0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 10.2446 7.88043 7.45262 6.88805 5.99459 8.81608 8.0744 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 6.36911 6.06176 12.3097 8.80762 6.96586 6.88805 5.99459 8.81608 11.7002 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 9.36807 10.515 5.44992 5.72491 7.45262 13.156 9.67164 8.81608 8.0744 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.10621 9.36807 10.515 4.74523 9.67579 6.96586 13.156 9.67164 8.81608 11.7002 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 8.57077 6.33889 11.4878 11.0722 8.83269 9.82483 5.84314 5.8245 9.81658 8.17486 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.34347 9.16962 11.887 17.7956 17.0926 9.25649 8.25132 13.6027 5.84066 14.3725 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.34347 9.16962 11.887 15.23 13.664 9.36104 8.25132 13.6027 5.84066 11.3426 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 12.7179 17.7572 9.05798 6.9194 12.31 6.55202 9.75037 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 12.7179 17.7572 9.05798 9.68677 7.64052 9.08536 13.2984 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 8.73993 9.63176 10.6679 4.91132 8.56342 5.85818 6.9194 12.31 6.55202 6.71103 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 8.73993 9.63176 10.6679 4.91132 8.56342 5.85818 9.68677 7.64052 9.08536 6.29394 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 9.87172 6.19042 6.35763 7.61939 7.99857 9.87025 6.20019 6.99446 6.13374 6.29394 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 9.87172 7.44174 7.36192 9.15779 15.5802 9.05798 12.4621 11.2897 6.55202 9.75037 numMergedOcc 0
13 mol 119 unq 6 iso 0 dist 9.87172 7.44174 7.36192 9.15779 15.5802 9.05798 6.20019 6.99446 9.08536 13.2984 numMergedOcc 0
14 mol 119 unq 7 iso 0 dist 9.87172 7.44174 7.36192 7.61939 7.99857 5.85818 12.4621 11.2897 6.55202 6.71103 numMergedOcc 0
15 mol 119 unq 8 iso 0 dist 9.87172 7.44174 7.36192 7.61939 7.99857 5.85818 6.20019 6.99446 9.08536 6.29394 numMergedOcc 0
16 mol 119 unq 9 iso 0 dist 6.18601 8.43904 10.3457 10.326 14.6439 9.87025 4.39676 8.95212 6.13374 6.29394 numMergedOcc 0
17 mol 130 unq 0 iso 0 dist 8.70949 6.89257 8.84655 5.97111 8.33077 6.42785 7.52422 13.7122 8.9677 5.77497 numMergedOcc 0
18 mol 130 unq 1 iso 0 dist 8.70949 6.89257 8.84655 6.97875 10.3572 6.82089 7.52422 13.7122 8.9677 12.7192 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 7.11802 7.92688 4.68409 8.6769 12.2715 9.4062 14.8533 13.5288 9.10003 11.7892 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 8.00618 7.92688 12.2037 8.6769 15.7259 9.4062 14.8533 20.9604 9.10003 11.7892 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 9.0018 9.31887 11.0415 13.9336 12.6297 7.01126 5.00913 13.6764 9.76114 15.0659 numMergedOcc 0
22 mol 175 unq 1 iso 0 dist 9.0018 9.31887 11.0415 11.873 15.2721 6.58434 5.00913 13.6764 9.76114 10.6405 numMergedOcc 0
23 mol 175 unq 2 iso 0 dist 7.652 9.31887 5.0384 13.9336 10.1905 7.01126 5.00913 10.1305 9.76114 15.0659 numMergedOcc 0
24 mol 175 unq 3 iso 0 dist 7.652 9.31887 5.0384 11.873 11.1503 6.58434 5.00913 10.1305 9.76114 10.6405 numMergedOcc 0
25 mol 197 unq 0 iso 0 dist 8.56633 8.99696 9.82139 15.4462 19.1226 9.71865 17.0276 12.8171 9.27218 15.0713 numMergedOcc 0
26 mol 214 unq 0 iso 0 dist 8.85478 7.46831 6.67959 5.63388 6.38157 5.10114 11.1534 7.46481 8.70987 5.73082 numMergedOcc 0
27 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 10.5813 8.03442 7.1372 4.1511 9.91384 7.79951 11.2819 numMergedOcc 0
