D0X0ZC AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.710 1.046 1.620 1.00 0.00 C HETATM 2 C UNL 1 0.670 1.721 2.844 1.00 0.00 C HETATM 3 C UNL 1 1.848 2.079 3.511 1.00 0.00 C HETATM 4 C UNL 1 3.070 1.748 2.904 1.00 0.00 C HETATM 5 C UNL 1 3.156 1.112 1.662 1.00 0.00 C HETATM 6 C UNL 1 1.948 0.741 1.023 1.00 0.00 C HETATM 7 S UNL 1 4.652 2.014 3.509 1.00 0.00 S HETATM 8 C UNL 1 5.307 1.357 2.075 1.00 0.00 C HETATM 9 N UNL 1 4.457 0.920 1.186 1.00 0.00 N HETATM 10 N UNL 1 6.668 1.381 2.106 1.00 0.00 N HETATM 11 C UNL 1 7.576 1.120 1.141 1.00 0.00 C HETATM 12 C UNL 1 7.209 0.869 -0.292 1.00 0.00 C HETATM 13 O UNL 1 8.770 1.151 1.465 1.00 0.00 O HETATM 14 N UNL 1 -0.622 2.068 3.459 1.00 0.00 N1+ HETATM 15 O UNL 1 -1.652 1.730 2.861 1.00 0.00 O HETATM 16 O UNL 1 -0.601 2.679 4.536 1.00 0.00 O1- HETATM 17 H UNL 1 -0.208 0.752 1.111 1.00 0.00 H HETATM 18 H UNL 1 1.837 2.596 4.467 1.00 0.00 H HETATM 19 H UNL 1 1.979 0.220 0.069 1.00 0.00 H HETATM 20 H UNL 1 7.082 1.641 2.990 1.00 0.00 H HETATM 21 H UNL 1 6.141 0.845 -0.486 1.00 0.00 H HETATM 22 H UNL 1 7.648 -0.083 -0.603 1.00 0.00 H HETATM 23 H UNL 1 7.647 1.672 -0.895 1.00 0.00 H CONECT 1 2 6 17 CONECT 2 1 3 14 CONECT 3 2 4 18 CONECT 4 3 5 7 CONECT 5 4 6 9 CONECT 6 5 1 19 CONECT 7 4 8 CONECT 8 7 9 10 CONECT 9 8 5 CONECT 10 8 11 20 CONECT 11 10 12 13 CONECT 12 11 21 22 23 CONECT 13 11 CONECT 14 2 15 16 CONECT 15 14 CONECT 16 14 CONECT 17 1 CONECT 18 3 CONECT 19 6 CONECT 20 10 CONECT 21 12 CONECT 22 12 CONECT 23 12 MASTER 0 0 0 0 0 0 0 0 23 0 23 0 END M END $$$$