0 mol 7 unq 0 iso 0 dist 8.88982 13.9585 7.10621 14.0137 5.72491 5.44992 16.991 9.67164 13.156 8.0744 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.8576 10.4545 8.41585 13.0722 7.88043 10.2446 5.33843 5.99459 6.88805 8.0744 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.8576 10.4545 8.41585 16.4052 8.80762 12.3097 5.33843 5.99459 6.88805 11.7002 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 8.51213 11.0081 9.51761 7.30279 7.55766 12.4713 5.34733 5.65084 12.6536 4.8604 numMergedOcc 0
4 mol 18 unq 1 iso 0 dist 8.51213 11.3758 7.3094 7.30279 7.55766 6.48196 5.34733 5.65084 9.36767 4.8604 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.80849 13.9888 8.86116 9.90348 6.72502 6.58998 6.08283 8.09311 11.6226 9.94429 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 6.80849 13.9888 8.86116 9.90348 6.72502 6.58998 6.99919 9.05357 13.1949 6.88355 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 6.80849 10.1696 8.38394 9.90348 6.72502 6.59374 6.08283 8.09311 6.17155 9.94429 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 6.80849 10.1696 8.38394 9.90348 6.72502 6.59374 6.99919 9.05357 10.3122 6.88355 numMergedOcc 0
9 mol 25 unq 0 iso 0 dist 6.00307 7.95074 7.57578 6.13982 6.90155 9.36158 3.8857 4.79873 10.2864 6.86525 numMergedOcc 0
10 mol 25 unq 1 iso 0 dist 6.00307 7.95074 7.57578 6.13982 6.90155 9.36158 11.2808 9.48085 5.18617 13.7717 numMergedOcc 0
11 mol 25 unq 2 iso 0 dist 6.00307 10.3928 7.17969 6.13982 6.90155 10.1525 3.8857 4.79873 11.4148 6.86525 numMergedOcc 0
12 mol 25 unq 3 iso 0 dist 6.00307 10.3928 7.17969 6.13982 6.90155 10.1525 11.2808 9.48085 5.68041 13.7717 numMergedOcc 0
13 mol 43 unq 0 iso 0 dist 8.99509 8.14351 5.73819 13.4933 8.44903 5.48048 11.0512 6.66407 5.07458 4.69849 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 6.47346 6.90896 5.83384 5.75556 8.03372 6.67948 4.0844 5.58833 9.00231 7.06894 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 7.14849 6.96904 6.69288 6.72936 4.92088 10.1489 3.95924 9.11204 8.44333 7.79894 numMergedOcc 0
16 mol 178 unq 1 iso 0 dist 7.14849 7.57303 6.43573 6.72936 4.92088 8.27339 3.95924 9.11204 6.8202 7.79894 numMergedOcc 0
17 mol 178 unq 2 iso 0 dist 7.14849 14.0459 7.17202 6.72936 4.92088 9.79302 3.95924 9.11204 14.9499 7.79894 numMergedOcc 0
18 mol 178 unq 3 iso 0 dist 7.14849 14.3001 8.81551 6.72936 4.92088 8.65097 3.95924 9.11204 14.2467 7.79894 numMergedOcc 0
19 mol 178 unq 4 iso 0 dist 8.63718 11.5509 6.69288 9.74054 4.92088 10.1489 12.5927 9.11204 8.44333 7.79894 numMergedOcc 0
20 mol 178 unq 5 iso 0 dist 8.63718 7.31401 6.43573 9.74054 4.92088 8.27339 12.5927 9.11204 6.8202 7.79894 numMergedOcc 0
21 mol 178 unq 6 iso 0 dist 8.63718 5.91018 7.17202 9.74054 4.92088 9.79302 12.5927 9.11204 14.9499 7.79894 numMergedOcc 0
22 mol 178 unq 7 iso 0 dist 8.63718 4.92895 8.81551 9.74054 4.92088 8.65097 12.5927 9.11204 14.2467 7.79894 numMergedOcc 0
23 mol 204 unq 0 iso 0 dist 6.20646 5.21426 7.10633 8.75405 6.85441 8.17229 6.05253 7.9133 10.7169 9.54203 numMergedOcc 0
24 mol 204 unq 1 iso 0 dist 6.20646 8.35604 8.51516 8.75405 6.85441 5.74707 6.05253 7.9133 5.57347 9.54203 numMergedOcc 0
25 mol 204 unq 2 iso 0 dist 6.73266 5.57112 7.10633 7.32929 6.85441 8.17229 13.3588 7.9133 10.7169 9.54203 numMergedOcc 0
26 mol 204 unq 3 iso 0 dist 6.73266 12.1292 8.51516 7.32929 6.85441 5.74707 13.3588 7.9133 5.57347 9.54203 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 8.9413 12.4455 9.45496 14.1265 7.5366 5.63086 14.075 7.81215 12.4252 11.0592 numMergedOcc 0
28 mol 234 unq 1 iso 0 dist 8.9413 14.0876 6.7625 14.1265 7.5366 5.6819 14.075 7.81215 5.75498 11.0592 numMergedOcc 0
29 mol 234 unq 2 iso 0 dist 4.91961 11.5103 9.45496 8.3084 7.5366 5.63086 4.84686 7.81215 12.4252 11.0592 numMergedOcc 0
30 mol 234 unq 3 iso 0 dist 4.91961 4.98993 6.7625 8.3084 7.5366 5.6819 4.84686 7.81215 5.75498 11.0592 numMergedOcc 0
31 mol 236 unq 0 iso 0 dist 5.99137 13.7629 9.81562 10.968 8.50331 7.22918 13.9834 9.3206 4.27181 5.59363 numMergedOcc 0
32 mol 236 unq 1 iso 0 dist 5.99137 13.3575 7.68742 10.968 8.50331 9.05842 13.9834 9.3206 4.89609 5.59363 numMergedOcc 0
33 mol 236 unq 2 iso 0 dist 5.99137 5.03598 6.27581 10.968 8.50331 7.00028 13.9834 9.3206 10.5774 5.59363 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 5.99187 5.74685 6.22714 8.22473 5.64181 10.216 13.6867 9.08509 12.7938 6.94907 numMergedOcc 0
35 mol 238 unq 1 iso 0 dist 5.99187 5.87189 7.31233 8.22473 5.64181 7.83352 13.6867 9.08509 11.0772 6.94907 numMergedOcc 0
