0 mol 29 unq 0 iso 0 dist 6.73481 3.97609 6.04161 8.54108 5.82508 8.58191 9.50033 7.50258 5.97852 8.53135 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 8.41842 11.8297 7.82815 13.9178 6.90464 9.03138 10.8869 8.04019 3.85975 8.0346 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.25561 6.69911 8.12959 14.1204 10.9249 8.8326 11.1358 11.0374 5.34337 5.37449 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.25561 6.69911 8.12959 14.1204 10.9249 8.8326 17.4052 17.6188 10.8827 9.52666 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 8.97499 3.94216 8.12959 12.5351 10.9249 8.8326 8.60527 11.0374 5.34337 5.37449 numMergedOcc 0
5 mol 76 unq 3 iso 0 dist 8.97499 3.94216 8.12959 12.5351 10.9249 8.8326 13.9541 17.6188 10.8827 9.52666 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.13958 9.05571 8.85652 15.3181 13.2909 8.46972 16.2977 17.0971 9.14454 7.26325 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.92685 12.989 9.67398 19.3415 12.7708 9.58844 15.7118 12.4848 6.5713 6.21554 numMergedOcc 0
8 mol 155 unq 0 iso 0 dist 5.16143 5.05961 5.55218 12.9127 11.0082 8.14405 14.638 11.8225 10.5172 8.3622 numMergedOcc 0
9 mol 155 unq 1 iso 0 dist 8.08392 5.68679 5.55218 6.80942 11.0082 8.14405 4.90139 11.8225 10.5172 8.3622 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 6.20851 9.12839 9.67711 10.5545 14.3635 8.09699 11.1357 13.976 5.35456 4.59484 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 7.55333 3.69062 6.50586 10.3441 6.38518 7.18098 6.67537 5.86839 3.73699 6.02053 numMergedOcc 0
12 mol 279 unq 0 iso 0 dist 6.39586 6.32559 9.24104 7.35799 6.25345 5.41277 12.7379 14.5527 7.98069 8.51994 numMergedOcc 0
13 mol 280 unq 0 iso 0 dist 6.0218 5.55901 7.4869 4.26671 5.846 6.16546 4.65268 4.45141 4.06908 6.38295 numMergedOcc 0
