0 mol 11 unq 0 iso 0 dist 6.09937 4.73237 8.68293 10.6838 13.5125 5.96346 9.94905 14.8738 6.84216 6.76736 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.07476 5.8961 6.84216 9.52695 6.76736 5.96346 11.7765 14.8738 8.68293 13.5125 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 9.04534 5.71129 6.58046 9.84802 8.84131 4.30695 11.8229 13.3327 8.01262 6.03873 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 9.04534 5.71129 6.58046 9.78754 6.51674 6.35398 11.8229 13.3327 8.01262 12.9584 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.6586 13.2653 8.23075 13.5984 12.2271 8.70827 13.2236 6.0925 4.7841 12.6431 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.6586 13.2653 8.23075 18.4559 12.2839 6.73939 13.2236 6.0925 4.7841 6.22954 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 6.3323 11.1132 7.44558 14.7325 9.63255 7.02927 14.9801 9.99088 8.11702 11.1265 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 6.3323 11.1132 7.44558 8.48774 4.0719 6.60933 14.9801 9.99088 8.11702 6.57741 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 7.08403 14.0364 7.02367 9.09263 5.40648 8.8822 15.267 10.8127 9.30832 15.5674 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 7.08403 14.0364 7.02367 5.37302 3.52111 9.66219 15.267 10.8127 9.30832 13.7232 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 6.01857 11.1675 7.42146 16.3287 10.5934 7.70232 14.563 9.77711 7.78789 6.05048 numMergedOcc 0
11 mol 117 unq 1 iso 0 dist 6.01857 11.1675 7.42146 17.054 11.9806 7.4671 14.563 9.77711 7.78789 4.42665 numMergedOcc 0
12 mol 117 unq 2 iso 0 dist 9.30187 6.7814 7.78789 12.6334 6.05048 7.70232 11.0312 9.77711 7.42146 10.5934 numMergedOcc 0
13 mol 117 unq 3 iso 0 dist 9.30187 6.7814 7.78789 10.3116 4.42665 7.4671 11.0312 9.77711 7.42146 11.9806 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 9.37245 4.12904 8.16252 9.62943 9.10855 9.07943 11.9872 3.25368 9.90947 9.82832 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 8.00063 12.1014 8.92592 8.90876 5.71136 7.44629 10.8516 3.44823 9.57452 5.46307 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 9.10344 4.41193 8.22001 8.95598 5.69882 6.42735 11.7036 10.045 9.84566 5.05856 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 7.49754 4.67262 4.66576 11.6475 6.78109 8.14332 12.6749 11.4531 9.09354 13.1121 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 7.68062 4.94196 6.1896 9.68811 5.34495 6.1951 10.7563 6.94905 6.09255 3.83106 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 9.60767 11.6193 5.4557 16.4974 7.26991 7.6595 17.4576 8.40845 7.12221 4.97531 numMergedOcc 0
