COMPND HMDB0060303 HETATM 1 O1 UNL 1 -3.704 0.254 1.111 1.00 0.00 O HETATM 2 C1 UNL 1 -3.177 0.058 -0.180 1.00 0.00 C HETATM 3 C2 UNL 1 -1.719 -0.232 -0.121 1.00 0.00 C HETATM 4 C3 UNL 1 -1.231 -1.516 -0.012 1.00 0.00 C HETATM 5 C4 UNL 1 0.118 -1.752 0.041 1.00 0.00 C HETATM 6 C5 UNL 1 1.031 -0.725 -0.013 1.00 0.00 C HETATM 7 C6 UNL 1 2.402 -0.994 0.043 1.00 0.00 C HETATM 8 C7 UNL 1 3.277 0.066 -0.015 1.00 0.00 C HETATM 9 C8 UNL 1 2.826 1.364 -0.124 1.00 0.00 C HETATM 10 C9 UNL 1 1.467 1.592 -0.176 1.00 0.00 C HETATM 11 C10 UNL 1 0.545 0.562 -0.122 1.00 0.00 C HETATM 12 C11 UNL 1 -0.818 0.798 -0.175 1.00 0.00 C HETATM 13 H1 UNL 1 -3.143 0.956 1.532 1.00 0.00 H HETATM 14 H2 UNL 1 -3.308 0.984 -0.774 1.00 0.00 H HETATM 15 H3 UNL 1 -3.725 -0.783 -0.638 1.00 0.00 H HETATM 16 H4 UNL 1 -1.902 -2.358 0.034 1.00 0.00 H HETATM 17 H5 UNL 1 0.524 -2.761 0.127 1.00 0.00 H HETATM 18 H6 UNL 1 2.722 -2.031 0.129 1.00 0.00 H HETATM 19 H7 UNL 1 4.350 -0.146 0.029 1.00 0.00 H HETATM 20 H8 UNL 1 3.519 2.213 -0.170 1.00 0.00 H HETATM 21 H9 UNL 1 1.101 2.620 -0.263 1.00 0.00 H HETATM 22 H10 UNL 1 -1.156 1.832 -0.262 1.00 0.00 H CONECT 1 2 13 CONECT 2 3 14 15 CONECT 3 4 4 12 CONECT 4 5 16 CONECT 5 6 6 17 CONECT 6 7 11 CONECT 7 8 8 18 CONECT 8 9 19 CONECT 9 10 10 20 CONECT 10 11 21 CONECT 11 12 12 CONECT 12 22 END