D0H2GT AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.707 -0.323 -2.311 1.00 0.00 C HETATM 2 C UNL 1 0.283 -1.171 -3.329 1.00 0.00 C HETATM 3 C UNL 1 -1.132 -1.340 -3.640 1.00 0.00 C HETATM 4 C UNL 1 -2.158 -0.644 -2.949 1.00 0.00 C HETATM 5 C UNL 1 -1.665 0.290 -2.019 1.00 0.00 C HETATM 6 C UNL 1 -0.286 0.390 -1.656 1.00 0.00 C HETATM 7 C UNL 1 -3.686 -0.924 -3.103 1.00 0.00 C HETATM 8 C UNL 1 -4.604 -0.929 -2.008 1.00 0.00 C HETATM 9 S UNL 1 -6.243 -1.304 -2.548 1.00 0.00 S HETATM 10 C UNL 1 -5.868 -1.449 -4.217 1.00 0.00 C HETATM 11 C UNL 1 -4.462 -1.232 -4.330 1.00 0.00 C HETATM 12 C UNL 1 -4.309 -0.680 -0.548 1.00 0.00 C HETATM 13 C UNL 1 -3.138 -1.252 -0.014 1.00 0.00 C HETATM 14 C UNL 1 -2.429 -0.665 1.045 1.00 0.00 C HETATM 15 C UNL 1 -2.935 0.469 1.665 1.00 0.00 C HETATM 16 C UNL 1 -4.202 0.899 1.324 1.00 0.00 C HETATM 17 C UNL 1 -4.906 0.353 0.234 1.00 0.00 C HETATM 18 O UNL 1 1.963 -0.109 -1.813 1.00 0.00 O HETATM 19 C UNL 1 3.185 -0.430 -2.492 1.00 0.00 C HETATM 20 C UNL 1 3.562 0.659 -3.508 1.00 0.00 C HETATM 21 C UNL 1 3.766 2.047 -2.900 1.00 0.00 C HETATM 22 O UNL 1 4.994 2.112 -2.183 1.00 0.00 O HETATM 23 CL UNL 1 -6.508 0.921 -0.016 1.00 0.00 Cl HETATM 24 C UNL 1 -6.866 -1.645 -5.389 1.00 0.00 C HETATM 25 O UNL 1 -6.383 -1.451 -6.536 1.00 0.00 O HETATM 26 N UNL 1 -8.295 -2.017 -5.409 1.00 0.00 N HETATM 27 C UNL 1 -9.044 -2.016 -6.702 1.00 0.00 C HETATM 28 C UNL 1 -10.115 -3.151 -6.887 1.00 0.00 C HETATM 29 C UNL 1 -11.152 -3.316 -5.727 1.00 0.00 C HETATM 30 C UNL 1 -10.689 -2.302 -4.611 1.00 0.00 C HETATM 31 C UNL 1 -9.151 -2.412 -4.289 1.00 0.00 C HETATM 32 C UNL 1 -11.077 -4.732 -5.049 1.00 0.00 C HETATM 33 N UNL 1 -11.094 -5.845 -5.832 1.00 0.00 N HETATM 34 O UNL 1 -11.068 -4.894 -3.828 1.00 0.00 O HETATM 35 C UNL 1 -12.666 -3.162 -6.161 1.00 0.00 C HETATM 36 C UNL 1 -13.206 -3.658 -7.371 1.00 0.00 C HETATM 37 C UNL 1 -14.588 -3.550 -7.679 1.00 0.00 C HETATM 38 C UNL 1 -15.480 -3.103 -6.717 1.00 0.00 C HETATM 39 C UNL 1 -14.994 -2.867 -5.444 1.00 0.00 C HETATM 40 C UNL 1 -13.615 -2.740 -5.215 1.00 0.00 C HETATM 41 H UNL 1 1.011 -1.761 -3.888 1.00 0.00 H HETATM 42 H UNL 1 -1.390 -2.062 -4.407 1.00 0.00 H HETATM 43 H UNL 1 -2.342 0.933 -1.464 1.00 0.00 H HETATM 44 H UNL 1 -0.007 1.027 -0.816 1.00 0.00 H HETATM 45 H UNL 1 -3.987 -1.282 -5.302 1.00 0.00 H HETATM 46 H UNL 1 -2.649 -2.085 -0.538 1.00 0.00 H HETATM 47 H UNL 1 -1.424 -1.023 