COMPND HMDB0032593 HETATM 1 N1 UNL 1 4.509 0.045 0.036 1.00 0.00 N HETATM 2 N2 UNL 1 3.389 0.018 0.004 1.00 0.00 N1+ HETATM 3 C1 UNL 1 2.007 -0.002 -0.042 1.00 0.00 C HETATM 4 C2 UNL 1 1.306 -1.186 -0.172 1.00 0.00 C HETATM 5 C3 UNL 1 -0.073 -1.193 -0.217 1.00 0.00 C HETATM 6 C4 UNL 1 -0.819 -0.036 -0.135 1.00 0.00 C HETATM 7 C5 UNL 1 -2.317 -0.063 -0.185 1.00 0.00 C HETATM 8 O1 UNL 1 -2.833 -0.191 1.106 1.00 0.00 O HETATM 9 C6 UNL 1 -0.123 1.148 -0.005 1.00 0.00 C HETATM 10 C7 UNL 1 1.256 1.160 0.040 1.00 0.00 C HETATM 11 H1 UNL 1 1.909 -2.087 -0.235 1.00 0.00 H HETATM 12 H2 UNL 1 -0.595 -2.129 -0.319 1.00 0.00 H HETATM 13 H3 UNL 1 -2.740 0.767 -0.748 1.00 0.00 H HETATM 14 H4 UNL 1 -2.590 -1.002 -0.718 1.00 0.00 H HETATM 15 H5 UNL 1 -3.365 0.591 1.386 1.00 0.00 H HETATM 16 H6 UNL 1 -0.712 2.058 0.059 1.00 0.00 H HETATM 17 H7 UNL 1 1.794 2.103 0.143 1.00 0.00 H CONECT 1 2 2 2 CONECT 2 3 CONECT 3 4 4 10 CONECT 4 5 11 CONECT 5 6 6 12 CONECT 6 7 9 CONECT 7 8 13 14 CONECT 8 15 CONECT 9 10 10 16 CONECT 10 17 END