COMPND 31272 AUTHOR GENERATED BY OPEN BABEL 2.3.2 HETATM 1 O LIG 1 -0.876 0.506 0.005 1.00 0.00 O HETATM 2 O LIG 1 -2.352 -1.271 -0.009 1.00 0.00 O HETATM 3 C LIG 1 1.516 0.413 0.020 1.00 0.00 C HETATM 4 C LIG 1 2.745 -0.493 0.009 1.00 0.00 C HETATM 5 C LIG 1 0.225 -0.392 0.010 1.00 0.00 C HETATM 6 C LIG 1 4.032 0.315 -0.025 1.00 0.00 C HETATM 7 C LIG 1 -2.116 -0.070 -0.004 1.00 0.00 C HETATM 8 C LIG 1 -3.174 0.992 -0.006 1.00 0.00 C HETATM 9 H LIG 1 1.533 1.065 0.902 1.00 0.00 H HETATM 10 H LIG 1 1.531 1.083 -0.849 1.00 0.00 H HETATM 11 H LIG 1 2.714 -1.153 -0.867 1.00 0.00 H HETATM 12 H LIG 1 2.743 -1.133 0.898 1.00 0.00 H HETATM 13 H LIG 1 0.183 -1.023 -0.886 1.00 0.00 H HETATM 14 H LIG 1 0.173 -1.029 0.900 1.00 0.00 H HETATM 15 H LIG 1 4.080 0.941 -0.921 1.00 0.00 H HETATM 16 H LIG 1 4.110 0.965 0.853 1.00 0.00 H HETATM 17 H LIG 1 4.899 -0.354 -0.031 1.00 0.00 H HETATM 18 H LIG 1 -3.075 1.611 -0.902 1.00 0.00 H HETATM 19 H LIG 1 -3.087 1.603 0.896 1.00 0.00 H HETATM 20 H LIG 1 -4.161 0.521 -0.016 1.00 0.00 H CONECT 1 5 7 CONECT 2 7 CONECT 3 4 5 9 10 CONECT 3 CONECT 4 3 6 11 12 CONECT 4 CONECT 5 1 3 13 14 CONECT 5 CONECT 6 4 15 16 17 CONECT 6 CONECT 7 1 2 8 CONECT 8 7 18 19 20 CONECT 8 CONECT 9 3 CONECT 10 3 CONECT 11 4 CONECT 12 4 CONECT 13 5 CONECT 14 5 CONECT 15 6 CONECT 16 6 CONECT 17 6 CONECT 18 8 CONECT 19 8 CONECT 20 8 MASTER 0 0 0 0 0 0 0 0 20 0 20 0 END