0 mol 2 unq 0 iso 0 dist 8.54182 7.29506 4.00237 4.8518 8.5893 5.74846 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 8.54182 7.29506 4.00237 7.12473 8.29974 4.93584 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 8.91798 9.75252 7.94369 8.69069 8.3189 14.7837 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 8.91798 5.27118 6.68853 8.69069 8.3189 10.6991 numMergedOcc 0
4 mol 27 unq 2 iso 0 dist 8.67055 8.16102 10.3125 7.7328 5.02965 10.6991 numMergedOcc 0
5 mol 27 unq 3 iso 0 dist 8.54422 9.75252 9.72913 8.69069 7.49305 14.7837 numMergedOcc 0
6 mol 27 unq 4 iso 0 dist 8.54422 5.27118 6.2181 8.69069 7.49305 10.6991 numMergedOcc 0
7 mol 27 unq 5 iso 0 dist 6.25236 8.16102 6.2181 7.7328 7.49305 10.6991 numMergedOcc 0
8 mol 59 unq 0 iso 0 dist 6.17977 8.90147 4.82623 7.57949 8.11934 6.10199 numMergedOcc 0
9 mol 59 unq 1 iso 0 dist 6.83083 6.9741 4.82623 5.27239 8.11934 6.10199 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 9.9065 7.87345 13.5745 8.88381 8.12196 16.1212 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 9.9065 9.01196 3.79749 8.88381 8.12196 10.0497 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 9.52341 9.11123 3.80816 9.20679 8.04669 10.6912 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 9.52341 9.11123 3.80816 9.58565 7.46162 10.3844 numMergedOcc 0
14 mol 153 unq 0 iso 0 dist 8.30572 5.17415 10.4694 10.1091 8.4455 13.2561 numMergedOcc 0
15 mol 153 unq 1 iso 0 dist 8.30572 8.379 9.20332 10.1091 8.4455 14.6593 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 8.01303 9.5648 5.09728 6.52044 6.00793 9.87581 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.83021 7.93815 5.18174 8.14015 9.21553 10.6483 numMergedOcc 0
18 mol 187 unq 0 iso 0 dist 5.95841 8.17194 3.86201 5.50745 5.14547 8.92454 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 8.59762 8.5458 10.8708 8.61424 6.02521 14.8201 numMergedOcc 0
20 mol 276 unq 0 iso 0 dist 9.63988 9.97709 8.55166 5.90125 6.11207 11.3055 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 8.99476 8.26365 12.4675 15.2655 9.61379 20.6899 numMergedOcc 0
