0 mol 14 unq 0 iso 0 dist 8.51112 12.3645 9.04767 5.58434 9.58855 10.6873 12.5485 5.67201 9.7022 14.3883 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 8.51112 12.3645 9.04767 5.58434 9.58855 10.6873 7.28563 4.53725 9.58196 10.3349 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.80849 13.9888 8.86116 9.90348 6.72502 6.58998 16.8105 10.0952 6.86014 10.7114 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.99509 8.14351 5.73819 13.4933 8.44903 5.48048 8.47617 5.06502 6.20293 10.0649 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.99509 8.14351 5.73819 13.4933 8.44903 5.48048 5.73331 5.89973 8.93915 13.5072 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 6.47346 6.90896 5.83384 5.75556 8.03372 6.67948 14.4108 9.05135 9.61051 15.3413 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 9.37459 8.41711 5.87555 13.8158 8.35555 5.59336 9.0847 5.42328 6.70283 10.4911 numMergedOcc 0
7 mol 152 unq 1 iso 0 dist 9.37459 8.41711 5.87555 13.8158 8.35555 5.59336 6.00061 5.54906 8.67331 13.0858 numMergedOcc 0
8 mol 152 unq 2 iso 0 dist 9.37459 4.82496 8.87437 13.8158 8.35555 10.9728 9.0847 5.42328 7.16148 10.4911 numMergedOcc 0
9 mol 152 unq 3 iso 0 dist 9.37459 4.82496 8.87437 13.8158 8.35555 10.9728 6.00061 5.54906 8.05741 13.0858 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 7.15963 14.1493 9.1374 4.41466 6.51749 13.8722 17.347 13.2049 8.03334 15.2991 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 7.15963 6.73556 5.98885 4.41466 6.51749 5.93488 11.5431 10.1912 9.09537 7.20392 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 6.04106 12.9245 7.26832 10.0849 5.60393 5.28092 13.1824 7.38516 6.03031 8.44861 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 6.04106 12.9245 7.26832 10.0849 5.60393 5.28092 19.8591 13.8543 7.80463 11.3521 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 7.51923 5.1071 9.774 7.21122 8.70977 9.9412 7.94694 5.63422 7.7366 12.3357 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 6.15754 12.4455 6.56247 14.1265 8.24186 5.63086 8.9413 5.88703 9.45496 7.5366 numMergedOcc 0
16 mol 234 unq 1 iso 0 dist 6.15754 14.0876 9.36357 14.1265 8.24186 5.6819 8.9413 5.88703 6.7625 7.5366 numMergedOcc 0
17 mol 234 unq 2 iso 0 dist 6.6281 10.0624 6.56247 14.0259 8.24186 5.63086 11.5469 5.88703 9.45496 7.5366 numMergedOcc 0
18 mol 234 unq 3 iso 0 dist 6.6281 13.9869 9.36357 14.0259 8.24186 5.6819 11.5469 5.88703 6.7625 7.5366 numMergedOcc 0
19 mol 234 unq 4 iso 0 dist 8.9413 12.4455 9.45496 14.1265 7.5366 5.63086 6.15754 5.88703 6.56247 8.24186 numMergedOcc 0
20 mol 234 unq 5 iso 0 dist 8.9413 14.0876 6.7625 14.1265 7.5366 5.6819 6.15754 5.88703 9.36357 8.24186 numMergedOcc 0
21 mol 234 unq 6 iso 0 dist 4.91961 11.5103 9.45496 8.3084 7.5366 5.63086 10.2233 5.88703 6.56247 8.24186 numMergedOcc 0
22 mol 234 unq 7 iso 0 dist 4.91961 4.98993 6.7625 8.3084 7.5366 5.6819 10.2233 5.88703 9.36357 8.24186 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 5.99137 13.7629 9.81562 10.968 8.50331 7.22918 11.0371 7.28249 8.03456 11.9847 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 5.99137 13.3575 7.68742 10.968 8.50331 9.05842 11.0371 7.28249 6.84306 11.9847 numMergedOcc 0
25 mol 236 unq 2 iso 0 dist 5.99137 5.03598 6.27581 10.968 8.50331 7.00028 11.0371 7.28249 9.99038 11.9847 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 5.31858 6.60345 6.42289 11.0804 7.99477 7.42673 11.1218 7.26417 6.60405 6.70815 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 5.31858 6.60345 6.42289 6.65689 7.86627 6.44209 11.1218 7.26417 6.60405 11.184 numMergedOcc 0
