0 mol 17 unq 0 iso 0 dist 5.59897 6.60096 4.47542 8.02917 6.5643 10.2814 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 8.48847 7.21054 4.03124 3.8895 6.93011 7.48723 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 7.39043 9.5002 8.49357 5.59536 9.0807 5.51053 numMergedOcc 0
3 mol 152 unq 0 iso 0 dist 6.21275 9.06844 5.04815 6.37913 8.52131 12.6211 numMergedOcc 0
4 mol 182 unq 0 iso 0 dist 8.63031 9.68323 9.60932 7.27394 9.75791 15.1576 numMergedOcc 0
5 mol 182 unq 1 iso 0 dist 8.63031 9.68323 9.60932 13.3767 7.52751 16.5273 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 6.94326 9.53805 4.93748 8.19192 8.35588 13.1354 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 8.14122 8.87054 14.064 5.30972 6.58557 11.4954 numMergedOcc 0
8 mol 230 unq 0 iso 0 dist 9.17138 8.78693 4.32112 3.99194 7.51295 8.91416 numMergedOcc 0
9 mol 230 unq 1 iso 0 dist 8.59955 7.48445 6.33966 10.6497 5.48736 10.5714 numMergedOcc 0
10 mol 248 unq 0 iso 0 dist 7.72564 8.53033 6.71088 7.81282 9.99025 14.088 numMergedOcc 0
11 mol 265 unq 0 iso 0 dist 9.74602 7.49913 15.3261 13.876 6.04835 20.2931 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 7.32898 8.30714 11.7852 3.81217 8.82003 10.3734 numMergedOcc 0
