0 mol 1 unq 0 iso 0 dist 6.41817 6.24156 3.81243 7.49891 7.83632 5.91417 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 7.13214 9.60361 6.12483 6.58295 10.6471 8.81608 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.34599 7.54282 5.29055 7.23962 6.15893 9.06516 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.34599 7.54282 5.29055 7.95969 14.2674 9.96121 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 6.32127 7.54282 4.76998 7.23962 5.497 9.06516 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 6.32127 7.54282 4.76998 7.95969 12.2621 9.96121 numMergedOcc 0
6 mol 27 unq 0 iso 0 dist 6.75307 9.21811 10.8132 3.71754 8.71752 6.78936 numMergedOcc 0
7 mol 27 unq 1 iso 0 dist 7.24775 9.21811 13.4461 3.71754 7.60283 6.78936 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.43804 7.6935 3.92737 11.1769 6.0129 4.44979 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 7.43804 8.71558 3.94967 11.1769 6.0129 6.61111 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 9.82907 6.68983 11.3075 5.80684 13.7968 5.51885 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 9.90113 8.64101 9.03836 12.4041 10.3281 6.65272 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 7.93807 5.57495 5.43662 6.77802 7.80054 9.1326 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 7.93807 9.38297 5.95858 6.77802 7.80054 7.30954 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.38735 9.43325 5.65634 6.29996 9.82146 7.25339 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 8.89293 9.43325 3.87082 6.29996 8.97471 7.25339 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 8.53661 7.31478 12.8131 12.3402 19.1851 8.65196 numMergedOcc 0
17 mol 213 unq 1 iso 0 dist 8.53661 7.31478 12.8131 6.32328 13.5848 5.461 numMergedOcc 0
18 mol 237 unq 0 iso 0 dist 6.78301 6.16312 4.08768 6.39326 5.98039 7.12731 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 8.03226 9.97859 13.8857 12.4402 13.0987 7.39547 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 8.03226 9.97859 13.8857 10.4365 10.1326 7.24334 numMergedOcc 0
21 mol 282 unq 0 iso 0 dist 5.94224 9.07173 4.10152 6.63358 6.8972 7.52924 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 9.52718 7.74312 5.97664 9.81184 5.59555 8.59762 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 9.52718 7.74312 5.97664 9.81184 5.59555 8.59762 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 9.52718 7.74312 5.97664 9.81184 5.59555 8.59762 numMergedOcc 0
