0 mol 5 unq 0 iso 0 dist 9.75695 7.8351 10.3438 9.59917 12.7681 7.95876 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.25201 6.22892 4.83427 12.1855 14.5045 9.87885 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.34802 5.87895 7.53308 6.87351 11.979 8.87744 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 9.34802 5.87895 7.53308 7.79018 12.0088 7.27472 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 6.0173 8.54845 5.02731 5.37928 5.62688 9.2898 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 8.25999 8.66921 7.66905 7.01498 13.8773 9.86334 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 9.86701 7.44784 8.37618 6.3642 12.2183 6.04595 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 9.45935 6.98781 5.14109 6.78963 10.8108 6.41689 numMergedOcc 0
8 mol 180 unq 0 iso 0 dist 8.74766 7.08676 10.1426 5.83274 12.7789 8.82325 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 9.0323 6.57849 5.47229 6.31671 13.3111 8.4844 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 9.40687 9.40003 5.68711 7.66602 6.91906 7.46481 numMergedOcc 0
11 mol 222 unq 0 iso 0 dist 6.19798 7.27481 5.01062 12.9462 11.2674 6.74196 numMergedOcc 0
12 mol 222 unq 1 iso 0 dist 6.19798 7.27481 5.01062 9.50604 10.656 8.36842 numMergedOcc 0
13 mol 222 unq 2 iso 0 dist 6.19798 7.27481 5.01062 9.68195 12.4834 9.75472 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 9.32977 7.47238 6.64614 6.2559 12.2228 6.71524 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 9.50474 9.27989 14.3464 3.28983 11.7858 6.73665 numMergedOcc 0
16 mol 276 unq 0 iso 0 dist 7.76689 5.30976 6.33662 3.87012 8.51449 8.6759 numMergedOcc 0
17 mol 276 unq 1 iso 0 dist 7.07283 5.30976 9.58401 3.87012 7.70127 8.6759 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 6.81709 7.34344 5.87119 12.1528 10.0338 5.83329 numMergedOcc 0
