0 mol 1 unq 0 iso 0 dist 9.40282 7.48521 6.86701 5.55208 5.84337 8.3673 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.36524 10.0272 7.18022 10.792 12.9926 8.87762 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 8.36524 6.65242 6.24711 10.792 12.9926 8.21762 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 5.84326 11.3819 9.2898 10.1446 6.60662 6.86162 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.27156 7.751 6.9103 9.00943 4.05764 5.6359 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 5.9651 4.60844 9.8703 10.165 11.0447 8.76815 numMergedOcc 0
6 mol 89 unq 0 iso 0 dist 8.56124 4.20641 7.47974 10.4878 12.1722 8.54514 numMergedOcc 0
7 mol 89 unq 1 iso 0 dist 8.85873 10.8883 5.51831 16.0502 7.8379 8.54514 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.5055 6.30012 7.22643 7.82774 4.28997 8.25027 numMergedOcc 0
9 mol 142 unq 0 iso 0 dist 8.86346 13.5413 7.81207 20.7517 12.444 9.64785 numMergedOcc 0
10 mol 142 unq 1 iso 0 dist 4.93681 9.85239 7.81207 16.6678 12.444 9.64785 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.73769 4.33589 5.37047 11.5538 6.99924 9.11877 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 5.21803 4.6728 7.37333 6.59061 4.7924 9.19254 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.09874 5.43915 8.59874 9.1484 5.10258 9.24772 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.77347 8.69152 6.61112 12.0103 6.15341 5.09756 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 9.93754 5.30128 6.50998 11.0035 9.6289 6.20862 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 9.93754 5.30128 6.50998 7.26267 5.92569 7.27888 numMergedOcc 0
17 mol 225 unq 2 iso 0 dist 9.93754 7.291 9.09424 7.26267 5.92569 9.0254 numMergedOcc 0
18 mol 225 unq 3 iso 0 dist 9.93754 15.2642 8.14831 12.8149 6.87089 4.58113 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 6.48196 5.17683 8.51625 11.8915 10.8561 7.86214 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 6.48196 5.17683 8.51625 6.59321 5.19558 5.29501 numMergedOcc 0
21 mol 233 unq 2 iso 0 dist 6.48196 5.17683 8.51625 9.80759 6.48373 8.81206 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 7.80612 8.97902 8.67156 12.9049 11.8651 6.02146 numMergedOcc 0
