D0UT1G AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 4.418 2.558 0.159 1.00 0.00 C HETATM 2 N UNL 1 3.678 1.390 0.524 1.00 0.00 N HETATM 3 C UNL 1 2.175 1.475 0.380 1.00 0.00 C HETATM 4 C UNL 1 1.422 3.142 0.806 1.00 0.00 C HETATM 5 N UNL 1 0.904 3.774 2.059 1.00 0.00 N HETATM 6 O UNL 1 1.761 4.007 -0.040 1.00 0.00 O HETATM 7 C UNL 1 1.829 -0.068 0.479 1.00 0.00 C HETATM 8 C UNL 1 0.308 5.289 3.016 1.00 0.00 C HETATM 9 C UNL 1 -0.763 6.606 3.983 1.00 0.00 C HETATM 10 N UNL 1 -0.376 8.161 4.750 1.00 0.00 N HETATM 11 C UNL 1 1.137 8.267 4.532 1.00 0.00 C HETATM 12 C UNL 1 1.843 7.254 3.846 1.00 0.00 C HETATM 13 O UNL 1 2.052 6.118 4.579 1.00 0.00 O HETATM 14 C UNL 1 1.310 5.006 4.131 1.00 0.00 C HETATM 15 O UNL 1 -2.006 6.372 4.107 1.00 0.00 O HETATM 16 C UNL 1 1.536 9.502 4.078 1.00 0.00 C HETATM 17 C UNL 1 1.527 9.513 2.655 1.00 0.00 C HETATM 18 C UNL 1 1.509 8.403 1.875 1.00 0.00 C HETATM 19 C UNL 1 2.159 7.366 2.460 1.00 0.00 C HETATM 20 C UNL 1 -1.172 9.830 5.174 1.00 0.00 C HETATM 21 C UNL 1 -1.960 11.280 6.216 1.00 0.00 C HETATM 22 C UNL 1 -1.281 12.740 6.243 1.00 0.00 C HETATM 23 C UNL 1 -1.921 14.131 6.653 1.00 0.00 C HETATM 24 C UNL 1 -3.077 14.135 7.359 1.00 0.00 C HETATM 25 C UNL 1 -3.755 12.945 7.393 1.00 0.00 C HETATM 26 C UNL 1 -3.298 11.577 6.859 1.00 0.00 C HETATM 27 C UNL 1 0.046 13.086 6.083 1.00 0.00 C HETATM 28 C UNL 1 0.537 14.153 6.896 1.00 0.00 C HETATM 29 C UNL 1 0.054 15.377 6.528 1.00 0.00 C HETATM 30 C UNL 1 -1.283 15.460 6.607 1.00 0.00 C HETATM 31 BR UNL 1 -2.087 17.153 6.926 1.00 0.00 Br HETATM 32 O UNL 1 -4.496 10.918 7.005 1.00 0.00 O HETATM 33 C UNL 1 -4.763 9.855 7.900 1.00 0.00 C HETATM 34 H UNL 1 5.504 2.411 0.238 1.00 0.00 H HETATM 35 H UNL 1 4.138 3.337 0.859 1.00 0.00 H HETATM 36 H UNL 1 4.211 2.840 -0.878 1.00 0.00 H HETATM 37 H UNL 1 4.012 0.911 1.354 1.00 0.00 H HETATM 38 H UNL 1 2.095 1.556 -0.727 1.00 0.00 H HETATM 39 H UNL 1 1.863 4.195 2.071 1.00 0.00 H HETATM 40 H UNL 1 1.284 -0.381 1.363 1.00 0.00 H HETATM 41 H UNL 1 2.745 -0.719 0.465 1.00 0.00 H HETATM 42 H UNL 1 1.337 -0.460 -0.432 1.00 0.00 H HETATM 43 H UNL 1 0.470 5.912 2.125 1.00 0.00 H HETATM 44 H UNL 1 0.767 4.525 4.945 1.00 0.00 H HETATM 45 H UNL 1 2.065 4.247 3.873 1.00 0.00 H HETATM 46 H UNL 1 1.576 10.436 4.711 1.00 0.00 H HETATM 47 H UNL 1 1.586 10.501 2.271 1.00 0.00 H HETATM 48 H UNL 1 0.394 8.114 1.782 1.00 0.00 H HETATM 49 H UNL 1 2.624 6.567 1.906 1.00 0.00 H HETATM 50 H UNL 1 -0.247 10.172 5.685 1.00 0.00 H HETATM 51 H UNL 1 -1.250 10.306 4.192 1.00 0.00 H HETATM 52 H UNL 1 -3.342 14.958 8.041 1.00 0.00 H HETATM 53 H UNL 1 -4.738 13.074 7.862 1.00 0.00 H HETATM 54 H UNL 1 0.350 13.236 5.039 1.00 0.00 H HETATM 55 H UNL 1 0.192 13.953 7.975 1.00 0.00 H HETATM 56 H UNL 1 0.676 16.285 6.500 1.00 0.00 H HETATM 57 H UNL 1 -5.564 10.098 8.629 1.00 0.00 H HETATM 58 H UNL 1 -3.913 9.455 8.451 1.00 0.00 H HETATM 59 H UNL 1 -5.204 9.130 7.220 1.00 0.00 H CONECT 1 2 34 35 36 CONECT 2 1 3 37 CONECT 3 7 4 2 38 CONECT 4 5 6 3 CONECT 5 4 8 39 CONECT 6 4 CONECT 7 3 40 41 42 CONECT 8 5 9 14 43 CONECT 9 8 10 15 CONECT 10 9 11 20 CONECT 11 10 12 16 CONECT 12 11 13 19 CONECT 13 12 14 CONECT 14 13 8 44 45 CONECT 15 9 CONECT 16 11 17 46 CONECT 17 16 18 47 CONECT 18 17 19 48 CONECT 19 18 12 49 CONECT 20 10 21 50 51 CONECT 21 20 22 26 CONECT 22 21 23 27 CONECT 23 22 24 30 CONECT 24 23 25 52 CONECT 25 24 26 53 CONECT 26 25 21 32 CONECT 27 22 28 54 CONECT 28 27 29 55 CONECT 29 28 30 56 CONECT 30 29 23 31 CONECT 31 30 CONECT 32 26 33 CONECT 33 32 57 58 59 CONECT 34 1 CONECT 35 1 CONECT 36 1 CONECT 37 2 CONECT 38 3 CONECT 39 5 CONECT 40 7 CONECT 41 7 CONECT 42 7 CONECT 43 8 CONECT 44 14 CONECT 45 14 CONECT 46 16 CONECT 47 17 CONECT 48 18 CONECT 49 19 CONECT 50 20 CONECT 51 20 CONECT 52 24 CONECT 53 25 CONECT 54 27 CONECT 55 28 CONECT 56 29 CONECT 57 33 CONECT 58 33 CONECT 59 33 MASTER 0 0 0 0 0 0 0 0 59 0 59 0 END M END $$$$