0 mol 0 unq 0 iso 0 dist 9.42137 5.66453 6.26831 13.5016 5.47921 9.83355 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 8.70244 4.53373 8.41731 10.7159 5.44352 9.71239 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.7522 14.6525 8.44506 12.9904 11.1182 9.97991 numMergedOcc 0
3 mol 71 unq 0 iso 0 dist 8.85372 6.90782 7.77916 9.42315 6.44499 9.90053 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.58841 5.25697 4.79949 13.2925 6.71804 9.42735 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 8.58841 10.7962 7.27693 13.2925 6.71804 9.98078 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.9747 8.89866 7.26086 10.1506 11.8887 9.60416 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 4.50572 7.87523 7.26086 8.18252 11.8887 9.60416 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 4.98864 5.01124 5.74857 9.94634 7.12329 9.03491 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 7.95871 7.39793 5.74857 14.3885 7.12329 9.03491 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 8.32241 5.93497 9.46588 10.6754 5.50061 9.31118 numMergedOcc 0
11 mol 126 unq 1 iso 0 dist 8.32241 5.93497 9.46588 14.0573 13.2671 8.44104 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 5.87223 6.8255 6.29767 12.6164 9.83647 7.90906 numMergedOcc 0
13 mol 212 unq 1 iso 0 dist 8.062 11.009 6.29767 9.74234 9.83647 7.90906 numMergedOcc 0
14 mol 212 unq 2 iso 0 dist 8.70011 8.66123 6.29767 11.5925 9.83647 7.90906 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.51764 10.5029 6.38157 14.1717 5.68711 7.30003 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 5.36829 8.38755 6.38157 7.71569 5.68711 7.30003 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 5.89502 5.73565 7.77998 13.7611 13.1177 8.72947 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 7.15815 9.82329 7.77998 14.0946 13.1177 8.72947 numMergedOcc 0
19 mol 257 unq 0 iso 0 dist 7.82899 5.76954 9.95546 9.27027 6.64096 8.14632 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 9.54857 12.7168 8.55558 14.4165 11.2159 8.30744 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 6.42725 12.2782 8.59697 11.4709 5.43184 8.30744 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 7.36905 5.7394 7.52281 6.43775 6.46871 9.54836 numMergedOcc 0
23 mol 264 unq 1 iso 0 dist 6.83408 5.7394 6.42588 6.43775 6.62911 9.54836 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 8.49076 9.69449 7.44083 14.7123 7.26296 9.44207 numMergedOcc 0
25 mol 274 unq 1 iso 0 dist 9.65265 14.2269 7.4099 9.04647 5.56999 8.9766 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 9.77689 9.41779 6.57903 11.633 7.0797 9.06496 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 8.51931 12.4389 6.57903 15.491 7.0797 9.06496 numMergedOcc 0
