0 mol 20 unq 0 iso 0 dist 5.21143 8.36009 9.0513 10.4916 10.8442 7.5517 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 5.75338 8.36009 4.49878 10.4916 10.6535 7.5517 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.01993 7.39066 6.36636 15.9289 11.5353 9.41425 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 9.51503 8.32519 4.32751 6.70627 10.8514 9.71949 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 8.51206 8.85675 4.8632 4.89837 6.76575 9.67274 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 8.65004 6.79584 7.45152 13.5573 16.6731 9.34689 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 9.86487 6.79584 16.6124 13.5573 22.5139 9.34689 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 9.95168 7.12662 10.5341 5.6183 14.1959 7.12765 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 9.95168 9.38 15.3866 5.6183 14.1959 6.28471 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 6.01599 8.08259 12.8363 7.66951 13.3209 5.22104 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 5.42285 8.08259 5.64188 7.66951 7.46845 5.22104 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 6.71675 8.24035 5.05856 8.17791 10.0164 9.12454 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.34668 8.86574 15.131 7.72772 12.1418 8.46395 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.34668 8.86574 15.131 10.0766 17.9182 6.08596 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 8.76308 8.86574 5.39534 7.72772 5.45675 8.46395 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 8.76308 8.86574 5.39534 10.0766 11.0802 6.08596 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 9.84017 7.4717 3.3739 12.0469 10.6135 8.19578 numMergedOcc 0
17 mol 270 unq 0 iso 0 dist 6.97639 7.96508 6.72549 9.59807 11.8464 9.64524 numMergedOcc 0
