0 mol 8 unq 0 iso 0 dist 8.37509 6.27477 11.3728 7.55301 15.3607 8.99126 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.58467 9.15677 7.42841 15.7188 13.8686 6.73162 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 8.71965 7.06199 9.81959 6.56884 11.9181 7.41857 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 8.49367 7.68916 12.5654 10.6328 18.1613 7.18176 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 4.79868 7.95122 5.54966 10.7301 11.1124 8.33704 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 4.79868 9.74268 9.69588 10.7301 11.1124 7.92394 numMergedOcc 0
6 mol 70 unq 2 iso 0 dist 4.79868 9.74268 9.69588 11.7565 13.657 9.93423 numMergedOcc 0
7 mol 70 unq 3 iso 0 dist 4.79868 9.74268 9.69588 12.3296 15.3168 9.34122 numMergedOcc 0
8 mol 86 unq 0 iso 0 dist 9.34342 5.49793 4.98527 4.51657 9.54683 7.79359 numMergedOcc 0
9 mol 127 unq 0 iso 0 dist 6.46753 9.79448 9.75166 11.8721 8.03243 8.59981 numMergedOcc 0
10 mol 127 unq 1 iso 0 dist 6.46753 9.79448 9.75166 11.5439 14.4347 7.34519 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 6.30762 9.69757 11.8349 12.4356 15.3058 8.6243 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 8.46837 7.39961 9.97803 5.58352 11.6317 8.47155 numMergedOcc 0
13 mol 156 unq 1 iso 0 dist 8.46837 7.80643 5.0966 5.58352 11.6317 9.36805 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 7.01007 8.50904 9.78176 14.6248 18.142 9.31887 numMergedOcc 0
15 mol 175 unq 1 iso 0 dist 7.01007 7.04318 6.15969 6.61225 12.2829 9.0664 numMergedOcc 0
16 mol 182 unq 0 iso 0 dist 5.16184 6.31492 5.40949 5.37421 9.23118 6.73313 numMergedOcc 0
17 mol 182 unq 1 iso 0 dist 8.54162 7.8621 5.40949 13.0784 9.23118 6.73313 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 7.73616 7.69537 7.85135 11.3668 15.1149 8.19953 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 9.97669 4.96568 5.11366 6.67645 9.01586 6.34034 numMergedOcc 0
20 mol 282 unq 0 iso 0 dist 9.40138 7.90792 5.04235 6.63358 10.0733 7.32347 numMergedOcc 0
21 mol 282 unq 1 iso 0 dist 8.37963 7.90792 15.4482 6.63358 12.6326 7.32347 numMergedOcc 0
22 mol 284 unq 0 iso 0 dist 7.71744 9.26573 7.29392 13.5055 15.2882 8.41504 numMergedOcc 0
23 mol 284 unq 1 iso 0 dist 4.70976 9.26573 5.10189 13.5055 11.0411 8.41504 numMergedOcc 0
24 mol 293 unq 0 iso 0 dist 9.50932 8.90008 5.13597 11.8919 13.3178 8.56847 numMergedOcc 0
25 mol 294 unq 0 iso 0 dist 9.83824 9.6958 5.94839 5.66912 10.4745 7.34205 numMergedOcc 0
26 mol 294 unq 1 iso 0 dist 5.49473 9.6958 12.2027 5.66912 9.70794 7.34205 numMergedOcc 0
