0 mol 34 unq 0 iso 0 dist 8.46741 6.28596 5.96987 9.85665 5.03302 5.40582 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.67252 8.77382 8.16387 16.8357 13.9097 9.47348 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.0757 9.10389 6.43837 8.40931 3.73188 8.7361 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 9.8958 9.74441 6.43837 12.9423 3.73188 8.7361 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 5.45684 11.7446 7.32896 17.608 12.2159 9.15386 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 7.76644 12.8925 7.32896 17.503 12.2159 9.15386 numMergedOcc 0
6 mol 172 unq 0 iso 0 dist 8.56457 7.00723 8.43951 9.15928 6.66731 5.44495 numMergedOcc 0
7 mol 172 unq 1 iso 0 dist 8.56457 7.00723 8.43951 14.2832 9.67949 9.54742 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 8.59787 17.388 9.85636 16.6692 8.45076 9.24822 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.57625 10.5985 9.51136 18.768 12.6492 9.9693 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 5.77828 4.35015 9.93547 5.67917 5.65008 8.6771 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 5.77828 4.35015 9.93547 8.96639 10.5857 9.58767 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 8.00841 9.5511 9.96797 8.98668 12.7003 7.73213 numMergedOcc 0
13 mol 241 unq 1 iso 0 dist 7.91178 4.91384 9.54502 11.956 14.1746 7.73213 numMergedOcc 0
14 mol 252 unq 0 iso 0 dist 4.91772 4.93284 5.63485 6.41821 4.90903 5.82903 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 9.38192 7.41014 8.50063 10.7452 4.25662 7.00833 numMergedOcc 0
16 mol 261 unq 1 iso 0 dist 6.99444 12.9946 8.50063 11.1786 4.25662 7.00833 numMergedOcc 0
17 mol 276 unq 0 iso 0 dist 5.54217 5.9082 6.77017 10.0077 5.32571 7.85804 numMergedOcc 0
18 mol 276 unq 1 iso 0 dist 7.01597 10.8127 8.12227 11.8795 7.18694 7.85804 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 6.51248 12.9014 8.99154 13.7887 9.07097 9.4493 numMergedOcc 0
