0 mol 10 unq 0 iso 0 dist 8.44864 4.87706 9.43029 6.50444 3.92592 9.39486 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.44507 8.43529 6.7142 13.0329 5.39199 8.96682 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.07989 6.4113 7.98985 10.7153 7.71726 5.7369 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 9.77272 16.2411 7.98985 17.2731 7.71726 5.7369 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 5.59552 5.92795 6.59716 9.68629 11.7168 9.99441 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 8.23777 3.82552 5.36587 9.58064 3.99855 6.96745 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 5.42828 3.78964 6.11407 10.9517 10.4943 7.31064 numMergedOcc 0
7 mol 112 unq 2 iso 0 dist 6.09626 4.45743 9.26353 4.77996 5.08111 7.31064 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 5.49198 5.19373 7.83568 12.7687 15.3699 8.14226 numMergedOcc 0
9 mol 170 unq 0 iso 0 dist 9.53158 10.2179 6.47164 12.5742 5.04147 8.75024 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 8.95598 6.60692 7.81263 8.27396 4.67256 4.61596 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 8.80931 3.7157 6.22742 8.60546 5.45812 8.22795 numMergedOcc 0
12 mol 195 unq 1 iso 0 dist 8.13947 6.61517 9.24936 9.48766 5.66395 6.396 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.15381 6.98142 8.24419 8.79378 5.70985 9.09594 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 5.89818 4.91709 8.43195 8.86886 6.67077 8.14294 numMergedOcc 0
15 mol 222 unq 1 iso 0 dist 5.89818 5.96186 8.23406 8.86886 6.67077 5.72 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 9.79381 11.9758 6.94762 11.0725 5.8463 9.3502 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 9.79381 3.69148 9.89167 11.0725 5.8463 9.34821 numMergedOcc 0
18 mol 225 unq 2 iso 0 dist 8.37379 12.7552 6.94762 9.49163 5.8463 9.3502 numMergedOcc 0
19 mol 225 unq 3 iso 0 dist 8.37379 5.69755 9.89167 9.49163 5.8463 9.34821 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 8.37813 5.45156 6.15635 9.94117 3.86189 8.93212 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 9.14116 4.88971 6.15635 10.6175 3.86189 8.93212 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 9.78826 13.255 5.61969 11.7289 10.5462 9.02537 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 6.60049 7.45665 8.6233 10.9744 6.89106 8.1635 numMergedOcc 0
24 mol 292 unq 1 iso 0 dist 6.60049 7.45665 8.6233 7.78796 3.92782 6.22943 numMergedOcc 0
25 mol 292 unq 2 iso 0 dist 6.60049 7.45665 8.6233 11.3673 5.93687 9.23612 numMergedOcc 0
