D07KVU AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.416 0.744 1.573 1.00 0.00 C HETATM 2 C UNL 1 -0.911 1.066 0.759 1.00 0.00 C HETATM 3 C UNL 1 -1.292 0.087 -0.382 1.00 0.00 C HETATM 4 C UNL 1 -0.490 -1.235 -0.049 1.00 0.00 C HETATM 5 C UNL 1 -0.237 -1.577 1.601 1.00 0.00 C HETATM 6 C UNL 1 0.170 -0.362 2.644 1.00 0.00 C HETATM 7 N UNL 1 1.342 -0.553 3.726 1.00 0.00 N HETATM 8 C UNL 1 1.824 -0.317 5.085 1.00 0.00 C HETATM 9 N UNL 1 1.274 0.050 6.362 1.00 0.00 N HETATM 10 C UNL 1 2.130 0.194 7.589 1.00 0.00 C HETATM 11 C UNL 1 3.493 0.093 7.442 1.00 0.00 C HETATM 12 C UNL 1 3.880 -0.464 6.236 1.00 0.00 C HETATM 13 N UNL 1 3.131 -0.633 5.097 1.00 0.00 N HETATM 14 N UNL 1 1.645 0.329 9.159 1.00 0.00 N HETATM 15 C UNL 1 2.297 0.216 10.534 1.00 0.00 C HETATM 16 C UNL 1 1.308 0.372 11.618 1.00 0.00 C HETATM 17 C UNL 1 0.108 0.558 10.877 1.00 0.00 C HETATM 18 C UNL 1 0.322 0.531 9.497 1.00 0.00 C HETATM 19 C UNL 1 3.622 -0.063 10.947 1.00 0.00 C HETATM 20 C UNL 1 3.896 -0.329 12.314 1.00 0.00 C HETATM 21 C UNL 1 2.948 -0.198 13.346 1.00 0.00 C HETATM 22 C UNL 1 1.616 0.231 13.143 1.00 0.00 C HETATM 23 N UNL 1 0.816 0.441 14.422 1.00 0.00 N HETATM 24 C UNL 1 -1.310 0.897 -1.895 1.00 0.00 C HETATM 25 O UNL 1 -0.369 0.706 -2.668 1.00 0.00 O HETATM 26 N UNL 1 -2.377 1.836 -2.179 1.00 0.00 N HETATM 27 C UNL 1 -2.340 2.754 -3.412 1.00 0.00 C HETATM 28 C UNL 1 -3.614 3.591 -3.823 1.00 0.00 C HETATM 29 N UNL 1 -4.664 3.572 -2.830 1.00 0.00 N HETATM 30 C UNL 1 -4.675 2.694 -1.790 1.00 0.00 C HETATM 31 C UNL 1 -3.734 1.592 -1.655 1.00 0.00 C HETATM 32 C UNL 1 -5.831 4.283 -2.773 1.00 0.00 C HETATM 33 N UNL 1 -6.475 3.902 -1.676 1.00 0.00 N HETATM 34 N UNL 1 -5.745 2.951 -1.057 1.00 0.00 N HETATM 35 C UNL 1 1.201 -0.222 15.737 1.00 0.00 C HETATM 36 C UNL 1 0.371 0.128 17.025 1.00 0.00 C HETATM 37 C UNL 1 -1.116 0.174 16.749 1.00 0.00 C HETATM 38 C UNL 1 -1.343 1.213 15.666 1.00 0.00 C HETATM 39 C UNL 1 -0.523 1.051 14.342 1.00 0.00 C HETATM 40 S UNL 1 -2.184 0.418 18.230 1.00 0.00 S HETATM 41 O UNL 1 -3.563 0.424 17.766 1.00 0.00 O HETATM 42 O UNL 1 -1.787 -0.549 19.238 1.00 0.00 O HETATM 43 C UNL 1 -1.921 2.026 18.968 1.00 0.00 C HETATM 44 H UNL 1 0.803 1.653 2.027 1.00 0.00 H HETATM 45 H UNL 1 1.191 0.407 0.863 1.00 0.00 H HETATM 46 H UNL 1 -0.846 2.079 0.358 1.00 0.00 H HETATM 47 H UNL 1 -1.749 1.043 1.467 1.00 0.00 H HETATM 48 H UNL 1 -2.340 -0.219 -0.283 1.00 0.00 H HETATM 49 H UNL 1 0.468 -1.254 -0.587 1.00 0.00 H HETATM 50 H UNL 1 -1.055 -2.089 -0.470 1.00 0.00 H HETATM 51 H UNL 1 0.438 -2.440 1.671 1.00 0.00 H HETATM 52 H UNL 1 -1.223 -1.936 1.930 1.00 0.00 H HETATM 53 H UNL 1 -0.719 -0.155 3.242 1.00 0.00 H HETATM 