D02CJU AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 4.103 9.644 5.240 1.00 0.00 C HETATM 2 C UNL 1 2.730 9.368 5.220 1.00 0.00 C HETATM 3 C UNL 1 2.194 8.374 6.041 1.00 0.00 C HETATM 4 C UNL 1 3.095 7.510 6.681 1.00 0.00 C HETATM 5 C UNL 1 4.479 7.656 6.522 1.00 0.00 C HETATM 6 C UNL 1 5.006 8.785 5.890 1.00 0.00 C HETATM 7 C UNL 1 0.736 8.336 6.330 1.00 0.00 C HETATM 8 C UNL 1 0.144 7.165 6.630 1.00 0.00 C HETATM 9 C UNL 1 -0.006 9.653 6.391 1.00 0.00 C HETATM 10 C UNL 1 -1.260 7.073 7.084 1.00 0.00 C HETATM 11 O UNL 1 -2.179 7.691 6.574 1.00 0.00 O HETATM 12 N UNL 1 -1.374 6.239 8.166 1.00 0.00 N HETATM 13 C UNL 1 -2.634 6.087 8.892 1.00 0.00 C HETATM 14 C UNL 1 -3.049 4.633 8.725 1.00 0.00 C HETATM 15 C UNL 1 -4.177 4.119 9.591 1.00 0.00 C HETATM 16 C UNL 1 -5.153 5.149 10.064 1.00 0.00 C HETATM 17 C UNL 1 -4.871 6.340 10.740 1.00 0.00 C HETATM 18 N UNL 1 -3.635 6.991 11.038 1.00 0.00 N HETATM 19 C UNL 1 -2.475 6.715 10.322 1.00 0.00 C HETATM 20 C UNL 1 -5.920 7.158 11.151 1.00 0.00 C HETATM 21 C UNL 1 -5.444 8.312 11.942 1.00 0.00 C HETATM 22 C UNL 1 -3.981 8.441 11.465 1.00 0.00 C HETATM 23 C UNL 1 -6.491 4.915 9.712 1.00 0.00 C HETATM 24 C UNL 1 -7.442 5.917 9.867 1.00 0.00 C HETATM 25 C UNL 1 -7.218 6.962 10.738 1.00 0.00 C HETATM 26 C UNL 1 -3.430 9.450 12.562 1.00 0.00 C HETATM 27 O UNL 1 -1.365 7.073 10.728 1.00 0.00 O HETATM 28 N UNL 1 -3.998 10.744 12.442 1.00 0.00 N HETATM 29 O UNL 1 -2.741 9.123 13.521 1.00 0.00 O HETATM 30 C UNL 1 -4.116 11.765 13.527 1.00 0.00 C HETATM 31 C UNL 1 -2.762 12.433 13.841 1.00 0.00 C HETATM 32 C UNL 1 -5.167 12.827 13.156 1.00 0.00 C HETATM 33 C UNL 1 -2.806 13.563 14.883 1.00 0.00 C HETATM 34 C UNL 1 -3.352 13.142 16.229 1.00 0.00 C HETATM 35 O UNL 1 -4.356 13.637 16.724 1.00 0.00 O HETATM 36 N UNL 1 -2.639 12.194 16.889 1.00 0.00 N HETATM 37 C UNL 1 6.498 9.006 5.808 1.00 0.00 C HETATM 38 F UNL 1 6.936 8.849 4.522 1.00 0.00 F HETATM 39 P UNL 1 7.292 10.588 6.223 1.00 0.00 P HETATM 40 F UNL 1 7.236 8.124 6.546 1.00 0.00 F HETATM 41 O UNL 1 8.746 10.580 5.503 1.00 0.00 O HETATM 42 O UNL 1 6.504 11.808 5.830 1.00 0.00 O HETATM 43 O UNL 1 7.729 10.651 7.792 1.00 0.00 O HETATM 44 C UNL 1 8.389 11.881 8.099 1.00 0.00 C HETATM 45 O UNL 1 9.028 11.888 9.362 1.00 0.00 O HETATM 46 C UNL 1 8.412 12.721 10.269 1.00 0.00 C HETATM 47 O UNL 1 7.236 13.056 10.153 1.00 0.00 O HETATM 48 C UNL 1 9.315 13.235 11.350 1.00 0.00 C HETATM 49 C UNL 1 10.046 14.470 10.797 1.00 0.00 C HETATM 50 C UNL 1 8.415 