0 mol 1 unq 0 iso 0 dist 5.55208 8.93702 6.28655 5.99543 9.48433 8.56884 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 8.09741 6.88603 12.1018 6.75623 8.14057 12.0114 numMergedOcc 0
2 mol 94 unq 0 iso 0 dist 6.33571 6.64613 5.64486 4.7907 7.34401 8.3586 numMergedOcc 0
3 mol 213 unq 0 iso 0 dist 6.45268 4.80429 5.06267 7.17515 9.24466 11.0791 numMergedOcc 0
4 mol 213 unq 1 iso 0 dist 6.45268 6.38872 4.91881 7.17515 9.24466 8.45368 numMergedOcc 0
5 mol 220 unq 0 iso 0 dist 7.30288 5.13604 6.32132 4.8419 5.07968 7.61951 numMergedOcc 0
6 mol 225 unq 0 iso 0 dist 6.89242 6.31342 6.4725 6.9955 9.30186 5.50387 numMergedOcc 0
7 mol 225 unq 1 iso 0 dist 6.89242 6.31342 6.4725 12.149 6.51997 12.9623 numMergedOcc 0
8 mol 229 unq 0 iso 0 dist 7.79058 9.81585 9.5164 9.84917 9.68636 17.6932 numMergedOcc 0
9 mol 229 unq 1 iso 0 dist 7.79058 9.81585 9.5164 5.14312 7.81415 12.5098 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 6.09111 8.98366 6.99665 6.54297 9.39439 9.43203 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 6.35418 7.05868 4.99523 6.37876 9.85618 12.3502 numMergedOcc 0
12 mol 243 unq 0 iso 0 dist 9.7462 7.96438 11.2863 6.87862 8.19458 12.0377 numMergedOcc 0
13 mol 243 unq 1 iso 0 dist 9.7462 7.96438 11.2863 10.3832 9.45133 16.4652 numMergedOcc 0
14 mol 264 unq 0 iso 0 dist 5.21387 5.50677 10.0789 7.50444 6.66602 11.8981 numMergedOcc 0
15 mol 264 unq 1 iso 0 dist 5.21387 8.75957 11.1032 7.50444 6.66602 12.2387 numMergedOcc 0
16 mol 294 unq 0 iso 0 dist 8.79534 7.86196 14.8622 9.13951 5.71661 13.4799 numMergedOcc 0
17 mol 294 unq 1 iso 0 dist 8.79534 7.86196 14.8622 10.409 8.98536 15.2356 numMergedOcc 0
