0 mol 11 unq 0 iso 0 dist 5.95165 7.95811 9.62262 11.5504 16.0707 8.40993 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.7435 8.23032 9.99434 12.1836 16.4599 8.22997 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.7522 8.99751 10.797 4.01506 13.4268 9.30674 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.7522 8.99751 10.797 8.29396 16.1537 8.25567 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.4545 7.11438 9.52327 12.8708 11.3075 7.11127 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 8.4545 7.11438 9.52327 6.46167 9.28057 6.37888 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 7.01176 7.11438 11.641 12.8708 15.2593 7.11127 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 7.01176 7.11438 11.641 6.46167 10.3713 6.37888 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.9747 9.25249 14.3413 4.66569 9.27497 8.41411 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.50322 6.72323 12.538 12.3753 16.8036 9.04845 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.50322 6.72323 12.538 14.0664 19.4418 7.94325 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 5.82404 6.72323 4.54648 12.3753 11.3707 9.04845 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 5.82404 6.72323 4.54648 14.0664 11.8159 7.94325 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.97921 8.63323 6.07158 8.37388 14.2752 9.76987 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 9.58911 5.66363 11.85 4.09371 12.7453 5.97968 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 9.58911 5.66363 11.85 10.0342 18.5206 8.50382 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 9.58911 5.66363 11.85 7.37799 11.622 8.63119 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 6.752 7.23557 5.8535 5.80929 9.34594 5.86419 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 6.752 7.23557 5.8535 4.20051 5.4913 8.86587 numMergedOcc 0
19 mol 205 unq 2 iso 0 dist 8.10287 8.86587 14.0496 9.66755 17.0855 5.86419 numMergedOcc 0
20 mol 205 unq 3 iso 0 dist 8.10287 8.86587 14.0496 4.20051 12.1752 7.23557 numMergedOcc 0
21 mol 205 unq 4 iso 0 dist 5.4913 8.86587 5.8535 9.66755 9.34594 5.86419 numMergedOcc 0
22 mol 205 unq 5 iso 0 dist 5.4913 8.86587 5.8535 4.20051 6.752 7.23557 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 6.11137 8.37813 9.52712 8.40987 13.9224 9.14116 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 7.89744 8.37813 14.1812 8.40987 15.5619 9.14116 numMergedOcc 0
25 mol 274 unq 0 iso 0 dist 6.55855 9.11072 6.16703 5.41461 9.7198 9.02071 numMergedOcc 0
26 mol 274 unq 1 iso 0 dist 9.52894 9.11072 6.40141 5.41461 11.9968 9.02071 numMergedOcc 0
27 mol 274 unq 2 iso 0 dist 9.71801 9.02071 6.20558 5.41461 12.6706 9.11072 numMergedOcc 0
