COMPND HMDB0245258 HETATM 1 O1 UNL 1 2.732 0.762 -0.764 1.00 0.00 O HETATM 2 N1 UNL 1 2.043 -0.046 -0.124 1.00 0.00 N1+ HETATM 3 O2 UNL 1 2.684 -1.045 0.551 1.00 0.00 O1- HETATM 4 C1 UNL 1 0.605 0.093 -0.114 1.00 0.00 C HETATM 5 C2 UNL 1 -0.288 -0.722 0.546 1.00 0.00 C HETATM 6 C3 UNL 1 -1.541 -0.232 0.287 1.00 0.00 C HETATM 7 C4 UNL 1 -1.377 0.870 -0.524 1.00 0.00 C HETATM 8 O3 UNL 1 -0.100 1.005 -0.721 1.00 0.00 O HETATM 9 H1 UNL 1 -0.060 -1.591 1.158 1.00 0.00 H HETATM 10 H2 UNL 1 -2.511 -0.585 0.618 1.00 0.00 H HETATM 11 H3 UNL 1 -2.188 1.491 -0.912 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 4 CONECT 4 5 5 8 CONECT 5 6 9 CONECT 6 7 7 10 CONECT 7 8 11 END