28 mol 227 unq 1 iso 0 dist 8.65997 6.95902 6.43754 7.22396 8.03442 7.1372 4.69247 9.91384 7.79951 11.2819 numMergedOcc 0
29 mol 227 unq 2 iso 0 dist 7.09863 8.17891 9.13836 10.5813 12.2278 7.1372 4.1511 10.3016 7.79951 11.2819 numMergedOcc 0
30 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 15.0089 17.7022 9.31673 13.7306 13.8176 7.02029 9.78535 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 6.57393 5.38637 6.20606 11.1167 13.7544 8.6597 13.378 14.7404 9.38131 4.14399 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 6.22714 7.49471 5.17471 13.0113 11.9624 6.89694 12.7938 9.08509 5.43613 5.63944 numMergedOcc 0
33 mol 238 unq 2 iso 0 dist 6.22714 7.49471 5.17471 13.0113 11.9624 6.89694 6.82305 10.1172 7.24334 8.5378 numMergedOcc 0
34 mol 238 unq 3 iso 0 dist 6.22714 7.49471 5.17471 10.216 5.64181 6.44735 12.7938 9.08509 5.43613 6.94907 numMergedOcc 0
35 mol 238 unq 4 iso 0 dist 6.22714 7.49471 5.17471 10.216 5.64181 6.44735 6.82305 10.1172 7.24334 11.4389 numMergedOcc 0
36 mol 238 unq 5 iso 0 dist 7.31233 6.55759 10.4664 7.83352 5.64181 8.6597 10.4966 9.7696 9.38131 4.14399 numMergedOcc 0
37 mol 238 unq 6 iso 0 dist 7.31233 7.02475 11.2717 7.83352 5.64181 7.47235 10.4966 9.7696 6.85253 4.14399 numMergedOcc 0
38 mol 238 unq 7 iso 0 dist 7.31233 7.67322 12.6986 11.0349 11.9624 7.61203 5.71717 10.1172 7.39547 8.5378 numMergedOcc 0
39 mol 238 unq 8 iso 0 dist 7.31233 7.19008 5.17471 11.0349 11.9624 6.89694 11.0772 9.08509 5.43613 5.63944 numMergedOcc 0
40 mol 238 unq 9 iso 0 dist 7.31233 7.19008 5.17471 11.0349 11.9624 6.89694 5.71717 10.1172 7.24334 8.5378 numMergedOcc 0
41 mol 238 unq 10 iso 0 dist 7.31233 7.19008 5.17471 7.83352 5.64181 6.44735 11.0772 9.08509 5.43613 6.94907 numMergedOcc 0
42 mol 238 unq 11 iso 0 dist 7.31233 7.19008 5.17471 7.83352 5.64181 6.44735 5.71717 10.1172 7.24334 11.4389 numMergedOcc 0
43 mol 248 unq 0 iso 0 dist 7.69895 6.07192 6.48757 5.99459 6.17052 8.53148 4.58289 9.05018 5.0345 7.14182 numMergedOcc 0
44 mol 248 unq 1 iso 0 dist 7.21521 6.07192 5.51827 5.99459 9.77666 8.53148 4.58289 9.33962 5.0345 7.14182 numMergedOcc 0
45 mol 248 unq 2 iso 0 dist 8.2965 6.07192 9.29921 5.99459 13.0539 8.53148 4.58289 11.4547 5.0345 7.14182 numMergedOcc 0
46 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 5.60748 10.5803 6.39918 10.282 14.2242 8.84648 4.67584 numMergedOcc 0
47 mol 259 unq 1 iso 0 dist 7.88519 7.48005 11.6195 5.60748 10.5803 6.39918 10.067 10.3406 6.23661 7.32929 numMergedOcc 0
48 mol 259 unq 2 iso 0 dist 7.84554 7.48005 11.8736 5.60748 12.4037 6.39918 10.282 16.7322 8.84648 4.67584 numMergedOcc 0
49 mol 259 unq 3 iso 0 dist 7.84554 7.48005 11.8736 5.60748 12.4037 6.39918 10.067 12.8546 6.23661 7.32929 numMergedOcc 0
50 mol 259 unq 4 iso 0 dist 7.46176 7.48005 5.79468 5.60748 8.55558 6.39918 10.282 11.7465 8.84648 4.67584 numMergedOcc 0
51 mol 259 unq 5 iso 0 dist 7.46176 7.48005 5.79468 5.60748 8.55558 6.39918 10.067 5.85442 6.23661 7.32929 numMergedOcc 0
52 mol 259 unq 6 iso 0 dist 5.30224 8.37865 5.31048 7.31951 8.59697 6.39918 4.04513 8.03219 8.84648 4.67584 numMergedOcc 0
53 mol 259 unq 7 iso 0 dist 5.30224 8.37865 5.31048 7.31951 8.59697 6.39918 7.09907 6.9899 6.23661 7.32929 numMergedOcc 0
54 mol 259 unq 8 iso 0 dist 9.18903 7.48005 12.6649 5.60748 14.4498 6.39918 10.282 19.0182 8.84648 4.67584 numMergedOcc 0
55 mol 259 unq 9 iso 0 dist 9.18903 7.48005 12.6649 5.60748 14.4498 6.39918 10.067 16.0301 6.23661 7.32929 numMergedOcc 0
