D0KP0U AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.090 0.015 0.041 1.00 0.00 C HETATM 2 C UNL 1 5.268 0.015 0.041 1.00 0.00 C HETATM 3 N UNL 1 4.770 0.531 -1.137 1.00 0.00 N HETATM 4 N UNL 1 3.332 0.168 -1.233 1.00 0.00 N HETATM 5 C UNL 1 2.530 0.015 0.041 1.00 0.00 C HETATM 6 C UNL 1 2.977 0.101 -2.667 1.00 0.00 C HETATM 7 C UNL 1 3.264 0.341 1.515 1.00 0.00 C HETATM 8 C UNL 1 4.052 1.521 1.751 1.00 0.00 C HETATM 9 C UNL 1 5.098 1.587 2.727 1.00 0.00 C HETATM 10 C UNL 1 5.398 0.481 3.530 1.00 0.00 C HETATM 11 C UNL 1 4.497 -0.591 3.474 1.00 0.00 C HETATM 12 C UNL 1 3.445 -0.664 2.495 1.00 0.00 C HETATM 13 C UNL 1 4.057 0.049 -3.604 1.00 0.00 C HETATM 14 C UNL 1 3.879 0.041 -4.991 1.00 0.00 C HETATM 15 C UNL 1 2.595 0.069 -5.504 1.00 0.00 C HETATM 16 C UNL 1 1.504 0.121 -4.612 1.00 0.00 C HETATM 17 C UNL 1 1.692 0.117 -3.204 1.00 0.00 C HETATM 18 S UNL 1 2.398 0.209 -7.250 1.00 0.00 S HETATM 19 O UNL 1 1.060 0.647 -7.541 1.00 0.00 O HETATM 20 O UNL 1 3.561 0.872 -7.816 1.00 0.00 O HETATM 21 N UNL 1 2.470 -1.377 -7.798 1.00 0.00 N HETATM 22 C UNL 1 6.719 0.412 4.278 1.00 0.00 C HETATM 23 C UNL 1 6.788 0.015 0.041 1.00 0.00 C HETATM 24 F UNL 1 7.322 -0.511 -1.096 1.00 0.00 F HETATM 25 F UNL 1 7.312 1.261 0.191 1.00 0.00 F HETATM 26 F UNL 1 7.277 -0.735 1.068 1.00 0.00 F HETATM 27 H UNL 1 0.058 0.015 0.041 1.00 0.00 H HETATM 28 H UNL 1 4.060 2.327 1.013 1.00 0.00 H HETATM 29 H UNL 1 5.774 2.448 2.755 1.00 0.00 H HETATM 30 H UNL 1 4.657 -1.442 4.144 1.00 0.00 H HETATM 31 H UNL 1 2.853 -1.573 2.464 1.00 0.00 H HETATM 32 H UNL 1 5.096 0.030 -3.274 1.00 0.00 H HETATM 33 H UNL 1 4.754 0.037 -5.647 1.00 0.00 H HETATM 34 H UNL 1 0.492 0.192 -5.013 1.00 0.00 H HETATM 35 H UNL 1 0.814 0.215 -2.572 1.00 0.00 H HETATM 36 H UNL 1 1.585 -1.630 -8.235 1.00 0.00 H HETATM 37 H UNL 1 3.266 -1.484 -8.435 1.00 0.00 H HETATM 38 H UNL 1 7.550 0.550 3.568 1.00 0.00 H HETATM 39 H UNL 1 6.895 -0.565 4.750 1.00 0.00 H HETATM 40 H UNL 1 6.823 1.182 5.053 1.00 0.00 H CONECT 1 2 5 27 CONECT 2 1 3 23 CONECT 3 2 4 CONECT 4 3 5 6 CONECT 5 4 1 7 CONECT 6 4 13 17 CONECT 7 5 8 12 CONECT 8 7 9 28 CONECT 9 8 10 29 CONECT 10 9 11 22 CONECT 11 10 12 30 CONECT 12 11 7 31 CONECT 13 6 14 32 CONECT 14 13 15 33 CONECT 15 14 16 18 CONECT 16 15 17 34 CONECT 17 16 6 35 CONECT 18 15 19 20 21 CONECT 19 18 CONECT 20 18 CONECT 21 18 36 37 CONECT 22 10 38 39 40 CONECT 23 2 24 25 26 CONECT 24 23 CONECT 25 23 CONECT 26 23 CONECT 27 1 CONECT 28 8 CONECT 29 9 CONECT 30 11 CONECT 31 12 CONECT 32 13 CONECT 33 14 CONECT 34 16 CONECT 35 17 CONECT 36 21 CONECT 37 21 CONECT 38 22 CONECT 39 22 CONECT 40 22 MASTER 0 0 0 0 0 0 0 0 40 0 40 0 END M END $$$$