0 mol 11 unq 0 iso 0 dist 9.04534 5.71129 6.58046 10.7838 3.56133 9.53002 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 5.70754 5.69927 8.4014 11.1074 11.1793 9.29358 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 8.93826 4.75787 6.09002 10.992 4.49303 6.93199 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 7.17695 6.21227 6.09002 10.3199 4.49303 6.93199 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.89667 5.3315 8.31381 9.97117 9.18438 6.73162 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.23055 4.56886 4.17838 11.2487 4.07336 7.96555 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 8.30746 5.1219 4.17838 11.2591 4.07336 7.96555 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 6.01857 11.1675 7.42146 8.0578 4.18875 7.20326 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 9.30187 6.7814 7.78789 8.78982 6.69019 7.20326 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.42225 7.38295 4.80684 8.95838 3.71283 7.39889 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 8.76449 6.91778 6.73617 11.9074 6.60281 8.33261 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 8.36182 6.91778 9.03544 11.9074 9.65163 8.33261 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 9.10344 4.41193 8.22001 10.7934 12.4034 9.52936 numMergedOcc 0
13 mol 188 unq 0 iso 0 dist 8.85223 6.04074 7.86092 10.8112 4.61059 6.90541 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 7.49754 7.78293 8.82761 13.1835 14.229 6.0965 numMergedOcc 0
15 mol 213 unq 1 iso 0 dist 7.49754 7.78293 8.82761 15.2728 14.9475 9.59129 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 7.68062 4.94196 6.1896 10.3296 4.24855 7.18041 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 7.68062 4.94196 6.1896 12.0113 10.7049 7.17547 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 4.90656 4.82768 5.1609 7.35476 3.72064 6.82208 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 8.1174 5.23741 8.08965 14.8164 14.2299 9.58736 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 6.61322 9.07364 8.03012 11.5077 6.93346 6.49982 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 6.69951 8.70769 8.25897 8.65525 11.0001 8.37865 numMergedOcc 0
