0 mol 29 unq 0 iso 0 dist 9.99467 4.31895 7.28761 11.9608 13.735 8.94936 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 6.42569 8.23825 6.64845 10.837 7.71372 5.9844 numMergedOcc 0
2 mol 33 unq 1 iso 0 dist 9.13872 11.1264 6.64845 14.5217 7.71372 5.9844 numMergedOcc 0
3 mol 33 unq 2 iso 0 dist 7.27307 8.7633 6.64845 13.0656 7.71372 5.9844 numMergedOcc 0
4 mol 33 unq 3 iso 0 dist 5.73206 8.68099 6.64845 12.2459 7.71372 5.9844 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.76585 6.90686 7.32236 15.6909 13.1056 9.07906 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 9.76585 6.90686 7.32236 10.6666 13.0177 8.75567 numMergedOcc 0
7 mol 54 unq 0 iso 0 dist 9.51017 9.87442 6.32539 15.0333 11.3368 7.11686 numMergedOcc 0
8 mol 54 unq 1 iso 0 dist 9.51017 9.87442 6.32539 14.3672 10.4389 9.43467 numMergedOcc 0
9 mol 54 unq 2 iso 0 dist 9.51017 9.87442 6.32539 11.0361 4.12189 8.41018 numMergedOcc 0
10 mol 54 unq 3 iso 0 dist 8.47212 5.89001 6.32539 12.6373 11.3368 7.11686 numMergedOcc 0
11 mol 54 unq 4 iso 0 dist 8.47212 5.89001 6.32539 14.6354 10.4389 9.43467 numMergedOcc 0
12 mol 54 unq 5 iso 0 dist 8.47212 5.89001 6.32539 11.7969 4.12189 8.41018 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 9.27044 6.73631 9.8821 11.0416 13.5661 5.62694 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 8.98208 6.73631 8.80003 11.0416 11.1406 5.62694 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 8.17814 9.46843 8.76341 15.1647 10.449 7.13306 numMergedOcc 0
16 mol 130 unq 1 iso 0 dist 9.14434 17.1586 8.76341 19.5186 10.449 7.13306 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 9.66811 13.2207 9.17101 19.9215 13.793 8.86966 numMergedOcc 0
18 mol 152 unq 1 iso 0 dist 9.66811 13.2207 9.17101 18.044 11.2124 5.7527 numMergedOcc 0
19 mol 159 unq 0 iso 0 dist 8.20121 7.38933 7.85744 4.91784 5.10423 6.32159 numMergedOcc 0
20 mol 167 unq 0 iso 0 dist 9.63473 15.7623 9.50912 18.8932 10.5479 6.85239 numMergedOcc 0
21 mol 167 unq 1 iso 0 dist 9.63473 15.7623 9.50912 14.2113 6.45463 5.72735 numMergedOcc 0
22 mol 167 unq 2 iso 0 dist 8.39087 11.3036 9.50912 16.2357 10.5479 6.85239 numMergedOcc 0
23 mol 167 unq 3 iso 0 dist 8.39087 11.3036 9.50912 12.2455 6.45463 5.72735 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 6.36789 10.9895 8.11956 10.799 5.25279 9.37545 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 6.36789 10.9895 8.11956 13.8056 9.29114 6.02579 numMergedOcc 0
26 mol 192 unq 0 iso 0 dist 9.78743 15.5077 5.90008 16.9086 9.17442 8.63044 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 8.27336 4.23271 4.70178 12.3201 5.2574 8.13183 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 8.27336 4.23271 4.70178 10.5495 7.48984 6.78929 numMergedOcc 0
29 mol 279 unq 0 iso 0 dist 9.16172 12.0174 8.82519 13.8323 8.00087 7.83245 numMergedOcc 0
30 mol 283 unq 0 iso 0 dist 5.90728 3.27256 4.1631 10.1589 8.37369 8.25636 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 6.19545 13.3799 9.82863 16.7272 12.5774 9.29241 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 6.19545 13.3799 9.82863 16.7272 12.5774 9.29241 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 6.19545 13.3799 9.82863 16.7272 12.5774 9.29241 numMergedOcc 0
