0 mol 6 unq 0 iso 0 dist 7.77032 6.23338 6.98764 7.60996 9.00426 7.29104 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 5.35469 3.86123 8.45034 8.95822 8.81141 12.221 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 6.68662 4.66619 9.76721 5.45556 7.43804 9.93763 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 9.11084 10.6589 9.76721 14.2929 7.43804 9.93763 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 9.38103 7.2983 6.00709 7.70407 5.06241 4.77736 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 6.13256 11.0627 6.00709 7.33135 5.06241 4.77736 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 9.12746 5.83041 7.11102 5.8069 7.3576 7.39536 numMergedOcc 0
7 mol 56 unq 1 iso 0 dist 9.12746 9.02154 8.48054 5.8069 7.3576 11.4735 numMergedOcc 0
8 mol 63 unq 0 iso 0 dist 8.65918 9.49238 8.20976 5.22335 9.82368 6.02306 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 7.0847 12.2484 8.79457 11.1659 7.38379 4.07807 numMergedOcc 0
10 mol 83 unq 1 iso 0 dist 7.0847 13.6357 9.25264 11.1659 7.38379 11.1783 numMergedOcc 0
11 mol 83 unq 2 iso 0 dist 5.8981 12.8549 8.79457 9.901 7.38379 4.07807 numMergedOcc 0
12 mol 83 unq 3 iso 0 dist 5.8981 6.82052 9.25264 9.901 7.38379 11.1783 numMergedOcc 0
13 mol 83 unq 4 iso 0 dist 8.57448 5.8771 9.94635 6.13867 7.09118 11.0193 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 7.10245 9.68695 5.11803 11.0127 9.29087 9.08676 numMergedOcc 0
15 mol 108 unq 0 iso 0 dist 6.55728 7.42635 6.23711 9.97657 9.54994 9.46026 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 9.62458 14.9303 9.64841 3.97123 6.49708 11.4158 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 9.64273 14.8648 9.5865 3.98367 6.45018 11.4182 numMergedOcc 0
18 mol 151 unq 0 iso 0 dist 5.37884 4.51635 8.13302 11.5023 9.07182 14.3361 numMergedOcc 0
19 mol 151 unq 1 iso 0 dist 5.37884 5.24414 5.11555 11.5023 9.07182 7.48212 numMergedOcc 0
20 mol 151 unq 2 iso 0 dist 5.37884 7.9137 8.29457 11.5023 9.07182 10.4263 numMergedOcc 0
21 mol 151 unq 3 iso 0 dist 6.24917 8.56008 8.13302 8.59029 9.07182 14.3361 numMergedOcc 0
22 mol 151 unq 4 iso 0 dist 6.24917 5.34678 5.11555 8.59029 9.07182 7.48212 numMergedOcc 0
23 mol 151 unq 5 iso 0 dist 6.24917 4.83603 8.29457 8.59029 9.07182 10.4263 numMergedOcc 0
24 mol 171 unq 0 iso 0 dist 5.54827 6.25206 9.2747 5.9285 7.75632 9.06963 numMergedOcc 0
25 mol 276 unq 0 iso 0 dist 8.34851 12.7549 6.11207 16.1562 9.2211 8.39039 numMergedOcc 0
26 mol 276 unq 1 iso 0 dist 9.97781 4.67753 6.11207 12.3609 9.2211 8.39039 numMergedOcc 0
