COMPND UNNAMED AUTHOR GENERATED BY OPEN BABEL 3.0.0 HETATM 1 C UNL 1 2.111 1.224 -0.058 1.00 0.00 C HETATM 2 O UNL 1 0.826 1.118 -0.432 1.00 0.00 O HETATM 3 O UNL 1 2.402 1.851 0.933 1.00 0.00 O HETATM 4 C UNL 1 3.190 0.556 -0.871 1.00 0.00 C HETATM 5 C UNL 1 4.553 0.831 -0.232 1.00 0.00 C HETATM 6 C UNL 1 5.648 0.152 -1.057 1.00 0.00 C HETATM 7 C UNL 1 7.011 0.427 -0.419 1.00 0.00 C HETATM 8 C UNL 1 8.107 -0.251 -1.244 1.00 0.00 C HETATM 9 S UNL 1 7.951 -2.082 -1.156 1.00 0.00 S HETATM 10 C UNL 1 9.737 -2.403 -1.452 1.00 0.00 C HETATM 11 C UNL 1 10.418 -1.218 -0.740 1.00 0.00 C HETATM 12 N UNL 1 10.699 -1.587 0.656 1.00 0.00 N HETATM 13 C UNL 1 10.057 -0.739 1.471 1.00 0.00 C HETATM 14 O UNL 1 10.115 -0.812 2.683 1.00 0.00 O HETATM 15 N UNL 1 9.347 0.198 0.828 1.00 0.00 N HETATM 16 C UNL 1 9.495 0.001 -0.623 1.00 0.00 C HETATM 17 P UNL 1 -0.268 1.855 0.492 1.00 0.00 P HETATM 18 O UNL 1 0.086 3.285 0.630 1.00 0.00 O HETATM 19 O UNL 1 -0.292 1.166 1.947 1.00 0.00 O HETATM 20 O UNL 1 -1.721 1.724 -0.188 1.00 0.00 O HETATM 21 C UNL 1 -2.886 2.363 0.336 1.00 0.00 C HETATM 22 C UNL 1 -4.091 2.032 -0.547 1.00 0.00 C HETATM 23 O UNL 1 -4.394 0.630 -0.455 1.00 0.00 O HETATM 24 C UNL 1 -5.331 2.803 -0.053 1.00 0.00 C HETATM 25 O UNL 1 -5.826 3.664 -1.079 1.00 0.00 O HETATM 26 C UNL 1 -6.362 1.694 0.270 1.00 0.00 C HETATM 27 O UNL 1 -7.670 2.073 -0.163 1.00 0.00 O HETATM 28 C UNL 1 -5.828 0.501 -0.563 1.00 0.00 C HETATM 29 N UNL 1 -6.276 -0.770 0.011 1.00 0.00 N HETATM 30 C UNL 1 -5.617 -1.510 0.947 1.00 0.00 C HETATM 31 N UNL 1 -6.300 -2.580 1.230 1.00 0.00 N HETATM 32 C UNL 1 -7.438 -2.596 0.496 1.00 0.00 C HETATM 33 C UNL 1 -8.528 -3.475 0.382 1.00 0.00 C HETATM 34 N UNL 1 -8.586 -4.634 1.136 1.00 0.00 N HETATM 35 N UNL 1 -9.504 -3.167 -0.467 1.00 0.00 N HETATM 36 C UNL 1 -9.458 -2.064 -1.191 1.00 0.00 C HETATM 37 N UNL 1 -8.457 -1.212 -1.117 1.00 0.00 N HETATM 38 C UNL 1 -7.439 -1.432 -0.292 1.00 0.00 C HETATM 39 H UNL 1 3.011 -0.519 -0.898 1.00 0.00 H HETATM 40 H UNL 1 3.178 0.953 -1.886 1.00 0.00 H HETATM 41 H UNL 1 4.732 1.906 -0.205 1.00 0.00 H HETATM 42 H UNL 1 4.565 0.434 0.783 1.00 0.00 H HETATM 43 H UNL 1 5.470 -0.923 -1.085 1.00 0.00 H HETATM 44 H UNL 1 5.636 0.549 -2.073 1.00 0.00 