D0RC4W AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 0.608 -2.924 -1.455 1.00 0.00 N HETATM 2 C UNL 1 0.305 -4.526 -2.327 1.00 0.00 C HETATM 3 C UNL 1 -0.708 -5.975 -1.461 1.00 0.00 C HETATM 4 C UNL 1 -1.425 -5.554 0.354 1.00 0.00 C HETATM 5 C UNL 1 -1.179 -3.981 0.935 1.00 0.00 C HETATM 6 C UNL 1 -0.059 -2.561 0.168 1.00 0.00 C HETATM 7 N UNL 1 -2.698 -5.713 -0.101 1.00 0.00 N HETATM 8 C UNL 1 -2.587 -4.789 -1.021 1.00 0.00 C HETATM 9 N UNL 1 -1.165 -4.049 -0.885 1.00 0.00 N HETATM 10 C UNL 1 -1.861 -3.259 -0.032 1.00 0.00 C HETATM 11 O UNL 1 -2.598 -2.333 -0.006 1.00 0.00 O HETATM 12 C UNL 1 0.538 -4.789 -0.092 1.00 0.00 C HETATM 13 C UNL 1 1.242 -4.434 1.163 1.00 0.00 C HETATM 14 C UNL 1 1.855 -5.324 2.091 1.00 0.00 C HETATM 15 C UNL 1 1.660 -6.660 1.926 1.00 0.00 C HETATM 16 C UNL 1 1.702 -7.001 0.616 1.00 0.00 C HETATM 17 C UNL 1 1.308 -6.033 -0.369 1.00 0.00 C HETATM 18 S UNL 1 -4.271 -4.245 -1.526 1.00 0.00 S HETATM 19 C UNL 1 -4.719 -3.646 -3.208 1.00 0.00 C HETATM 20 C UNL 1 -6.287 -3.776 -3.780 1.00 0.00 C HETATM 21 C UNL 1 -7.214 -2.521 -4.160 1.00 0.00 C HETATM 22 C UNL 1 -8.702 -2.850 -4.620 1.00 0.00 C HETATM 23 C UNL 1 -9.363 -3.970 -3.821 1.00 0.00 C HETATM 24 C UNL 1 -8.395 -5.136 -3.761 1.00 0.00 C HETATM 25 C UNL 1 -7.168 -4.713 -2.947 1.00 0.00 C HETATM 26 C UNL 1 1.524 -1.989 -2.063 1.00 0.00 C HETATM 27 O UNL 1 2.262 -2.488 -2.938 1.00 0.00 O HETATM 28 C UNL 1 1.735 -0.434 -1.666 1.00 0.00 C HETATM 29 C UNL 1 1.741 0.603 -2.905 1.00 0.00 C HETATM 30 N UNL 1 1.528 1.702 -1.924 1.00 0.00 N HETATM 31 C UNL 1 0.729 0.638 -1.133 1.00 0.00 C HETATM 32 C UNL 1 0.648 2.844 -2.342 1.00 0.00 C HETATM 33 C UNL 1 0.912 3.862 -3.498 1.00 0.00 C HETATM 34 C UNL 1 2.054 4.039 -4.296 1.00 0.00 C HETATM 35 C UNL 1 2.158 5.103 -5.281 1.00 0.00 C HETATM 36 C UNL 1 1.149 6.063 -5.458 1.00 0.00 C HETATM 37 C UNL 1 0.027 5.902 -4.632 1.00 0.00 C HETATM 38 C UNL 1 -0.107 4.820 -3.728 1.00 0.00 C HETATM 39 C UNL 1 1.122 7.271 -6.408 1.00 0.00 C HETATM 40 C UNL 1 2.069 7.453 -7.614 1.00 0.00 C HETATM 41 C UNL 1 1.682 8.693 -8.437 1.00 0.00 C HETATM 42 O UNL 1 0.759 9.454 -8.177 1.00 0.00 O HETATM 43 O UNL 1 2.508 8.839 -9.518 1.00 0.00 O HETATM 44 C UNL 1 2.219 9.970 -10.360 1.00 0.00 C HETATM 45 H UNL 1 1.296 -4.884 -2.643 1.00 0.00 H HETATM 46 H UNL 1 -0.256 -4.255 -3.227 1.00 0.00 H HETATM 47 H UNL 1 -0.257 -6.987 -1.458 1.00 0.00 H HETATM 48 H UNL 1 -1.512 -6.202 -2.182 1.00 0.00 H HETATM 49 H UNL 1 -0.600 -1.612 -0.018 1.00 0.00 H HETATM 50 H UNL 1 0.732 -2.125 0.801 1.00 0.00 H HETATM 51 H UNL 1 1.542 -3.441 1.470 1.00 0.00 H HETATM 52 H UNL 1 2.811 -5.001 2.520 1.00 0.00 H HETATM 53 H UNL 1 0.902 -7.163 2.543 1.00 0.00 H HETATM 54 H UNL 1 1.927 -8.033 0.333 1.00 0.00 H HETATM 55 H UNL 1 1.539 -6.408 -1.367 1.00 0.00 H HETATM 56 H UNL 1 -4.120 -4.262 -3.885 1.00 0.00 H HETATM 57 H UNL 1 -4.386 -2.610 -3.300 1.00 