D0JY1I AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.044 -0.980 0.069 1.00 0.00 C HETATM 2 C UNL 1 2.826 -2.070 -0.411 1.00 0.00 C HETATM 3 C UNL 1 3.450 -1.992 -1.656 1.00 0.00 C HETATM 4 C UNL 1 2.889 -1.056 -2.525 1.00 0.00 C HETATM 5 C UNL 1 1.624 -0.508 -2.203 1.00 0.00 C HETATM 6 C UNL 1 1.143 -0.536 -0.877 1.00 0.00 C HETATM 7 C UNL 1 -0.348 -0.685 -0.654 1.00 0.00 C HETATM 8 N UNL 1 4.514 -2.836 -2.096 1.00 0.00 N HETATM 9 N UNL 1 2.849 -0.081 0.892 1.00 0.00 N HETATM 10 C UNL 1 2.992 1.183 1.350 1.00 0.00 C HETATM 11 S UNL 1 4.683 1.455 1.815 1.00 0.00 S HETATM 12 C UNL 1 4.306 2.958 2.487 1.00 0.00 C HETATM 13 C UNL 1 2.970 3.248 2.351 1.00 0.00 C HETATM 14 N UNL 1 2.244 2.234 1.645 1.00 0.00 N HETATM 15 C UNL 1 2.449 4.542 2.865 1.00 0.00 C HETATM 16 C UNL 1 3.155 5.353 3.789 1.00 0.00 C HETATM 17 C UNL 1 2.691 6.626 4.142 1.00 0.00 C HETATM 18 C UNL 1 1.511 7.060 3.599 1.00 0.00 C HETATM 19 N UNL 1 0.765 6.316 2.751 1.00 0.00 N HETATM 20 C UNL 1 1.252 5.074 2.415 1.00 0.00 C HETATM 21 C UNL 1 4.969 -3.970 -1.435 1.00 0.00 C HETATM 22 C UNL 1 6.111 -4.802 -2.008 1.00 0.00 C HETATM 23 O UNL 1 4.461 -4.416 -0.399 1.00 0.00 O HETATM 24 C UNL 1 7.211 -4.343 -2.749 1.00 0.00 C HETATM 25 C UNL 1 8.262 -5.243 -3.136 1.00 0.00 C HETATM 26 C UNL 1 8.213 -6.601 -2.812 1.00 0.00 C HETATM 27 C UNL 1 7.105 -7.041 -2.083 1.00 0.00 C HETATM 28 C UNL 1 6.094 -6.168 -1.677 1.00 0.00 C HETATM 29 C UNL 1 9.196 -7.664 -3.156 1.00 0.00 C HETATM 30 C UNL 1 10.491 -7.606 -3.523 1.00 0.00 C HETATM 31 C UNL 1 11.225 -8.930 -3.654 1.00 0.00 C HETATM 32 N UNL 1 12.568 -8.881 -3.837 1.00 0.00 N HETATM 33 O UNL 1 10.650 -10.004 -3.518 1.00 0.00 O HETATM 34 O UNL 1 13.155 -7.732 -4.406 1.00 0.00 O HETATM 35 H UNL 1 2.785 -3.005 0.139 1.00 0.00 H HETATM 36 H UNL 1 3.288 -0.901 -3.523 1.00 0.00 H HETATM 37 H UNL 1 0.965 -0.206 -3.014 1.00 0.00 H HETATM 38 H UNL 1 -0.726 -1.562 -1.203 1.00 0.00 H HETATM 39 H UNL 1 -0.893 0.195 -1.002 1.00 0.00 H HETATM 40 H UNL 1 -0.592 -0.855 0.402 1.00 0.00 H HETATM 41 H UNL 1 4.896 -2.642 -3.017 1.00 0.00 H HETATM 42 H UNL 1 3.617 -0.661 1.239 1.00 0.00 H HETATM 43 H UNL 1 5.103 3.541 2.939 1.00 0.00 H HETATM 44 H UNL 1 4.083 5.026 4.244 1.00 0.00 H HETATM 45 H UNL 1 3.251 7.262 4.830 1.00 0.00 H HETATM 46 H UNL 1 1.108 8.057 3.821 1.00 0.00 H HETATM 47 H UNL 1 0.621 4.524 1.729 1.00 0.00 H HETATM 48 H UNL 1 7.307 -3.288 -3.000 1.00 0.00 H HETATM 49 H UNL 1 9.113 -4.839 -3.688 1.00 0.00 H HETATM 50 H UNL 1 7.015 -8.090 -1.793 1.00 0.00 H HETATM 51 H UNL 1 5.283 -6.569 -1.071 1.00 0.00 H HETATM 52 H UNL 1 8.779 -8.665 -3.042 1.00 0.00 H HETATM 53 H UNL 1 11.037 -6.695 -3.667 1.00 0.00 H HETATM 54 H UNL 1 13.005 -9.769 -4.070 1.00 0.00 H HETATM 55 H UNL 1 13.464 -7.256 -3.611 1.00 0.00 H CONECT 1 2 6 9 CONECT 2 1 3 35 CONECT 3 2 4 8 CONECT 4 3 5 36 CONECT 5 4 6 37 CONECT 6 5 1 7 CONECT 7 6 38 39 40 CONECT 8 3 21 41 CONECT 9 1 10 42 CONECT 10 9 11 14 CONECT 11 10 12 CONECT 12 11 13 43 CONECT 13 12 14 15 CONECT 14 13 10 CONECT 15 13 16 20 CONECT 16 15 17 44 CONECT 17 16 18 45 CONECT 18 17 19 46 CONECT 19 18 20 CONECT 20 19 15 47 CONECT 21 8 22 23 CONECT 22 21 24 28 CONECT 23 21 CONECT 24 22 25 48 CONECT 25 24 26 49 CONECT 26 25 27 29 CONECT 27 26 28 50 CONECT 28 27 22 51 CONECT 29 26 30 52 CONECT 30 29 31 53 CONECT 31 30 32 33 CONECT 32 31 34 54 CONECT 33 31 CONECT 34 32 55 CONECT 35 2 CONECT 36 4 CONECT 37 5 CONECT 38 7 CONECT 39 7 CONECT 40 7 CONECT 41 8 CONECT 42 9 CONECT 43 12 CONECT 44 16 CONECT 45 17 CONECT 46 18 CONECT 47 20 CONECT 48 24 CONECT 49 25 CONECT 50 27 CONECT 51 28 CONECT 52 29 CONECT 53 30 CONECT 54 32 CONECT 55 34 MASTER 0 0 0 0 0 0 0 0 55 0 55 0 END M END $$$$