COMPND HMDB0245001 HETATM 1 N1 UNL 1 -2.722 -1.090 -0.136 1.00 0.00 N HETATM 2 C1 UNL 1 -1.593 -0.478 -0.080 1.00 0.00 C HETATM 3 N2 UNL 1 -0.473 -1.195 -0.024 1.00 0.00 N HETATM 4 C2 UNL 1 0.744 -0.620 0.037 1.00 0.00 C HETATM 5 N3 UNL 1 2.004 -1.082 0.099 1.00 0.00 N HETATM 6 C3 UNL 1 2.852 -0.042 0.142 1.00 0.00 C HETATM 7 N4 UNL 1 2.156 1.110 0.108 1.00 0.00 N HETATM 8 C4 UNL 1 0.842 0.846 0.043 1.00 0.00 C HETATM 9 C5 UNL 1 -0.327 1.540 -0.015 1.00 0.00 C HETATM 10 CL1 UNL 1 -0.255 3.291 -0.010 1.00 0.00 CL HETATM 11 N5 UNL 1 -1.488 0.865 -0.074 1.00 0.00 N HETATM 12 H1 UNL 1 -2.755 -2.129 -0.139 1.00 0.00 H HETATM 13 H2 UNL 1 -0.549 -2.253 -0.029 1.00 0.00 H HETATM 14 H3 UNL 1 3.943 -0.166 0.196 1.00 0.00 H HETATM 15 H4 UNL 1 -2.380 1.404 -0.118 1.00 0.00 H CONECT 1 2 2 12 CONECT 2 3 11 CONECT 3 4 13 CONECT 4 5 5 8 CONECT 5 6 CONECT 6 7 7 14 CONECT 7 8 CONECT 8 9 9 CONECT 9 10 11 CONECT 11 15 END