D0ET4U AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.060 3.931 -0.023 1.00 0.00 C HETATM 2 C UNL 1 0.033 3.903 0.897 1.00 0.00 C HETATM 3 C UNL 1 -1.265 3.700 0.434 1.00 0.00 C HETATM 4 C UNL 1 -1.499 3.440 -0.939 1.00 0.00 C HETATM 5 N UNL 1 -0.470 3.434 -1.826 1.00 0.00 N HETATM 6 C UNL 1 0.768 3.727 -1.359 1.00 0.00 C HETATM 7 N UNL 1 -2.802 3.074 -1.430 1.00 0.00 N HETATM 8 C UNL 1 -3.183 1.878 -0.826 1.00 0.00 C HETATM 9 C UNL 1 -3.727 4.283 -1.475 1.00 0.00 C HETATM 10 C UNL 1 -3.294 5.457 -2.425 1.00 0.00 C HETATM 11 C UNL 1 -4.156 6.276 -3.185 1.00 0.00 C HETATM 12 C UNL 1 -3.645 7.292 -4.071 1.00 0.00 C HETATM 13 C UNL 1 -2.262 7.455 -4.248 1.00 0.00 C HETATM 14 C UNL 1 -1.435 6.696 -3.450 1.00 0.00 C HETATM 15 C UNL 1 -1.964 5.856 -2.484 1.00 0.00 C HETATM 16 C UNL 1 -1.522 8.428 -5.104 1.00 0.00 C HETATM 17 O UNL 1 -0.298 8.559 -5.001 1.00 0.00 O HETATM 18 N UNL 1 -2.197 9.162 -6.045 1.00 0.00 N HETATM 19 O UNL 1 -1.324 9.869 -6.902 1.00 0.00 O HETATM 20 N UNL 1 -2.538 1.396 0.225 1.00 0.00 N HETATM 21 C UNL 1 -2.787 0.080 0.324 1.00 0.00 C HETATM 22 C UNL 1 -3.759 -0.290 -0.586 1.00 0.00 C HETATM 23 N UNL 1 -3.986 0.865 -1.340 1.00 0.00 N HETATM 24 C UNL 1 -4.811 0.886 -2.521 1.00 0.00 C HETATM 25 C UNL 1 -2.190 -0.842 1.190 1.00 0.00 C HETATM 26 C UNL 1 -2.654 -2.158 1.172 1.00 0.00 C HETATM 27 C UNL 1 -3.679 -2.530 0.303 1.00 0.00 C HETATM 28 C UNL 1 -4.234 -1.604 -0.611 1.00 0.00 C HETATM 29 F UNL 1 2.317 4.172 0.371 1.00 0.00 F HETATM 30 H UNL 1 0.243 3.974 1.958 1.00 0.00 H HETATM 31 H UNL 1 -2.077 3.622 1.155 1.00 0.00 H HETATM 32 H UNL 1 1.537 3.813 -2.116 1.00 0.00 H HETATM 33 H UNL 1 -3.872 4.699 -0.468 1.00 0.00 H HETATM 34 H UNL 1 -4.714 3.940 -1.819 1.00 0.00 H HETATM 35 H UNL 1 -5.238 6.192 -3.080 1.00 0.00 H HETATM 36 H UNL 1 -4.344 7.950 -4.584 1.00 0.00 H HETATM 37 H UNL 1 -0.350 6.769 -3.515 1.00 0.00 H HETATM 38 H UNL 1 -1.236 5.524 -1.772 1.00 0.00 H HETATM 39 H UNL 1 -3.091 8.891 -6.433 1.00 0.00 H HETATM 40 H UNL 1 -0.428 9.669 -6.533 1.00 0.00 H HETATM 41 H UNL 1 -4.852 -0.122 -2.952 1.00 0.00 H HETATM 42 H UNL 1 -4.396 1.567 -3.265 1.00 0.00 H HETATM 43 H UNL 1 -5.819 1.187 -2.225 1.00 0.00 H HETATM 44 H UNL 1 -1.379 -0.524 1.838 1.00 0.00 H HETATM 45 H UNL 1 -2.202 -2.885 1.844 1.00 0.00 H HETATM 46 H UNL 1 -4.027 -3.559 0.298 1.00 0.00 H HETATM 47 H UNL 1 -5.021 -1.925 -1.298 1.00 0.00 H CONECT 1 2 6 29 CONECT 2 1 3 30 CONECT 3 2 4 31 CONECT 4 3 5 7 CONECT 5 4 6 CONECT 6 5 1 32 CONECT 7 4 8 9 CONECT 8 7 20 23 CONECT 9 7 10 33 34 CONECT 10 9 11 15 CONECT 11 10 12 35 CONECT 12 11 13 36 CONECT 13 12 14 16 CONECT 14 13 15 37 CONECT 15 14 10 38 CONECT 16 13 17 18 CONECT 17 16 CONECT 18 16 19 39 CONECT 19 18 40 CONECT 20 8 21 CONECT 21 20 22 25 CONECT 22 21 23 28 CONECT 23 22 8 24 CONECT 24 23 41 42 43 CONECT 25 21 26 44 CONECT 26 25 27 45 CONECT 27 26 28 46 CONECT 28 27 22 47 CONECT 29 1 CONECT 30 2 CONECT 31 3 CONECT 32 6 CONECT 33 9 CONECT 34 9 CONECT 35 11 CONECT 36 12 CONECT 37 14 CONECT 38 15 CONECT 39 18 CONECT 40 19 CONECT 41 24 CONECT 42 24 CONECT 43 24 CONECT 44 25 CONECT 45 26 CONECT 46 27 CONECT 47 28 MASTER 0 0 0 0 0 0 0 0 47 0 47 0 END M END $$$$