0 mol 43 unq 0 iso 0 dist 8.54999 14.3492 8.03754 20.9981 14.0204 8.80331 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.54999 14.3492 8.03754 20.2843 13.1056 6.20293 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.93939 6.34076 9.41049 6.04163 4.60412 5.93252 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 6.09318 4.81535 5.68286 10.9574 5.73349 7.9245 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.11115 9.7565 9.64673 8.27456 12.0894 7.27724 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 9.11115 9.7565 9.64673 15.5421 16.4832 8.03644 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 7.74102 10.3096 9.1146 15.8905 11.0256 7.11802 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 5.89811 5.06314 6.13878 7.86668 5.4508 6.18308 numMergedOcc 0
8 mol 234 unq 0 iso 0 dist 5.68265 5.44278 5.46736 10.3795 4.82695 8.34494 numMergedOcc 0
9 mol 234 unq 1 iso 0 dist 5.68265 5.44278 5.46736 7.17032 4.93623 6.56247 numMergedOcc 0
10 mol 234 unq 2 iso 0 dist 5.68265 5.44278 5.46736 12.069 11.7817 9.36357 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 7.61854 5.03598 5.90804 11.0371 13.6195 9.99038 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 7.61854 5.03598 5.90804 5.99137 7.45579 6.27581 numMergedOcc 0
13 mol 248 unq 0 iso 0 dist 9.37614 6.00666 8.98788 10.899 9.01779 9.56569 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 7.87577 6.60345 9.04358 11.1218 8.81588 6.60405 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 7.87577 6.60345 9.04358 5.31858 5.90131 6.42289 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 5.74302 5.85483 9.77784 6.85589 5.09097 7.73141 numMergedOcc 0
17 mol 261 unq 1 iso 0 dist 5.74302 4.31412 5.00128 10.2299 9.40373 8.02547 numMergedOcc 0
18 mol 261 unq 2 iso 0 dist 5.74302 4.31412 5.00128 6.85589 5.09097 8.43057 numMergedOcc 0
19 mol 261 unq 3 iso 0 dist 5.74302 4.31412 5.00128 6.68878 4.86901 6.05727 numMergedOcc 0
