0 mol 4 unq 0 iso 0 dist 8.67981 7.97369 6.66589 11.0101 4.70233 9.71908 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 5.44077 5.16403 9.05728 11.7135 11.2948 9.18371 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.72833 4.61096 8.54845 9.60995 12.3451 6.80741 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 9.41952 5.85228 6.46655 5.58384 6.55138 6.48625 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.09675 14.4838 9.89021 19.4701 14.4661 9.02288 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.09675 14.4838 9.89021 23.3625 18.6603 9.58544 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 9.02753 12.3838 9.89021 19.2786 14.4661 9.02288 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 9.02753 12.3838 9.89021 21.5185 18.6603 9.58544 numMergedOcc 0
8 mol 87 unq 0 iso 0 dist 6.97882 11.2491 9.1329 10.4154 6.69874 8.50159 numMergedOcc 0
9 mol 87 unq 1 iso 0 dist 9.4868 11.2491 5.26938 10.4154 3.66319 8.50159 numMergedOcc 0
10 mol 87 unq 2 iso 0 dist 7.7858 11.2195 9.1329 13.6844 6.69874 8.50159 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 5.53726 4.33359 6.30103 9.88184 7.30364 7.84888 numMergedOcc 0
12 mol 127 unq 0 iso 0 dist 8.58317 4.70935 7.73139 12.184 14.0161 8.40046 numMergedOcc 0
13 mol 127 unq 1 iso 0 dist 5.52891 4.70935 8.62711 12.184 15.8417 8.40046 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 9.46039 5.80488 9.18691 5.46716 4.81215 5.46922 numMergedOcc 0
15 mol 185 unq 0 iso 0 dist 7.64068 5.77911 9.03315 5.40655 4.81985 8.04591 numMergedOcc 0
16 mol 185 unq 1 iso 0 dist 9.83898 13.2401 9.03315 13.4891 4.81985 8.04591 numMergedOcc 0
17 mol 188 unq 0 iso 0 dist 9.4789 4.04545 7.95028 8.48582 6.11696 9.24118 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 5.33103 3.84723 6.53736 9.97171 14.0406 9.67457 numMergedOcc 0
19 mol 210 unq 1 iso 0 dist 9.01301 3.84723 8.18851 9.97171 11.7201 9.67457 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 8.55805 15.5892 7.30244 17.2113 11.8854 8.48112 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 7.78329 4.53819 6.095 10.7871 11.1791 9.18675 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 9.54274 5.45802 5.32724 11.7761 6.46711 9.9605 numMergedOcc 0
23 mol 250 unq 1 iso 0 dist 8.65735 3.78208 5.32724 12.3265 6.46711 9.9605 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 9.17911 9.07364 9.67877 10.3095 9.0655 5.73296 numMergedOcc 0
25 mol 258 unq 1 iso 0 dist 9.52903 14.2753 9.67877 13.9865 9.0655 5.73296 numMergedOcc 0
26 mol 273 unq 0 iso 0 dist 9.80002 10.5063 6.54753 13.9604 4.62586 8.90885 numMergedOcc 0
27 mol 273 unq 1 iso 0 dist 6.73794 5.75973 6.54753 8.78928 4.62586 8.90885 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 8.77418 4.45344 7.35866 11.3517 5.09231 8.27793 numMergedOcc 0
29 mol 294 unq 0 iso 0 dist 5.71656 5.57606 8.52208 10.7501 6.79888 9.70907 numMergedOcc 0
30 mol 294 unq 1 iso 0 dist 5.71656 5.57606 8.52208 5.27236 7.05161 6.47832 numMergedOcc 0
