0 mol 10 unq 0 iso 0 dist 8.44864 6.50444 3.92592 4.87706 9.43029 9.39486 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.99751 9.90986 5.29055 13.4787 9.36924 13.4718 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.44507 9.90986 4.76998 8.43529 6.7142 10.2011 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 8.25567 9.22183 6.64374 10.8015 9.36924 13.8864 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 5.84625 8.85156 10.5604 7.4999 7.58739 15.59 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 5.84625 8.85156 10.5604 4.99692 9.01564 10.9762 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 5.84625 8.85156 10.5604 3.70586 7.11065 12.4865 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 5.59552 9.68629 11.7168 5.92795 6.59716 9.99441 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 5.59552 9.68629 11.7168 10.2656 6.87506 13.7026 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 6.09626 4.77996 5.08111 4.45743 9.26353 7.31064 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 9.34823 9.10803 14.1584 5.92411 8.67537 14.339 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 5.49198 9.13697 6.06606 5.19373 7.83568 9.54071 numMergedOcc 0
12 mol 169 unq 0 iso 0 dist 5.51388 6.27683 3.95773 14.6592 9.15283 10.2894 numMergedOcc 0
13 mol 169 unq 1 iso 0 dist 8.68909 7.1757 3.95773 11.1071 9.15283 10.2894 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 6.21194 6.76574 4.88147 9.12839 7.47964 9.80507 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 8.95598 8.27396 4.67256 6.60692 7.81263 4.61596 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 8.80931 8.60546 5.45812 3.7157 6.22742 8.22795 numMergedOcc 0
17 mol 195 unq 1 iso 0 dist 8.13947 9.48766 5.66395 6.61517 9.24936 6.396 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 8.15381 8.79378 5.70985 6.98142 8.24419 9.09594 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 5.89818 8.86886 6.67077 4.91709 8.43195 8.14294 numMergedOcc 0
20 mol 222 unq 1 iso 0 dist 5.89818 8.86886 6.67077 5.96186 8.23406 5.72 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 8.37379 9.49163 5.8463 12.7552 6.94762 9.3502 numMergedOcc 0
22 mol 225 unq 1 iso 0 dist 8.37379 9.49163 5.8463 5.69755 9.89167 9.34821 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 8.37813 9.94117 3.86189 5.45156 6.15635 8.93212 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 6.81257 9.54428 5.08871 3.86293 9.03998 10.5144 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 6.60049 7.78796 3.92782 7.45665 8.6233 6.22943 numMergedOcc 0
