0 mol 10 unq 0 iso 0 dist 8.50323 9.20508 9.43805 8.97985 3.96253 6.08667 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.50323 9.93682 5.98205 8.97985 3.96253 3.9383 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 6.42002 5.87364 4.6621 7.89835 13.1378 10.5097 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 6.42002 5.87364 4.6621 9.94205 14.7372 12.7656 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 6.42002 5.87364 4.6621 9.08453 11.8326 10.2902 numMergedOcc 0
5 mol 31 unq 0 iso 0 dist 9.14173 7.44056 6.35268 8.47797 12.3775 6.97727 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 4.44406 9.9451 10.9858 7.86479 4.03744 11.8894 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 9.01327 5.45873 6.59567 8.72835 15.1093 12.99 numMergedOcc 0
8 mol 91 unq 1 iso 0 dist 9.01327 6.97995 13.5142 8.72835 15.1093 6.34042 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.67848 6.45174 11.2032 5.93561 4.28346 7.14708 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 9.67848 6.45174 11.2032 5.33967 9.50699 9.91505 numMergedOcc 0
11 mol 109 unq 2 iso 0 dist 9.67848 8.46446 16.2359 5.93561 4.28346 13.0165 numMergedOcc 0
12 mol 109 unq 3 iso 0 dist 9.67848 8.46446 16.2359 5.33967 9.50699 7.60413 numMergedOcc 0
13 mol 123 unq 0 iso 0 dist 6.49558 7.36361 5.25923 6.49766 7.20593 10.9073 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 5.89342 6.07708 7.55884 5.82174 3.39015 4.60149 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 6.4064 9.13228 9.96392 8.90926 8.69874 13.4105 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 7.17252 9.13228 5.65874 8.90926 8.27421 13.4105 numMergedOcc 0
17 mol 196 unq 0 iso 0 dist 5.66536 6.23981 10.2325 4.48862 9.81062 5.40367 numMergedOcc 0
18 mol 196 unq 1 iso 0 dist 5.66536 5.92441 9.88583 4.48862 9.81062 6.70817 numMergedOcc 0
