D0GR1X AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 0.702 0.145 0.084 1.00 0.00 N HETATM 2 C UNL 1 -0.185 1.111 -0.400 1.00 0.00 C HETATM 3 C UNL 1 0.113 1.704 -1.684 1.00 0.00 C HETATM 4 C UNL 1 1.429 2.015 -2.108 1.00 0.00 C HETATM 5 N UNL 1 2.471 2.411 -1.286 1.00 0.00 N HETATM 6 C UNL 1 2.575 1.793 0.064 1.00 0.00 C HETATM 7 C UNL 1 2.195 0.303 0.098 1.00 0.00 C HETATM 8 S UNL 1 -1.630 1.473 0.349 1.00 0.00 S HETATM 9 C UNL 1 3.077 -0.548 -0.879 1.00 0.00 C HETATM 10 C UNL 1 4.580 -0.537 -0.482 1.00 0.00 C HETATM 11 C UNL 1 5.564 -1.181 -1.477 1.00 0.00 C HETATM 12 C UNL 1 5.821 -0.464 -2.812 1.00 0.00 C HETATM 13 N UNL 1 6.373 0.879 -2.666 1.00 0.00 N HETATM 14 N UNL 1 -0.647 1.358 -2.747 1.00 0.00 N HETATM 15 N UNL 1 0.263 0.683 -3.471 1.00 0.00 N HETATM 16 C UNL 1 1.532 1.249 -3.271 1.00 0.00 C HETATM 17 C UNL 1 2.684 3.879 -1.161 1.00 0.00 C HETATM 18 C UNL 1 4.160 4.189 -1.463 1.00 0.00 C HETATM 19 C UNL 1 4.406 4.070 -2.965 1.00 0.00 C HETATM 20 C UNL 1 4.549 5.574 -0.958 1.00 0.00 C HETATM 21 C UNL 1 -0.027 -0.737 -3.701 1.00 0.00 C HETATM 22 C UNL 1 -0.989 -1.048 -4.856 1.00 0.00 C HETATM 23 C UNL 1 -0.324 -0.764 -6.198 1.00 0.00 C HETATM 24 C UNL 1 -1.426 -2.519 -4.796 1.00 0.00 C HETATM 25 H UNL 1 0.320 -0.281 0.920 1.00 0.00 H HETATM 26 H UNL 1 1.942 2.328 0.782 1.00 0.00 H HETATM 27 H UNL 1 3.603 1.921 0.431 1.00 0.00 H HETATM 28 H UNL 1 2.440 -0.065 1.101 1.00 0.00 H HETATM 29 H UNL 1 2.712 -1.579 -0.917 1.00 0.00 H HETATM 30 H UNL 1 3.024 -0.174 -1.897 1.00 0.00 H HETATM 31 H UNL 1 4.672 -1.080 0.467 1.00 0.00 H HETATM 32 H UNL 1 4.931 0.480 -0.281 1.00 0.00 H HETATM 33 H UNL 1 5.238 -2.203 -1.694 1.00 0.00 H HETATM 34 H UNL 1 6.534 -1.275 -0.966 1.00 0.00 H HETATM 35 H UNL 1 4.912 -0.424 -3.418 1.00 0.00 H HETATM 36 H UNL 1 6.555 -1.055 -3.377 1.00 0.00 H HETATM 37 H UNL 1 5.648 1.506 -2.315 1.00 0.00 H HETATM 38 H UNL 1 6.615 1.241 -3.582 1.00 0.00 H HETATM 39 H UNL 1 2.398 0.834 -3.773 1.00 0.00 H HETATM 40 H UNL 1 2.449 4.201 -0.137 1.00 0.00 H HETATM 41 H UNL 1 2.007 4.451 -1.807 1.00 0.00 H HETATM 42 H UNL 1 4.792 3.455 -0.950 1.00 0.00 H HETATM 43 H UNL 1 3.946 4.905 -3.503 1.00 0.00 H HETATM 44 H UNL 1 3.981 3.143 -3.365 1.00 0.00 H HETATM 45 H UNL 1 5.475 4.062 -3.174 1.00 0.00 H HETATM 46 H UNL 1 3.969 6.360 -1.441 1.00 0.00 H HETATM 47 H UNL 1 5.613 5.763 -1.150 1.00 0.00 H HETATM 48 H UNL 1 4.396 5.655 0.127 1.00 0.00 H HETATM 49 H UNL 1 -0.508 -1.082 -2.760 1.00 0.00 H HETATM 50 H UNL 1 0.913 -1.285 -3.782 1.00 0.00 H HETATM 51 H UNL 1 -1.890 -0.425 -4.773 1.00 0.00 H HETATM 52 H UNL 1 0.578 -1.372 -6.324 1.00 0.00 H HETATM 53 H UNL 1 -0.043 0.289 -6.283 1.00 0.00 H HETATM 54 H UNL 1 -1.005 -0.997 -7.025 1.00 0.00 H HETATM 55 H UNL 1 -0.565 -3.192 -4.878 1.00 0.00 H HETATM 56 H UNL 1 -2.118 -2.758 -5.611 1.00 0.00 H HETATM 57 H UNL 1 -1.937 -2.741 -3.853 1.00 0.00 H CONECT 1 2 7 25 CONECT 2 1 3 8 CONECT 3 2 4 14 CONECT 4 3 5 16 CONECT 5 4 6 17 CONECT 6 5 7 26 27 CONECT 7 6 1 9 28 CONECT 8 2 CONECT 9 10 7 29 30 CONECT 10 9 11 31 32 CONECT 11 10 12 33 34 CONECT 12 11 13 35 36 CONECT 13 12 37 38 CONECT 14 3 15 CONECT 15 14 16 21 CONECT 16 15 4 39 CONECT 17 5 18 40 41 CONECT 18 17 19 20 42 CONECT 19 18 43 44 45 CONECT 20 18 46 47 48 CONECT 21 15 22 49 50 CONECT 22 21 23 24 51 CONECT 23 22 52 53 54 CONECT 24 22 55 56 57 CONECT 25 1 CONECT 26 6 CONECT 27 6 CONECT 28 7 CONECT 29 9 CONECT 30 9 CONECT 31 10 CONECT 32 10 CONECT 33 11 CONECT 34 11 CONECT 35 12 CONECT 36 12 CONECT 37 13 CONECT 38 13 CONECT 39 16 CONECT 40 17 CONECT 41 17 CONECT 42 18 CONECT 43 19 CONECT 44 19 CONECT 45 19 CONECT 46 20 CONECT 47 20 CONECT 48 20 CONECT 49 21 CONECT 50 21 CONECT 51 22 CONECT 52 23 CONECT 53 23 CONECT 54 23 CONECT 55 24 CONECT 56 24 CONECT 57 24 MASTER 0 0 0 0 0 0 0 0 57 0 57 0 END M END $$$$