0 mol 10 unq 0 iso 0 dist 6.88548 7.45552 5.06897 6.32714 9.38807 9.0507 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.88548 7.45552 5.06897 4.20242 9.17211 7.06047 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.15652 10.9024 8.70141 8.92687 4.90592 12.1061 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.15652 10.9024 8.70141 5.12527 8.16324 6.81998 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.44893 10.7171 8.70141 6.2838 4.90592 12.1061 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.44893 10.7171 8.70141 11.8259 8.16324 6.81998 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 7.2612 11.9212 9.46609 11.5196 9.5053 4.29919 numMergedOcc 0
7 mol 34 unq 0 iso 0 dist 8.72742 6.66112 7.27883 13.3807 6.15801 9.02863 numMergedOcc 0
8 mol 34 unq 1 iso 0 dist 8.72742 6.66112 7.27883 14.8083 9.63403 12.015 numMergedOcc 0
9 mol 34 unq 2 iso 0 dist 8.72742 6.66112 7.27883 5.89131 8.07314 4.1203 numMergedOcc 0
10 mol 52 unq 0 iso 0 dist 9.87921 6.12403 9.46302 11.0384 9.80143 5.51146 numMergedOcc 0
11 mol 68 unq 0 iso 0 dist 5.94459 6.51886 5.74389 10.2437 6.40693 6.32283 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 7.05954 5.27016 8.95651 8.51558 9.05259 4.1125 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 5.36473 4.73128 5.82501 8.30856 7.42482 3.88006 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 8.74174 9.10578 9.3832 5.81031 9.79069 4.04072 numMergedOcc 0
15 mol 163 unq 1 iso 0 dist 8.74174 9.10578 9.3832 11.0152 9.27496 16.9342 numMergedOcc 0
16 mol 163 unq 2 iso 0 dist 8.74174 9.44058 6.0247 5.81031 9.79069 12.5525 numMergedOcc 0
17 mol 163 unq 3 iso 0 dist 8.74174 9.44058 6.0247 11.0152 9.27496 4.37572 numMergedOcc 0
18 mol 163 unq 4 iso 0 dist 8.74174 5.51241 6.40873 5.81031 9.79069 8.81556 numMergedOcc 0
19 mol 163 unq 5 iso 0 dist 8.74174 5.51241 6.40873 11.0152 9.27496 7.05786 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 9.94949 8.02514 9.52012 10.0197 8.43933 7.42937 numMergedOcc 0
21 mol 237 unq 0 iso 0 dist 6.96229 7.63505 8.06435 4.61626 5.6703 3.96327 numMergedOcc 0
22 mol 237 unq 1 iso 0 dist 6.96229 7.63505 8.06435 5.14102 8.72819 9.75157 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 8.74485 6.94884 8.81373 5.29882 5.0804 4.13135 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 7.95244 6.59723 7.71972 4.69368 7.79704 6.70266 numMergedOcc 0
25 mol 274 unq 1 iso 0 dist 5.57832 6.59723 9.76049 4.69368 9.39276 6.70266 numMergedOcc 0
