0 mol 16 unq 0 iso 0 dist 6.28033 6.64634 7.65889 9.9153 6.51133 5.94982 5.40044 4.7319 6.86055 6.72833 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.28033 6.64634 7.65889 9.9153 6.51133 5.94982 11.5215 11.6856 5.01101 6.93532 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.23095 11.9503 7.6114 11.0789 5.68392 6.29797 11.5983 6.03987 5.86705 6.85556 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 6.7212 11.1406 9.55118 16.4419 11.6378 7.58875 11.6369 9.96708 5.69391 9.27838 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.124 15.7072 8.68662 13.2119 6.56633 8.96616 13.4367 6.19304 6.20232 9.24757 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.124 15.2252 7.4369 13.2119 6.56633 6.14542 13.4367 6.19304 5.70116 9.24757 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 5.90776 5.30951 7.13008 13.24 10.9681 8.93769 12.013 13.2315 6.95017 7.52354 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 8.22596 13.0711 9.21662 12.0939 5.42531 6.59691 12.6449 10.1489 4.03277 7.01812 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 8.22596 13.0711 9.21662 12.0939 5.42531 6.59691 17.9195 13.2001 6.23008 8.30845 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.62648 12.6962 7.64052 19.8226 12.0175 8.67537 15.3885 9.72413 4.39676 6.73586 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 7.27598 12.487 7.93372 9.95528 5.29786 9.0176 7.41837 9.5126 12.847 7.69991 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 7.27598 12.487 7.93372 9.95528 5.29786 9.0176 6.50005 6.37586 8.06642 6.23142 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 7.27598 12.487 7.93372 9.95528 5.29786 9.0176 12.0971 9.71307 4.00092 9.94764 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 8.90247 11.9701 9.76212 11.3392 4.43096 7.35884 14.0828 8.03334 6.50233 6.46704 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 6.58792 11.9701 8.59874 11.3392 6.06566 7.35884 14.0828 10.9639 6.50233 6.46704 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 9.18245 5.68795 5.05973 10.7896 5.48529 5.99437 9.04896 9.81747 5.71898 9.39829 numMergedOcc 0
16 mol 181 unq 3 iso 0 dist 9.18245 5.68795 5.05973 10.7896 5.48529 5.99437 7.40358 9.11469 5.93724 6.41453 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 9.60159 5.19262 5.23634 11.9075 6.35849 9.18728 7.51316 7.22101 5.0317 7.43071 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 9.60159 5.19262 5.23634 11.9075 6.35849 9.18728 6.38287 7.09863 5.83175 6.02296 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 9.60159 5.19262 5.23634 11.7218 10.9607 8.91971 7.51316 7.22101 5.0317 5.41321 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 9.95045 13.3209 6.71524 11.8822 4.9377 9.9183 16.5322 10.5803 9.74344 8.50102 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 9.95045 13.3209 6.71524 11.8822 4.9377 9.9183 12.5761 8.27212 5.10213 9.40808 numMergedOcc 0
