COMPND 46173192 AUTHOR GENERATED BY OPEN BABEL 2.3.2 HETATM 1 S LIG 1 1.923 -0.056 -0.001 1.00 0.00 S HETATM 2 O LIG 1 10.615 -1.423 -0.001 1.00 0.00 O1- HETATM 3 N LIG 1 9.379 -0.781 0.001 1.00 0.00 N1+ HETATM 4 C LIG 1 5.164 -0.171 -0.000 1.00 0.00 C HETATM 5 C LIG 1 3.693 0.845 0.001 1.00 0.00 C HETATM 6 C LIG 1 6.796 0.554 0.001 1.00 0.00 C HETATM 7 C LIG 1 0.306 0.956 0.001 1.00 0.00 C HETATM 8 C LIG 1 8.326 -0.244 -0.002 1.00 0.00 C HETATM 9 H LIG 1 5.106 -0.799 0.889 1.00 0.00 H HETATM 10 H LIG 1 5.106 -0.796 -0.891 1.00 0.00 H HETATM 11 H LIG 1 3.735 1.474 -0.888 1.00 0.00 H HETATM 12 H LIG 1 3.735 1.472 0.892 1.00 0.00 H HETATM 13 H LIG 1 6.816 1.185 -0.888 1.00 0.00 H HETATM 14 H LIG 1 6.816 1.181 0.892 1.00 0.00 H HETATM 15 H LIG 1 -0.547 0.278 -0.000 1.00 0.00 H HETATM 16 H LIG 1 0.270 1.586 -0.888 1.00 0.00 H HETATM 17 H LIG 1 0.270 1.583 0.892 1.00 0.00 H CONECT 1 5 7 CONECT 2 3 CONECT 3 2 8 CONECT 4 5 6 9 10 CONECT 4 CONECT 5 1 4 11 12 CONECT 5 CONECT 6 4 8 13 14 CONECT 6 CONECT 7 1 15 16 17 CONECT 7 CONECT 8 3 6 CONECT 9 4 CONECT 10 4 CONECT 11 5 CONECT 12 5 CONECT 13 6 CONECT 14 6 CONECT 15 7 CONECT 16 7 CONECT 17 7 MASTER 0 0 0 0 0 0 0 0 17 0 17 0 END