0 mol 59 unq 0 iso 0 dist 9.92545 6.4125 5.58384 9.28075 6.55138 9.41952 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 6.37408 9.04231 6.88786 10.276 9.86454 5.73908 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 6.37408 9.04231 6.88786 12.0433 6.30184 6.77421 numMergedOcc 0
3 mol 87 unq 0 iso 0 dist 6.90483 6.02518 5.87906 8.21588 5.6513 6.97882 numMergedOcc 0
4 mol 87 unq 1 iso 0 dist 6.90483 6.02518 5.87906 6.62798 7.41574 9.4868 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.17537 3.97579 5.57712 7.40582 5.88809 5.37819 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 8.63253 5.57291 8.07962 7.90927 6.43211 9.22651 numMergedOcc 0
7 mol 102 unq 1 iso 0 dist 8.63253 6.91222 7.58908 7.90927 6.43211 5.32892 numMergedOcc 0
8 mol 102 unq 2 iso 0 dist 5.15752 5.57291 9.54857 7.90927 6.93587 9.22651 numMergedOcc 0
9 mol 102 unq 3 iso 0 dist 5.15752 6.91222 9.32058 7.90927 6.93587 5.32892 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 7.66464 8.73594 6.32669 14.8258 7.38452 9.28415 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 8.32453 10.559 5.46716 10.8949 4.81215 9.46039 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 8.13798 4.49942 5.46716 10.3508 4.81215 9.46039 numMergedOcc 0
13 mol 143 unq 2 iso 0 dist 5.25485 5.03245 5.46716 7.58683 4.81215 9.46039 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.76509 10.7753 9.89709 9.35708 9.79728 5.31333 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 8.88323 5.23162 9.89938 10.8007 4.38458 9.50782 numMergedOcc 0
16 mol 217 unq 0 iso 0 dist 7.19347 9.47932 5.89788 16.5931 10.8948 8.72578 numMergedOcc 0
17 mol 217 unq 1 iso 0 dist 7.19347 9.47932 5.89788 7.70005 5.21449 8.80103 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 7.60093 5.18467 6.14732 12.6356 8.98279 9.87685 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 5.59326 5.29294 7.49024 10.8403 11.0588 7.51446 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 8.24507 13.9951 8.78928 7.29081 4.62586 6.73794 numMergedOcc 0
