0 mol 14 unq 0 iso 0 dist 8.31896 4.97366 8.25832 5.58255 6.45858 5.45641 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.07029 7.54726 8.6112 10.1933 6.88695 4.09495 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 6.82522 5.73392 8.36326 7.94986 8.69069 3.96825 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 6.82522 5.73392 8.36326 14.1188 9.65047 16.7208 numMergedOcc 0
4 mol 95 unq 2 iso 0 dist 9.89353 13.5149 8.36326 10.538 8.69069 3.96825 numMergedOcc 0
5 mol 95 unq 3 iso 0 dist 9.89353 13.5149 8.36326 9.70895 9.65047 16.7208 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 4.9418 12.2608 9.57953 5.88774 4.99966 8.44658 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 6.9952 4.18707 6.4879 4.4932 8.67193 4.07494 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 5.67586 9.67496 7.10223 4.97206 7.26897 10.2589 numMergedOcc 0
9 mol 171 unq 0 iso 0 dist 9.53702 15.7265 8.59783 6.71379 6.07091 9.22906 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.99093 7.15944 5.75545 15.3902 9.58911 8.58814 numMergedOcc 0
11 mol 187 unq 0 iso 0 dist 9.70054 11.1344 7.81168 13.9 9.36086 12.368 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 6.28071 9.31621 7.556 8.03208 6.25429 4.57882 numMergedOcc 0
13 mol 196 unq 1 iso 0 dist 6.28071 9.31621 7.556 4.07683 6.87731 6.70722 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 6.91126 9.7911 8.92054 6.70342 9.11256 5.23741 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 7.5977 5.56436 8.23739 5.43925 6.36911 4.37426 numMergedOcc 0
16 mol 257 unq 1 iso 0 dist 7.5977 5.56436 8.23739 10.056 7.82899 5.8531 numMergedOcc 0
17 mol 292 unq 0 iso 0 dist 8.99187 5.50542 8.35169 7.70638 9.64124 10.1669 numMergedOcc 0
18 mol 292 unq 1 iso 0 dist 8.99187 5.50542 8.35169 5.67679 9.30668 5.58251 numMergedOcc 0
19 mol 292 unq 2 iso 0 dist 7.60019 4.56764 8.35169 5.0721 7.53641 8.04474 numMergedOcc 0
20 mol 292 unq 3 iso 0 dist 7.60019 5.86441 7.7557 5.0721 7.53641 9.00118 numMergedOcc 0
