0 mol 1 unq 0 iso 0 dist 8.70365 9.56692 13.0376 8.19374 15.9896 8.56884 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.33719 9.56692 5.972 8.19374 11.5768 8.56884 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 8.37509 8.23769 7.05482 8.93161 14.0169 8.33604 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 8.07051 9.01727 7.59628 9.63729 13.6378 9.39469 numMergedOcc 0
4 mol 100 unq 1 iso 0 dist 8.07051 9.01727 7.59628 6.27843 6.78459 4.76815 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.39818 9.87854 8.00732 10.7944 11.3088 7.39889 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 9.39818 9.87854 8.00732 16.5599 17.6376 9.63176 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 9.39818 9.87854 8.00732 5.72463 10.517 7.44174 numMergedOcc 0
8 mol 119 unq 3 iso 0 dist 8.91758 6.41992 8.19286 5.78487 10.517 9.38288 numMergedOcc 0
9 mol 119 unq 4 iso 0 dist 8.91758 8.15125 10.5326 5.78487 10.517 6.19042 numMergedOcc 0
10 mol 119 unq 5 iso 0 dist 8.91758 8.15125 10.5326 13.4592 18.1993 8.43904 numMergedOcc 0
11 mol 124 unq 0 iso 0 dist 9.69841 7.87439 10.5858 6.27128 13.8916 6.83051 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 8.46837 9.89595 10.3893 6.52984 7.30021 6.27641 numMergedOcc 0
13 mol 189 unq 0 iso 0 dist 9.22035 7.17249 6.20044 6.67182 10.831 6.50241 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 9.00353 5.35423 6.18134 7.87106 12.2172 6.95408 numMergedOcc 0
15 mol 194 unq 1 iso 0 dist 9.00353 5.35423 6.18134 6.11703 14.7719 9.57538 numMergedOcc 0
16 mol 194 unq 2 iso 0 dist 9.00353 5.35423 6.18134 6.8726 14.1424 9.2285 numMergedOcc 0
17 mol 194 unq 3 iso 0 dist 9.00353 5.35423 6.18134 6.80685 11.2754 7.58278 numMergedOcc 0
18 mol 197 unq 0 iso 0 dist 6.66634 9.69154 5.92782 17.1306 11.0336 8.99696 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 8.80158 7.15628 9.29471 8.27402 15.26 7.34205 numMergedOcc 0
20 mol 294 unq 1 iso 0 dist 6.075 5.81774 7.47947 12.3326 14.5766 9.03492 numMergedOcc 0
21 mol 294 unq 2 iso 0 dist 5.27696 5.81774 5.08713 12.3326 13.9033 9.03492 numMergedOcc 0
