D08CEK AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 3.010 1.121 0.780 1.00 0.00 N HETATM 2 C UNL 1 2.223 1.039 1.898 1.00 0.00 C HETATM 3 N UNL 1 1.292 0.163 2.085 1.00 0.00 N HETATM 4 N UNL 1 1.350 -0.800 1.149 1.00 0.00 N HETATM 5 C UNL 1 2.474 -1.115 0.417 1.00 0.00 C HETATM 6 C UNL 1 3.133 0.094 -0.037 1.00 0.00 C HETATM 7 C UNL 1 0.315 -1.319 0.390 1.00 0.00 C HETATM 8 N UNL 1 0.798 -2.232 -0.434 1.00 0.00 N HETATM 9 C UNL 1 2.106 -2.411 0.031 1.00 0.00 C HETATM 10 N UNL 1 3.852 0.401 -1.172 1.00 0.00 N HETATM 11 C UNL 1 2.173 -3.658 0.930 1.00 0.00 C HETATM 12 C UNL 1 3.119 -4.220 1.800 1.00 0.00 C HETATM 13 N UNL 1 2.349 -5.045 2.620 1.00 0.00 N HETATM 14 N UNL 1 1.172 -5.385 2.070 1.00 0.00 N HETATM 15 C UNL 1 1.056 -4.524 1.064 1.00 0.00 C HETATM 16 C UNL 1 4.590 -4.181 1.849 1.00 0.00 C HETATM 17 C UNL 1 2.560 -5.497 3.970 1.00 0.00 C HETATM 18 C UNL 1 5.350 -3.219 1.183 1.00 0.00 C HETATM 19 C UNL 1 6.720 -3.432 0.960 1.00 0.00 C HETATM 20 C UNL 1 7.374 -4.530 1.536 1.00 0.00 C HETATM 21 C UNL 1 6.679 -5.315 2.444 1.00 0.00 C HETATM 22 C UNL 1 5.295 -5.247 2.437 1.00 0.00 C HETATM 23 C UNL 1 -1.045 -0.736 0.458 1.00 0.00 C HETATM 24 C UNL 1 4.190 -0.398 -2.299 1.00 0.00 C HETATM 25 C UNL 1 4.335 0.953 -3.080 1.00 0.00 C HETATM 26 C UNL 1 3.349 1.466 -2.016 1.00 0.00 C HETATM 27 C UNL 1 8.711 -5.034 1.059 1.00 0.00 C HETATM 28 F UNL 1 9.238 -4.311 0.032 1.00 0.00 F HETATM 29 F UNL 1 9.655 -5.070 2.035 1.00 0.00 F HETATM 30 F UNL 1 8.616 -6.315 0.590 1.00 0.00 F HETATM 31 O UNL 1 3.909 0.986 -4.465 1.00 0.00 O HETATM 32 C UNL 1 4.170 2.190 -5.184 1.00 0.00 C HETATM 33 H UNL 1 2.347 1.838 2.645 1.00 0.00 H HETATM 34 H UNL 1 0.142 -4.523 0.481 1.00 0.00 H HETATM 35 H UNL 1 3.604 -5.594 4.247 1.00 0.00 H HETATM 36 H UNL 1 2.068 -6.469 4.109 1.00 0.00 H HETATM 37 H UNL 1 2.101 -4.764 4.650 1.00 0.00 H HETATM 38 H UNL 1 4.885 -2.351 0.735 1.00 0.00 H HETATM 39 H UNL 1 7.255 -2.766 0.286 1.00 0.00 H HETATM 40 H UNL 1 7.180 -6.082 3.029 1.00 0.00 H HETATM 41 H UNL 1 4.790 -6.129 2.821 1.00 0.00 H HETATM 42 H UNL 1 -1.023 0.284 0.054 1.00 0.00 H HETATM 43 H UNL 1 -1.405 -0.680 1.491 1.00 0.00 H HETATM 44 H UNL 1 -1.752 -1.322 -0.127 1.00 0.00 H HETATM 45 H UNL 1 3.400 -1.058 -2.663 1.00 0.00 H HETATM 46 H UNL 1 5.129 -0.938 -2.157 1.00 0.00 H HETATM 47 H UNL 1 5.333 1.404 -2.970 1.00 0.00 H HETATM 48 H UNL 1 2.292 1.356 -2.294 1.00 0.00 H HETATM 49 H UNL 1 3.534 2.472 -1.633 1.00 0.00 H HETATM 50 H UNL 1 3.345 2.369 -5.879 1.00 0.00 H HETATM 51 H UNL 1 5.094 2.082 -5.762 1.00 0.00 H HETATM 52 H UNL 1 4.259 3.054 -4.518 1.00 0.00 H CONECT 1 2 6 CONECT 2 1 3 33 CONECT 3 2 4 CONECT 4 3 5 7 CONECT 5 4 6 9 CONECT 6 5 1 10 CONECT 7 4 8 23 CONECT 8 7 9 CONECT 9 8 5 11 CONECT 10 6 24 26 CONECT 11 9 12 15 CONECT 12 11 13 16 CONECT 13 12 14 17 CONECT 14 13 15 CONECT 15 14 11 34 CONECT 16 12 18 22 CONECT 17 13 35 36 37 CONECT 18 16 19 38 CONECT 19 18 20 39 CONECT 20 27 19 21 CONECT 21 20 22 40 CONECT 22 21 16 41 CONECT 23 7 42 43 44 CONECT 24 10 25 45 46 CONECT 25 31 24 26 47 CONECT 26 25 10 48 49 CONECT 27 28 29 30 20 CONECT 28 27 CONECT 29 27 CONECT 30 27 CONECT 31 32 25 CONECT 32 31 50 51 52 CONECT 33 2 CONECT 34 15 CONECT 35 17 CONECT 36 17 CONECT 37 17 CONECT 38 18 CONECT 39 19 CONECT 40 21 CONECT 41 22 CONECT 42 23 CONECT 43 23 CONECT 44 23 CONECT 45 24 CONECT 46 24 CONECT 47 25 CONECT 48 26 CONECT 49 26 CONECT 50 32 CONECT 51 32 CONECT 52 32 MASTER 0 0 0 0 0 0 0 0 52 0 52 0 END M END $$$$