0 mol 46 unq 0 iso 0 dist 8.99557 11.6888 9.14996 13.9983 9.50444 14.3159 numMergedOcc 0
1 mol 46 unq 1 iso 0 dist 8.99557 5.79552 9.47718 13.9983 9.50444 10.8201 numMergedOcc 0
2 mol 46 unq 2 iso 0 dist 8.99557 14.6072 8.9459 13.9983 9.50444 4.72547 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 8.82074 8.61728 9.3664 5.18119 6.49521 11.3868 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 8.29369 8.86457 9.53794 15.0398 9.4486 18.0271 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 8.29369 7.59211 9.84346 15.0398 9.4486 18.5554 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 6.75455 10.6415 9.53794 14.0841 9.4486 18.0271 numMergedOcc 0
7 mol 78 unq 3 iso 0 dist 6.75455 5.13304 9.84346 14.0841 9.4486 18.5554 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 7.923 5.17317 8.36326 8.81193 9.49995 10.2414 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 8.54807 12.9313 8.36326 9.30974 9.49995 10.2414 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 9.9065 16.0236 8.06034 7.77418 8.23777 10.347 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 9.52341 8.57385 7.72434 9.62296 8.4733 13.0801 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 9.36038 12.1164 7.5447 18.0796 9.62943 14.0837 numMergedOcc 0
13 mol 163 unq 1 iso 0 dist 9.36038 18.4036 9.04757 18.0796 9.62943 6.09134 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 6.58221 11.3596 8.44483 11.5609 7.91434 13.754 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 6.58221 11.3596 8.44483 12.4099 7.79437 15.222 numMergedOcc 0
16 mol 169 unq 2 iso 0 dist 6.58221 11.6029 9.79864 11.5609 7.91434 9.38287 numMergedOcc 0
17 mol 169 unq 3 iso 0 dist 6.58221 11.6029 9.79864 12.4099 7.79437 13.8794 numMergedOcc 0
18 mol 169 unq 4 iso 0 dist 6.58221 10.4615 9.73241 11.5609 7.91434 4.80754 numMergedOcc 0
19 mol 169 unq 5 iso 0 dist 6.58221 10.4615 9.73241 12.4099 7.79437 8.15907 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 8.31953 12.5979 9.60643 9.4448 6.81257 5.04243 numMergedOcc 0
21 mol 278 unq 1 iso 0 dist 8.31953 13.4866 7.79408 9.4448 6.81257 4.74121 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 9.22345 10.9754 8.35169 10.1755 6.68863 9.58852 numMergedOcc 0
