D08UPQ AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -15.675 6.082 -11.660 1.00 0.00 C HETATM 2 N UNL 1 -14.468 6.679 -11.088 1.00 0.00 N HETATM 3 C UNL 1 -13.278 5.814 -11.304 1.00 0.00 C HETATM 4 C UNL 1 -12.913 4.819 -9.860 1.00 0.00 C HETATM 5 N UNL 1 -13.371 5.129 -8.475 1.00 0.00 N HETATM 6 C UNL 1 -12.459 5.057 -6.913 1.00 0.00 C HETATM 7 C UNL 1 -13.061 4.225 -5.203 1.00 0.00 C HETATM 8 N UNL 1 -12.664 4.469 -3.536 1.00 0.00 N HETATM 9 C UNL 1 -11.473 6.489 -7.352 1.00 0.00 C HETATM 10 C UNL 1 -9.994 6.522 -6.943 1.00 0.00 C HETATM 11 C UNL 1 -11.243 6.677 -8.934 1.00 0.00 C HETATM 12 C UNL 1 -12.171 7.823 -7.008 1.00 0.00 C HETATM 13 O UNL 1 -13.914 3.305 -5.359 1.00 0.00 O HETATM 14 C UNL 1 -12.227 6.738 -12.086 1.00 0.00 C HETATM 15 O UNL 1 -12.137 3.870 -10.046 1.00 0.00 O HETATM 16 C UNL 1 -13.134 3.988 -1.717 1.00 0.00 C HETATM 17 C UNL 1 -14.641 4.035 -1.738 1.00 0.00 C HETATM 18 C UNL 1 -15.045 5.351 -2.327 1.00 0.00 C HETATM 19 C UNL 1 -14.126 6.235 -2.992 1.00 0.00 C HETATM 20 C UNL 1 -12.744 5.857 -3.524 1.00 0.00 C HETATM 21 C UNL 1 -16.271 5.821 -1.881 1.00 0.00 C HETATM 22 C UNL 1 -16.382 7.192 -1.833 1.00 0.00 C HETATM 23 C UNL 1 -15.797 7.893 -2.862 1.00 0.00 C HETATM 24 C UNL 1 -14.461 7.550 -3.088 1.00 0.00 C HETATM 25 C UNL 1 -12.722 3.666 0.184 1.00 0.00 C HETATM 26 O UNL 1 -11.567 3.183 0.350 1.00 0.00 O HETATM 27 N UNL 1 -13.449 3.899 1.721 1.00 0.00 N HETATM 28 C UNL 1 -14.836 4.553 2.161 1.00 0.00 C HETATM 29 C UNL 1 -12.464 3.845 3.099 1.00 0.00 C HETATM 30 C UNL 1 -15.819 4.179 3.462 1.00 0.00 C HETATM 31 C UNL 1 -15.826 3.074 4.328 1.00 0.00 C HETATM 32 C UNL 1 -16.947 2.724 5.200 1.00 0.00 C HETATM 33 C UNL 1 -18.168 3.400 5.222 1.00 0.00 C HETATM 34 C UNL 1 -18.044 4.669 4.568 1.00 0.00 C HETATM 35 C UNL 1 -16.860 5.075 3.811 1.00 0.00 C HETATM 36 C UNL 1 -19.461 2.847 5.929 1.00 0.00 C HETATM 37 O UNL 1 -20.357 3.638 6.275 1.00 0.00 O HETATM 38 N UNL 1 -19.542 1.459 6.179 1.00 0.00 N HETATM 39 C UNL 1 -20.613 0.401 6.654 1.00 0.00 C HETATM 40 C UNL 1 -22.138 0.519 6.503 1.00 0.00 C HETATM 41 N UNL 1 -22.589 0.934 7.846 1.00 0.00 N HETATM 42 C UNL 1 -21.928 0.139 8.977 1.00 0.00 C HETATM 43 C UNL 1 -20.562 -0.227 8.154 1.00 0.00 C HETATM 44 C UNL 1 -18.771 -0.006 11.090 1.00 0.00 C HETATM 45 N UNL 1 -18.621 1.257 11.783 1.00 0.00 N HETATM 46 C UNL 1 -18.732 2.480 10.939 1.00 0.00 C HETATM 47 C UNL 1 -20.222 2.789 10.659 1.00 0.00 C HETATM 48 N UNL 1 -20.801 2.833 9.416 1.00 0.00 N HETATM 49 C UNL 1 -22.298 2.934 9.250 1.00 0.00 C HETATM 50 C UNL 1 -22.718 2.316 7.915 1.00 0.00 C HETATM 51 C UNL 1 -23.014 4.268 9.566 1.00 0.00 C HETATM 52 C UNL 1 -22.369 5.380 8.754 1.00 0.00 C HETATM 53 C UNL 1 -24.550 4.134 