0 mol 0 unq 0 iso 0 dist 6.8892 9.33581 9.9221 7.16694 9.16606 13.6092 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.8892 9.17422 6.20282 7.16694 9.16606 5.77454 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 8.68949 9.19009 14.0069 6.04779 7.74386 14.6655 numMergedOcc 0
3 mol 13 unq 0 iso 0 dist 9.11704 6.31087 4.79414 5.88082 9.20106 9.13498 numMergedOcc 0
4 mol 13 unq 1 iso 0 dist 9.11704 6.31087 4.79414 7.10396 7.76514 8.03374 numMergedOcc 0
5 mol 13 unq 2 iso 0 dist 9.11704 6.93633 7.64367 5.88082 9.20106 6.83525 numMergedOcc 0
6 mol 13 unq 3 iso 0 dist 9.11704 6.93633 7.64367 7.10396 7.76514 11.4234 numMergedOcc 0
7 mol 64 unq 0 iso 0 dist 6.3141 6.63043 11.6115 7.20844 9.27697 13.2171 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.8353 7.11654 11.1646 7.82218 5.92836 13.2018 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 7.86075 7.66395 5.7509 8.07672 7.62505 11.0609 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 9.52029 8.64731 5.13383 13.8486 9.23669 10.1463 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 4.81837 8.03228 9.41146 6.25023 7.25362 14.2048 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 6.43519 8.03228 4.52818 5.07259 8.27071 11.4068 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 9.01071 5.52821 4.74522 13.3781 7.449 9.83439 numMergedOcc 0
14 mol 239 unq 1 iso 0 dist 9.01071 5.52821 4.74522 14.2324 8.98789 9.82627 numMergedOcc 0
15 mol 239 unq 2 iso 0 dist 8.86185 5.52821 13.9081 10.1043 7.80073 15.2165 numMergedOcc 0
16 mol 244 unq 0 iso 0 dist 7.79787 8.47853 5.82417 8.64762 6.2667 9.09654 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 8.10903 8.58595 12.495 5.79358 8.73425 14.2523 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 7.25618 8.58595 11.0189 5.79358 9.65711 14.2523 numMergedOcc 0
