0 mol 34 unq 0 iso 0 dist 6.20159 7.66913 11.3492 12.4957 9.67624 19.0992 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 7.94809 6.27321 13.6446 3.62638 6.33905 7.98985 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 6.35752 8.64736 3.69039 5.42116 8.31317 11.6929 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 8.32098 7.32157 10.0734 6.10195 9.08333 12.8658 numMergedOcc 0
4 mol 134 unq 0 iso 0 dist 6.94623 6.08299 5.51309 5.02911 8.99648 9.57051 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 5.7306 8.85675 11.9741 11.0848 9.11555 19.4366 numMergedOcc 0
6 mol 154 unq 1 iso 0 dist 5.7306 8.85675 11.9741 13.294 8.88053 20.5967 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 7.87925 8.41708 4.04186 6.50911 9.61582 9.45907 numMergedOcc 0
8 mol 197 unq 0 iso 0 dist 5.38508 9.45718 6.84735 6.06776 9.32113 15.1445 numMergedOcc 0
9 mol 197 unq 1 iso 0 dist 5.38508 8.56826 7.92095 6.06776 9.32113 14.0329 numMergedOcc 0
10 mol 197 unq 2 iso 0 dist 6.51529 9.45718 10.9225 6.06776 7.26931 15.1445 numMergedOcc 0
11 mol 197 unq 3 iso 0 dist 6.51529 8.56826 11.6499 6.06776 7.26931 14.0329 numMergedOcc 0
12 mol 197 unq 4 iso 0 dist 6.18166 9.3055 5.47413 10.1353 9.44911 14.8145 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 6.0626 7.32216 4.09076 7.67194 9.1447 7.30592 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 6.0626 9.92206 6.69164 7.67194 9.1447 9.46687 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 7.70125 7.51337 7.66364 4.36059 9.16901 6.94762 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 7.70125 7.51337 7.66364 5.94475 6.77853 11.0847 numMergedOcc 0
17 mol 225 unq 2 iso 0 dist 7.70125 8.05594 3.7016 4.36059 9.16901 7.7086 numMergedOcc 0
18 mol 225 unq 3 iso 0 dist 7.70125 8.05594 3.7016 5.94475 6.77853 9.57507 numMergedOcc 0
19 mol 270 unq 0 iso 0 dist 8.19788 6.97639 11.4433 8.21361 6.30711 14.381 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 8.20612 6.59092 9.23974 4.3735 5.3725 5.61969 numMergedOcc 0
