0 mol 42 unq 0 iso 0 dist 8.23258 5.85932 5.3502 8.35702 9.53458 11.7172 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 9.9795 8.82052 4.18004 11.5334 7.1589 10.6125 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 9.26438 9.9387 15.9335 12.3653 5.34214 19.9211 numMergedOcc 0
3 mol 111 unq 0 iso 0 dist 6.34542 6.90574 6.39411 6.40295 7.71107 9.84514 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 8.86938 5.9819 8.56707 13.5573 6.47042 12.0448 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 6.71293 5.93793 9.70339 7.72177 8.58188 13.5701 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 7.34207 6.03116 6.55507 6.03671 7.72144 10.8148 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 9.52413 6.59729 10.3944 12.1191 9.83476 13.6463 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 9.52413 6.59729 10.3944 10.0766 6.258 13.7851 numMergedOcc 0
9 mol 225 unq 0 iso 0 dist 9.93754 6.06105 10.6484 9.46577 6.6561 12.5052 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 9.2067 8.43941 5.27959 5.00301 7.99477 6.47194 numMergedOcc 0
11 mol 258 unq 1 iso 0 dist 9.2067 8.43941 5.27959 5.99575 7.86627 10.472 numMergedOcc 0
12 mol 258 unq 2 iso 0 dist 9.16078 8.43941 8.25921 5.99575 7.93574 10.472 numMergedOcc 0
13 mol 294 unq 0 iso 0 dist 7.77765 5.78275 12.0308 5.94806 9.13907 7.41079 numMergedOcc 0
