0 mol 1 unq 0 iso 0 dist 5.55208 5.99543 9.48433 9.35554 10.1549 9.00903 numMergedOcc 0
1 mol 52 unq 0 iso 0 dist 9.12055 11.2268 9.6112 9.00028 9.99897 7.34143 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 8.09741 6.75623 8.14057 7.96299 7.39819 5.83409 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 7.82774 5.61003 9.45717 7.5055 4.28997 6.82262 numMergedOcc 0
4 mol 142 unq 0 iso 0 dist 9.02319 7.17212 6.91573 11.9068 12.444 9.2313 numMergedOcc 0
5 mol 142 unq 1 iso 0 dist 9.02319 7.17212 6.91573 9.11832 7.18287 5.31024 numMergedOcc 0
6 mol 180 unq 0 iso 0 dist 8.63182 9.94 7.24785 16.2693 14.0966 9.62337 numMergedOcc 0
7 mol 182 unq 0 iso 0 dist 5.31957 5.4214 7.21035 11.8862 8.27436 9.31746 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 5.97162 9.40374 5.47189 10.8152 5.48717 7.54065 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 7.30288 4.8419 5.07968 10.5119 4.58603 9.41367 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 7.79058 9.84917 9.68636 15.4353 10.705 8.22528 numMergedOcc 0
11 mol 229 unq 1 iso 0 dist 7.79058 9.84917 9.68636 11.2852 5.6419 7.03423 numMergedOcc 0
12 mol 229 unq 2 iso 0 dist 7.79058 5.14312 7.81415 11.2852 5.6419 9.06952 numMergedOcc 0
13 mol 278 unq 0 iso 0 dist 8.33893 11.2037 8.62414 18.2275 12.2316 8.44326 numMergedOcc 0
14 mol 292 unq 0 iso 0 dist 6.59906 5.0721 6.87804 10.0145 11.634 8.2734 numMergedOcc 0
15 mol 292 unq 1 iso 0 dist 7.1839 5.0721 6.07571 10.0145 8.66797 8.2734 numMergedOcc 0
