0 mol 24 unq 0 iso 0 dist 9.54519 12.1061 8.4051 18.501 15.5315 7.29868 8.6586 6.7846 7.85986 13.7992 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 12.1061 8.4051 18.501 15.5315 7.29868 13.2236 8.03955 4.30252 8.92779 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.54519 12.1061 8.4051 12.511 14.6259 8.60554 8.6586 6.7846 7.85986 13.2846 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.54519 12.1061 8.4051 12.511 14.6259 8.60554 13.2236 8.03955 4.30252 12.3897 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.11056 11.095 8.60554 14.2881 14.6259 8.4051 15.4692 13.2846 7.85986 6.7846 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 6.11056 11.095 8.60554 14.2881 14.6259 8.4051 15.1745 12.3897 4.30252 8.03955 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 6.11056 11.095 8.60554 14.4535 10.0952 7.29868 15.4692 13.2846 7.85986 13.7992 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 6.11056 11.095 8.60554 14.4535 10.0952 7.29868 15.1745 12.3897 4.30252 8.92779 numMergedOcc 0
8 mol 62 unq 0 iso 0 dist 8.1599 7.46975 4.74544 14.3699 8.62608 7.56205 6.35779 5.9487 8.21895 14.3608 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.4545 4.1125 5.9465 7.01176 5.04493 6.97962 7.7399 12.2908 6.89071 13.6054 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.4545 4.1125 5.9465 11.7125 9.35561 9.95342 7.7399 12.2908 6.89071 11.2746 numMergedOcc 0
11 mol 92 unq 2 iso 0 dist 7.01176 4.1125 6.97962 8.4545 5.04493 5.9465 7.7399 13.6054 6.89071 12.2908 numMergedOcc 0
12 mol 92 unq 3 iso 0 dist 7.01176 4.1125 6.97962 11.7125 12.7769 9.95342 7.7399 13.6054 6.89071 11.2746 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 5.22543 5.08458 6.98314 9.96707 6.69637 7.61685 6.67863 6.2696 9.44645 10.1773 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 8.79558 11.4857 6.86319 17.0839 10.2747 6.70531 17.4373 12.4987 6.14222 5.93821 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 9.36079 10.9922 6.16414 14.4684 5.63422 7.75885 11.8579 4.46135 7.9416 3.56132 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 7.42904 8.16827 6.16414 12.7047 5.63422 7.75885 10.9003 4.46135 7.9416 3.56132 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 7.70279 6.36084 8.50102 9.29752 6.56633 9.40808 11.6863 6.95968 9.78273 4.04428 numMergedOcc 0
18 mol 232 unq 1 iso 0 dist 9.29752 6.36084 9.40808 7.70279 6.56633 8.50102 11.6863 4.04428 9.78273 6.95968 numMergedOcc 0
19 mol 249 unq 0 iso 0 dist 6.37672 4.20164 5.48118 9.83485 5.3927 7.25858 12.1989 10.3504 8.76518 10.9925 numMergedOcc 0
20 mol 249 unq 1 iso 0 dist 8.94023 5.93404 5.48118 12.7659 5.3927 7.25858 11.121 10.3504 8.76518 10.9925 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 9.59174 5.32742 9.63959 14.8786 12.4198 9.96262 11.7178 4.83605 9.36974 8.21389 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 9.59174 5.32742 9.63959 9.98141 12.321 7.21311 11.7178 4.83605 9.36974 11.9728 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 6.55855 5.15747 6.39866 12.6706 11.3308 8.52587 9.82713 4.60007 8.09181 12.5154 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 9.71801 4.36131 8.52587 9.7198 11.3308 6.39866 12.3011 12.5154 8.09181 4.60007 numMergedOcc 0
