D01RBE AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 0.715 0.190 -0.546 1.00 0.00 N HETATM 2 C UNL 1 0.193 0.912 -1.724 1.00 0.00 C HETATM 3 C UNL 1 -1.363 0.910 -1.946 1.00 0.00 C HETATM 4 C UNL 1 -2.220 1.096 -0.634 1.00 0.00 C HETATM 5 C UNL 1 -1.696 -0.008 0.292 1.00 0.00 C HETATM 6 C UNL 1 -0.176 0.235 0.620 1.00 0.00 C HETATM 7 C UNL 1 -3.808 1.413 -0.857 1.00 0.00 C HETATM 8 C UNL 1 2.151 0.162 -0.423 1.00 0.00 C HETATM 9 C UNL 1 2.891 -0.783 0.633 1.00 0.00 C HETATM 10 O UNL 1 2.875 0.815 -1.214 1.00 0.00 O HETATM 11 C UNL 1 2.948 -0.533 2.178 1.00 0.00 C HETATM 12 C UNL 1 2.797 -1.957 2.816 1.00 0.00 C HETATM 13 N UNL 1 3.008 -2.901 1.712 1.00 0.00 N HETATM 14 C UNL 1 2.408 -2.240 0.540 1.00 0.00 C HETATM 15 C UNL 1 -4.189 2.175 -1.974 1.00 0.00 C HETATM 16 C UNL 1 -4.962 1.236 -2.725 1.00 0.00 C HETATM 17 N UNL 1 -5.278 0.175 -1.968 1.00 0.00 N HETATM 18 N UNL 1 -5.078 0.703 -0.723 1.00 0.00 N HETATM 19 C UNL 1 -6.348 0.920 0.052 1.00 0.00 C HETATM 20 C UNL 1 4.176 0.136 2.825 1.00 0.00 C HETATM 21 C UNL 1 -7.538 0.299 -0.413 1.00 0.00 C HETATM 22 C UNL 1 -8.577 -0.081 0.444 1.00 0.00 C HETATM 23 C UNL 1 -8.578 0.422 1.729 1.00 0.00 C HETATM 24 C UNL 1 -7.647 1.427 2.047 1.00 0.00 C HETATM 25 C UNL 1 -6.570 1.722 1.160 1.00 0.00 C HETATM 26 C UNL 1 5.497 -0.044 2.384 1.00 0.00 C HETATM 27 C UNL 1 6.577 0.534 3.077 1.00 0.00 C HETATM 28 C UNL 1 6.363 1.278 4.231 1.00 0.00 C HETATM 29 C UNL 1 5.076 1.446 4.716 1.00 0.00 C HETATM 30 C UNL 1 4.006 0.867 4.022 1.00 0.00 C HETATM 31 F UNL 1 -9.565 0.128 2.588 1.00 0.00 F HETATM 32 CL UNL 1 -9.896 -1.016 -0.156 1.00 0.00 Cl HETATM 33 C UNL 1 2.648 -4.325 1.950 1.00 0.00 C HETATM 34 F UNL 1 7.410 1.821 4.870 1.00 0.00 F HETATM 35 F UNL 1 2.777 0.984 4.552 1.00 0.00 F HETATM 36 C UNL 1 -5.271 1.249 -4.168 1.00 0.00 C HETATM 37 C UNL 1 1.159 -4.556 2.284 1.00 0.00 C HETATM 38 C UNL 1 3.002 -5.157 0.695 1.00 0.00 C HETATM 39 C UNL 1 3.480 -4.931 3.111 1.00 0.00 C HETATM 40 H UNL 1 0.683 0.491 -2.616 1.00 0.00 H HETATM 41 H UNL 1 0.549 1.947 -1.655 1.00 0.00 H HETATM 42 H UNL 1 -1.636 -0.035 -2.437 1.00 0.00 H HETATM 43 H UNL 1 -1.581 1.699 -2.676 1.00 0.00 H HETATM 44 H UNL 1 -1.881 2.048 -0.201 1.00 0.00 H HETATM 45 H UNL 1 -1.782 -0.996 -0.187 1.00 0.00 H HETATM 46 H UNL 1 -2.264 -0.029 1.222 1.00 0.00 H HETATM 47 H UNL 1 0.162 -0.490 1.361 1.00 0.00 H HETATM 48 H UNL 1 -0.041 1.237 1.053 1.00 0.00 H HETATM 49 H