D0H8VN AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 6.787 1.853 2.079 1.00 0.00 N HETATM 2 C UNL 1 6.914 3.235 2.170 1.00 0.00 C HETATM 3 C UNL 1 6.065 3.998 1.461 1.00 0.00 C HETATM 4 C UNL 1 5.003 3.263 0.725 1.00 0.00 C HETATM 5 C UNL 1 4.484 2.213 1.424 1.00 0.00 C HETATM 6 C UNL 1 5.655 1.235 1.544 1.00 0.00 C HETATM 7 O UNL 1 5.545 0.038 1.329 1.00 0.00 O HETATM 8 C UNL 1 7.915 3.789 3.123 1.00 0.00 C HETATM 9 C UNL 1 5.333 3.158 -0.762 1.00 0.00 C HETATM 10 C UNL 1 3.989 2.381 2.858 1.00 0.00 C HETATM 11 N UNL 1 2.609 2.022 3.079 1.00 0.00 N HETATM 12 C UNL 1 2.266 1.889 4.422 1.00 0.00 C HETATM 13 C UNL 1 0.833 1.786 4.790 1.00 0.00 C HETATM 14 O UNL 1 3.092 1.893 5.319 1.00 0.00 O HETATM 15 C UNL 1 0.469 2.290 6.052 1.00 0.00 C HETATM 16 C UNL 1 -0.825 2.164 6.524 1.00 0.00 C HETATM 17 C UNL 1 -1.754 1.463 5.615 1.00 0.00 C HETATM 18 C UNL 1 -1.402 0.902 4.283 1.00 0.00 C HETATM 19 C UNL 1 -0.072 1.111 3.950 1.00 0.00 C HETATM 20 C UNL 1 -1.073 2.759 7.908 1.00 0.00 C HETATM 21 N UNL 1 -2.242 0.190 3.382 1.00 0.00 N HETATM 22 C UNL 1 -3.612 -0.202 3.828 1.00 0.00 C HETATM 23 C UNL 1 -2.000 -0.340 1.937 1.00 0.00 C HETATM 24 C UNL 1 -0.614 -0.644 1.343 1.00 0.00 C HETATM 25 C UNL 1 -0.717 -1.277 -0.069 1.00 0.00 C HETATM 26 O UNL 1 -1.588 -0.558 -0.944 1.00 0.00 O HETATM 27 C UNL 1 -2.885 -0.361 -0.390 1.00 0.00 C HETATM 28 C UNL 1 -2.761 0.488 0.877 1.00 0.00 C HETATM 29 C UNL 1 -3.625 -1.520 4.591 1.00 0.00 C HETATM 30 C UNL 1 -1.508 3.178 9.063 1.00 0.00 C HETATM 31 C UNL 1 -2.014 3.666 10.411 1.00 0.00 C HETATM 32 C UNL 1 -1.683 5.209 10.106 1.00 0.00 C HETATM 33 C UNL 1 -1.875 6.264 11.175 1.00 0.00 C HETATM 34 N UNL 1 -1.304 5.846 12.447 1.00 0.00 N HETATM 35 C UNL 1 -1.848 4.533 12.826 1.00 0.00 C HETATM 36 C UNL 1 -1.499 3.378 11.809 1.00 0.00 C HETATM 37 C UNL 1 -1.568 6.895 13.447 1.00 0.00 C HETATM 38 H UNL 1 7.509 1.239 2.437 1.00 0.00 H HETATM 39 H UNL 1 6.057 5.077 1.452 1.00 0.00 H HETATM 40 H UNL 1 7.852 3.255 4.079 1.00 0.00 H HETATM 41 H UNL 1 7.706 4.842 3.339 1.00 0.00 H HETATM 42 H UNL 1 8.930 3.702 2.733 1.00 0.00 H HETATM 43 H UNL 1 5.978 3.982 -1.096 1.00 0.00 H HETATM 44 H UNL 1 4.420 3.197 -1.364 1.00 0.00 H HETATM 45 H UNL 1 5.862 2.227 -0.997 1.00 0.00 H HETATM 46 H UNL 1 4.088 3.421 3.195 1.00 0.00 H HETATM 47 H UNL 1 4.596 1.776 3.546 1.00 0.00 H HETATM 48 H UNL 1 1.906 2.300 2.409 1.00 0.00 H HETATM 49 H UNL 1 1.224 2.766 6.671 1.00 0.00 H HETATM 50 H UNL 1 -2.781 1.351 5.966 1.00 0.00 H HETATM 51 H UNL 1 0.349 0.697 3.053 1.00 0.00 H HETATM 52 H UNL 