 unq 2 iso 0 dist 6.41477 8.88741 10.1876 6.5875 10.2386 7.30472 9.43169 8.80293 7.78464 6.05727 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 6.23539 6.66936 5.95045 7.44724 6.90434 4.81916 14.2462 13.2927 7.94155 9.7748 numMergedOcc 0