1.295 1.00 0.00 H HETATM 48 H UNL 1 -2.334 1.006 2.408 1.00 0.00 H HETATM 49 H UNL 1 -4.641 1.731 1.880 1.00 0.00 H HETATM 50 H UNL 1 3.133 -1.421 -2.964 1.00 0.00 H HETATM 51 H UNL 1 3.978 -0.504 -1.732 1.00 0.00 H HETATM 52 H UNL 1 2.761 0.734 -4.256 1.00 0.00 H HETATM 53 H UNL 1 4.485 0.352 -4.020 1.00 0.00 H HETATM 54 H UNL 1 2.943 2.352 -2.244 1.00 0.00 H HETATM 55 H UNL 1 3.830 2.786 -3.705 1.00 0.00 H HETATM 56 H UNL 1 4.809 1.853 -1.264 1.00 0.00 H HETATM 57 H UNL 1 -8.355 -2.054 -7.555 1.00 0.00 H HETATM 58 H UNL 1 -9.562 -1.050 -6.775 1.00 0.00 H HETATM 59 H UNL 1 -9.563 -4.087 -7.020 1.00 0.00 H HETATM 60 H UNL 1 -10.625 -2.961 -7.840 1.00 0.00 H HETATM 61 H UNL 1 -11.242 -2.471 -3.680 1.00 0.00 H HETATM 62 H UNL 1 -10.940 -1.281 -4.930 1.00 0.00 H HETATM 63 H UNL 1 -8.895 -3.454 -4.075 1.00 0.00 H HETATM 64 H UNL 1 -8.918 -1.809 -3.407 1.00 0.00 H HETATM 65 H UNL 1 -11.203 -5.845 -6.834 1.00 0.00 H HETATM 66 H UNL 1 -11.135 -6.733 -5.343 1.00 0.00 H HETATM 67 H UNL 1 -12.597 -4.192 -8.096 1.00 0.00 H HETATM 68 H UNL 1 -14.984 -3.892 -8.632 1.00 0.00 H HETATM 69 H UNL 1 -16.546 -3.014 -6.924 1.00 0.00 H HETATM 70 H UNL 1 -15.678 -2.870 -4.599 1.00 0.00 H HETATM 71 H UNL 1 -13.316 -2.383 -4.235 1.00 0.00 H CONECT 1 2 6 18 CONECT 2 1 3 41 CONECT 3 2 4 42 CONECT 4 3 5 7 CONECT 5 4 6 43 CONECT 6 5 1 44 CONECT 7 4 8 11 CONECT 8 7 9 12 CONECT 9 8 10 CONECT 10 9 11 24 CONECT 11 10 7 45 CONECT 12 8 13 17 CONECT 13 12 14 46 CONECT 14 13 15 47 CONECT 15 14 16 48 CONECT 16 15 17 49 CONECT 17 16 12 23 CONECT 18 1 19 CONECT 19 18 20 50 51 CONECT 20 19 21 52 53 CONECT 21 20 22 54 55 CONECT 22 21 56 CONECT 23 17 CONECT 24 10 25 26 CONECT 25 24 CONECT 26 24 27 31 CONECT 27 26 28 57 58 CONECT 28 27 29 59 60 CONECT 29 28 30 32 35 CONECT 30 29 31 61 62 CONECT 31 30 26 63 64 CONECT 32 29 33 34 CONECT 33 32 65 66 CONECT 34 32 CONECT 35 29 36 40 CONECT 36 35 37 67 CONECT 37 36 38 68 CONECT 38 37 39 69 CONECT 39 38 40 70 CONECT 40 39 35 71 CONECT 41 2 CONECT 42 3 CONECT 43 5 CONECT 44 6 CONECT 45 11 CONECT 46 13 CONECT 47 14 CONECT 48 15 CONECT 49 16 CONECT 50 19 CONECT 51 19 CONECT 52 20 CONECT 53 20 CONECT 54 21 CONECT 55 21 CONECT 56 22 CONECT 57 27 CONECT 58 27 CONECT 59 28 CONECT 60 28 CONECT 61 30 CONECT 62 30 CONECT 63 31 CONECT 64 31 CONECT 65 33 CONECT 66 33 CONECT 67 36 CONECT 68 37 CONECT 69 38 CONECT 70 39 CONECT 71 40 MASTER 0 0 0 0 0 0 0 0 71 0 71 0 END M END $$$$