54 H UNL 1 2.229 -0.711 3.235 1.00 0.00 H HETATM 55 H UNL 1 4.235 0.338 8.190 1.00 0.00 H HETATM 56 H UNL 1 4.869 -0.922 6.170 1.00 0.00 H HETATM 57 H UNL 1 -0.869 0.636 11.308 1.00 0.00 H HETATM 58 H UNL 1 -0.414 0.632 8.695 1.00 0.00 H HETATM 59 H UNL 1 4.447 -0.164 10.254 1.00 0.00 H HETATM 60 H UNL 1 4.889 -0.699 12.598 1.00 0.00 H HETATM 61 H UNL 1 3.312 -0.436 14.345 1.00 0.00 H HETATM 62 H UNL 1 -2.034 2.178 -4.289 1.00 0.00 H HETATM 63 H UNL 1 -1.544 3.485 -3.225 1.00 0.00 H HETATM 64 H UNL 1 -4.062 3.222 -4.758 1.00 0.00 H HETATM 65 H UNL 1 -3.360 4.650 -4.006 1.00 0.00 H HETATM 66 H UNL 1 -4.116 0.722 -2.225 1.00 0.00 H HETATM 67 H UNL 1 -3.643 1.301 -0.595 1.00 0.00 H HETATM 68 H UNL 1 -6.172 5.001 -3.528 1.00 0.00 H HETATM 69 H UNL 1 2.232 0.030 16.011 1.00 0.00 H HETATM 70 H UNL 1 1.140 -1.308 15.608 1.00 0.00 H HETATM 71 H UNL 1 0.702 1.081 17.461 1.00 0.00 H HETATM 72 H UNL 1 0.579 -0.622 17.807 1.00 0.00 H HETATM 73 H UNL 1 -1.440 -0.814 16.400 1.00 0.00 H HETATM 74 H UNL 1 -1.143 2.206 16.098 1.00 0.00 H HETATM 75 H UNL 1 -2.411 1.227 15.409 1.00 0.00 H HETATM 76 H UNL 1 -1.129 0.468 13.646 1.00 0.00 H HETATM 77 H UNL 1 -0.403 2.062 13.940 1.00 0.00 H HETATM 78 H UNL 1 -2.142 2.811 18.245 1.00 0.00 H HETATM 79 H UNL 1 -0.909 2.099 19.361 1.00 0.00 H HETATM 80 H UNL 1 -2.628 2.122 19.805 1.00 0.00 H CONECT 1 2 6 44 45 CONECT 2 1 3 46 47 CONECT 3 2 4 24 48 CONECT 4 3 5 49 50 CONECT 5 4 6 51 52 CONECT 6 5 1 7 53 CONECT 7 8 6 54 CONECT 8 7 9 13 CONECT 9 8 10 CONECT 10 9 11 14 CONECT 11 10 12 55 CONECT 12 11 13 56 CONECT 13 12 8 CONECT 14 10 15 18 CONECT 15 14 16 19 CONECT 16 15 17 22 CONECT 17 16 18 57 CONECT 18 17 14 58 CONECT 19 15 20 59 CONECT 20 19 21 60 CONECT 21 20 22 61 CONECT 22 21 16 23 CONECT 23 22 35 39 CONECT 24 3 25 26 CONECT 25 24 CONECT 26 24 27 31 CONECT 27 26 28 62 63 CONECT 28 27 29 64 65 CONECT 29 28 30 32 CONECT 30 29 31 34 CONECT 31 30 26 66 67 CONECT 32 29 33 68 CONECT 33 32 34 CONECT 34 33 30 CONECT 35 23 36 69 70 CONECT 36 35 37 71 72 CONECT 37 36 38 40 73 CONECT 38 37 39 74 75 CONECT 39 38 23 76 77 CONECT 40 37 41 42 43 CONECT 41 40 CONECT 42 40 CONECT 43 40 78 79 80 CONECT 44 1 CONECT 45 1 CONECT 46 2 CONECT 47 2 CONECT 48 3 CONECT 49 4 CONECT 50 4 CONECT 51 5 CONECT 52 5 CONECT 53 6 CONECT 54 7 CONECT 55 11 CONECT 56 12 CONECT 57 17 CONECT 58 18 CONECT 59 19 CONECT 60 20 CONECT 61 21 CONECT 62 27 CONECT 63 27 CONECT 64 28 CONECT 65 28 CONECT 66 31 CONECT 67 31 CONECT 68 32 CONECT 69 35 CONECT 70 35 CONECT 71 36 CONECT 72 36 CONECT 73 37 CONECT 74 38 CONECT 75 38 CONECT 76 39 CONECT 77 39 CONECT 78 43 CONECT 79 43 CONECT 80 43 MASTER 0 0 0 0 0 0 0 0 80 0 80 0 END M END $$$$