0 mol 54 unq 0 iso 0 dist 7.54869 9.93082 6.4484 7.72019 11.6538 16.0954 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 6.29729 9.93082 9.96705 7.72019 7.15034 16.0954 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 7.06827 9.43008 7.49784 7.96096 5.5517 12.7651 numMergedOcc 0
3 mol 63 unq 1 iso 0 dist 7.06827 7.63422 11.1633 7.96096 5.5517 14.1877 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 9.09856 8.07646 6.73735 9.38079 6.00473 3.88766 numMergedOcc 0
5 mol 130 unq 1 iso 0 dist 9.14697 8.07646 8.01932 9.38079 10.2148 3.88766 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.44721 7.83463 12.131 9.86726 12.0859 5.53314 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 5.44721 9.55375 14.928 9.86726 12.0859 10.9007 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.66832 7.99796 5.52883 8.54306 3.81541 6.18856 numMergedOcc 0
9 mol 196 unq 0 iso 0 dist 9.99721 9.36505 8.50224 5.71508 12.1426 12.8544 numMergedOcc 0
10 mol 196 unq 1 iso 0 dist 8.95053 9.36505 12.4046 5.71508 7.02978 12.8544 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 7.08106 6.19843 5.87279 8.90428 4.29623 4.73037 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 9.76857 6.42875 6.4057 8.55981 14.0085 7.99695 numMergedOcc 0
13 mol 230 unq 0 iso 0 dist 8.61375 9.94373 6.17246 6.43155 4.65404 8.76971 numMergedOcc 0
14 mol 256 unq 0 iso 0 dist 5.16817 8.96004 5.94495 6.87466 4.6374 3.96807 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 5.99069 7.83933 7.52936 9.22548 11.147 13.0664 numMergedOcc 0
16 mol 264 unq 1 iso 0 dist 5.99069 7.83933 7.52936 7.95116 10.0018 10.4666 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 7.67993 7.94609 5.82477 7.34607 13.7682 14.8481 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 8.03669 7.94609 7.15796 7.34607 11.879 14.8481 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 8.99319 8.35986 5.02767 8.22327 8.90741 6.79999 numMergedOcc 0
