0 mol 16 unq 0 iso 0 dist 8.62634 6.68517 6.05535 5.1333 5.36911 6.72833 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.3613 8.36524 12.6572 10.5928 8.58962 15.5521 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 6.68599 5.36895 8.61524 13.8714 9.18836 15.233 numMergedOcc 0
3 mol 41 unq 1 iso 0 dist 6.68599 5.36895 8.61524 7.50942 6.07294 12.0418 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 6.09042 8.27156 10.894 8.86056 9.79863 16.9406 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 9.5663 9.56181 5.59762 5.40109 9.23947 9.97159 numMergedOcc 0
6 mol 83 unq 0 iso 0 dist 9.48319 9.86416 15.2271 10.3314 7.65069 16.182 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.98532 8.3558 5.1767 10.2731 6.15654 6.95572 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 8.98532 8.3558 5.1767 4.66752 7.89887 7.38677 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 7.90927 8.84131 9.9427 12.5434 8.62829 17.7307 numMergedOcc 0
10 mol 102 unq 1 iso 0 dist 6.7095 8.84131 7.49575 11.7136 9.2062 9.24642 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 5.46484 8.95071 6.49831 5.69026 8.88405 12.0062 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 5.46484 8.95071 6.49831 8.22446 7.13854 9.89 numMergedOcc 0
13 mol 236 unq 2 iso 0 dist 8.80671 7.49412 6.81625 11.4601 8.88405 12.2375 numMergedOcc 0
14 mol 236 unq 3 iso 0 dist 8.80671 7.49412 6.81625 6.4298 7.13854 7.1686 numMergedOcc 0
15 mol 252 unq 0 iso 0 dist 5.41885 7.91348 5.96471 5.53416 7.60896 12.4684 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 9.66298 9.80409 13.6041 11.7392 6.45102 13.1245 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 6.20998 6.95233 5.98169 7.30886 6.77259 10.7037 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 6.20998 9.61741 13.6708 7.30886 6.77259 10.0654 numMergedOcc 0
19 mol 266 unq 2 iso 0 dist 6.20998 5.61056 10.2407 7.30886 6.77259 10.6338 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 7.29081 9.79022 11.0966 6.85615 9.57659 16.3903 numMergedOcc 0
21 mol 273 unq 1 iso 0 dist 7.29081 9.79022 11.0966 9.64596 7.8424 17.7926 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 8.64546 6.94723 6.0971 10.8277 7.42529 9.57924 numMergedOcc 0
23 mol 280 unq 1 iso 0 dist 3.97964 6.52188 6.0971 5.51019 7.42529 9.57924 numMergedOcc 0
24 mol 280 unq 2 iso 0 dist 4.55639 6.94723 6.96139 5.92566 8.47055 12.8136 numMergedOcc 0
25 mol 280 unq 3 iso 0 dist 7.72152 6.52188 6.96139 10.0297 8.47055 12.8136 numMergedOcc 0
26 mol 285 unq 0 iso 0 dist 4.49395 6.44657 9.237 9.67478 6.46935 11.7541 numMergedOcc 0
