0 mol 7 unq 0 iso 0 dist 8.57129 9.65595 12.8084 9.14481 15.2825 17.9163 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.5546 8.55721 7.87577 5.9925 4.30874 7.80518 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.5546 8.98361 16.9043 5.9925 4.30874 13.5661 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 9.5546 5.91778 14.3362 5.9925 4.30874 11.1406 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 9.71543 8.8747 13.6353 7.11094 13.8529 5.98393 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 9.71543 8.8747 13.6353 7.21175 11.575 14.0558 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 7.3603 8.8747 15.5845 7.11094 12.959 5.98393 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 7.3603 8.8747 15.5845 7.21175 5.82029 14.0558 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 8.70414 9.21293 9.46835 9.96122 5.25096 5.79309 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 8.67673 7.56295 13.7959 6.46256 9.45588 5.06947 numMergedOcc 0
10 mol 228 unq 0 iso 0 dist 7.42402 5.91099 5.09715 9.1622 7.05573 5.34702 numMergedOcc 0
11 mol 228 unq 1 iso 0 dist 7.63265 5.89089 7.4344 9.17984 5.84747 5.34643 numMergedOcc 0
12 mol 228 unq 2 iso 0 dist 7.56754 5.91099 7.20896 9.1622 5.70777 5.34702 numMergedOcc 0
13 mol 228 unq 3 iso 0 dist 7.22088 5.89089 5.35058 9.17984 7.18261 5.34643 numMergedOcc 0
14 mol 272 unq 0 iso 0 dist 8.19471 6.5986 11.0763 7.22413 4.78295 8.76783 numMergedOcc 0
15 mol 272 unq 1 iso 0 dist 4.98404 6.5986 4.4648 7.22413 8.26567 8.76783 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.2745 6.8828 10.1749 8.45131 5.10722 11.2254 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 9.2745 6.8828 10.1749 8.45131 5.10722 11.2254 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 9.2745 6.8828 10.1749 8.45131 5.10722 11.2254 numMergedOcc 0
