0 mol 1 unq 0 iso 0 dist 8.47429 8.93851 3.84685 9.40282 6.25854 9.98089 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.47429 8.93851 3.84685 9.35554 14.6429 15.6106 numMergedOcc 0
2 mol 2 unq 0 iso 0 dist 9.76215 9.49821 12.0525 7.99162 12.506 4.67907 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.12062 4.97286 5.70643 8.36524 15.5673 11.7949 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 7.7961 9.75898 15.9972 6.35333 5.16403 14.1805 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 6.26722 8.58727 14.3686 8.66715 12.7925 5.34829 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 6.26722 8.58727 14.3686 9.00172 12.7637 9.67676 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 6.26722 8.61597 6.37933 8.66715 12.7925 13.3831 numMergedOcc 0
8 mol 133 unq 3 iso 0 dist 6.26722 8.61597 6.37933 9.00172 12.7637 9.74121 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.49649 8.11189 9.69206 8.31276 15.5462 14.5913 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.49649 8.11189 9.69206 5.79157 6.36794 11.9734 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 8.49649 8.11189 9.69206 5.50687 5.73965 5.57177 numMergedOcc 0
12 mol 134 unq 3 iso 0 dist 8.49649 8.11189 9.69206 7.30919 11.0638 10.8108 numMergedOcc 0
13 mol 142 unq 0 iso 0 dist 7.99533 7.44118 4.58408 9.57509 4.00645 4.76849 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 6.22466 5.82681 7.99002 9.52413 11.7795 5.5366 numMergedOcc 0
15 mol 207 unq 0 iso 0 dist 9.13327 7.08146 4.73052 5.18312 5.66029 6.2409 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 6.3344 8.9906 9.9501 5.92907 4.1329 8.42394 numMergedOcc 0
17 mol 229 unq 0 iso 0 dist 4.38586 7.06416 3.99138 8.53615 8.65216 9.17 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 4.91191 8.08374 5.89828 6.48196 6.52848 11.2631 numMergedOcc 0
19 mol 233 unq 1 iso 0 dist 4.91191 8.2689 8.98176 6.48196 6.52848 4.80704 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 6.79115 8.74211 4.93347 5.77925 4.38595 5.03564 numMergedOcc 0
21 mol 237 unq 0 iso 0 dist 5.73318 9.07452 4.80051 9.59483 4.51174 4.88404 numMergedOcc 0
22 mol 241 unq 0 iso 0 dist 5.66945 9.89398 8.94039 6.90245 6.72492 10.8667 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 8.07113 7.43425 5.96176 9.80409 4.49913 6.75336 numMergedOcc 0
24 mol 271 unq 0 iso 0 dist 9.27556 9.22385 9.86334 7.9494 6.3252 5.71631 numMergedOcc 0
25 mol 271 unq 1 iso 0 dist 9.27556 6.56531 5.60228 7.9494 6.3252 5.27791 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 6.58667 4.66834 4.80425 9.38793 4.84657 8.31543 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 6.58667 8.90911 10.0416 9.38793 4.84657 10.6013 numMergedOcc 0
28 mol 277 unq 2 iso 0 dist 6.01542 4.66834 9.70521 9.38793 13.791 8.31543 numMergedOcc 0
29 mol 277 unq 3 iso 0 dist 6.01542 8.90911 8.11496 9.38793 13.791 10.6013 numMergedOcc 0
30 mol 278 unq 0 iso 0 dist 8.79625 9.23937 7.97433 9.91518 13.5373 14.0179 numMergedOcc 0
31 mol 278 unq 1 iso 0 dist 9.9609 9.23937 13.6514 9.91518 11.4765 14.0179 numMergedOcc 0
