0 mol 61 unq 0 iso 0 dist 7.63526 5.22908 6.94677 11.9454 9.25641 8.42799 18.4407 12.7481 16.2005 9.22002 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 6.02731 13.7005 8.2746 4.05764 4.74544 10.9596 4.85282 7.46975 15.5808 8.1599 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 6.65318 4.3613 8.48774 7.12509 6.60933 11.1132 14.2517 9.51381 17.5036 8.35636 numMergedOcc 0
3 mol 109 unq 1 iso 0 dist 6.65318 9.83914 9.53055 7.12509 6.60933 6.78736 14.2517 9.51381 11.9764 8.35636 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 5.7085 12.0115 9.66068 11.4228 8.8822 16.3524 16.4545 11.2266 16.285 8.89481 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.04937 4.62381 8.75431 7.79117 8.99399 10.7421 11.0698 5.73999 11.8884 6.40546 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.98622 9.70402 9.86988 8.48942 7.58957 7.59962 4.76012 4.92611 10.5788 6.38163 numMergedOcc 0
7 mol 171 unq 0 iso 0 dist 8.53734 12.6444 6.21194 11.071 9.61462 9.22906 7.7195 4.98945 8.59783 6.07091 numMergedOcc 0
8 mol 171 unq 1 iso 0 dist 6.08141 7.0159 6.21194 10.3893 9.61462 9.22906 8.30819 4.98945 8.59783 6.07091 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 6.38654 5.64063 7.26887 6.89249 8.94014 4.39639 14.4186 16.2294 13.7206 9.32451 numMergedOcc 0
10 mol 238 unq 1 iso 0 dist 9.77185 10.1782 7.26887 9.71057 8.94014 4.39639 14.1871 16.2294 13.7206 9.32451 numMergedOcc 0
11 mol 243 unq 0 iso 0 dist 7.24253 14.1451 8.55613 6.54531 7.49645 11.7757 5.1766 3.87679 12.2591 6.86162 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 7.41653 11.4452 8.63176 6.88723 9.63959 8.27707 10.577 5.32742 8.37512 9.59174 numMergedOcc 0