H HETATM 45 H UNL 1 7.190 1.502 -0.392 1.00 0.00 H HETATM 46 H UNL 1 7.023 0.031 0.596 1.00 0.00 H HETATM 47 H UNL 1 8.076 0.090 -2.279 1.00 0.00 H HETATM 48 H UNL 1 10.039 -3.349 -1.002 1.00 0.00 H HETATM 49 H UNL 1 9.960 -2.393 -2.519 1.00 0.00 H HETATM 50 H UNL 1 11.342 -0.950 -1.253 1.00 0.00 H HETATM 51 H UNL 1 11.258 -2.327 0.941 1.00 0.00 H HETATM 52 H UNL 1 8.820 0.894 1.251 1.00 0.00 H HETATM 53 H UNL 1 9.960 0.873 -1.081 1.00 0.00 H HETATM 54 H UNL 1 -0.517 0.225 1.933 1.00 0.00 H HETATM 55 H UNL 1 -3.070 2.007 1.350 1.00 0.00 H HETATM 56 H UNL 1 -2.733 3.442 0.352 1.00 0.00 H HETATM 57 H UNL 1 -3.875 2.298 -1.582 1.00 0.00 H HETATM 58 H UNL 1 -5.091 3.376 0.843 1.00 0.00 H HETATM 59 H UNL 1 -6.607 4.173 -0.822 1.00 0.00 H HETATM 60 H UNL 1 -6.360 1.458 1.334 1.00 0.00 H HETATM 61 H UNL 1 -8.011 2.870 0.266 1.00 0.00 H HETATM 62 H UNL 1 -6.144 0.587 -1.603 1.00 0.00 H HETATM 63 H UNL 1 -4.667 -1.246 1.389 1.00 0.00 H HETATM 64 H UNL 1 -7.868 -4.847 1.752 1.00 0.00 H HETATM 65 H UNL 1 -9.344 -5.233 1.048 1.00 0.00 H HETATM 66 H UNL 1 -10.272 -1.852 -1.868 1.00 0.00 H CONECT 1 2 3 3 4 CONECT 2 1 17 CONECT 3 1 1 CONECT 4 1 5 39 40 CONECT 5 4 6 41 42 CONECT 6 5 7 43 44 CONECT 7 6 8 45 46 CONECT 8 7 9 16 47 CONECT 9 8 10 CONECT 10 9 11 48 49 CONECT 11 10 12 16 50 CONECT 12 11 13 51 CONECT 13 12 14 14 15 CONECT 14 13 13 CONECT 15 13 16 52 CONECT 16 8 11 15 53 CONECT 17 2 18 18 19 CONECT 17 20 CONECT 18 17 17 CONECT 19 17 54 CONECT 20 17 21 CONECT 21 20 22 55 56 CONECT 22 21 23 24 57 CONECT 23 22 28 CONECT 24 22 25 26 58 CONECT 25 24 59 CONECT 26 24 27 28 60 CONECT 27 26 61 CONECT 28 23 26 29 62 CONECT 29 28 30 38 CONECT 30 29 31 31 63 CONECT 31 30 30 32 CONECT 32 31 33 33 38 CONECT 33 32 32 34 35 CONECT 34 33 64 65 CONECT 35 33 36 36 CONECT 36 35 35 37 66 CONECT 37 36 38 38 CONECT 38 29 32 37 37 CONECT 39 4 CONECT 40 4 CONECT 41 5 CONECT 42 5 CONECT 43 6 CONECT 44 6 CONECT 45 7 CONECT 46 7 CONECT 47 8 CONECT 48 10 CONECT 49 10 CONECT 50 11 CONECT 51 12 CONECT 52 15 CONECT 53 16 CONECT 54 19 CONECT 55 21 CONECT 56 21 CONECT 57 22 CONECT 58 24 CONECT 59 25 CONECT 60 26 CONECT 61 27 CONECT 62 28 CONECT 63 30 CONECT 64 34 CONECT 65 34 CONECT 66 36 MASTER 0 0 0 0 0 0 0 0 66 0 66 0 END