0 mol 10 unq 0 iso 0 dist 8.98746 4.75564 6.77807 5.99743 7.60549 6.18431 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.50775 5.3532 5.72005 10.2259 3.73148 6.41656 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 7.50775 5.3532 5.72005 10.0722 6.08459 8.54034 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.36742 8.90517 8.97754 15.0906 12.5394 6.81793 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.48195 4.25802 7.34832 11.8292 9.10687 8.96684 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 7.07773 8.03682 7.34832 8.71284 9.10687 8.96684 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 8.99393 6.97552 5.4713 10.8303 3.57198 5.43693 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 9.67751 10.5737 7.71625 18.3177 12.8723 8.77355 numMergedOcc 0
8 mol 107 unq 0 iso 0 dist 9.4238 10.1326 6.49371 13.4299 8.49625 5.33764 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 8.41675 5.36267 8.49847 9.99644 4.94367 7.75314 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 7.74168 9.00263 9.92715 15.2013 17.5034 7.58337 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.62945 9.55695 9.34653 14.9169 13.2309 6.88127 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 7.26295 11.023 4.45769 9.819 3.7326 4.19371 numMergedOcc 0
13 mol 194 unq 1 iso 0 dist 7.26295 12.3736 8.99961 9.819 3.7326 9.71015 numMergedOcc 0
14 mol 194 unq 2 iso 0 dist 7.31316 11.023 5.89939 9.819 7.29209 4.19371 numMergedOcc 0
15 mol 194 unq 3 iso 0 dist 7.31316 12.3736 8.18853 9.819 7.29209 9.71015 numMergedOcc 0
16 mol 194 unq 4 iso 0 dist 8.9865 9.72284 5.89939 13.6378 7.29209 4.19371 numMergedOcc 0
17 mol 194 unq 5 iso 0 dist 8.9865 8.10284 8.18853 13.6378 7.29209 9.71015 numMergedOcc 0
18 mol 231 unq 0 iso 0 dist 6.8533 9.55173 8.48015 10.7108 4.02097 9.60504 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 7.54349 7.44658 7.62991 11.7647 11.8619 8.09509 numMergedOcc 0
20 mol 252 unq 1 iso 0 dist 7.38867 8.846 9.81261 9.1191 3.99887 8.09509 numMergedOcc 0
