0 mol 61 unq 0 iso 0 dist 5.97418 8.60577 6.44323 9.33927 9.12873 12.1803 numMergedOcc 0
1 mol 103 unq 0 iso 0 dist 8.70106 5.94478 10.2138 14.2575 8.10965 16.3885 numMergedOcc 0
2 mol 125 unq 0 iso 0 dist 4.81596 8.38646 6.06241 5.29844 6.31546 10.0351 numMergedOcc 0
3 mol 131 unq 0 iso 0 dist 8.95717 9.64856 7.14559 7.19035 8.89564 11.7668 numMergedOcc 0
4 mol 131 unq 1 iso 0 dist 8.95717 6.38977 11.3296 7.19035 8.89564 12.1672 numMergedOcc 0
5 mol 131 unq 2 iso 0 dist 8.95717 9.69757 15.665 7.19035 8.89564 13.952 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 7.14447 9.0339 11.6877 4.73274 5.52837 10.31 numMergedOcc 0
7 mol 132 unq 1 iso 0 dist 7.14447 8.48641 11.8999 4.73274 5.52837 11.4629 numMergedOcc 0
8 mol 132 unq 2 iso 0 dist 7.14447 6.23573 5.77316 4.73274 5.52837 7.84864 numMergedOcc 0
9 mol 136 unq 0 iso 0 dist 9.67457 6.53519 10.4141 13.4598 8.99371 16.377 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 6.45502 8.1504 5.16728 10.9769 8.6903 13.7921 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.98221 8.08787 9.13357 5.29106 8.72113 12.1539 numMergedOcc 0
12 mol 189 unq 0 iso 0 dist 9.20296 9.58744 6.36139 10.9007 9.40683 12.8253 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 7.83611 5.80867 11.3233 7.54337 8.73074 9.98332 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 8.89382 8.98617 4.68085 5.07803 8.50897 10.9949 numMergedOcc 0
15 mol 241 unq 1 iso 0 dist 8.89382 8.98617 4.68085 10.9305 8.10031 10.4109 numMergedOcc 0
16 mol 241 unq 2 iso 0 dist 8.89382 6.74552 10.8729 5.07803 8.50897 11.408 numMergedOcc 0
17 mol 241 unq 3 iso 0 dist 8.89382 6.74552 10.8729 10.9305 8.10031 15.4035 numMergedOcc 0
18 mol 252 unq 0 iso 0 dist 9.31855 9.78185 13.943 12.2252 8.85493 20.6832 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 8.27377 7.0247 12.8819 9.97671 8.2681 10.8682 numMergedOcc 0
