D0XY7C AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.350 -1.068 1.358 1.00 0.00 C HETATM 2 C UNL 1 1.173 -2.107 2.313 1.00 0.00 C HETATM 3 C UNL 1 -0.124 -2.637 2.568 1.00 0.00 C HETATM 4 C UNL 1 -1.245 -2.068 1.945 1.00 0.00 C HETATM 5 C UNL 1 -1.032 -1.012 1.035 1.00 0.00 C HETATM 6 C UNL 1 0.234 -0.510 0.756 1.00 0.00 C HETATM 7 O UNL 1 2.610 -0.608 1.077 1.00 0.00 O HETATM 8 N UNL 1 2.299 -2.546 3.072 1.00 0.00 N HETATM 9 C UNL 1 -2.652 -2.242 2.358 1.00 0.00 C HETATM 10 N UNL 1 -3.421 -1.179 2.359 1.00 0.00 N HETATM 11 C UNL 1 -4.608 -1.404 2.996 1.00 0.00 C HETATM 12 C UNL 1 -4.886 -2.739 3.235 1.00 0.00 C HETATM 13 S UNL 1 -3.453 -3.667 2.876 1.00 0.00 S HETATM 14 C UNL 1 -5.338 -0.173 3.386 1.00 0.00 C HETATM 15 C UNL 1 -6.112 -3.294 3.776 1.00 0.00 C HETATM 16 O UNL 1 -6.117 -4.649 3.844 1.00 0.00 O HETATM 17 O UNL 1 -7.086 -2.643 4.131 1.00 0.00 O HETATM 18 C UNL 1 2.496 -3.738 3.725 1.00 0.00 C HETATM 19 C UNL 1 3.768 -3.645 4.234 1.00 0.00 C HETATM 20 N UNL 1 4.288 -2.423 3.967 1.00 0.00 N HETATM 21 N UNL 1 3.382 -1.757 3.266 1.00 0.00 N HETATM 22 C UNL 1 2.875 -0.252 -0.284 1.00 0.00 C HETATM 23 C UNL 1 4.392 -0.011 -0.507 1.00 0.00 C HETATM 24 C UNL 1 5.195 -1.296 -0.241 1.00 0.00 C HETATM 25 C UNL 1 4.621 0.429 -1.964 1.00 0.00 C HETATM 26 C UNL 1 4.915 1.094 0.426 1.00 0.00 C HETATM 27 H UNL 1 -0.267 -3.386 3.341 1.00 0.00 H HETATM 28 H UNL 1 -1.888 -0.499 0.594 1.00 0.00 H HETATM 29 H UNL 1 0.306 0.367 0.123 1.00 0.00 H HETATM 30 H UNL 1 -6.413 -0.301 3.487 1.00 0.00 H HETATM 31 H UNL 1 -5.149 0.620 2.652 1.00 0.00 H HETATM 32 H UNL 1 -4.923 0.170 4.341 1.00 0.00 H HETATM 33 H UNL 1 -5.296 -5.039 3.500 1.00 0.00 H HETATM 34 H UNL 1 1.784 -4.543 3.715 1.00 0.00 H HETATM 35 H UNL 1 4.346 -4.390 4.768 1.00 0.00 H HETATM 36 H UNL 1 2.335 0.669 -0.532 1.00 0.00 H HETATM 37 H UNL 1 2.530 -1.056 -0.948 1.00 0.00 H HETATM 38 H UNL 1 4.820 -2.131 -0.842 1.00 0.00 H HETATM 39 H UNL 1 5.151 -1.589 0.812 1.00 0.00 H HETATM 40 H UNL 1 6.253 -1.155 -0.496 1.00 0.00 H HETATM 41 H UNL 1 4.210 -0.300 -2.671 1.00 0.00 H HETATM 42 H UNL 1 5.690 0.538 -2.182 1.00 0.00 H HETATM 43 H UNL 1 4.145 1.396 -2.164 1.00 0.00 H HETATM 44 H UNL 1 4.803 0.822 1.481 1.00 0.00 H HETATM 45 H UNL 1 4.381 2.036 0.261 1.00 0.00 H HETATM 46 H UNL 1 5.981 1.283 0.247 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 8 CONECT 3 2 4 27 CONECT 4 3 5 9 CONECT 5 4 6 28 CONECT 6 5 1 29 CONECT 7 1 22 CONECT 8 2 18 21 CONECT 9 4 10 13 CONECT 10 9 11 CONECT 11 10 12 14 CONECT 12 11 13 15 CONECT 13 12 9 CONECT 14 11 30 31 32 CONECT 15 12 16 17 CONECT 16 15 33 CONECT 17 15 CONECT 18 8 19 34 CONECT 19 18 20 35 CONECT 20 19 21 CONECT 21 20 8 CONECT 22 7 23 36 37 CONECT 23 22 24 25 26 CONECT 24 23 38 39 40 CONECT 25 23 41 42 43 CONECT 26 23 44 45 46 CONECT 27 3 CONECT 28 5 CONECT 29 6 CONECT 30 14 CONECT 31 14 CONECT 32 14 CONECT 33 16 CONECT 34 18 CONECT 35 19 CONECT 36 22 CONECT 37 22 CONECT 38 24 CONECT 39 24 CONECT 40 24 CONECT 41 25 CONECT 42 25 CONECT 43 25 CONECT 44 26 CONECT 45 26 CONECT 46 26 MASTER 0 0 0 0 0 0 0 0 46 0 46 0 END M END $$$$