0 mol 16 unq 0 iso 0 dist 6.36377 4.78943 5.05803 7.979 5.72175 8.17898 12.4209 11.6856 10.2656 9.04834 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.54519 5.80023 7.36323 10.5 5.75653 5.87895 5.22466 11.5038 4.87334 9.57974 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 7.35142 4.93292 7.38797 8.39608 5.87956 8.21553 9.16746 11.7839 7.16971 8.22762 numMergedOcc 0
3 mol 71 unq 1 iso 0 dist 9.50139 6.53623 7.38797 7.28815 5.87956 8.21553 5.67157 11.7839 7.16971 8.22762 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 6.95595 12.7957 7.79912 10.4728 5.06305 7.118 10.309 8.56639 5.64643 8.24814 numMergedOcc 0
5 mol 75 unq 1 iso 0 dist 6.95595 10.309 8.56639 10.4728 5.06305 8.24814 12.7957 7.79912 5.64643 7.118 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.02717 5.28901 7.30858 10.2401 7.64822 7.44784 11.0268 7.88312 11.5723 9.56867 numMergedOcc 0
7 mol 115 unq 1 iso 0 dist 5.02717 11.0268 7.88312 10.2401 7.64822 9.56867 5.28901 7.30858 11.5723 7.44784 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 8.7366 4.90475 7.7059 9.00166 6.04014 6.2403 6.34266 11.5751 4.35917 8.34869 numMergedOcc 0
9 mol 132 unq 1 iso 0 dist 8.7366 4.90475 7.7059 7.16287 10.0823 6.495 6.34266 11.5751 4.35917 9.43748 numMergedOcc 0
10 mol 236 unq 0 iso 0 dist 9.89665 4.38595 6.84306 13.6852 4.88785 9.97357 11.247 7.68742 7.28249 6.36941 numMergedOcc 0
11 mol 236 unq 1 iso 0 dist 9.89665 11.247 7.68742 13.6852 4.88785 6.36941 4.38595 6.84306 7.28249 9.97357 numMergedOcc 0
12 mol 236 unq 2 iso 0 dist 9.05929 4.38595 8.35971 13.6852 16.5918 9.97357 11.247 11.2141 7.28249 6.36941 numMergedOcc 0
13 mol 236 unq 3 iso 0 dist 5.66569 11.2013 9.99038 8.20542 10.2557 9.97357 4.15973 6.27581 7.28249 6.36941 numMergedOcc 0
14 mol 236 unq 4 iso 0 dist 5.66569 4.15973 6.27581 8.20542 10.2557 6.36941 11.2013 9.99038 7.28249 9.97357 numMergedOcc 0
15 mol 236 unq 5 iso 0 dist 6.11137 15.1664 9.99038 12.2537 10.2557 9.97357 9.01197 6.27581 7.28249 6.36941 numMergedOcc 0
16 mol 236 unq 6 iso 0 dist 6.11137 9.01197 6.27581 12.2537 10.2557 6.36941 15.1664 9.99038 7.28249 9.97357 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 8.91612 5.11865 6.73034 12.3062 6.27022 7.71295 11.9866 11.6434 7.25988 7.80525 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 5.73834 7.52881 6.42289 12.3615 8.73372 7.9357 12.3042 10.1675 5.30627 5.79537 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 5.73834 7.52881 6.42289 9.52903 9.78068 8.81059 14.2753 17.2071 17.2075 9.67877 numMergedOcc 0
20 mol 258 unq 2 iso 0 dist 5.73834 7.52881 6.42289 9.52903 9.78068 8.81059 12.3042 10.1675 5.30627 9.12006 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 9.29635 10.8075 9.7748 6.70414 5.77904 8.35794 14.2115 12.5685 5.59609 9.84188 numMergedOcc 0
