0 mol 21 unq 0 iso 0 dist 5.27589 11.3343 9.19322 16.0236 12.26 9.76497 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 4.78749 8.18324 8.88399 9.10173 6.08168 9.08536 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.11297 8.09674 9.26813 5.55764 5.80848 9.50403 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.26306 4.31415 7.6981 10.0867 6.07725 9.50681 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 8.35786 5.60117 7.09464 10.4514 6.61394 9.28353 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 5.8915 11.0367 8.10965 11.7177 8.17578 9.42064 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 7.6886 5.07153 7.39303 8.17621 8.55838 5.56645 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 7.94925 13.7855 8.20389 15.4175 8.04676 6.49794 numMergedOcc 0
8 mol 217 unq 0 iso 0 dist 5.98787 5.42117 6.86611 8.04881 5.62958 6.10085 numMergedOcc 0
9 mol 252 unq 0 iso 0 dist 6.70777 9.58249 7.56716 11.8216 5.1925 9.85857 numMergedOcc 0
10 mol 266 unq 0 iso 0 dist 6.20998 12.234 8.08479 20.9756 16.661 9.87436 numMergedOcc 0
11 mol 266 unq 1 iso 0 dist 6.20998 12.234 8.08479 11.5133 9.91179 7.27283 numMergedOcc 0
12 mol 266 unq 2 iso 0 dist 7.72433 9.83164 7.07099 12.3079 5.46443 6.25877 numMergedOcc 0
13 mol 266 unq 3 iso 0 dist 7.72433 9.83164 7.07099 17.6437 14.7075 8.35447 numMergedOcc 0
14 mol 280 unq 0 iso 0 dist 8.64546 5.45852 7.61357 12.4246 16.4761 9.79817 numMergedOcc 0
15 mol 280 unq 1 iso 0 dist 3.97964 4.78798 7.61357 14.5243 16.4761 9.79817 numMergedOcc 0
16 mol 280 unq 2 iso 0 dist 4.55639 4.85466 7.31523 12.4246 15.4348 8.71581 numMergedOcc 0
17 mol 280 unq 3 iso 0 dist 4.55639 5.45852 8.67836 12.4246 15.4348 9.79817 numMergedOcc 0
18 mol 280 unq 4 iso 0 dist 7.72152 9.78637 7.31523 14.5243 15.4348 8.71581 numMergedOcc 0
19 mol 280 unq 5 iso 0 dist 7.72152 4.78798 8.67836 14.5243 15.4348 9.79817 numMergedOcc 0
