0 mol 59 unq 0 iso 0 dist 9.28075 9.92545 6.55138 6.4125 9.41952 5.58384 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 9.1916 9.20898 14.0561 5.99599 8.29328 14.1783 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 9.1916 9.58823 5.45501 5.99599 8.29328 11.4228 numMergedOcc 0
3 mol 69 unq 2 iso 0 dist 9.1916 9.98026 4.02596 5.99599 8.29328 11.1433 numMergedOcc 0
4 mol 87 unq 0 iso 0 dist 8.21588 6.90483 5.6513 6.02518 6.97882 5.87906 numMergedOcc 0
5 mol 87 unq 1 iso 0 dist 8.21588 6.90483 5.6513 13.04 7.7858 12.9552 numMergedOcc 0
6 mol 87 unq 2 iso 0 dist 8.21588 7.67411 6.69874 6.02518 6.97882 10.4154 numMergedOcc 0
7 mol 87 unq 3 iso 0 dist 8.21588 7.67411 6.69874 13.04 7.7858 13.6844 numMergedOcc 0
8 mol 87 unq 4 iso 0 dist 6.62798 6.90483 7.41574 6.02518 9.4868 5.87906 numMergedOcc 0
9 mol 87 unq 5 iso 0 dist 6.62798 7.67411 3.66319 6.02518 9.4868 10.4154 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 7.40582 6.17537 5.88809 3.97579 5.37819 5.57712 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 7.90927 8.63253 6.43211 5.57291 9.22651 8.07962 numMergedOcc 0
12 mol 102 unq 1 iso 0 dist 7.90927 8.63253 6.43211 6.91222 5.32892 7.58908 numMergedOcc 0
13 mol 102 unq 2 iso 0 dist 7.90927 5.15752 6.93587 5.57291 9.22651 9.54857 numMergedOcc 0
14 mol 102 unq 3 iso 0 dist 7.90927 5.15752 6.93587 6.91222 5.32892 9.32058 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 7.58683 5.25485 4.81215 5.03245 9.46039 5.46716 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.35708 9.76509 9.79728 10.7753 5.31333 9.89709 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 7.70005 7.19347 5.21449 9.47932 8.80103 5.89788 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 8.76741 7.60093 11.1791 5.44668 7.78329 10.7871 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 7.29081 8.24507 4.62586 15.0113 9.80002 13.9604 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 7.29081 8.24507 4.62586 13.9951 6.73794 8.78928 numMergedOcc 0
