0 mol 9 unq 0 iso 0 dist 9.9919 5.95912 6.20227 15.4961 10.6533 9.78006 13.8037 6.21879 8.04924 5.60154 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 7.11102 7.39536 7.3576 14.0262 11.2895 6.77886 5.67098 4.30611 5.86571 10.9467 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 8.48054 11.4735 7.3576 17.7498 11.2895 6.77886 8.58218 4.30611 5.86571 10.9467 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.98606 7.07175 9.93806 7.5819 5.44942 8.65802 14.9008 10.1497 9.20197 12.3813 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 6.29634 9.79485 8.81779 8.44385 4.55137 7.99857 10.2497 4.15435 9.87025 6.35763 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 6.29634 9.79485 8.81779 8.44385 4.55137 7.99857 13.4009 9.54775 5.85818 7.36192 numMergedOcc 0
6 mol 119 unq 2 iso 0 dist 6.29634 9.79485 8.81779 5.63005 6.42493 8.56342 10.2497 4.15435 9.87025 10.0197 numMergedOcc 0
7 mol 119 unq 3 iso 0 dist 6.29634 9.79485 8.81779 5.63005 6.42493 8.56342 13.4009 9.54775 5.85818 10.6679 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 9.64841 11.4158 6.49708 14.4106 5.29844 9.02318 19.0296 12.0468 8.12589 12.144 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 9.64841 11.4158 6.49708 15.3258 6.55924 9.74542 19.0296 12.0468 8.12589 10.2478 numMergedOcc 0
10 mol 148 unq 2 iso 0 dist 9.64841 11.4158 6.49708 18.2028 9.61708 7.97543 19.0296 12.0468 8.12589 6.29254 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 9.5865 11.4182 6.45018 15.3303 6.62435 9.6606 19.003 12.1191 8.11592 10.2318 numMergedOcc 0
12 mol 150 unq 1 iso 0 dist 9.5865 11.4182 6.45018 18.2061 9.72618 7.85526 19.003 12.1191 8.11592 6.25747 numMergedOcc 0
13 mol 150 unq 2 iso 0 dist 9.5865 11.4182 6.45018 14.558 5.50847 8.94552 19.003 12.1191 8.11592 12.154 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 9.2747 9.06963 7.75632 10.2921 8.62666 7.71426 14.2344 10.2914 5.73148 8.08908 numMergedOcc 0
15 mol 171 unq 1 iso 0 dist 9.2747 9.06963 7.75632 11.2403 11.8746 5.10618 14.2344 10.2914 5.73148 6.05805 numMergedOcc 0
16 mol 171 unq 2 iso 0 dist 9.2747 9.06963 7.75632 16.6364 9.0509 9.86681 14.2344 10.2914 5.73148 8.83561 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.25305 8.4512 6.61806 16.8184 12.2848 8.44861 10.9783 4.13682 5.42696 8.66809 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 8.25305 8.4512 6.61806 12.7788 9.41884 5.60393 10.9783 4.13682 5.42696 6.23291 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 9.05875 11.6166 7.48626 17.1928 10.2428 6.38157 11.3867 4.77836 5.10114 6.67959 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 6.02521 5.68266 6.45821 11.7899 7.79008 8.0751 10.3296 7.51787 6.23898 7.35842 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 7.03647 9.67929 9.18343 16.4096 11.7207 8.87609 16.5511 13.6736 7.29542 5.06326 numMergedOcc 0
22 mol 227 unq 0 iso 0 dist 8.99259 7.06191 9.94302 9.96308 13.798 8.38865 14.955 13.7364 9.20589 9.60993 numMergedOcc 0
23 mol 227 unq 1 iso 0 dist 8.99259 7.06191 9.94302 9.96308 13.798 8.38865 10.9376 5.45009 7.89801 13.3557 numMergedOcc 0
24 mol 227 unq 2 iso 0 dist 8.99259 7.06191 9.94302 9.95674 10.9445 5.4694 14.955 13.7364 9.20589 5.34702 numMergedOcc 0
25 mol 227 unq 3 iso 0 dist 8.99259 7.06191 9.94302 9.95674 10.9445 5.4694 10.9376 5.45009 7.89801 8.8709 numMergedOcc 0
