0 mol 7 unq 0 iso 0 dist 8.41173 7.38748 10.1841 5.20935 6.64582 10.7032 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 7.71924 5.36278 8.02814 4.10356 5.92844 7.28761 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 6.19262 8.80748 13.1875 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 7.8986 9.75299 8.49962 6.19262 8.80748 14.2666 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 7.24183 5.41357 7.05519 10.0177 8.80748 13.1875 numMergedOcc 0
5 mol 64 unq 3 iso 0 dist 7.24183 9.30042 8.49962 10.0177 8.80748 14.2666 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.92936 7.48556 4.97519 5.05394 5.52283 9.78757 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 5.92936 9.47045 9.95663 5.05394 5.52283 11.3128 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 5.92936 8.68218 6.87319 5.05394 5.52283 8.40154 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 8.4438 7.58027 9.96367 8.15716 5.52283 11.4491 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 8.4438 4.34694 9.65371 8.15716 5.52283 9.85641 numMergedOcc 0
11 mol 132 unq 0 iso 0 dist 8.15549 9.39389 10.8474 4.6147 7.17412 11.1945 numMergedOcc 0
12 mol 132 unq 1 iso 0 dist 8.15549 9.39389 10.8474 6.20797 5.69956 13.4052 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 7.60912 9.54337 6.50839 4.72814 7.2108 11.9271 numMergedOcc 0
14 mol 159 unq 1 iso 0 dist 7.60912 6.86212 8.83633 4.72814 7.2108 7.85744 numMergedOcc 0
15 mol 159 unq 2 iso 0 dist 7.60912 9.9368 13.4546 4.72814 7.2108 10.541 numMergedOcc 0
16 mol 165 unq 0 iso 0 dist 8.2197 7.21397 10.5947 12.3719 8.74203 16.0061 numMergedOcc 0
17 mol 165 unq 1 iso 0 dist 8.2197 7.21397 10.5947 8.46989 6.78432 14.4639 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 11.533 8.78286 6.93215 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 7.35148 6.39087 11.4142 3.96711 9.57951 7.01486 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 7.57716 6.50756 8.34243 8.9233 9.17067 14.4416 numMergedOcc 0
21 mol 223 unq 0 iso 0 dist 9.29204 6.97426 4.73988 7.62322 9.5824 10.4778 numMergedOcc 0
22 mol 223 unq 1 iso 0 dist 9.29204 8.87456 8.36102 7.62322 9.5824 11.8723 numMergedOcc 0
23 mol 223 unq 2 iso 0 dist 9.14789 6.97426 4.78255 7.62322 8.82318 10.4778 numMergedOcc 0
24 mol 223 unq 3 iso 0 dist 9.14789 8.87456 5.43913 7.62322 8.82318 11.8723 numMergedOcc 0
25 mol 229 unq 0 iso 0 dist 8.36396 7.48693 5.52342 8.08105 6.54801 9.80592 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 6.00654 9.01071 12.178 12.6605 9.42537 18.8992 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 6.00654 8.86185 8.20191 12.6605 9.42537 15.5233 numMergedOcc 0
28 mol 239 unq 2 iso 0 dist 9.59937 7.58554 5.94643 10.7751 6.71734 9.90442 numMergedOcc 0
29 mol 244 unq 0 iso 0 dist 6.51428 7.43391 4.69664 7.92205 6.26442 10.7079 numMergedOcc 0
30 mol 244 unq 1 iso 0 dist 6.51428 7.79787 13.4155 7.92205 6.26442 14.4395 numMergedOcc 0
31 mol 261 unq 0 iso 0 dist 6.41477 8.88741 10.1876 8.93055 9.17214 16.3353 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 9.63694 6.57444 13.1376 7.27987 9.27112 10.772 numMergedOcc 0
33 mol 266 unq 1 iso 0 dist 9.63694 7.9555 14.6225 7.27987 9.27112 14.6001 numMergedOcc 0
34 mol 281 unq 0 iso 0 dist 6.7897 6.58925 4.37855 8.71561 9.55134 11.4144 numMergedOcc 0
35 mol 283 unq 0 iso 0 dist 7.53773 9.243 6.85055 5.25699 5.7378 10.9067 numMergedOcc 0
36 mol 283 unq 1 iso 0 dist 7.13925 5.71075 7.75306 5.14397 6.91284 9.74502 numMergedOcc 0
