D0HZ7J AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 3.427 -4.410 0.991 1.00 0.00 C HETATM 2 C UNL 1 2.390 -5.353 1.015 1.00 0.00 C HETATM 3 C UNL 1 1.075 -4.909 1.168 1.00 0.00 C HETATM 4 C UNL 1 0.904 -3.589 1.562 1.00 0.00 C HETATM 5 C UNL 1 2.010 -3.005 2.234 1.00 0.00 C HETATM 6 C UNL 1 3.220 -3.165 1.565 1.00 0.00 C HETATM 7 O UNL 1 2.608 -6.693 0.870 1.00 0.00 O HETATM 8 C UNL 1 3.822 -7.144 1.489 1.00 0.00 C HETATM 9 C UNL 1 2.146 -3.279 3.765 1.00 0.00 C HETATM 10 C UNL 1 3.115 -2.402 4.561 1.00 0.00 C HETATM 11 C UNL 1 0.211 -2.639 0.602 1.00 0.00 C HETATM 12 O UNL 1 0.470 -1.441 0.765 1.00 0.00 O HETATM 13 C UNL 1 2.574 -1.100 5.106 1.00 0.00 C HETATM 14 N UNL 1 1.650 -0.417 4.347 1.00 0.00 N HETATM 15 O UNL 1 3.064 -0.598 6.115 1.00 0.00 O HETATM 16 N UNL 1 -0.581 -3.088 -0.511 1.00 0.00 N HETATM 17 C UNL 1 -0.653 -2.044 -1.553 1.00 0.00 C HETATM 18 C UNL 1 -1.940 -1.292 -1.235 1.00 0.00 C HETATM 19 C UNL 1 -2.870 -2.467 -1.016 1.00 0.00 C HETATM 20 C UNL 1 -1.995 -3.464 -0.217 1.00 0.00 C HETATM 21 C UNL 1 -2.460 -4.883 -0.526 1.00 0.00 C HETATM 22 N UNL 1 -2.654 -5.566 -1.662 1.00 0.00 N HETATM 23 C UNL 1 -3.435 -6.679 -1.282 1.00 0.00 C HETATM 24 C UNL 1 -3.681 -6.576 0.071 1.00 0.00 C HETATM 25 O UNL 1 -3.066 -5.474 0.559 1.00 0.00 O HETATM 26 C UNL 1 -3.932 -7.822 -2.090 1.00 0.00 C HETATM 27 N UNL 1 -3.802 -7.744 -3.471 1.00 0.00 N HETATM 28 C UNL 1 -3.766 -8.948 -4.313 1.00 0.00 C HETATM 29 C UNL 1 -5.084 -9.655 -4.736 1.00 0.00 C HETATM 30 C UNL 1 -6.012 -8.844 -5.649 1.00 0.00 C HETATM 31 C UNL 1 -7.274 -9.594 -6.167 1.00 0.00 C HETATM 32 C UNL 1 -7.232 -10.442 -7.477 1.00 0.00 C HETATM 33 C UNL 1 -6.828 -11.928 -7.333 1.00 0.00 C HETATM 34 C UNL 1 -6.651 -12.671 -8.678 1.00 0.00 C HETATM 35 C UNL 1 -5.890 -11.864 -9.726 1.00 0.00 C HETATM 36 C UNL 1 -6.530 -10.495 -9.892 1.00 0.00 C HETATM 37 C UNL 1 -6.423 -9.743 -8.573 1.00 0.00 C HETATM 38 O UNL 1 -4.419 -8.815 -1.550 1.00 0.00 O HETATM 39 S UNL 1 1.103 1.122 4.676 1.00 0.00 S HETATM 40 C UNL 1 2.569 2.094 4.360 1.00 0.00 C HETATM 41 C UNL 1 2.291 3.581 4.426 1.00 0.00 C HETATM 42 O UNL 1 0.131 1.418 3.645 1.00 0.00 O HETATM 43 O UNL 1 0.735 1.213 6.069 1.00 0.00 O HETATM 44 H UNL 1 4.416 -4.675 0.630 1.00 0.00 H HETATM 45 H UNL 1 0.235 -5.547 0.920 1.00 0.00 H HETATM 46 H UNL 1 4.068 -2.509 1.734 1.00 0.00 H HETATM 47 H UNL 1 3.593 -7.990 2.144 1.00 0.00 H HETATM 48 H UNL 1 4.330 -6.399 2.117 1.00 0.00 H HETATM 49 H UNL 1 4.508 -7.477 0.705 1.00 0.00 H HETATM 50 H UNL 1 2.539 -4.307 3.853 1.00 0.00 H HETATM 51 H UNL 1 1.158 -3.292 4.236 1.00 0.00 H HETATM 52 H UNL 1 4.029 -2.165 4.008 1.00 0.00 H HETATM 53 H UNL 1 3.425 -2.975 5.449 1.00 0.00 H HETATM 54 H UNL 1 1.334 -0.744 3.426 1.00 0.00 H HETATM 55 H UNL 1 -0.731 -2.537 -2.530 1.00 0.00 H HETATM 56 H UNL 1 0.220 -1.382 -1.577 1.00 0.00 H HETATM 57 H UNL 1 -2.268 -0.618 -2.030 1.00 0.00 H HETATM 58 H UNL 1 -1.847 -0.712 -0.308 1.00 0.00 H HETATM 59 H UNL 1 -3.159 -2.874 -1.995 1.00 0.00 H HETATM 60 H UNL 1 -3.789 -2.199 -0.487 1.00 0.00 H HETATM 61 H UNL 1 -2.152 -3.270 0.852 1.00 0.00 H HETATM 62 H UNL 1 -4.245 -7.167 0.778 1.00 0.00 H HETATM 63 H UNL 1 -3.277 -6.936 -3.787 1.00 0.00 H HETATM 64 H UNL 1 -3.159 -9.689 -3.777 1.00 0.00 H HETATM 65 H UNL 1 -3.208 -8.674 -5.215 1.00 0.00 H HETATM 66 H UNL 1 -5.636 -9.987 -3.851 1.00 0.00 H HETATM 67 H UNL 1 -4.794 -10.561 -5.285 1.00 0.00 H HETATM 68 H UNL 1 -5.447 -8.416 -6.482 1.00 0.00 H HETATM 69 H UNL 1 -6.367 -7.988 -5.061 1.00 0.00 H HETATM 70 H UNL 1 -7.991 -8.788 -6.395 1.00 0.00 H HETATM 71 H UNL 1 -7.741 -10.169 -5.359 1.00 0.00 H HETATM 72 H UNL 1 -8.276 -10.474 -7.829 1.00 0.00 H HETATM 73 H UNL 1 -7.601 -12.461 -6.762 1.00 0.00 H HETATM 74 H UNL 1 -5.900 -12.016 -6.761 1.00 0.00 H HETATM 75 H UNL 1 -6.132 -13.623 -8.511 1.00 0.00 H HETATM 76 H UNL 1 -7.636 -12.930 -9.089 1.00 0.00 H HETATM 77 H UNL 1 -5.881 -12.392 -10.687 1.00 0.00 H HETATM 78 H UNL 1 -4.843 -11.750 -9.418 1.00 0.00 H HETATM 79 H UNL 1 -7.582 -10.604 -10.186 1.00 0.00 H HETATM 80 H UNL 1 -6.029 -9.931 -10.686 1.00 0.00 H HETATM 81 H UNL 1 -6.778 -8.716 -8.705 1.00 0.00 H HETATM 82 H UNL 1 -5.367 -9.697 -8.281 1.00 0.00 H HETATM 83 H UNL 1 2.923 1.824 3.359 1.00 0.00 H HETATM 84 H UNL 1 3.326 1.818 5.098 1.00 0.00 H HETATM 85 H UNL 1 1.505 3.869 3.722 1.00 0.00 H HETATM 86 H UNL 1 3.195 4.144 4.177 1.00 0.00 H HETATM 87 H UNL 1 1.969 3.874 5.430 1.00 0.00 H CONECT 1 2 6 44 CONECT 2 1 3 7 CONECT 3 2 4 45 CONECT 4 3 5 11 CONECT 5 4 6 9 CONECT 6 5 1 46 CONECT 7 2 8 CONECT 8 7 47 48 49 CONECT 9 5 10 50 51 CONECT 10 9 13 52 53 CONECT 11 4 12 16 CONECT 12 11 CONECT 13 10 14 15 CONECT 14 13 39 54 CONECT 15 13 CONECT 16 11 17 20 CONECT 17 16 18 55 56 CONECT 18 17 19 57 58 CONECT 19 18 20 59 60 CONECT 20 19 16 21 61 CONECT 21 20 22 25 CONECT 22 21 23 CONECT 23 22 24 26 CONECT 24 23 25 62 CONECT 25 24 21 CONECT 26 23 27 38 CONECT 27 26 28 63 CONECT 28 27 29 64 65 CONECT 29 28 30 66 67 CONECT 30 29 31 68 69 CONECT 31 30 32 70 71 CONECT 32 31 33 37 72 CONECT 33 32 34 73 74 CONECT 34 33 35 75 76 CONECT 35 34 36 77 78 CONECT 36 35 37 79 80 CONECT 37 36 32 81 82 CONECT 38 26 CONECT 39 14 40 42 43 CONECT 40 39 41 83 84 CONECT 41 40 85 86 87 CONECT 42 39 CONECT 43 39 CONECT 44 1 CONECT 45 3 CONECT 46 6 CONECT 47 8 CONECT 48 8 CONECT 49 8 CONECT 50 9 CONECT 51 9 CONECT 52 10 CONECT 53 10 CONECT 54 14 CONECT 55 17 CONECT 56 17 CONECT 57 18 CONECT 58 18 CONECT 59 19 CONECT 60 19 CONECT 61 20 CONECT 62 24 CONECT 63 27 CONECT 64 28 CONECT 65 28 CONECT 66 29 CONECT 67 29 CONECT 68 30 CONECT 69 30 CONECT 70 31 CONECT 71 31 CONECT 72 32 CONECT 73 33 CONECT 74 33 CONECT 75 34 CONECT 76 34 CONECT 77 35 CONECT 78 35 CONECT 79 36 CONECT 80 36 CONECT 81 37 CONECT 82 37 CONECT 83 40 CONECT 84 40 CONECT 85 41 CONECT 86 41 CONECT 87 41 MASTER 0 0 0 0 0 0 0 0 87 0 87 0 END M END $$$$