0 mol 28 unq 0 iso 0 dist 6.75443 9.02508 8.32838 6.18197 8.48456 13.0211 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 6.75443 8.44081 11.6229 6.18197 8.48456 14.5796 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 9.02508 6.75443 8.32838 13.6562 7.24073 14.5877 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 9.02508 8.44081 8.39028 13.6562 7.24073 12.8275 numMergedOcc 0
4 mol 28 unq 4 iso 0 dist 8.44081 6.75443 11.6229 12.3614 8.24422 17.5979 numMergedOcc 0
5 mol 28 unq 5 iso 0 dist 8.44081 6.75443 11.6229 9.5295 8.99724 15.9976 numMergedOcc 0
6 mol 28 unq 6 iso 0 dist 8.44081 9.02508 8.39028 12.3614 8.24422 12.7836 numMergedOcc 0
7 mol 28 unq 7 iso 0 dist 8.44081 9.02508 8.39028 9.5295 8.99724 14.1171 numMergedOcc 0
8 mol 32 unq 0 iso 0 dist 6.93878 6.32082 5.43691 7.68244 8.67141 10.757 numMergedOcc 0
9 mol 96 unq 0 iso 0 dist 6.29224 8.14767 5.82135 7.13132 8.71026 12.4392 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 8.6969 9.18318 3.39244 13.8647 7.14505 4.7588 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 9.18318 8.6969 3.39244 13.8647 4.7588 7.14505 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 7.94124 5.92298 3.39244 8.18784 7.14505 4.7588 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 5.92298 7.94124 3.39244 8.18784 4.7588 7.14505 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 8.63202 6.01062 11.6683 6.94063 4.59484 12.0059 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 5.70397 4.67361 6.15397 11.9426 8.27071 12.381 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 4.67361 5.70397 6.15397 4.69923 8.63185 10.13 numMergedOcc 0
17 mol 205 unq 2 iso 0 dist 4.67361 5.70397 6.15397 7.90201 7.25362 9.27861 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 9.73405 9.8444 16.8505 12.7026 7.75366 17.7543 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 8.78619 8.2245 6.44724 12.7099 8.98789 14.0716 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.39145 9.77903 15.3048 4.33589 9.24592 12.9689 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 9.39145 9.77903 15.3048 4.33589 9.24592 12.9689 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 9.39145 9.77903 15.3048 4.33589 9.24592 12.9689 numMergedOcc 0
