0 mol 33 unq 0 iso 0 dist 7.99091 8.43688 10.264 8.37901 7.07421 3.80563 10.4304 8.04019 10.1561 8.07619 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 7.99091 8.43688 10.264 8.37901 7.07421 3.80563 9.147 7.44828 14.8069 12.7461 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 7.32268 8.36667 8.99315 8.70964 5.09223 11.5923 6.69576 9.39278 11.0084 13.0693 numMergedOcc 0
3 mol 132 unq 0 iso 0 dist 7.73306 8.15549 5.6296 9.39389 8.41467 10.8474 8.91031 6.94745 10.1299 13.8199 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.54607 9.6582 7.72261 9.23104 7.21249 12.4825 11.5137 5.79195 6.00667 12.8531 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 8.54607 5.17734 4.27464 9.23104 7.21249 7.75771 11.5137 5.79195 8.00919 12.8531 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 8.54607 9.07294 16.2835 5.79195 11.5137 5.35551 7.21249 9.23104 15.2961 12.8531 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 5.9183 6.68364 9.74045 6.87456 7.75087 7.87375 6.57809 5.40826 12.8467 9.68834 numMergedOcc 0
8 mol 165 unq 0 iso 0 dist 9.13163 9.59989 14.676 6.85551 4.81643 9.94274 5.54803 5.99596 13.7887 6.89325 numMergedOcc 0
9 mol 165 unq 1 iso 0 dist 7.74717 8.2197 9.78341 7.21397 14.5599 10.5947 14.2908 6.85551 14.9361 21.2763 numMergedOcc 0
10 mol 165 unq 2 iso 0 dist 7.74717 9.59989 11.997 6.85551 14.2908 9.94274 14.5599 7.21397 18.7338 21.2763 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 8.40971 7.30965 9.583 6.2016 9.45543 5.21255 15.7405 9.69055 18.6797 16.6062 numMergedOcc 0
12 mol 192 unq 1 iso 0 dist 8.40971 7.30965 9.583 8.3453 5.39993 5.1366 15.7405 9.69055 18.6797 14.36 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 9.38418 7.00683 14.0964 9.52029 17.6365 8.61406 13.9005 9.38188 19.2873 23.2898 numMergedOcc 0
14 mol 229 unq 0 iso 0 dist 5.22312 8.36396 9.09385 7.48693 4.88762 5.52342 5.39195 7.39596 13.691 11.6255 numMergedOcc 0
15 mol 255 unq 0 iso 0 dist 7.20562 9.72048 5.17298 7.57779 4.80717 9.92518 4.03201 9.40767 11.497 9.21841 numMergedOcc 0
16 mol 276 unq 0 iso 0 dist 9.15041 9.68846 12.7102 9.87655 8.99762 4.97223 7.75603 7.60807 15.3804 13.1857 numMergedOcc 0
17 mol 293 unq 0 iso 0 dist 9.15753 8.42712 6.51518 6.42608 11.0181 8.14268 4.88851 9.65156 11.8618 10.2129 numMergedOcc 0