13.669 12.526 1.00 0.00 C HETATM 51 C UNL 1 10.334 12.205 11.836 1.00 0.00 C HETATM 52 C UNL 1 9.766 9.727 5.990 1.00 0.00 C HETATM 53 O UNL 1 10.999 10.073 5.336 1.00 0.00 O HETATM 54 C UNL 1 11.945 10.709 6.076 1.00 0.00 C HETATM 55 C UNL 1 13.159 11.128 5.202 1.00 0.00 C HETATM 56 C UNL 1 12.976 10.724 3.745 1.00 0.00 C HETATM 57 C UNL 1 13.316 12.654 5.295 1.00 0.00 C HETATM 58 C UNL 1 14.433 10.467 5.756 1.00 0.00 C HETATM 59 O UNL 1 11.857 10.950 7.266 1.00 0.00 O HETATM 60 H UNL 1 4.447 10.547 4.735 1.00 0.00 H HETATM 61 H UNL 1 2.080 9.968 4.586 1.00 0.00 H HETATM 62 H UNL 1 2.742 6.724 7.345 1.00 0.00 H HETATM 63 H UNL 1 5.136 6.889 6.930 1.00 0.00 H HETATM 64 H UNL 1 0.676 6.222 6.604 1.00 0.00 H HETATM 65 H UNL 1 0.654 10.523 6.325 1.00 0.00 H HETATM 66 H UNL 1 -0.534 9.756 7.346 1.00 0.00 H HETATM 67 H UNL 1 -0.733 9.729 5.575 1.00 0.00 H HETATM 68 H UNL 1 -0.535 5.944 8.652 1.00 0.00 H HETATM 69 H UNL 1 -3.383 6.708 8.384 1.00 0.00 H HETATM 70 H UNL 1 -2.198 3.945 8.824 1.00 0.00 H HETATM 71 H UNL 1 -3.354 4.515 7.671 1.00 0.00 H HETATM 72 H UNL 1 -3.806 3.521 10.428 1.00 0.00 H HETATM 73 H UNL 1 -4.712 3.393 8.953 1.00 0.00 H HETATM 74 H UNL 1 -5.495 8.060 13.010 1.00 0.00 H HETATM 75 H UNL 1 -6.032 9.212 11.750 1.00 0.00 H HETATM 76 H UNL 1 -3.932 9.000 10.516 1.00 0.00 H HETATM 77 H UNL 1 -6.784 3.995 9.210 1.00 0.00 H HETATM 78 H UNL 1 -8.307 5.930 9.212 1.00 0.00 H HETATM 79 H UNL 1 -8.000 7.669 10.988 1.00 0.00 H HETATM 80 H UNL 1 -4.475 10.976 11.578 1.00 0.00 H HETATM 81 H UNL 1 -4.473 11.229 14.415 1.00 0.00 H HETATM 82 H UNL 1 -2.355 12.858 12.914 1.00 0.00 H HETATM 83 H UNL 1 -2.048 11.666 14.161 1.00 0.00 H HETATM 84 H UNL 1 -4.814 13.479 12.347 1.00 0.00 H HETATM 85 H UNL 1 -5.407 13.478 14.011 1.00 0.00 H HETATM 86 H UNL 1 -6.113 12.380 12.833 1.00 0.00 H HETATM 87 H UNL 1 -3.398 14.412 14.524 1.00 0.00 H HETATM 88 H UNL 1 -1.793 13.955 15.043 1.00 0.00 H HETATM 89 H UNL 1 -1.897 11.654 16.455 1.00 0.00 H HETATM 90 H UNL 1 -2.996 11.875 17.780 1.00 0.00 H HETATM 91 H UNL 1 7.688 12.711 7.956 1.00 0.00 H HETATM 92 H UNL 1 9.196 12.053 7.385 1.00 0.00 H HETATM 93 H UNL 1 9.338 15.213 10.402 1.00 0.00 H HETATM 94 H UNL 1 10.715 14.202 9.967 1.00 0.00 H HETATM 95 H UNL 1 10.650 14.963 11.565 1.00 0.00 H HETATM 96 H UNL 1 7.703 14.443 12.209 1.00 0.00 H HETATM 97 H UNL 1 9.001 14.083 13.353 1.00 0.00 H HETATM 98 H UNL 1 7.833 12.824 12.895 1.00 0.00 H HETATM 99 H UNL 1 11.042 11.935 11.042 1.00 0.00 H HETATM 100 H UNL 1 