0 mol 11 unq 0 iso 0 dist 5.43238 8.73067 8.17605 4.79838 3.66215 6.76736 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.43238 9.09091 7.5901 5.25331 3.56133 6.51674 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.71914 8.2946 6.45654 9.29284 11.418 6.35031 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 7.71914 9.25346 11.9626 9.29284 11.418 5.50427 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.54797 7.34031 12.9941 8.44353 5.59994 11.6319 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 9.54797 7.34031 12.9941 6.11249 7.78417 5.39812 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 9.54797 7.34031 12.9941 7.86326 5.47187 8.55482 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 9.54797 7.34031 12.9941 4.74786 12.3016 3.50984 numMergedOcc 0
8 mol 48 unq 4 iso 0 dist 9.76285 8.58829 4.40229 7.08628 4.12075 6.34854 numMergedOcc 0
9 mol 48 unq 5 iso 0 dist 9.76285 7.281 13.0328 4.53565 12.2529 3.65036 numMergedOcc 0
10 mol 48 unq 6 iso 0 dist 9.76285 7.281 13.0328 8.53722 5.98272 11.611 numMergedOcc 0
11 mol 48 unq 7 iso 0 dist 9.76285 7.281 13.0328 6.15814 7.83821 5.37655 numMergedOcc 0
12 mol 48 unq 8 iso 0 dist 9.76285 7.281 13.0328 7.70284 5.51708 8.48119 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 8.39249 5.79343 6.76585 7.93956 12.4143 5.99273 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.55681 5.52683 6.76437 6.40751 10.3318 3.84623 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 6.2135 5.52683 5.39904 6.40751 5.72856 3.84623 numMergedOcc 0
16 mol 141 unq 2 iso 0 dist 6.2135 5.26989 8.7258 9.75587 5.09294 10.5099 numMergedOcc 0
17 mol 141 unq 3 iso 0 dist 6.2135 7.76442 6.67552 9.75587 5.09294 9.18464 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 9.40622 7.13252 14.048 7.61421 10.4087 13.4378 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 5.89018 9.55606 8.92711 7.76863 6.68247 9.16458 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 5.89018 7.10526 7.34293 4.51124 3.99343 3.85186 numMergedOcc 0
21 mol 204 unq 2 iso 0 dist 5.89018 7.10526 7.34293 8.41517 11.4601 9.61866 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 9.86861 7.10413 10.4271 8.49913 4.31097 9.85068 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 8.49841 7.43663 7.17691 5.69634 11.8096 6.67757 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 9.6101 7.43663 4.51304 5.69634 6.12476 6.67757 numMergedOcc 0
25 mol 234 unq 2 iso 0 dist 5.32183 7.94068 4.51304 6.81195 6.12476 6.67757 numMergedOcc 0
26 mol 234 unq 3 iso 0 dist 5.32183 7.22019 6.56416 6.81195 6.12476 3.64991 numMergedOcc 0
27 mol 235 unq 0 iso 0 dist 7.27958 7.95766 4.29892 9.11149 9.32678 6.82702 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 6.00721 8.90076 13.3255 8.71877 6.07223 13.8952 numMergedOcc 0
29 mol 238 unq 1 iso 0 dist 6.00721 6.62002 9.71156 8.71877 6.07223 12.856 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 7.25543 7.02079 7.4465 8.08777 3.78476 5.88357 numMergedOcc 0
31 mol 239 unq 1 iso 0 dist 7.25543 5.88802 6.76677 8.08777 3.78476 9.24057 numMergedOcc 0
32 mol 239 unq 2 iso 0 dist 8.53287 9.01462 12.0657 9.99181 14.8407 7.18773 numMergedOcc 0
33 mol 250 unq 0 iso 0 dist 8.86638 5.97993 6.40578 8.73744 3.70231 4.14699 numMergedOcc 0
34 mol 250 unq 1 iso 0 dist 5.94383 6.44252 6.40578 6.61917 3.70231 4.14699 numMergedOcc 0
35 mol 250 unq 2 iso 0 dist 7.88284 6.44252 9.48491 6.61917 6.14028 4.14699 numMergedOcc 0
36 mol 254 unq 0 iso 0 dist 6.03988 8.94909 6.6011 6.59989 6.19835 11.9238 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 8.49866 9.20749 11.0599 9.85661 15.8795 6.97575 numMergedOcc 0
