0 mol 0 unq 0 iso 0 dist 9.92758 5.55156 7.88507 7.16694 13.7494 6.94181 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 9.70414 9.06397 5.82783 8.26107 10.9294 9.23497 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 6.0173 8.54845 5.02731 10.2322 12.3579 9.77018 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 7.41911 7.14865 6.13436 10.0636 14.5458 9.20523 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 8.86521 8.35604 10.7649 9.50302 14.4474 6.55511 numMergedOcc 0
5 mol 159 unq 0 iso 0 dist 7.14478 8.55431 8.60459 16.0092 17.7781 9.21254 numMergedOcc 0
6 mol 232 unq 0 iso 0 dist 9.32977 7.47238 6.64614 16.9546 14.6668 9.95045 numMergedOcc 0
7 mol 239 unq 0 iso 0 dist 9.50474 9.27989 14.3464 9.44182 11.0381 6.83046 numMergedOcc 0
8 mol 240 unq 0 iso 0 dist 8.99501 6.83069 15.1513 9.79222 15.8011 9.68888 numMergedOcc 0
9 mol 274 unq 0 iso 0 dist 6.08059 6.21831 5.55557 6.33183 11.5007 8.78883 numMergedOcc 0
10 mol 274 unq 1 iso 0 dist 8.04439 9.81087 10.9553 9.24343 10.1489 5.82876 numMergedOcc 0
11 mol 276 unq 0 iso 0 dist 7.76689 8.28881 13.8743 11.4303 18.8142 9.64575 numMergedOcc 0
12 mol 276 unq 1 iso 0 dist 7.07283 8.28881 7.16212 11.4303 13.7158 9.64575 numMergedOcc 0