1 -4.245 -0.376 2.945 1.00 0.00 H HETATM 53 H UNL 1 -4.121 0.598 4.368 1.00 0.00 H HETATM 54 H UNL 1 -2.477 -1.333 1.950 1.00 0.00 H HETATM 55 H UNL 1 -0.035 -1.316 1.984 1.00 0.00 H HETATM 56 H UNL 1 -0.056 0.285 1.194 1.00 0.00 H HETATM 57 H UNL 1 -1.045 -2.322 -0.027 1.00 0.00 H HETATM 58 H UNL 1 0.270 -1.273 -0.548 1.00 0.00 H HETATM 59 H UNL 1 -3.355 -1.334 -0.195 1.00 0.00 H HETATM 60 H UNL 1 -3.501 0.146 -1.141 1.00 0.00 H HETATM 61 H UNL 1 -3.752 0.802 1.208 1.00 0.00 H HETATM 62 H UNL 1 -2.187 1.394 0.643 1.00 0.00 H HETATM 63 H UNL 1 -3.159 -2.328 4.015 1.00 0.00 H HETATM 64 H UNL 1 -4.659 -1.824 4.791 1.00 0.00 H HETATM 65 H UNL 1 -3.101 -1.435 5.545 1.00 0.00 H HETATM 66 H UNL 1 -3.108 3.571 10.413 1.00 0.00 H HETATM 67 H UNL 1 -2.260 5.532 9.227 1.00 0.00 H HETATM 68 H UNL 1 -0.623 5.275 9.806 1.00 0.00 H HETATM 69 H UNL 1 -2.937 6.523 11.261 1.00 0.00 H HETATM 70 H UNL 1 -1.359 7.176 10.836 1.00 0.00 H HETATM 71 H UNL 1 -2.938 4.612 12.946 1.00 0.00 H HETATM 72 H UNL 1 -1.441 4.258 13.806 1.00 0.00 H HETATM 73 H UNL 1 -0.422 3.194 11.820 1.00 0.00 H HETATM 74 H UNL 1 -1.991 2.473 12.186 1.00 0.00 H HETATM 75 H UNL 1 -1.007 7.807 13.200 1.00 0.00 H HETATM 76 H UNL 1 -1.243 6.596 14.448 1.00 0.00 H HETATM 77 H UNL 1 -2.629 7.171 13.500 1.00 0.00 H CONECT 1 2 6 38 CONECT 2 1 3 8 CONECT 3 2 4 39 CONECT 4 3 5 9 CONECT 5 4 6 10 CONECT 6 5 1 7 CONECT 7 6 CONECT 8 2 40 41 42 CONECT 9 4 43 44 45 CONECT 10 5 11 46 47 CONECT 11 10 12 48 CONECT 12 11 13 14 CONECT 13 12 15 19 CONECT 14 12 CONECT 15 13 16 49 CONECT 16 15 17 20 CONECT 17 16 18 50 CONECT 18 17 19 21 CONECT 19 18 13 51 CONECT 20 16 30 CONECT 21 18 22 23 CONECT 22 21 29 52 53 CONECT 23 21 24 28 54 CONECT 24 23 25 55 56 CONECT 25 24 26 57 58 CONECT 26 25 27 CONECT 27 26 28 59 60 CONECT 28 27 23 61 62 CONECT 29 22 63 64 65 CONECT 30 20 31 CONECT 31 30 32 36 66 CONECT 32 31 33 67 68 CONECT 33 32 34 69 70 CONECT 34 33 35 37 CONECT 35 34 36 71 72 CONECT 36 35 31 73 74 CONECT 37 34 75 76 77 CONECT 38 1 CONECT 39 3 CONECT 40 8 CONECT 41 8 CONECT 42 8 CONECT 43 9 CONECT 44 9 CONECT 45 9 CONECT 46 10 CONECT 47 10 CONECT 48 11 CONECT 49 15 CONECT 50 17 CONECT 51 19 CONECT 52 22 CONECT 53 22 CONECT 54 23 CONECT 55 24 CONECT 56 24 CONECT 57 25 CONECT 58 25 CONECT 59 27 CONECT 60 27 CONECT 61 28 CONECT 62 28 CONECT 63 29 CONECT 64 29 CONECT 65 29 CONECT 66 31 CONECT 67 32 CONECT 68 32 CONECT 69 33 CONECT 70 33 CONECT 71 35 CONECT 72 35 CONECT 73 36 CONECT 74 36 CONECT 75 37 CONECT 76 37 CONECT 77 37 MASTER 0 0 0 0 0 0 0 0 77 0 77 0 END M END $$$$