D08CGI AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 1.933 -0.216 0.780 1.00 0.00 N HETATM 2 C UNL 1 1.078 0.859 0.665 1.00 0.00 C HETATM 3 C UNL 1 1.334 2.142 1.594 1.00 0.00 C HETATM 4 N UNL 1 0.485 2.050 2.826 1.00 0.00 N HETATM 5 C UNL 1 0.745 1.102 3.785 1.00 0.00 C HETATM 6 C UNL 1 1.798 -1.384 0.029 1.00 0.00 C HETATM 7 C UNL 1 -0.129 0.927 4.980 1.00 0.00 C HETATM 8 C UNL 1 -1.243 1.688 5.628 1.00 0.00 C HETATM 9 O UNL 1 0.121 1.918 6.008 1.00 0.00 O HETATM 10 C UNL 1 -1.949 2.879 5.144 1.00 0.00 C HETATM 11 O UNL 1 -2.952 2.804 4.457 1.00 0.00 O HETATM 12 O UNL 1 -1.450 4.039 5.630 1.00 0.00 O HETATM 13 O UNL 1 1.699 0.338 3.657 1.00 0.00 O HETATM 14 O UNL 1 0.089 0.881 -0.070 1.00 0.00 O HETATM 15 C UNL 1 2.820 2.528 1.890 1.00 0.00 C HETATM 16 C UNL 1 3.952 3.586 1.787 1.00 0.00 C HETATM 17 C UNL 1 4.095 4.697 0.966 1.00 0.00 C HETATM 18 S UNL 1 5.614 5.465 1.249 1.00 0.00 S HETATM 19 C UNL 1 5.927 4.344 2.505 1.00 0.00 C HETATM 20 N UNL 1 5.024 3.408 2.672 1.00 0.00 N HETATM 21 S UNL 1 3.212 -2.359 0.093 1.00 0.00 S HETATM 22 C UNL 1 2.513 -3.453 -1.027 1.00 0.00 C HETATM 23 C UNL 1 1.193 -3.117 -1.273 1.00 0.00 C HETATM 24 N UNL 1 0.824 -1.871 -0.715 1.00 0.00 N HETATM 25 C UNL 1 0.298 -3.995 -2.069 1.00 0.00 C HETATM 26 C UNL 1 0.558 -5.383 -2.206 1.00 0.00 C HETATM 27 C UNL 1 -0.277 -6.221 -2.972 1.00 0.00 C HETATM 28 C UNL 1 -1.391 -5.686 -3.608 1.00 0.00 C HETATM 29 C UNL 1 -1.674 -4.339 -3.482 1.00 0.00 C HETATM 30 C UNL 1 -0.841 -3.494 -2.714 1.00 0.00 C HETATM 31 F UNL 1 -2.184 -6.485 -4.337 1.00 0.00 F HETATM 32 H UNL 1 2.717 -0.184 1.417 1.00 0.00 H HETATM 33 H UNL 1 0.890 2.965 1.012 1.00 0.00 H HETATM 34 H UNL 1 -0.211 2.767 2.981 1.00 0.00 H HETATM 35 H UNL 1 -0.111 -0.114 5.298 1.00 0.00 H HETATM 36 H UNL 1 -1.851 1.112 6.321 1.00 0.00 H HETATM 37 H UNL 1 -0.687 3.869 6.222 1.00 0.00 H HETATM 38 H UNL 1 2.363 3.398 2.402 1.00 0.00 H HETATM 39 H UNL 1 3.073 2.310 0.843 1.00 0.00 H HETATM 40 H UNL 1 3.429 5.101 0.219 1.00 0.00 H HETATM 41 H UNL 1 6.816 4.405 3.117 1.00 0.00 H HETATM 42 H UNL 1 3.080 -4.294 -1.404 1.00 0.00 H HETATM 43 H UNL 1 1.406 -5.846 -1.711 1.00 0.00 H HETATM 44 H UNL 1 -0.057 -7.284 -3.063 1.00 0.00 H HETATM 45 H UNL 1 -2.553 -3.940 -3.987 1.00 0.00 H HETATM 46 H UNL 1 -1.092 -2.439 -2.636 1.00 0.00 H CONECT 1 2 6 32 CONECT 2 1 3 14 CONECT 3 2 4 15 33 CONECT 4 3 5 34 CONECT 5 4 7 13 CONECT 6 1 21 24 CONECT 7 5 8 9 35 CONECT 8 7 9 10 36 CONECT 9 8 7 CONECT 10 8 11 12 CONECT 11 10 CONECT 12 10 37 CONECT 13 5 CONECT 14 2 CONECT 15 3 16 38 39 CONECT 16 15 17 20 CONECT 17 16 18 40 CONECT 18 17 19 CONECT 19 18 20 41 CONECT 20 19 16 CONECT 21 6 22 CONECT 22 21 23 42 CONECT 23 22 24 25 CONECT 24 23 6 CONECT 25 23 26 30 CONECT 26 25 27 43 CONECT 27 26 28 44 CONECT 28 27 29 31 CONECT 29 28 30 45 CONECT 30 29 25 46 CONECT 31 28 CONECT 32 1 CONECT 33 3 CONECT 34 4 CONECT 35 7 CONECT 36 8 CONECT 37 12 CONECT 38 15 CONECT 39 15 CONECT 40 17 CONECT 41 19 CONECT 42 22 CONECT 43 26 CONECT 44 27 CONECT 45 29 CONECT 46 30 MASTER 0 0 0 0 0 0 0 0 46 0 46 0 END M END $$$$