D0IG6J AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.513 0.279 -0.704 1.00 0.00 C HETATM 2 N UNL 1 -0.220 -0.644 -1.653 1.00 0.00 N HETATM 3 C UNL 1 -1.385 -1.397 -1.181 1.00 0.00 C HETATM 4 C UNL 1 -1.624 -1.524 0.323 1.00 0.00 C HETATM 5 N UNL 1 -1.095 -0.514 1.269 1.00 0.00 N HETATM 6 C UNL 1 0.325 -0.268 0.851 1.00 0.00 C HETATM 7 C UNL 1 2.029 0.522 -1.129 1.00 0.00 C HETATM 8 C UNL 1 -0.445 -0.338 -3.020 1.00 0.00 C HETATM 9 C UNL 1 2.494 0.500 -2.469 1.00 0.00 C HETATM 10 C UNL 1 3.816 0.812 -2.850 1.00 0.00 C HETATM 11 C UNL 1 4.725 1.171 -1.890 1.00 0.00 C HETATM 12 C UNL 1 4.330 1.233 -0.558 1.00 0.00 C HETATM 13 C UNL 1 2.998 0.924 -0.188 1.00 0.00 C HETATM 14 C UNL 1 -0.204 -1.370 -3.952 1.00 0.00 C HETATM 15 C UNL 1 0.051 -1.088 -5.297 1.00 0.00 C HETATM 16 C UNL 1 0.028 0.231 -5.725 1.00 0.00 C HETATM 17 C UNL 1 -0.586 1.185 -4.915 1.00 0.00 C HETATM 18 C UNL 1 -0.830 0.899 -3.563 1.00 0.00 C HETATM 19 O UNL 1 0.674 0.520 -6.902 1.00 0.00 O HETATM 20 CL UNL 1 -1.694 2.079 -2.646 1.00 0.00 Cl HETATM 21 C UNL 1 -1.418 -1.072 2.643 1.00 0.00 C HETATM 22 C UNL 1 -1.300 -0.282 3.984 1.00 0.00 C HETATM 23 N UNL 1 -2.017 -0.880 5.142 1.00 0.00 N HETATM 24 C UNL 1 1.335 1.805 -6.868 1.00 0.00 C HETATM 25 C UNL 1 2.636 1.792 -7.672 1.00 0.00 C HETATM 26 O UNL 1 2.403 1.500 -9.044 1.00 0.00 O HETATM 27 CL UNL 1 6.353 1.564 -2.327 1.00 0.00 Cl HETATM 28 C UNL 1 -1.513 -1.037 6.414 1.00 0.00 C HETATM 29 C UNL 1 -2.541 -1.588 7.187 1.00 0.00 C HETATM 30 N UNL 1 -3.669 -1.717 6.391 1.00 0.00 N HETATM 31 C UNL 1 -3.332 -1.251 5.207 1.00 0.00 C HETATM 32 C UNL 1 -2.491 -1.952 8.604 1.00 0.00 C HETATM 33 O UNL 1 -1.534 -1.738 9.341 1.00 0.00 O HETATM 34 N UNL 1 -3.625 -2.565 9.071 1.00 0.00 N HETATM 35 H UNL 1 0.050 1.272 -0.722 1.00 0.00 H HETATM 36 H UNL 1 -2.306 -1.002 -1.628 1.00 0.00 H HETATM 37 H UNL 1 -1.265 -2.426 -1.551 1.00 0.00 H HETATM 38 H UNL 1 -1.257 -2.517 0.618 1.00 0.00 H HETATM 39 H UNL 1 -2.715 -1.558 0.446 1.00 0.00 H HETATM 40 H UNL 1 0.914 -1.189 0.952 1.00 0.00 H HETATM 41 H UNL 1 0.756 0.474 1.533 1.00 0.00 H HETATM 42 H UNL 1 1.848 0.248 -3.295 1.00 0.00 H HETATM 43 H UNL 1 4.105 0.768 -3.898 1.00 0.00 H HETATM 44 H UNL 1 5.048 1.531 0.204 1.00 0.00 H HETATM 45 H UNL 1 2.753 1.033 0.863 1.00 0.00 H HETATM 46 H UNL 1 -0.102 -2.397 -3.609 1.00 0.00 H HETATM 47 H UNL 1 0.362 -1.885 -5.966 1.00 0.00 H HETATM 48 H UNL 1 -0.829 2.165 -5.317 1.00 0.00 H HETATM 49 H UNL 1 -0.933 -2.048 2.777 1.00 0.00 H HETATM 50 H UNL 1 -2.494 -1.291 2.582 1.00 0.00 H HETATM 51 H UNL 1 -1.722 0.723 3.886 1.00 0.00 H HETATM 52 H UNL 1 -0.248 -0.205 4.274 1.00 0.00 H HETATM 53 H UNL 1 1.606 2.095 -5.844 1.00 0.00 H HETATM 54 H UNL 1 0.643 2.539 -7.291 1.00 0.00 H HETATM 55 H UNL 1 3.343 1.054 -7.280 1.00 0.00 H HETATM 56 H UNL 1 3.107 2.780 -7.617 1.00 0.00 H HETATM 57 H UNL 1 2.036 0.598 -9.071 1.00 0.00 H HETATM 58 H UNL 1 -0.505 -0.760 6.691 1.00 0.00 H HETATM 59 H UNL 1 -4.016 -1.158 4.372 1.00 0.00 H HETATM 60 H UNL 1 -4.394 -2.752 8.434 1.00 0.00 H HETATM 61 H UNL 1 -3.672 -2.853 10.039 1.00 0.00 H CONECT 1 2 6 7 35 CONECT 2 1 3 8 CONECT 3 2 4 36 37 CONECT 4 3 5 38 39 CONECT 5 4 6 21 CONECT 6 5 1 40 41 CONECT 7 9 13 1 CONECT 8 2 14 18 CONECT 9 7 10 42 CONECT 10 9 11 43 CONECT 11 10 12 27 CONECT 12 11 13 44 CONECT 13 12 7 45 CONECT 14 8 15 46 CONECT 15 14 16 47 CONECT 16 15 17 19 CONECT 17 16 18 48 CONECT 18 17 8 20 CONECT 19 16 24 CONECT 20 18 CONECT 21 5 22 49 50 CONECT 22 21 23 51 52 CONECT 23 22 28 31 CONECT 24 19 25 53 54 CONECT 25 24 26 55 56 CONECT 26 25 57 CONECT 27 11 CONECT 28 23 29 58 CONECT 29 28 30 32 CONECT 30 29 31 CONECT 31 30 23 59 CONECT 32 29 33 34 CONECT 33 32 CONECT 34 32 60 61 CONECT 35 1 CONECT 36 3 CONECT 37 3 CONECT 38 4 CONECT 39 4 CONECT 40 6 CONECT 41 6 CONECT 42 9 CONECT 43 10 CONECT 44 12 CONECT 45 13 CONECT 46 14 CONECT 47 15 CONECT 48 17 CONECT 49 21 CONECT 50 21 CONECT 51 22 CONECT 52 22 CONECT 53 24 CONECT 54 24 CONECT 55 25 CONECT 56 25 CONECT 57 26 CONECT 58 28 CONECT 59 31 CONECT 60 34 CONECT 61 34 MASTER 0 0 0 0 0 0 0 0 61 0 61 0 END M END $$$$