0 mol 54 unq 0 iso 0 dist 6.59893 9.06005 13.0997 8.02105 7.21717 14.414 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 7.84983 9.56737 4.81926 6.64072 5.93884 7.68678 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 9.56737 7.84983 4.81926 6.64072 7.68678 5.93884 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.26679 9.68526 15.7123 11.2253 9.24757 13.8696 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 7.26679 9.30776 12.016 11.2253 9.24757 13.0145 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 9.59261 6.67936 10.6225 5.24592 5.78706 5.59328 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 9.59261 8.25817 12.7411 5.24592 5.78706 7.5242 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 6.67936 9.59261 10.6225 5.24592 5.59328 5.78706 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 6.67936 8.25817 7.72877 5.24592 5.59328 7.5242 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 8.25817 9.59261 12.7411 5.24592 7.5242 5.78706 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 8.25817 6.67936 7.72877 5.24592 7.5242 5.59328 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 9.80678 9.43411 9.15076 12.8733 8.31932 16.7818 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 8.42445 7.25166 11.6284 12.5697 6.84011 15.5929 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 8.54461 7.83619 8.38345 7.91054 8.78276 7.96646 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 7.83619 8.54461 8.38345 7.91054 7.96646 8.78276 numMergedOcc 0
15 mol 231 unq 0 iso 0 dist 7.79865 6.14348 4.06055 7.00432 6.98875 6.54852 numMergedOcc 0
16 mol 231 unq 1 iso 0 dist 6.14348 7.79865 4.06055 7.00432 6.54852 6.98875 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 9.71281 9.2433 12.1984 6.18998 6.36341 12.0305 numMergedOcc 0
18 mol 249 unq 0 iso 0 dist 7.29898 5.78121 8.34718 10.4369 5.48118 10.0024 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 5.81927 6.09782 4.26007 7.15953 7.6595 10.8994 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 6.09782 5.81927 4.26007 8.01004 9.63959 10.3917 numMergedOcc 0
21 mol 273 unq 0 iso 0 dist 8.90885 9.96963 5.96724 5.06747 8.83865 9.18157 numMergedOcc 0
22 mol 273 unq 1 iso 0 dist 9.96963 8.90885 5.96724 5.06747 9.18157 8.83865 numMergedOcc 0