9.350 1.00 0.00 C HETATM 54 O UNL 1 -23.092 2.975 6.932 1.00 0.00 O HETATM 55 C UNL 1 -17.646 2.574 9.891 1.00 0.00 C HETATM 56 O UNL 1 -20.913 2.927 11.664 1.00 0.00 O HETATM 57 C UNL 1 -22.927 4.616 11.059 1.00 0.00 C HETATM 58 C UNL 1 -22.637 0.334 10.696 1.00 0.00 C HETATM 59 N UNL 1 -21.990 0.603 11.949 1.00 0.00 N HETATM 60 O UNL 1 -23.884 0.317 10.704 1.00 0.00 O HETATM 61 C UNL 1 -22.382 1.098 13.563 1.00 0.00 C HETATM 62 C UNL 1 -22.544 2.606 14.090 1.00 0.00 C HETATM 63 C UNL 1 -23.088 2.881 15.552 1.00 0.00 C HETATM 64 C UNL 1 -23.214 1.727 16.527 1.00 0.00 C HETATM 65 C UNL 1 -23.517 0.443 15.801 1.00 0.00 C HETATM 66 C UNL 1 -23.351 0.282 14.381 1.00 0.00 C HETATM 67 C UNL 1 -24.325 -0.417 16.564 1.00 0.00 C HETATM 68 C UNL 1 -25.312 -1.041 15.832 1.00 0.00 C HETATM 69 C UNL 1 -24.949 -1.501 14.566 1.00 0.00 C HETATM 70 C UNL 1 -24.163 -0.664 13.777 1.00 0.00 C HETATM 71 C UNL 1 -12.335 2.529 3.932 1.00 0.00 C HETATM 72 C UNL 1 -12.632 5.036 4.159 1.00 0.00 C HETATM 73 C UNL 1 -11.770 6.111 3.995 1.00 0.00 C HETATM 74 C UNL 1 -12.069 7.350 4.586 1.00 0.00 C HETATM 75 C UNL 1 -13.253 7.477 5.275 1.00 0.00 C HETATM 76 C UNL 1 -13.772 6.348 5.886 1.00 0.00 C HETATM 77 C UNL 1 -13.443 5.127 5.310 1.00 0.00 C HETATM 78 F UNL 1 -13.910 4.031 5.931 1.00 0.00 F HETATM 79 H UNL 1 -16.447 6.854 -11.758 1.00 0.00 H HETATM 80 H UNL 1 -16.038 5.325 -10.967 1.00 0.00 H HETATM 81 H UNL 1 -15.561 5.633 -12.659 1.00 0.00 H HETATM 82 H UNL 1 -14.326 7.586 -11.545 1.00 0.00 H HETATM 83 H UNL 1 -13.484 5.069 -12.095 1.00 0.00 H HETATM 84 H UNL 1 -14.056 5.881 -8.497 1.00 0.00 H HETATM 85 H UNL 1 -11.765 4.251 -7.215 1.00 0.00 H HETATM 86 H UNL 1 -9.462 5.620 -7.235 1.00 0.00 H HETATM 87 H UNL 1 -9.844 6.756 -5.883 1.00 0.00 H HETATM 88 H UNL 1 -9.473 7.345 -7.477 1.00 0.00 H HETATM 89 H UNL 1 -10.801 5.793 -9.405 1.00 0.00 H HETATM 90 H UNL 1 -10.553 7.490 -9.206 1.00 0.00 H HETATM 91 H UNL 1 -12.161 7.010 -9.424 1.00 0.00 H HETATM 92 H UNL 1 -11.920 8.170 -6.006 1.00 0.00 H HETATM 93 H UNL 1 -13.255 7.759 -7.131 1.00 0.00 H HETATM 94 H UNL 1 -11.843 8.628 -7.691 1.00 0.00 H HETATM 95 H UNL 1 -11.915 7.637 -11.539 1.00 0.00 H HETATM 96 H UNL 1 -12.673 7.145 -13.023 1.00 0.00 H HETATM 97 H UNL 1 -11.324 6.220 -12.431 1.00 0.00 H HETATM 98 H UNL 1 -12.726 4.966 -1.428 1.00 0.00 H HETATM 99 H UNL 1 -14.976 4.031 -0.693 1.00 0.00 H HETATM 100 H UNL 1 -15.117 3.156 -2.184 1.00 0.00 H HETATM 101 H UNL 1 -11.929 6.231 -2.899 1.00 0.00 H HETATM 102 H UNL 1 -12.603 6.276 -4.525 1.00 0.00 H HETATM 103 H UNL 1 -16.892 5.193 -1.216 1.00 0.00 H HETATM 104 H UNL 1 -16.055 7.527 -0.823 1.00 0.00 H HETATM 105 H UNL 1 -16.376 7.855 -3.793 1.00 0.00 H HETATM 106 H UNL 1 -13.788 