0 mol 45 unq 0 iso 0 dist 9.69419 10.4981 5.90391 6.74214 7.18002 4.98191 numMergedOcc 0
1 mol 45 unq 1 iso 0 dist 9.69419 5.04589 8.82771 6.74214 7.18002 3.76045 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 6.71884 5.56177 8.96223 9.96122 9.07741 7.15195 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 6.71884 5.56177 8.96223 5.32648 8.0388 4.09906 numMergedOcc 0
4 mol 55 unq 2 iso 0 dist 6.71884 5.56177 8.96223 12.7872 9.7883 11.4933 numMergedOcc 0
5 mol 55 unq 3 iso 0 dist 9.25575 16.9545 8.96223 13.0046 9.07741 7.15195 numMergedOcc 0
6 mol 55 unq 4 iso 0 dist 9.25575 16.9545 8.96223 14.8358 8.0388 4.09906 numMergedOcc 0
7 mol 55 unq 5 iso 0 dist 9.25575 16.9545 8.96223 9.78627 9.7883 11.4933 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 7.61405 13.9417 9.94312 5.86721 6.8173 12.3047 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 9.02174 6.98012 8.97683 9.52728 9.45247 9.59418 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 6.77889 10.3871 7.8034 5.906 6.94015 5.0614 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 8.22039 4.27597 9.98097 4.40012 7.43587 5.76787 numMergedOcc 0
12 mol 165 unq 0 iso 0 dist 6.35749 4.70469 6.31455 6.65543 9.93641 3.67488 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 6.02559 7.97595 7.02608 3.71345 7.69241 11.5221 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 6.02559 7.97595 7.02608 12.3716 8.56192 5.5435 numMergedOcc 0
15 mol 176 unq 2 iso 0 dist 6.02559 7.97595 7.02608 8.25138 7.77962 10.9534 numMergedOcc 0
16 mol 176 unq 3 iso 0 dist 6.02559 7.97595 7.02608 7.10617 8.6431 12.9083 numMergedOcc 0
17 mol 176 unq 4 iso 0 dist 8.12047 11.6044 7.02608 11.1744 7.69241 11.5221 numMergedOcc 0
18 mol 176 unq 5 iso 0 dist 8.12047 11.6044 7.02608 11.8836 8.56192 5.5435 numMergedOcc 0
19 mol 176 unq 6 iso 0 dist 8.12047 11.6044 7.02608 3.52268 7.77962 10.9534 numMergedOcc 0
20 mol 176 unq 7 iso 0 dist 8.12047 11.6044 7.02608 7.39809 8.6431 12.9083 numMergedOcc 0
21 mol 184 unq 0 iso 0 dist 8.57284 7.61145 5.13722 5.65165 8.98606 10.5517 numMergedOcc 0
22 mol 184 unq 1 iso 0 dist 5.34832 4.50907 5.13722 10.8625 8.98606 10.5517 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 9.47309 9.23449 4.99301 3.7422 6.04509 5.8264 numMergedOcc 0
24 mol 247 unq 0 iso 0 dist 9.69819 5.66757 9.48468 4.21655 9.42253 6.6862 numMergedOcc 0
25 mol 249 unq 0 iso 0 dist 8.9281 10.7575 5.66519 4.76162 9.38713 11.9148 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 8.13376 8.59148 9.2772 3.94409 8.75224 5.5217 numMergedOcc 0
27 mol 265 unq 0 iso 0 dist 5.14122 8.48131 8.19772 3.99477 6.80043 11.5884 numMergedOcc 0
