COMPND HMDB0060369 HETATM 1 C1 UNL 1 -2.955 0.814 -0.560 1.00 0.00 C HETATM 2 C2 UNL 1 -1.720 0.239 0.159 1.00 0.00 C HETATM 3 C3 UNL 1 -1.893 -0.353 1.445 1.00 0.00 C HETATM 4 O1 UNL 1 -3.123 -0.310 1.873 1.00 0.00 O HETATM 5 O2 UNL 1 -0.989 -0.938 2.269 1.00 0.00 O HETATM 6 C4 UNL 1 -0.561 0.309 -0.438 1.00 0.00 C HETATM 7 CL1 UNL 1 -0.627 1.097 -2.054 1.00 0.00 CL HETATM 8 C5 UNL 1 0.721 -0.158 0.038 1.00 0.00 C HETATM 9 O3 UNL 1 0.912 -0.724 1.117 1.00 0.00 O HETATM 10 C6 UNL 1 1.949 0.031 -0.803 1.00 0.00 C HETATM 11 C7 UNL 1 3.110 -0.555 -0.118 1.00 0.00 C HETATM 12 O4 UNL 1 3.101 -1.677 0.484 1.00 0.00 O HETATM 13 O5 UNL 1 4.331 0.160 -0.108 1.00 0.00 O HETATM 14 H1 UNL 1 -3.413 0.064 -1.204 1.00 0.00 H HETATM 15 H2 UNL 1 -2.613 1.727 -1.067 1.00 0.00 H HETATM 16 H3 UNL 1 -3.644 1.089 0.262 1.00 0.00 H HETATM 17 H4 UNL 1 -1.024 -1.910 2.602 1.00 0.00 H HETATM 18 H5 UNL 1 1.746 -0.628 -1.704 1.00 0.00 H HETATM 19 H6 UNL 1 2.128 1.071 -1.086 1.00 0.00 H HETATM 20 H7 UNL 1 4.563 0.652 -0.932 1.00 0.00 H CONECT 1 2 14 15 16 CONECT 2 3 6 6 CONECT 3 4 4 5 CONECT 5 17 CONECT 6 7 8 CONECT 8 9 9 10 CONECT 10 11 18 19 CONECT 11 12 12 13 CONECT 13 20 END