D05NBB AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 8.543 4.316 5.079 1.00 0.00 N HETATM 2 C UNL 1 8.072 5.484 4.628 1.00 0.00 C HETATM 3 N UNL 1 8.662 6.644 4.870 1.00 0.00 N HETATM 4 C UNL 1 9.932 6.557 5.308 1.00 0.00 C HETATM 5 C UNL 1 10.640 5.376 5.046 1.00 0.00 C HETATM 6 C UNL 1 9.836 4.335 5.462 1.00 0.00 C HETATM 7 C UNL 1 10.069 7.561 6.458 1.00 0.00 C HETATM 8 N UNL 1 10.779 7.489 7.666 1.00 0.00 N HETATM 9 C UNL 1 10.556 8.625 8.440 1.00 0.00 C HETATM 10 C UNL 1 9.639 9.421 7.794 1.00 0.00 C HETATM 11 C UNL 1 9.318 8.746 6.590 1.00 0.00 C HETATM 12 C UNL 1 11.169 8.964 9.765 1.00 0.00 C HETATM 13 C UNL 1 10.695 10.323 10.313 1.00 0.00 C HETATM 14 N UNL 1 9.659 11.033 9.564 1.00 0.00 N HETATM 15 C UNL 1 9.155 10.682 8.333 1.00 0.00 C HETATM 16 O UNL 1 8.353 11.407 7.756 1.00 0.00 O HETATM 17 C UNL 1 11.603 6.385 8.104 1.00 0.00 C HETATM 18 C UNL 1 10.991 4.949 3.607 1.00 0.00 C HETATM 19 C UNL 1 10.991 4.308 2.566 1.00 0.00 C HETATM 20 C UNL 1 10.695 3.323 1.496 1.00 0.00 C HETATM 21 C UNL 1 11.609 2.846 0.520 1.00 0.00 C HETATM 22 C UNL 1 11.274 1.745 -0.325 1.00 0.00 C HETATM 23 C UNL 1 9.969 1.236 -0.286 1.00 0.00 C HETATM 24 C UNL 1 9.012 1.833 0.514 1.00 0.00 C HETATM 25 C UNL 1 9.393 2.792 1.458 1.00 0.00 C HETATM 26 C UNL 1 12.143 1.115 -1.392 1.00 0.00 C HETATM 27 C UNL 1 13.649 1.218 -1.272 1.00 0.00 C HETATM 28 N UNL 1 14.195 0.207 -0.490 1.00 0.00 N HETATM 29 C UNL 1 15.523 -0.230 -0.544 1.00 0.00 C HETATM 30 C UNL 1 16.012 -0.945 0.594 1.00 0.00 C HETATM 31 C UNL 1 17.257 -1.601 0.563 1.00 0.00 C HETATM 32 C UNL 1 17.911 -1.623 -0.648 1.00 0.00 C HETATM 33 C UNL 1 17.762 -0.379 -1.341 1.00 0.00 C HETATM 34 C UNL 1 16.410 -0.007 -1.582 1.00 0.00 C HETATM 35 O UNL 1 14.279 2.088 -1.873 1.00 0.00 O HETATM 36 C UNL 1 17.907 -2.999 -1.501 1.00 0.00 C HETATM 37 N UNL 1 17.754 -4.419 -0.944 1.00 0.00 N HETATM 38 C UNL 1 17.671 -5.471 -2.058 1.00 0.00 C HETATM 39 C UNL 1 17.330 -6.996 -1.627 1.00 0.00 C HETATM 40 N UNL 1 16.168 -7.110 -0.713 1.00 0.00 N HETATM 41 C UNL 1 16.390 -6.096 0.349 1.00 0.00 C HETATM 42 C UNL 1 16.524 -4.636 -0.164 1.00 0.00 C HETATM 43 C UNL 1 15.973 -8.417 -0.023 1.00 0.00 C HETATM 44 C UNL 1 15.580 -9.694 -0.773 1.00 0.00 C HETATM 45 C UNL 1 18.515 0.915 -0.844 1.00 0.00 C HETATM 46 F UNL 1 19.233 0.723 0.298 1.00 0.00 F HETATM 47 F UNL 1 19.382 1.421 -1.762 1.00 0.00 F HETATM 48 F UNL 1 17.672 1.959 -0.545 1.00 0.00 F HETATM 49 N UNL 1 7.333 5.522 3.452 1.00 0.00 N HETATM 50 H UNL 1 10.253 3.359 5.696 1.00 0.00 H HETATM 51 H UNL 1 8.581 9.093 5.876 1.00 0.00 H HETATM 52 H UNL 1 12.259 9.000 9.669 1.00 0.00 H HETATM 53 H UNL 1 10.935 8.196 10.512 1.00 0.00 H HETATM 54 H UNL 1 10.313 10.209 11.337 1.00 0.00 H HETATM 55 H UNL 1 11.542 11.020 10.395 1.00 0.00 H HETATM 56 H UNL 1 9.338 11.934 9.898 1.00 0.00 H HETATM 57 H UNL 1 12.005 6.589 9.101 1.00 0.00 H HETATM 