0 mol 11 unq 0 iso 0 dist 5.59847 7.4835 6.50001 6.49709 4.10106 5.95165 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.48944 10.7171 6.36381 10.6551 5.50396 9.54519 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 9.23015 4.93826 5.77745 8.94828 5.63212 8.40051 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 9.23015 4.93826 5.77745 13.2682 6.47509 8.6396 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 8.3224 6.21952 5.14358 3.68549 6.54878 6.88974 numMergedOcc 0
5 mol 30 unq 1 iso 0 dist 7.54379 5.06613 7.51725 3.68549 4.20285 5.5814 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.91019 11.8317 9.762 11.5741 5.9144 8.67532 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 5.96246 4.84407 9.70292 8.49531 7.26851 8.69069 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 5.96246 4.84407 9.70292 11.3191 14.2178 9.65047 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 6.37954 10.4899 8.3505 9.32725 3.9764 5.9747 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 6.62354 9.97562 9.94704 9.26438 5.00433 8.3164 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 8.00085 13.5611 9.94704 6.43255 5.00433 8.3164 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.14652 13.5949 8.78303 9.14415 4.46337 9.60369 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 6.14652 13.5949 8.78303 9.79337 7.41373 9.55556 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 9.36144 8.60571 8.79378 5.82039 7.89575 9.78438 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 5.9625 5.05085 9.94117 8.95071 10.5937 6.11137 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 5.9625 5.05085 9.94117 11.2107 14.162 7.89744 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 9.61255 10.0125 7.15079 17.9263 11.4471 9.71801 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 7.64703 6.59723 4.97796 11.6773 8.87855 6.55855 numMergedOcc 0
19 mol 274 unq 2 iso 0 dist 7.64703 6.59723 4.97796 11.5347 13.0867 9.52894 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 7.46806 12.7948 9.7061 10.3954 5.50627 5.75596 numMergedOcc 0
21 mol 292 unq 1 iso 0 dist 7.46806 12.7948 9.7061 17.8017 11.5965 9.11438 numMergedOcc 0
22 mol 292 unq 2 iso 0 dist 7.46806 12.7948 9.7061 19.3432 14.7162 8.37867 numMergedOcc 0
23 mol 292 unq 3 iso 0 dist 7.48212 4.56764 5.72473 12.2559 6.80049 9.64124 numMergedOcc 0
24 mol 292 unq 4 iso 0 dist 7.48212 4.56764 5.72473 10.0145 7.8414 9.30668 numMergedOcc 0
