0 mol 26 unq 0 iso 0 dist 5.20647 8.90473 9.75778 4.9737 4.04528 5.81765 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 5.83051 8.90473 7.87345 4.9737 4.75209 5.81765 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.12062 8.36524 15.5673 7.66913 10.8394 7.86199 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 9.073 5.9651 5.71797 8.44761 7.47006 10.0743 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 9.073 5.9651 5.71797 6.81124 4.02051 6.20057 numMergedOcc 0
5 mol 70 unq 0 iso 0 dist 9.2794 6.77833 5.51579 6.13606 4.12515 4.36555 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.32868 9.96446 9.29076 6.15011 11.8069 8.70803 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 7.32868 6.70686 4.39652 6.15011 11.8069 8.87994 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 9.35364 7.90775 15.7022 8.4204 10.2414 13.3662 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 9.35364 8.49531 3.96825 8.4204 10.2414 6.71199 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 6.26722 8.66715 12.7925 9.29665 5.21047 17.3196 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 6.26722 9.00172 12.7637 9.29665 5.21047 16.1302 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 9.71025 6.44195 5.88662 8.85675 10.3128 10.0639 numMergedOcc 0
13 mol 154 unq 1 iso 0 dist 9.71025 7.34207 12.461 8.85675 10.3128 5.27847 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 9.19569 6.28961 4.34424 8.59976 11.3012 10.3792 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 9.19569 6.28961 4.34424 9.71763 9.12553 8.6888 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 6.22466 9.52413 11.7795 8.34668 5.18732 15.1778 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 6.22466 9.52413 11.7795 8.76308 12.1022 8.14815 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 8.95136 9.25882 10.6076 6.32542 4.8012 6.09749 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 5.91079 6.11505 4.78067 6.79634 8.35349 11.6232 numMergedOcc 0
20 mol 209 unq 0 iso 0 dist 6.3344 5.92907 4.1329 9.17634 7.34675 10.6456 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 6.91126 6.45574 6.84447 4.46919 3.93066 7.60081 numMergedOcc 0
22 mol 235 unq 1 iso 0 dist 9.48967 6.45574 7.38431 4.46919 13.0408 7.60081 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 6.58667 9.38793 4.84657 7.64361 13.7282 16.4697 numMergedOcc 0
24 mol 277 unq 1 iso 0 dist 6.01542 9.38793 13.791 7.64361 4.60075 16.4697 numMergedOcc 0
25 mol 278 unq 0 iso 0 dist 8.79625 9.91518 13.5373 6.9592 4.74121 14.3412 numMergedOcc 0
26 mol 278 unq 1 iso 0 dist 9.9609 9.91518 11.4765 6.9592 14.9084 14.3412 numMergedOcc 0