UNL 1 3.936 -0.797 0.274 1.00 0.00 H HETATM 50 H UNL 1 2.078 0.070 2.454 1.00 0.00 H HETATM 51 H UNL 1 1.787 -2.046 3.236 1.00 0.00 H HETATM 52 H UNL 1 3.508 -2.145 3.632 1.00 0.00 H HETATM 53 H UNL 1 1.318 -2.296 0.572 1.00 0.00 H HETATM 54 H UNL 1 2.754 -2.684 -0.397 1.00 0.00 H HETATM 55 H UNL 1 -3.627 2.985 -2.416 1.00 0.00 H HETATM 56 H UNL 1 -7.905 0.639 -1.400 1.00 0.00 H HETATM 57 H UNL 1 -7.834 2.015 2.933 1.00 0.00 H HETATM 58 H UNL 1 -6.130 2.718 1.213 1.00 0.00 H HETATM 59 H UNL 1 5.722 -0.667 1.521 1.00 0.00 H HETATM 60 H UNL 1 7.597 0.391 2.728 1.00 0.00 H HETATM 61 H UNL 1 4.897 2.001 5.631 1.00 0.00 H HETATM 62 H UNL 1 -4.340 1.153 -4.734 1.00 0.00 H HETATM 63 H UNL 1 -5.764 2.184 -4.449 1.00 0.00 H HETATM 64 H UNL 1 -5.928 0.417 -4.444 1.00 0.00 H HETATM 65 H UNL 1 0.940 -5.629 2.357 1.00 0.00 H HETATM 66 H UNL 1 0.496 -4.150 1.515 1.00 0.00 H HETATM 67 H UNL 1 0.882 -4.113 3.246 1.00 0.00 H HETATM 68 H UNL 1 2.824 -6.227 0.862 1.00 0.00 H HETATM 69 H UNL 1 4.060 -5.042 0.430 1.00 0.00 H HETATM 70 H UNL 1 2.398 -4.871 -0.172 1.00 0.00 H HETATM 71 H UNL 1 3.281 -6.008 3.211 1.00 0.00 H HETATM 72 H UNL 1 3.239 -4.478 4.078 1.00 0.00 H HETATM 73 H UNL 1 4.556 -4.822 2.938 1.00 0.00 H CONECT 1 2 6 8 CONECT 2 1 3 40 41 CONECT 3 2 4 42 43 CONECT 4 3 5 7 44 CONECT 5 4 6 45 46 CONECT 6 5 1 47 48 CONECT 7 4 15 18 CONECT 8 1 9 10 CONECT 9 8 11 14 49 CONECT 10 8 CONECT 11 9 12 20 50 CONECT 12 11 13 51 52 CONECT 13 12 14 33 CONECT 14 13 9 53 54 CONECT 15 7 16 55 CONECT 16 36 15 17 CONECT 17 16 18 CONECT 18 17 7 19 CONECT 19 18 21 25 CONECT 20 26 30 11 CONECT 21 19 22 56 CONECT 22 21 23 32 CONECT 23 22 24 31 CONECT 24 23 25 57 CONECT 25 24 19 58 CONECT 26 20 27 59 CONECT 27 26 28 60 CONECT 28 27 29 34 CONECT 29 28 30 61 CONECT 30 29 20 35 CONECT 31 23 CONECT 32 22 CONECT 33 37 38 39 13 CONECT 34 28 CONECT 35 30 CONECT 36 16 62 63 64 CONECT 37 33 65 66 67 CONECT 38 33 68 69 70 CONECT 39 33 71 72 73 CONECT 40 2 CONECT 41 2 CONECT 42 3 CONECT 43 3 CONECT 44 4 CONECT 45 5 CONECT 46 5 CONECT 47 6 CONECT 48 6 CONECT 49 9 CONECT 50 11 CONECT 51 12 CONECT 52 12 CONECT 53 14 CONECT 54 14 CONECT 55 15 CONECT 56 21 CONECT 57 24 CONECT 58 25 CONECT 59 26 CONECT 60 27 CONECT 61 29 CONECT 62 36 CONECT 63 36 CONECT 64 36 CONECT 65 37 CONECT 66 37 CONECT 67 37 CONECT 68 38 CONECT 69 38 CONECT 70 38 CONECT 71 39 CONECT 72 39 CONECT 73 39 MASTER 0 0 0 0 0 0 0 0 73 0 73 0 END M END $$$$