0 mol 7 unq 0 iso 0 dist 9.20552 13.6107 8.8576 5.26458 5.99972 8.401 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.80052 4.86597 5.38103 6.39388 7.47858 6.23859 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.94828 7.11194 6.00307 6.84017 6.16347 6.03478 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.94828 7.11194 6.00307 15.5398 7.92503 9.60684 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.06275 14.8755 8.47617 5.33298 8.95682 12.8271 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.90024 5.00932 8.47617 13.2914 8.95682 12.8271 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 8.27156 11.3515 9.58156 5.40878 4.74544 6.71938 numMergedOcc 0
7 mol 62 unq 1 iso 0 dist 8.27156 11.2658 7.59416 5.40878 4.74544 6.76473 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 6.86713 11.5826 8.13273 5.04455 9.49454 15.7943 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 9.83528 10.7274 4.31067 15.5475 6.65501 9.0917 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 7.54969 5.76482 4.31067 13.2316 6.65501 9.0917 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 8.47907 8.96396 8.054 10.577 8.88537 5.97096 numMergedOcc 0
12 mol 122 unq 1 iso 0 dist 8.47907 8.96396 8.054 6.9595 9.23819 4.4646 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 9.94179 7.03937 6.29975 4.77149 6.66772 5.42142 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 9.36732 14.2286 7.23126 9.71153 6.86319 7.68725 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 9.36732 16.543 7.82805 9.71153 6.86319 9.74385 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 7.70631 10.0858 9.14737 14.5203 7.50013 14.372 numMergedOcc 0
17 mol 197 unq 1 iso 0 dist 7.70631 10.0858 9.14737 11.199 5.81233 14.6749 numMergedOcc 0
18 mol 197 unq 2 iso 0 dist 7.70631 10.0858 9.14737 12.0358 6.92924 5.9589 numMergedOcc 0
19 mol 197 unq 3 iso 0 dist 7.70631 10.0858 9.14737 7.10431 7.14306 9.27427 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 9.73691 9.92307 8.48081 10.1372 8.14332 12.2528 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 7.8128 7.37236 8.84872 12.5723 9.55668 9.6662 numMergedOcc 0
22 mol 240 unq 0 iso 0 dist 7.6664 10.8459 7.0935 5.1741 6.68687 12.7219 numMergedOcc 0
23 mol 243 unq 0 iso 0 dist 7.80612 14.2037 8.69557 9.85403 8.76935 6.86882 numMergedOcc 0
24 mol 243 unq 1 iso 0 dist 7.80612 14.2037 8.69557 7.14241 8.47652 10.1903 numMergedOcc 0
25 mol 243 unq 2 iso 0 dist 7.80612 4.72507 4.89168 9.85403 8.76935 5.73931 numMergedOcc 0
26 mol 243 unq 3 iso 0 dist 7.80612 4.72507 4.89168 7.14241 8.47652 4.41191 numMergedOcc 0
27 mol 284 unq 0 iso 0 dist 7.43241 15.2838 9.12551 10.1686 6.78191 9.83671 numMergedOcc 0