58 H UNL 1 12.428 6.280 7.400 1.00 0.00 H HETATM 59 H UNL 1 10.985 5.487 8.154 1.00 0.00 H HETATM 60 H UNL 1 12.568 3.345 0.391 1.00 0.00 H HETATM 61 H UNL 1 9.679 0.398 -0.921 1.00 0.00 H HETATM 62 H UNL 1 7.967 1.553 0.396 1.00 0.00 H HETATM 63 H UNL 1 8.639 3.118 2.171 1.00 0.00 H HETATM 64 H UNL 1 11.862 1.524 -2.373 1.00 0.00 H HETATM 65 H UNL 1 11.917 0.036 -1.458 1.00 0.00 H HETATM 66 H UNL 1 13.594 -0.258 0.148 1.00 0.00 H HETATM 67 H UNL 1 15.450 -0.939 1.522 1.00 0.00 H HETATM 68 H UNL 1 17.628 -2.148 1.420 1.00 0.00 H HETATM 69 H UNL 1 16.181 0.750 -2.340 1.00 0.00 H HETATM 70 H UNL 1 17.127 -2.859 -2.256 1.00 0.00 H HETATM 71 H UNL 1 18.889 -2.984 -1.989 1.00 0.00 H HETATM 72 H UNL 1 18.616 -5.492 -2.616 1.00 0.00 H HETATM 73 H UNL 1 16.886 -5.175 -2.770 1.00 0.00 H HETATM 74 H UNL 1 18.225 -7.435 -1.167 1.00 0.00 H HETATM 75 H UNL 1 17.125 -7.581 -2.536 1.00 0.00 H HETATM 76 H UNL 1 17.292 -6.362 0.920 1.00 0.00 H HETATM 77 H UNL 1 15.545 -6.123 1.044 1.00 0.00 H HETATM 78 H UNL 1 15.635 -4.377 -0.751 1.00 0.00 H HETATM 79 H UNL 1 16.544 -4.018 0.730 1.00 0.00 H HETATM 80 H UNL 1 15.132 -8.268 0.671 1.00 0.00 H HETATM 81 H UNL 1 16.842 -8.656 0.601 1.00 0.00 H HETATM 82 H UNL 1 14.662 -9.576 -1.356 1.00 0.00 H HETATM 83 H UNL 1 15.365 -10.478 -0.027 1.00 0.00 H HETATM 84 H UNL 1 16.378 -10.079 -1.410 1.00 0.00 H HETATM 85 H UNL 1 8.010 5.218 2.754 1.00 0.00 H HETATM 86 H UNL 1 7.217 6.525 3.312 1.00 0.00 H CONECT 1 2 6 CONECT 2 1 3 49 CONECT 3 2 4 CONECT 4 3 5 7 CONECT 5 4 6 18 CONECT 6 5 1 50 CONECT 7 4 8 11 CONECT 8 7 9 17 CONECT 9 8 10 12 CONECT 10 9 11 15 CONECT 11 10 7 51 CONECT 12 9 13 52 53 CONECT 13 12 14 54 55 CONECT 14 13 15 56 CONECT 15 14 10 16 CONECT 16 15 CONECT 17 8 57 58 59 CONECT 18 5 19 CONECT 19 18 20 CONECT 20 19 21 25 CONECT 21 20 22 60 CONECT 22 21 23 26 CONECT 23 22 24 61 CONECT 24 23 25 62 CONECT 25 24 20 63 CONECT 26 22 27 64 65 CONECT 27 26 28 35 CONECT 28 27 29 66 CONECT 29 28 30 34 CONECT 30 29 31 67 CONECT 31 30 32 68 CONECT 32 31 33 36 CONECT 33 32 34 45 CONECT 34 33 29 69 CONECT 35 27 CONECT 36 32 37 70 71 CONECT 37 36 38 42 CONECT 38 37 39 72 73 CONECT 39 38 40 74 75 CONECT 40 39 41 43 CONECT 41 40 42 76 77 CONECT 42 41 37 78 79 CONECT 43 40 44 80 81 CONECT 44 43 82 83 84 CONECT 45 33 46 47 48 CONECT 46 45 CONECT 47 45 CONECT 48 45 CONECT 49 2 85 86 CONECT 50 6 CONECT 51 11 CONECT 52 12 CONECT 53 12 CONECT 54 13 CONECT 55 13 CONECT 56 14 CONECT 57 17 CONECT 58 17 CONECT 59 17 CONECT 60 21 CONECT 61 23 CONECT 62 24 CONECT 63 25 CONECT 64 26 CONECT 65 26 CONECT 66 28 CONECT 67 30 CONECT 68 31 CONECT 69 34 CONECT 70 36 CONECT 71 36 CONECT 72 38 CONECT 73 38 CONECT 74 39 CONECT 75 39 CONECT 76 41 CONECT 77 41 CONECT 78 42 CONECT 79 42 CONECT 80 43 CONECT 81 43 CONECT 82 44 CONECT 83 44 CONECT 84 44 CONECT 85 49 CONECT 86 49 MASTER 0 0 0 0 0 0 0 0 86 0 86 0 END M END $$$$