D0X9RA AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 0.746 1.442 0.662 1.00 0.00 N HETATM 2 C UNL 1 0.663 2.535 1.655 1.00 0.00 C HETATM 3 C UNL 1 -0.772 3.007 1.937 1.00 0.00 C HETATM 4 C UNL 1 -1.664 1.844 2.398 1.00 0.00 C HETATM 5 C UNL 1 -1.579 0.741 1.335 1.00 0.00 C HETATM 6 C UNL 1 -0.137 0.325 1.023 1.00 0.00 C HETATM 7 C UNL 1 2.168 1.000 0.565 1.00 0.00 C HETATM 8 C UNL 1 -3.121 2.312 2.669 1.00 0.00 C HETATM 9 C UNL 1 -4.023 1.194 3.231 1.00 0.00 C HETATM 10 C UNL 1 -5.492 1.506 3.450 1.00 0.00 C HETATM 11 C UNL 1 -6.428 0.462 3.300 1.00 0.00 C HETATM 12 C UNL 1 -7.791 0.668 3.536 1.00 0.00 C HETATM 13 C UNL 1 -8.236 1.921 3.939 1.00 0.00 C HETATM 14 C UNL 1 -7.327 2.964 4.115 1.00 0.00 C HETATM 15 C UNL 1 -5.960 2.754 3.876 1.00 0.00 C HETATM 16 C UNL 1 2.455 -0.156 -0.413 1.00 0.00 C HETATM 17 O UNL 1 2.084 0.182 -1.743 1.00 0.00 O HETATM 18 I UNL 1 -10.261 2.233 4.293 1.00 0.00 I HETATM 19 H UNL 1 1.237 3.396 1.289 1.00 0.00 H HETATM 20 H UNL 1 1.120 2.224 2.605 1.00 0.00 H HETATM 21 H UNL 1 -1.187 3.465 1.031 1.00 0.00 H HETATM 22 H UNL 1 -0.746 3.788 2.707 1.00 0.00 H HETATM 23 H UNL 1 -1.254 1.454 3.340 1.00 0.00 H HETATM 24 H UNL 1 -2.070 1.081 0.413 1.00 0.00 H HETATM 25 H UNL 1 -2.111 -0.154 1.671 1.00 0.00 H HETATM 26 H UNL 1 0.269 -0.221 1.886 1.00 0.00 H HETATM 27 H UNL 1 -0.189 -0.376 0.185 1.00 0.00 H HETATM 28 H UNL 1 2.538 0.702 1.555 1.00 0.00 H HETATM 29 H UNL 1 2.763 1.860 0.234 1.00 0.00 H HETATM 30 H UNL 1 -3.559 2.711 1.746 1.00 0.00 H HETATM 31 H UNL 1 -3.088 3.143 3.386 1.00 0.00 H HETATM 32 H UNL 1 -3.611 0.846 4.187 1.00 0.00 H HETATM 33 H UNL 1 -3.982 0.346 2.539 1.00 0.00 H HETATM 34 H UNL 1 -6.097 -0.531 3.000 1.00 0.00 H HETATM 35 H UNL 1 -8.484 -0.162 3.409 1.00 0.00 H HETATM 36 H UNL 1 -7.664 3.942 4.445 1.00 0.00 H HETATM 37 H UNL 1 -5.273 3.579 4.039 1.00 0.00 H HETATM 38 H UNL 1 1.932 -1.074 -0.127 1.00 0.00 H HETATM 39 H UNL 1 3.527 -0.382 -0.410 1.00 0.00 H HETATM 40 H UNL 1 1.192 0.572 -1.680 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 19 20 CONECT 3 2 4 21 22 CONECT 4 3 5 8 23 CONECT 5 4 6 24 25 CONECT 6 5 1 26 27 CONECT 7 1 16 28 29 CONECT 8 4 9 30 31 CONECT 9 8 10 32 33 CONECT 10 9 11 15 CONECT 11 10 12 34 CONECT 12 11 13 35 CONECT 13 12 14 18 CONECT 14 13 15 36 CONECT 15 14 10 37 CONECT 16 7 17 38 39 CONECT 17 16 40 CONECT 18 13 CONECT 19 2 CONECT 20 2 CONECT 21 3 CONECT 22 3 CONECT 23 4 CONECT 24 5 CONECT 25 5 CONECT 26 6 CONECT 27 6 CONECT 28 7 CONECT 29 7 CONECT 30 8 CONECT 31 8 CONECT 32 9 CONECT 33 9 CONECT 34 11 CONECT 35 12 CONECT 36 14 CONECT 37 15 CONECT 38 16 CONECT 39 16 CONECT 40 17 MASTER 0 0 0 0 0 0 0 0 40 0 40 0 END M END $$$$