8.258 -3.612 1.00 0.00 H HETATM 107 H UNL 1 -15.490 4.555 1.294 1.00 0.00 H HETATM 108 H UNL 1 -14.554 5.598 2.362 1.00 0.00 H HETATM 109 H UNL 1 -11.464 3.979 2.682 1.00 0.00 H HETATM 110 H UNL 1 -14.968 2.464 4.497 1.00 0.00 H HETATM 111 H UNL 1 -16.793 1.973 5.969 1.00 0.00 H HETATM 112 H UNL 1 -18.859 5.398 4.696 1.00 0.00 H HETATM 113 H UNL 1 -16.761 6.135 3.577 1.00 0.00 H HETATM 114 H UNL 1 -18.811 0.986 5.659 1.00 0.00 H HETATM 115 H UNL 1 -20.341 -0.406 5.950 1.00 0.00 H HETATM 116 H UNL 1 -22.559 -0.484 6.325 1.00 0.00 H HETATM 117 H UNL 1 -22.472 1.145 5.666 1.00 0.00 H HETATM 118 H UNL 1 -22.437 -0.841 8.847 1.00 0.00 H HETATM 119 H UNL 1 -20.629 -1.315 7.951 1.00 0.00 H HETATM 120 H UNL 1 -19.591 -0.068 8.598 1.00 0.00 H HETATM 121 H UNL 1 -18.881 -0.818 11.810 1.00 0.00 H HETATM 122 H UNL 1 -17.926 -0.231 10.438 1.00 0.00 H HETATM 123 H UNL 1 -19.692 -0.010 10.514 1.00 0.00 H HETATM 124 H UNL 1 -17.733 1.273 12.280 1.00 0.00 H HETATM 125 H UNL 1 -18.498 3.305 11.629 1.00 0.00 H HETATM 126 H UNL 1 -20.253 2.740 8.564 1.00 0.00 H HETATM 127 H UNL 1 -22.727 2.299 9.999 1.00 0.00 H HETATM 128 H UNL 1 -22.227 5.096 7.708 1.00 0.00 H HETATM 129 H UNL 1 -21.375 5.601 9.160 1.00 0.00 H HETATM 130 H UNL 1 -22.965 6.292 8.783 1.00 0.00 H HETATM 131 H UNL 1 -24.849 3.816 8.350 1.00 0.00 H HETATM 132 H UNL 1 -25.049 5.087 9.555 1.00 0.00 H HETATM 133 H UNL 1 -24.978 3.401 10.054 1.00 0.00 H HETATM 134 H UNL 1 -17.595 1.698 9.240 1.00 0.00 H HETATM 135 H UNL 1 -16.678 2.650 10.408 1.00 0.00 H HETATM 136 H UNL 1 -17.751 3.464 9.268 1.00 0.00 H HETATM 137 H UNL 1 -21.912 4.847 11.382 1.00 0.00 H HETATM 138 H UNL 1 -23.328 3.783 11.643 1.00 0.00 H HETATM 139 H UNL 1 -23.523 5.495 11.303 1.00 0.00 H HETATM 140 H UNL 1 -20.988 0.592 11.911 1.00 0.00 H HETATM 141 H UNL 1 -21.404 0.837 14.005 1.00 0.00 H HETATM 142 H UNL 1 -21.574 3.114 14.062 1.00 0.00 H HETATM 143 H UNL 1 -23.227 3.159 13.456 1.00 0.00 H HETATM 144 H UNL 1 -22.524 3.683 16.061 1.00 0.00 H HETATM 145 H UNL 1 -24.101 3.316 15.465 1.00 0.00 H HETATM 146 H UNL 1 -24.116 1.961 17.144 1.00 0.00 H HETATM 147 H UNL 1 -22.414 1.651 17.280 1.00 0.00 H HETATM 148 H UNL 1 -24.508 -0.216 17.630 1.00 0.00 H HETATM 149 H UNL 1 -26.198 -0.359 15.817 1.00 0.00 H HETATM 150 H UNL 1 -24.554 -2.519 14.563 1.00 0.00 H HETATM 151 H UNL 1 -24.165 -0.773 12.710 1.00 0.00 H HETATM 152 H UNL 1 -13.248 2.051 4.233 1.00 0.00 H HETATM 153 H UNL 1 -11.800 2.728 4.877 1.00 0.00 H HETATM 154 H UNL 1 -11.746 1.773 3.407 1.00 0.00 H HETATM 155 H UNL 1 -10.849 6.025 3.438 1.00 0.00 H HETATM 156 H UNL 1 -11.403 8.216 4.469 1.00 0.00 H HETATM 157 H UNL 1 -13.908 8.327 5.077 1.00 0.00 H HETATM 158 H UNL 1 -14.476 6.438 6.710 