0 mol 30 unq 0 iso 0 dist 5.55376 5.28534 9.29609 9.41089 6.55815 14.3828 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 5.55376 5.28534 9.29609 4.7721 7.09121 9.27784 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.23849 8.34599 5.44028 10.8073 6.40693 7.25845 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 6.4776 7.78455 5.44028 9.58376 6.40693 7.25845 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.27584 11.0833 6.00564 15.4112 8.70863 4.58085 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.40964 6.82303 9.93806 5.04277 8.57827 11.3027 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.40964 6.82303 9.93806 6.77665 7.94453 4.64144 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 8.71813 10.1633 7.04752 6.12935 6.76575 4.31811 numMergedOcc 0
8 mol 135 unq 0 iso 0 dist 5.49024 6.64633 9.54038 9.25955 8.83856 15.7885 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 6.64084 10.4764 9.38045 4.57581 6.76055 9.44283 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 6.64084 10.4764 9.38045 11.2833 9.36343 10.8632 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 9.27256 8.04855 6.0532 4.93161 7.58035 6.49195 numMergedOcc 0
12 mol 162 unq 1 iso 0 dist 8.6792 4.15457 6.00293 10.301 7.14263 8.06906 numMergedOcc 0
13 mol 162 unq 2 iso 0 dist 8.6792 4.15457 6.00293 4.05981 8.57005 6.76865 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 9.02096 7.18711 6.59925 8.56805 8.05247 11.3868 numMergedOcc 0
15 mol 175 unq 1 iso 0 dist 9.02096 7.18711 6.59925 11.8728 9.71028 11.3992 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 8.7062 15.1157 9.85415 4.79372 5.95375 11.0113 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 8.7062 7.96379 5.96238 4.79372 5.95375 3.5693 numMergedOcc 0
18 mol 205 unq 2 iso 0 dist 8.7062 6.9259 8.24405 4.79372 5.95375 6.29383 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 6.86851 6.72933 7.81987 11.277 8.34416 11.3876 numMergedOcc 0
20 mol 230 unq 1 iso 0 dist 6.86851 6.72933 7.81987 9.16476 6.34832 6.78617 numMergedOcc 0
21 mol 230 unq 2 iso 0 dist 9.88392 15.9225 7.81987 6.41577 8.34416 11.3876 numMergedOcc 0
22 mol 230 unq 3 iso 0 dist 9.88392 15.9225 7.81987 10.5257 6.34832 6.78617 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 8.35413 11.9012 8.65191 10.3959 9.91199 6.08477 numMergedOcc 0
