D01RUK AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.486 1.247 2.131 1.00 0.00 C HETATM 2 N UNL 1 -0.296 0.576 1.155 1.00 0.00 N HETATM 3 C UNL 1 -0.791 0.975 -0.073 1.00 0.00 C HETATM 4 N UNL 1 -1.359 -0.119 -0.813 1.00 0.00 N HETATM 5 O UNL 1 -0.682 2.111 -0.535 1.00 0.00 O HETATM 6 C UNL 1 -1.765 0.123 -2.193 1.00 0.00 C HETATM 7 C UNL 1 -1.716 -1.118 -3.100 1.00 0.00 C HETATM 8 C UNL 1 -1.884 -2.457 -2.380 1.00 0.00 C HETATM 9 C UNL 1 -2.699 -2.228 -1.096 1.00 0.00 C HETATM 10 C UNL 1 -2.045 -1.231 -0.144 1.00 0.00 C HETATM 11 C UNL 1 -0.597 -3.315 -2.150 1.00 0.00 C HETATM 12 N UNL 1 -0.552 -3.863 -0.906 1.00 0.00 N HETATM 13 C UNL 1 -0.761 -5.197 -0.848 1.00 0.00 C HETATM 14 C UNL 1 -0.849 -6.028 -1.960 1.00 0.00 C HETATM 15 C UNL 1 -0.422 -5.474 -3.169 1.00 0.00 C HETATM 16 C UNL 1 -0.210 -4.095 -3.242 1.00 0.00 C HETATM 17 CL UNL 1 0.377 -3.413 -4.705 1.00 0.00 Cl HETATM 18 C UNL 1 -1.585 -7.342 -1.824 1.00 0.00 C HETATM 19 C UNL 1 -1.360 -8.441 -2.870 1.00 0.00 C HETATM 20 O UNL 1 -0.054 -9.001 -2.729 1.00 0.00 O HETATM 21 O UNL 1 -1.333 -7.879 -0.522 1.00 0.00 O HETATM 22 F UNL 1 -2.737 -3.205 -3.184 1.00 0.00 F HETATM 23 C UNL 1 0.628 2.626 2.322 1.00 0.00 C HETATM 24 C UNL 1 1.543 3.124 3.300 1.00 0.00 C HETATM 25 C UNL 1 2.324 2.247 4.077 1.00 0.00 C HETATM 26 C UNL 1 2.095 0.879 3.938 1.00 0.00 C HETATM 27 C UNL 1 1.205 0.395 2.976 1.00 0.00 C HETATM 28 C UNL 1 3.438 2.689 4.998 1.00 0.00 C HETATM 29 F UNL 1 3.899 3.944 4.751 1.00 0.00 F HETATM 30 F UNL 1 3.094 2.661 6.315 1.00 0.00 F HETATM 31 F UNL 1 4.534 1.875 4.895 1.00 0.00 F HETATM 32 H UNL 1 -0.214 -0.418 1.217 1.00 0.00 H HETATM 33 H UNL 1 -1.159 0.914 -2.644 1.00 0.00 H HETATM 34 H UNL 1 -2.796 0.501 -2.158 1.00 0.00 H HETATM 35 H UNL 1 -0.811 -1.099 -3.712 1.00 0.00 H HETATM 36 H UNL 1 -2.542 -1.023 -3.821 1.00 0.00 H HETATM 37 H UNL 1 -2.910 -3.169 -0.573 1.00 0.00 H HETATM 38 H UNL 1 -3.691 -1.861 -1.388 1.00 0.00 H HETATM 39 H UNL 1 -1.344 -1.755 0.509 1.00 0.00 H HETATM 40 H UNL 1 -2.820 -0.799 0.499 1.00 0.00 H HETATM 41 H UNL 1 -0.946 -5.574 0.156 1.00 0.00 H HETATM 42 H UNL 1 -0.343 -6.069 -4.075 1.00 0.00 H HETATM 43 H UNL 1 -2.652 -7.081 -1.857 1.00 0.00 H HETATM 44 H UNL 1 -1.515 -8.106 -3.899 1.00 0.00 H HETATM 45 H UNL 1 -2.062 -9.261 -2.674 1.00 0.00 H HETATM 46 H UNL 1 0.583 -8.344 -3.060 1.00 0.00 H HETATM 47 H UNL 1 -0.755 -8.655 -0.657 1.00 0.00 H HETATM 48 H UNL 1 0.050 3.342 1.735 1.00 0.00 H HETATM 49 H UNL 1 1.652 4.202 3.432 1.00 0.00 H HETATM 50 H UNL 1 2.650 0.166 4.543 1.00 0.00 H HETATM 51 H UNL 1 1.129 -0.680 2.863 1.00 0.00 H CONECT 1 2 23 27 CONECT 2 1 3 32 CONECT 3 2 4 5 CONECT 4 3 6 10 CONECT 5 3 CONECT 6 4 7 33 34 CONECT 7 6 8 35 36 CONECT 8 7 9 11 22 CONECT 9 8 10 37 38 CONECT 10 9 4 39 40 CONECT 11 8 12 16 CONECT 12 11 13 CONECT 13 12 14 41 CONECT 14 13 15 18 CONECT 15 14 16 42 CONECT 16 15 11 17 CONECT 17 16 CONECT 18 14 19 21 43 CONECT 19 18 20 44 45 CONECT 20 19 46 CONECT 21 18 47 CONECT 22 8 CONECT 23 1 24 48 CONECT 24 23 25 49 CONECT 25 24 26 28 CONECT 26 25 27 50 CONECT 27 26 1 51 CONECT 28 25 29 30 31 CONECT 29 28 CONECT 30 28 CONECT 31 28 CONECT 32 2 CONECT 33 6 CONECT 34 6 CONECT 35 7 CONECT 36 7 CONECT 37 9 CONECT 38 9 CONECT 39 10 CONECT 40 10 CONECT 41 13 CONECT 42 15 CONECT 43 18 CONECT 44 19 CONECT 45 19 CONECT 46 20 CONECT 47 21 CONECT 48 23 CONECT 49 24 CONECT 50 26 CONECT 51 27 MASTER 0 0 0 0 0 0 0 0 51 0 51 0 END M END $$$$