0.00 H HETATM 58 H UNL 1 -6.130 -4.252 -4.760 1.00 0.00 H HETATM 59 H UNL 1 -6.765 -1.935 -4.972 1.00 0.00 H HETATM 60 H UNL 1 -7.313 -1.858 -3.294 1.00 0.00 H HETATM 61 H UNL 1 -9.339 -1.954 -4.550 1.00 0.00 H HETATM 62 H UNL 1 -8.732 -3.132 -5.684 1.00 0.00 H HETATM 63 H UNL 1 -10.316 -4.285 -4.270 1.00 0.00 H HETATM 64 H UNL 1 -9.606 -3.614 -2.811 1.00 0.00 H HETATM 65 H UNL 1 -8.101 -5.415 -4.783 1.00 0.00 H HETATM 66 H UNL 1 -8.871 -6.014 -3.316 1.00 0.00 H HETATM 67 H UNL 1 -6.621 -5.604 -2.642 1.00 0.00 H HETATM 68 H UNL 1 -7.496 -4.186 -2.039 1.00 0.00 H HETATM 69 H UNL 1 2.675 -0.354 -1.086 1.00 0.00 H HETATM 70 H UNL 1 0.925 0.464 -3.623 1.00 0.00 H HETATM 71 H UNL 1 2.690 0.688 -3.440 1.00 0.00 H HETATM 72 H UNL 1 -0.309 0.491 -1.453 1.00 0.00 H HETATM 73 H UNL 1 0.744 0.805 -0.049 1.00 0.00 H HETATM 74 H UNL 1 0.649 3.497 -1.452 1.00 0.00 H HETATM 75 H UNL 1 -0.387 2.500 -2.454 1.00 0.00 H HETATM 76 H UNL 1 2.899 3.364 -4.179 1.00 0.00 H HETATM 77 H UNL 1 3.058 5.150 -5.892 1.00 0.00 H HETATM 78 H UNL 1 -0.780 6.635 -4.687 1.00 0.00 H HETATM 79 H UNL 1 -1.050 4.749 -3.188 1.00 0.00 H HETATM 80 H UNL 1 1.202 8.177 -5.788 1.00 0.00 H HETATM 81 H UNL 1 0.105 7.294 -6.829 1.00 0.00 H HETATM 82 H UNL 1 2.006 6.585 -8.276 1.00 0.00 H HETATM 83 H UNL 1 3.101 7.585 -7.276 1.00 0.00 H HETATM 84 H UNL 1 2.928 9.969 -11.195 1.00 0.00 H HETATM 85 H UNL 1 2.345 10.910 -9.811 1.00 0.00 H HETATM 86 H UNL 1 1.208 9.903 -10.776 1.00 0.00 H CONECT 1 2 6 26 CONECT 2 1 3 45 46 CONECT 3 2 4 47 48 CONECT 4 3 5 7 CONECT 5 4 6 10 CONECT 6 5 1 49 50 CONECT 7 4 8 CONECT 8 7 9 18 CONECT 9 8 10 12 CONECT 10 9 5 11 CONECT 11 10 CONECT 12 9 13 17 CONECT 13 12 14 51 CONECT 14 13 15 52 CONECT 15 14 16 53 CONECT 16 15 17 54 CONECT 17 16 12 55 CONECT 18 8 19 CONECT 19 18 20 56 57 CONECT 20 19 21 25 58 CONECT 21 20 22 59 60 CONECT 22 21 23 61 62 CONECT 23 22 24 63 64 CONECT 24 23 25 65 66 CONECT 25 24 20 67 68 CONECT 26 1 27 28 CONECT 27 26 CONECT 28 26 29 31 69 CONECT 29 28 30 70 71 CONECT 30 29 31 32 CONECT 31 30 28 72 73 CONECT 32 30 33 74 75 CONECT 33 32 34 38 CONECT 34 33 35 76 CONECT 35 34 36 77 CONECT 36 35 37 39 CONECT 37 36 38 78 CONECT 38 37 33 79 CONECT 39 36 40 80 81 CONECT 40 39 41 82 83 CONECT 41 40 42 43 CONECT 42 41 CONECT 43 41 44 CONECT 44 43 84 85 86 CONECT 45 2 CONECT 46 2 CONECT 47 3 CONECT 48 3 CONECT 49 6 CONECT 50 6 CONECT 51 13 CONECT 52 14 CONECT 53 15 CONECT 54 16 CONECT 55 17 CONECT 56 19 CONECT 57 19 CONECT 58 20 CONECT 59 21 CONECT 60 21 CONECT 61 22 CONECT 62 22 CONECT 63 23 CONECT 64 23 CONECT 65 24 CONECT 66 24 CONECT 67 25 CONECT 68 25 CONECT 69 28 CONECT 70 29 CONECT 71 29 CONECT 72 31 CONECT 73 31 CONECT 74 32 CONECT 75 32 CONECT 76 34 CONECT 77 35 CONECT 78 37 CONECT 79 38 CONECT 80 39 CONECT 81 39 CONECT 82 40 CONECT 83 40 CONECT 84 44 CONECT 85 44 CONECT 86 44 MASTER 0 0 0 0 0 0 0 0 86 0 86 0 END M END $$$$