COMPND HMDB0245062 HETATM 1 N1 UNL 1 2.081 -0.945 -0.049 1.00 0.00 N HETATM 2 C1 UNL 1 0.658 -0.897 -0.023 1.00 0.00 C HETATM 3 N2 UNL 1 -0.121 -1.984 -0.018 1.00 0.00 N HETATM 4 C2 UNL 1 -1.462 -1.957 0.007 1.00 0.00 C HETATM 5 CL1 UNL 1 -2.379 -3.454 0.009 1.00 0.00 CL HETATM 6 N3 UNL 1 -2.053 -0.757 0.029 1.00 0.00 N HETATM 7 C3 UNL 1 -1.329 0.401 0.026 1.00 0.00 C HETATM 8 N4 UNL 1 -1.660 1.699 0.044 1.00 0.00 N HETATM 9 C4 UNL 1 -0.545 2.452 0.031 1.00 0.00 C HETATM 10 N5 UNL 1 0.498 1.613 0.004 1.00 0.00 N HETATM 11 C5 UNL 1 0.051 0.356 0.000 1.00 0.00 C HETATM 12 H1 UNL 1 2.600 -0.722 -0.904 1.00 0.00 H HETATM 13 H2 UNL 1 2.612 -1.213 0.818 1.00 0.00 H HETATM 14 H3 UNL 1 -0.461 3.541 0.039 1.00 0.00 H HETATM 15 H4 UNL 1 1.509 1.868 -0.013 1.00 0.00 H CONECT 1 2 12 13 CONECT 2 3 3 11 CONECT 3 4 CONECT 4 5 6 6 CONECT 6 7 CONECT 7 8 11 11 CONECT 8 9 9 CONECT 9 10 14 CONECT 10 11 15 END