0 mol 17 unq 0 iso 0 dist 6.53817 9.16861 12.6863 7.83348 8.70792 16.3172 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.85305 6.72467 6.29127 16.2037 9.99939 11.4922 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 5.36645 8.80334 4.84988 5.39197 7.15542 8.44353 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 5.36645 8.80334 4.84988 9.53255 8.89047 6.11249 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 5.36645 8.80334 4.84988 7.75132 8.89003 7.86326 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.125 6.28472 5.007 5.58299 9.94407 9.72714 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 8.125 8.74881 11.3449 5.58299 9.94407 13.4355 numMergedOcc 0
7 mol 75 unq 0 iso 0 dist 7.16583 7.14313 10.0425 4.79348 9.16597 7.30467 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 9.0361 6.793 5.498 6.04036 5.54256 7.68537 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 7.5984 8.57285 5.44503 5.08025 8.99891 8.08798 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 8.58946 9.72291 11.206 11.6251 9.86868 15.5833 numMergedOcc 0
11 mol 167 unq 1 iso 0 dist 8.58946 9.72291 11.206 6.39898 6.83528 14.4948 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 7.0119 9.5964 4.8585 6.18377 9.4629 11.6006 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 8.09769 9.38761 4.74167 12.3063 9.64116 14.1371 numMergedOcc 0
14 mol 248 unq 0 iso 0 dist 6.44967 9.83514 6.48757 8.32249 7.79063 10.7209 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 7.30618 8.40198 4.62998 6.33641 9.18744 7.77225 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 7.30618 9.95761 12.5126 6.33641 9.18744 15.7293 numMergedOcc 0
17 mol 287 unq 2 iso 0 dist 9.22306 9.11967 4.62998 4.57745 9.18744 7.77225 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.30618 8.40198 4.62998 6.33641 9.18744 7.77225 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 7.30618 9.95761 12.5126 6.33641 9.18744 15.7293 numMergedOcc 0
20 mol 288 unq 2 iso 0 dist 9.22306 9.11967 4.62998 4.57745 9.18744 7.77225 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.30618 8.40198 4.62998 6.33641 9.18744 7.77225 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 7.30618 9.95761 12.5126 6.33641 9.18744 15.7293 numMergedOcc 0
23 mol 289 unq 2 iso 0 dist 9.22306 9.11967 4.62998 4.57745 9.18744 7.77225 numMergedOcc 0