1.00 0.00 H CONECT 1 2 79 80 81 CONECT 2 1 3 82 CONECT 3 14 4 2 83 CONECT 4 5 15 3 CONECT 5 4 6 84 CONECT 6 9 7 5 85 CONECT 7 8 13 6 CONECT 8 7 16 20 CONECT 9 6 10 11 12 CONECT 10 9 86 87 88 CONECT 11 9 89 90 91 CONECT 12 9 92 93 94 CONECT 13 7 CONECT 14 3 95 96 97 CONECT 15 4 CONECT 16 8 17 25 98 CONECT 17 16 18 99 100 CONECT 18 17 19 21 CONECT 19 18 20 24 CONECT 20 19 8 101 102 CONECT 21 18 22 103 CONECT 22 21 23 104 CONECT 23 22 24 105 CONECT 24 23 19 106 CONECT 25 26 27 16 CONECT 26 25 CONECT 27 25 28 29 CONECT 28 27 30 107 108 CONECT 29 72 71 27 109 CONECT 30 28 31 35 CONECT 31 30 32 110 CONECT 32 31 33 111 CONECT 33 32 34 36 CONECT 34 33 35 112 CONECT 35 34 30 113 CONECT 36 33 37 38 CONECT 37 36 CONECT 38 36 39 114 CONECT 39 40 43 38 115 CONECT 40 39 41 116 117 CONECT 41 40 42 50 CONECT 42 41 43 58 118 CONECT 43 42 39 119 120 CONECT 44 45 121 122 123 CONECT 45 44 46 124 CONECT 46 45 47 55 125 CONECT 47 46 48 56 CONECT 48 47 49 126 CONECT 49 48 50 51 127 CONECT 50 49 54 41 CONECT 51 49 52 53 57 CONECT 52 51 128 129 130 CONECT 53 51 131 132 133 CONECT 54 50 CONECT 55 46 134 135 136 CONECT 56 47 CONECT 57 51 137 138 139 CONECT 58 59 60 42 CONECT 59 58 61 140 CONECT 60 58 CONECT 61 62 66 59 141 CONECT 62 61 63 142 143 CONECT 63 62 64 144 145 CONECT 64 63 65 146 147 CONECT 65 64 66 67 CONECT 66 65 61 70 CONECT 67 65 68 148 CONECT 68 67 69 149 CONECT 69 68 70 150 CONECT 70 69 66 151 CONECT 71 29 152 153 154 CONECT 72 29 73 77 CONECT 73 72 74 155 CONECT 74 73 75 156 CONECT 75 74 76 157 CONECT 76 75 77 158 CONECT 77 76 72 78 CONECT 78 77 CONECT 79 1 CONECT 80 1 CONECT 81 1 CONECT 82 2 CONECT 83 3 CONECT 84 5 CONECT 85 6 CONECT 86 10 CONECT 87 10 CONECT 88 10 CONECT 89 11 CONECT 90 11 CONECT 91 11 CONECT 92 12 CONECT 93 12 CONECT 94 12 CONECT 95 14 CONECT 96 14 CONECT 97 14 CONECT 98 16 CONECT 99 17 CONECT 100 17 CONECT 101 20 CONECT 102 20 CONECT 103 21 CONECT 104 22 CONECT 105 23 CONECT 106 24 CONECT 107 28 CONECT 108 28 CONECT 109 29 CONECT 110 31 CONECT 111 32 CONECT 112 34 CONECT 113 35 CONECT 114 38 CONECT 115 39 CONECT 116 40 CONECT 117 40 CONECT 118 42 CONECT 119 43 CONECT 120 43 CONECT 121 44 CONECT 122 44 CONECT 123 44 CONECT 124 45 CONECT 125 46 CONECT 126 48 CONECT 127 49 CONECT 128 52 CONECT 129 52 CONECT 130 52 CONECT 131 53 CONECT 132 53 CONECT 133 53 CONECT 134 55 CONECT 135 55 CONECT 136 55 CONECT 137 57 CONECT 138 57 CONECT 139 57 CONECT 140 59 CONECT 141 61 CONECT 142 62 CONECT 143 62 CONECT 144 63 CONECT 145 63 CONECT 146 64 CONECT 147 64 CONECT 148 67 CONECT 149 68 CONECT 150 69 CONECT 151 70 CONECT 152 71 CONECT 153 71 CONECT 154 71 CONECT 155 73 CONECT 156 74 CONECT 157 75 CONECT 158 76 MASTER 0 0 0 0 0 0 0 0 158 0 158 0 END M END $$$$