0 mol 53 unq 0 iso 0 dist 6.70095 8.83047 5.75171 8.5021 6.52918 9.61785 5.86191 8.56916 6.2676 10.99 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.58027 5.14178 5.81309 6.82707 12.5165 9.43915 4.93697 10.2801 5.17145 8.4701 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 4.34694 5.14178 4.66422 6.82707 10.5011 9.43915 4.93697 7.47162 5.17145 8.4701 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.64686 6.07578 6.15669 7.99438 14.0351 10.3996 5.21981 6.30814 8.04168 10.8539 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 8.64686 6.07578 6.15669 7.99438 14.0351 10.3996 8.12985 7.318 5.70907 14.9591 numMergedOcc 0
5 mol 79 unq 2 iso 0 dist 8.64686 6.07578 6.15669 6.64915 13.4228 11.2341 5.21981 6.30814 8.04168 8.50427 numMergedOcc 0
6 mol 79 unq 3 iso 0 dist 8.64686 6.07578 6.15669 6.64915 13.4228 11.2341 8.12985 7.318 5.70907 14.7047 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.15664 5.22996 8.98815 8.96747 4.92054 12.0757 7.25403 11.295 7.0561 12.7637 numMergedOcc 0
8 mol 195 unq 0 iso 0 dist 7.2833 5.46768 4.52076 9.25935 8.71774 6.0634 4.79025 9.20541 6.34234 6.22742 numMergedOcc 0
9 mol 195 unq 1 iso 0 dist 7.2833 5.46768 4.52076 9.25935 8.71774 6.0634 6.01032 6.65077 7.87972 13.3723 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 8.48545 8.83751 10.4475 6.91534 9.08479 13.3917 3.28983 9.993 6.43209 8.95511 numMergedOcc 0
11 mol 239 unq 1 iso 0 dist 8.48545 8.83751 10.4475 8.67704 5.88166 14.4176 3.28983 9.993 6.43209 11.3228 numMergedOcc 0
12 mol 239 unq 2 iso 0 dist 8.48545 8.77688 5.68875 6.91534 9.08479 9.38172 3.28983 9.993 8.48769 8.95511 numMergedOcc 0
13 mol 239 unq 3 iso 0 dist 8.48545 8.77688 5.68875 8.67704 5.88166 9.33091 3.28983 9.993 8.48769 11.3228 numMergedOcc 0
14 mol 250 unq 0 iso 0 dist 7.89067 5.43238 4.67276 9.5746 10.6289 6.93529 5.17779 10.2736 6.93875 10.9081 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 8.8646 9.98606 16.41 9.54381 14.5123 8.62248 9.91008 18.5741 8.20485 9.63518 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 8.03486 7.5355 10.4013 9.29922 15.4124 8.43508 4.91802 8.34313 5.81528 7.17958 numMergedOcc 0
17 mol 284 unq 0 iso 0 dist 7.74965 5.68818 5.94174 4.87349 9.47092 9.97867 14.1802 13.4665 9.07503 18.8783 numMergedOcc 0
18 mol 284 unq 1 iso 0 dist 7.74965 5.68818 5.94174 4.87349 9.47092 9.97867 11.9492 13.0377 7.63256 16.5656 numMergedOcc 0
