0 mol 34 unq 0 iso 0 dist 9.18109 6.44363 14.739 7.84627 9.52614 12.8352 numMergedOcc 0
1 mol 83 unq 0 iso 0 dist 8.48766 9.94635 5.97999 12.1829 7.02558 12.9488 numMergedOcc 0
2 mol 83 unq 1 iso 0 dist 6.55004 9.25264 6.31825 7.57208 8.81183 7.40801 numMergedOcc 0
3 mol 108 unq 0 iso 0 dist 6.79804 9.10985 13.2894 6.94601 7.52802 13.1677 numMergedOcc 0
4 mol 108 unq 1 iso 0 dist 6.79804 9.10985 13.2894 5.49549 8.1971 13.8476 numMergedOcc 0
5 mol 108 unq 2 iso 0 dist 6.79804 9.10985 13.2894 5.53105 7.84262 9.01604 numMergedOcc 0
6 mol 108 unq 3 iso 0 dist 6.79804 6.23711 9.59715 6.94601 7.52802 11.0818 numMergedOcc 0
7 mol 108 unq 4 iso 0 dist 6.79804 6.23711 9.59715 5.49549 8.1971 10.7039 numMergedOcc 0
8 mol 108 unq 5 iso 0 dist 6.79804 6.23711 9.59715 5.53105 7.84262 5.37466 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 5.43052 4.78944 7.33204 6.72551 7.24538 10.4551 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 9.44788 6.29634 12.8122 4.46648 9.40633 9.58147 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 9.44788 6.29634 12.8122 9.33725 9.42432 15.4917 numMergedOcc 0
12 mol 119 unq 2 iso 0 dist 9.44788 6.29634 12.8122 10.872 9.22776 16.2041 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 9.21256 4.80778 5.57013 13.9116 8.43088 10.3078 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 8.3243 6.58803 5.57013 15.5016 8.43088 10.3078 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 8.95239 9.96967 5.57013 17.2482 8.43088 10.3078 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 6.23615 6.31523 5.57013 4.70999 8.43088 10.3078 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 6.32669 6.18881 3.79724 5.05068 7.83578 6.48738 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 5.46716 8.58421 3.88898 11.6391 8.99696 11.482 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.71223 9.33272 13.0654 9.45075 8.43722 14.4081 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 4.90407 8.71535 8.27718 3.75614 6.41452 6.5546 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 5.45793 4.98888 3.85191 5.45575 9.29355 8.14526 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 5.45793 4.98888 3.85191 7.04297 7.87978 7.75803 numMergedOcc 0
23 mol 259 unq 2 iso 0 dist 5.45793 4.98888 3.85191 6.13878 6.13752 7.94491 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 9.33447 7.01175 9.68248 7.43132 8.14167 12.4802 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 3.90274 9.58747 8.62775 8.18304 8.14167 12.9901 numMergedOcc 0
26 mol 266 unq 2 iso 0 dist 3.90274 7.50074 9.68248 8.18304 8.14167 12.4802 numMergedOcc 0