9.843 11.287 12.166 1.00 0.00 H HETATM 101 H UNL 1 10.925 12.597 12.674 1.00 0.00 H HETATM 102 H UNL 1 9.533 8.694 5.716 1.00 0.00 H HETATM 103 H UNL 1 9.854 9.775 7.072 1.00 0.00 H HETATM 104 H UNL 1 12.119 11.216 3.285 1.00 0.00 H HETATM 105 H UNL 1 12.835 9.629 3.631 1.00 0.00 H HETATM 106 H UNL 1 13.867 10.994 3.140 1.00 0.00 H HETATM 107 H UNL 1 12.439 13.168 4.899 1.00 0.00 H HETATM 108 H UNL 1 14.196 12.988 4.720 1.00 0.00 H HETATM 109 H UNL 1 13.458 12.988 6.330 1.00 0.00 H HETATM 110 H UNL 1 14.365 9.375 5.731 1.00 0.00 H HETATM 111 H UNL 1 14.634 10.760 6.794 1.00 0.00 H HETATM 112 H UNL 1 15.316 10.757 5.157 1.00 0.00 H CONECT 1 2 6 60 CONECT 2 1 3 61 CONECT 3 2 4 7 CONECT 4 3 5 62 CONECT 5 4 6 63 CONECT 6 5 1 37 CONECT 7 3 8 9 CONECT 8 7 10 64 CONECT 9 7 65 66 67 CONECT 10 8 11 12 CONECT 11 10 CONECT 12 10 13 68 CONECT 13 14 19 12 69 CONECT 14 13 15 70 71 CONECT 15 14 16 72 73 CONECT 16 15 17 23 CONECT 17 16 18 20 CONECT 18 17 19 22 CONECT 19 18 13 27 CONECT 20 17 21 25 CONECT 21 20 22 74 75 CONECT 22 21 18 26 76 CONECT 23 16 24 77 CONECT 24 23 25 78 CONECT 25 24 20 79 CONECT 26 22 28 29 CONECT 27 19 CONECT 28 26 30 80 CONECT 29 26 CONECT 30 28 31 32 81 CONECT 31 30 33 82 83 CONECT 32 30 84 85 86 CONECT 33 31 34 87 88 CONECT 34 33 35 36 CONECT 35 34 CONECT 36 34 89 90 CONECT 37 6 38 39 40 CONECT 38 37 CONECT 39 37 41 42 43 CONECT 40 37 CONECT 41 39 52 CONECT 42 39 CONECT 43 39 44 CONECT 44 43 45 91 92 CONECT 45 44 46 CONECT 46 45 47 48 CONECT 47 46 CONECT 48 46 49 50 51 CONECT 49 48 93 94 95 CONECT 50 48 96 97 98 CONECT 51 48 99 100 101 CONECT 52 41 53 102 103 CONECT 53 52 54 CONECT 54 53 55 59 CONECT 55 54 56 57 58 CONECT 56 55 104 105 106 CONECT 57 55 107 108 109 CONECT 58 55 110 111 112 CONECT 59 54 CONECT 60 1 CONECT 61 2 CONECT 62 4 CONECT 63 5 CONECT 64 8 CONECT 65 9 CONECT 66 9 CONECT 67 9 CONECT 68 12 CONECT 69 13 CONECT 70 14 CONECT 71 14 CONECT 72 15 CONECT 73 15 CONECT 74 21 CONECT 75 21 CONECT 76 22 CONECT 77 23 CONECT 78 24 CONECT 79 25 CONECT 80 28 CONECT 81 30 CONECT 82 31 CONECT 83 31 CONECT 84 32 CONECT 85 32 CONECT 86 32 CONECT 87 33 CONECT 88 33 CONECT 89 36 CONECT 90 36 CONECT 91 44 CONECT 92 44 CONECT 93 49 CONECT 94 49 CONECT 95 49 CONECT 96 50 CONECT 97 50 CONECT 98 50 CONECT 99 51 CONECT 100 51 CONECT 101 51 CONECT 102 52 CONECT 103 52 CONECT 104 56 CONECT 105 56 CONECT 106 56 CONECT 107 57 CONECT 108 57 CONECT 109 57 CONECT 110 58 CONECT 111 58 CONECT 112 58 MASTER 0 0 0 0 0 0 0 0 112 0 112 0 END M END $$$$