D0V7QU AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.023 0.026 0.086 1.00 0.00 C HETATM 2 N UNL 1 0.540 1.195 0.530 1.00 0.00 N HETATM 3 C UNL 1 -0.770 1.389 0.414 1.00 0.00 C HETATM 4 N UNL 1 -1.556 0.435 -0.145 1.00 0.00 N HETATM 5 C UNL 1 -0.969 -0.727 -0.562 1.00 0.00 C HETATM 6 N UNL 1 0.316 -0.957 -0.465 1.00 0.00 N HETATM 7 N UNL 1 2.401 -0.114 0.225 1.00 0.00 N HETATM 8 C UNL 1 3.117 -1.191 -0.065 1.00 0.00 C HETATM 9 S UNL 1 -2.017 -2.013 -1.327 1.00 0.00 S HETATM 10 C UNL 1 -1.260 -3.590 -1.883 1.00 0.00 C HETATM 11 C UNL 1 0.032 -4.089 -1.691 1.00 0.00 C HETATM 12 C UNL 1 0.465 -5.392 -2.177 1.00 0.00 C HETATM 13 C UNL 1 -0.401 -6.240 -2.888 1.00 0.00 C HETATM 14 C UNL 1 -1.696 -5.763 -3.057 1.00 0.00 C HETATM 15 C UNL 1 -2.115 -4.483 -2.575 1.00 0.00 C HETATM 16 N UNL 1 -0.121 -7.550 -3.374 1.00 0.00 N HETATM 17 N UNL 1 -1.265 2.657 0.843 1.00 0.00 N HETATM 18 C UNL 1 -0.411 3.414 1.808 1.00 0.00 C HETATM 19 C UNL 1 -1.027 4.774 2.285 1.00 0.00 C HETATM 20 N UNL 1 -2.405 4.639 2.792 1.00 0.00 N HETATM 21 C UNL 1 -3.228 4.035 1.726 1.00 0.00 C HETATM 22 C UNL 1 -2.707 2.694 1.119 1.00 0.00 C HETATM 23 C UNL 1 -2.971 5.938 3.191 1.00 0.00 C HETATM 24 N UNL 1 2.710 -2.352 -0.504 1.00 0.00 N HETATM 25 C UNL 1 3.752 -3.228 -0.688 1.00 0.00 C HETATM 26 C UNL 1 4.997 -2.738 -0.382 1.00 0.00 C HETATM 27 S UNL 1 4.857 -1.119 0.165 1.00 0.00 S HETATM 28 C UNL 1 6.320 -3.405 -0.472 1.00 0.00 C HETATM 29 C UNL 1 0.906 -8.448 -3.456 1.00 0.00 C HETATM 30 N UNL 1 2.202 -8.017 -3.322 1.00 0.00 N HETATM 31 O UNL 1 0.602 -9.607 -3.749 1.00 0.00 O HETATM 32 C UNL 1 3.347 -8.869 -3.292 1.00 0.00 C HETATM 33 C UNL 1 4.602 -8.368 -3.685 1.00 0.00 C HETATM 34 C UNL 1 5.723 -9.207 -3.756 1.00 0.00 C HETATM 35 C UNL 1 5.608 -10.520 -3.340 1.00 0.00 C HETATM 36 C UNL 1 4.484 -10.883 -2.618 1.00 0.00 C HETATM 37 C UNL 1 3.299 -10.175 -2.799 1.00 0.00 C HETATM 38 H UNL 1 2.833 0.693 0.611 1.00 0.00 H HETATM 39 H UNL 1 0.743 -3.496 -1.128 1.00 0.00 H HETATM 40 H UNL 1 1.477 -5.714 -1.927 1.00 0.00 H HETATM 41 H UNL 1 -2.432 -6.382 -3.560 1.00 0.00 H HETATM 42 H UNL 1 -3.159 -4.220 -2.748 1.00 0.00 H HETATM 43 H UNL 1 -0.949 -8.039 -3.707 1.00 0.00 H HETATM 44 H UNL 1 0.556 3.658 1.349 1.00 0.00 H HETATM 45 H UNL 1 -0.217 2.805 2.700 1.00 0.00 H HETATM 46 H UNL 1 -0.994 5.504 1.463 1.00 0.00 H HETATM 47 H UNL 1 -0.393 5.182 3.086 1.00 0.00 H HETATM 48 H UNL 1 -3.361 4.763 0.914 1.00 0.00 H HETATM 49 H UNL 1 -4.225 3.838 2.139 1.00 0.00 H HETATM 50 H UNL 1 -2.975 1.883 1.805 1.00 0.00 H HETATM 51 H UNL 1 -3.246 2.553 0.176 1.00 0.00 H HETATM 52 H UNL 1 -2.412 6.386 4.021 1.00 0.00 H HETATM 53 H UNL 1 -4.002 5.815 3.548 1.00 0.00 H HETATM 54 H UNL 1 -2.991 6.663 2.367 1.00 0.00 H HETATM 55 H UNL 1 3.540 -4.223 -1.053 1.00 0.00 H HETATM 56 H UNL 1 6.194 -4.434 -0.832 1.00 0.00 H HETATM 57 H UNL 1 6.800 -3.447 0.505 1.00 0.00 H HETATM 58 H UNL 1 6.968 -2.882 -1.176 1.00 0.00 H HETATM 59 H UNL 1 2.362 -7.062 -3.589 1.00 0.00 H HETATM 60 H UNL 1 4.706 -7.355 -4.056 1.00 0.00 H HETATM 61 H UNL 1 6.660 -8.869 -4.191 1.00 0.00 H HETATM 62 H UNL 1 6.267 -11.288 -3.744 1.00 0.00 H HETATM 63 H UNL 1 4.673 -11.146 -1.560 1.00 0.00 H HETATM 64 H UNL 1 2.377 -10.640 -2.464 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 CONECT 3 2 4 17 CONECT 4 3 5 CONECT 5 4 6 9 CONECT 6 5 1 CONECT 7 1 8 38 CONECT 8 7 24 27 CONECT 9 5 10 CONECT 10 9 11 15 CONECT 11 10 12 39 CONECT 12 11 13 40 CONECT 13 12 14 16 CONECT 14 13 15 41 CONECT 15 14 10 42 CONECT 16 13 29 43 CONECT 17 3 18 22 CONECT 18 17 19 44 45 CONECT 19 18 20 46 47 CONECT 20 19 21 23 CONECT 21 20 22 48 49 CONECT 22 21 17 50 51 CONECT 23 20 52 53 54 CONECT 24 8 25 CONECT 25 24 26 55 CONECT 26 25 27 28 CONECT 27 26 8 CONECT 28 26 56 57 58 CONECT 29 16 30 31 CONECT 30 29 32 59 CONECT 31 29 CONECT 32 30 33 37 CONECT 33 32 34 60 CONECT 34 33 35 61 CONECT 35 34 36 62 CONECT 36 35 37 63 CONECT 37 36 32 64 CONECT 38 7 CONECT 39 11 CONECT 40 12 CONECT 41 14 CONECT 42 15 CONECT 43 16 CONECT 44 18 CONECT 45 18 CONECT 46 19 CONECT 47 19 CONECT 48 21 CONECT 49 21 CONECT 50 22 CONECT 51 22 CONECT 52 23 CONECT 53 23 CONECT 54 23 CONECT 55 25 CONECT 56 28 CONECT 57 28 CONECT 58 28 CONECT 59 30 CONECT 60 33 CONECT 61 34 CONECT 62 35 CONECT 63 36 CONECT 64 37 MASTER 0 0 0 0 0 0 0 0 64 0 64 0 END M END $$$$