D04QRX AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 3.387 -1.867 -1.521 1.00 0.00 C HETATM 2 C UNL 1 3.994 -3.130 -1.581 1.00 0.00 C HETATM 3 C UNL 1 3.370 -4.112 -0.820 1.00 0.00 C HETATM 4 N UNL 1 2.826 -3.712 0.365 1.00 0.00 N HETATM 5 C UNL 1 2.727 -2.383 0.642 1.00 0.00 C HETATM 6 C UNL 1 2.967 -1.399 -0.292 1.00 0.00 C HETATM 7 N UNL 1 3.402 -5.489 -1.153 1.00 0.00 N HETATM 8 C UNL 1 2.516 -6.220 -0.231 1.00 0.00 C HETATM 9 C UNL 1 2.842 -7.689 -0.318 1.00 0.00 C HETATM 10 C UNL 1 2.459 -8.159 -1.701 1.00 0.00 C HETATM 11 C UNL 1 3.385 -7.528 -2.771 1.00 0.00 C HETATM 12 C UNL 1 3.318 -5.933 -2.604 1.00 0.00 C HETATM 13 N UNL 1 5.451 -3.115 -1.480 1.00 0.00 N HETATM 14 C UNL 1 6.217 -2.058 -1.970 1.00 0.00 C HETATM 15 C UNL 1 7.615 -1.878 -1.488 1.00 0.00 C HETATM 16 O UNL 1 5.777 -1.292 -2.802 1.00 0.00 O HETATM 17 C UNL 1 8.351 -0.855 -2.051 1.00 0.00 C HETATM 18 S UNL 1 9.945 -0.829 -1.487 1.00 0.00 S HETATM 19 C UNL 1 9.570 -2.123 -0.403 1.00 0.00 C HETATM 20 N UNL 1 8.313 -2.585 -0.476 1.00 0.00 N HETATM 21 C UNL 1 10.649 -2.569 0.544 1.00 0.00 C HETATM 22 N UNL 1 2.755 -0.036 -0.073 1.00 0.00 N HETATM 23 C UNL 1 12.027 -2.238 0.489 1.00 0.00 C HETATM 24 N UNL 1 12.708 -2.687 1.544 1.00 0.00 N HETATM 25 N UNL 1 11.766 -3.303 2.281 1.00 0.00 N HETATM 26 C UNL 1 10.536 -3.335 1.679 1.00 0.00 C HETATM 27 C UNL 1 2.929 -8.083 -4.162 1.00 0.00 C HETATM 28 C UNL 1 3.398 -9.545 -4.449 1.00 0.00 C HETATM 29 N UNL 1 4.012 -10.272 -3.347 1.00 0.00 N HETATM 30 C UNL 1 4.997 -9.516 -2.590 1.00 0.00 C HETATM 31 C UNL 1 4.858 -7.992 -2.682 1.00 0.00 C HETATM 32 H UNL 1 3.331 -1.239 -2.410 1.00 0.00 H HETATM 33 H UNL 1 2.426 -2.145 1.656 1.00 0.00 H HETATM 34 H UNL 1 1.457 -6.038 -0.476 1.00 0.00 H HETATM 35 H UNL 1 2.672 -5.939 0.816 1.00 0.00 H HETATM 36 H UNL 1 2.294 -8.250 0.443 1.00 0.00 H HETATM 37 H UNL 1 3.911 -7.845 -0.129 1.00 0.00 H HETATM 38 H UNL 1 1.417 -7.877 -1.915 1.00 0.00 H HETATM 39 H UNL 1 2.456 -9.246 -1.697 1.00 0.00 H HETATM 40 H UNL 1 2.383 -5.565 -3.050 1.00 0.00 H HETATM 41 H UNL 1 4.147 -5.486 -3.166 1.00 0.00 H HETATM 42 H UNL 1 5.859 -3.752 -0.800 1.00 0.00 H HETATM 43 H UNL 1 8.020 -0.148 -2.803 1.00 0.00 H HETATM 44 H UNL 1 3.550 0.512 -0.391 1.00 0.00 H HETATM 45 H UNL 1 2.508 0.213 0.886 1.00 0.00 H HETATM 46 H UNL 1 12.567 -1.681 -0.269 1.00 0.00 H HETATM 47 H UNL 1 12.036 -3.652 3.194 1.00 0.00 H HETATM 48 H UNL 1 9.699 -3.825 2.152 1.00 0.00 H HETATM 49 H UNL 1 3.340 -7.457 -4.965 1.00 0.00 H HETATM 50 H UNL 1 1.838 -8.034 -4.265 1.00 0.00 H HETATM 51 H UNL 1 4.118 -9.541 -5.277 1.00 0.00 H HETATM 52 H UNL 1 2.547 -10.134 -4.819 1.00 0.00 H HETATM 53 H UNL 1 3.293 -10.653 -2.725 1.00 0.00 H HETATM 54 H UNL 1 5.997 -9.806 -2.930 1.00 0.00 H HETATM 55 H UNL 1 4.939 -9.819 -1.538 1.00 0.00 H HETATM 56 H UNL 1 5.384 -7.659 -3.590 1.00 0.00 H HETATM 57 H UNL 1 5.385 -7.519 -1.848 1.00 0.00 H CONECT 1 2 6 32 CONECT 2 1 3 13 CONECT 3 2 4 7 CONECT 4 3 5 CONECT 5 4 6 33 CONECT 6 5 1 22 CONECT 7 3 8 12 CONECT 8 7 9 34 35 CONECT 9 8 10 36 37 CONECT 10 9 11 38 39 CONECT 11 10 12 27 31 CONECT 12 11 7 40 41 CONECT 13 2 14 42 CONECT 14 13 15 16 CONECT 15 14 17 20 CONECT 16 14 CONECT 17 15 18 43 CONECT 18 17 19 CONECT 19 18 20 21 CONECT 20 19 15 CONECT 21 19 23 26 CONECT 22 6 44 45 CONECT 23 21 24 46 CONECT 24 23 25 CONECT 25 24 26 47 CONECT 26 25 21 48 CONECT 27 11 28 49 50 CONECT 28 27 29 51 52 CONECT 29 28 30 53 CONECT 30 29 31 54 55 CONECT 31 30 11 56 57 CONECT 32 1 CONECT 33 5 CONECT 34 8 CONECT 35 8 CONECT 36 9 CONECT 37 9 CONECT 38 10 CONECT 39 10 CONECT 40 12 CONECT 41 12 CONECT 42 13 CONECT 43 17 CONECT 44 22 CONECT 45 22 CONECT 46 23 CONECT 47 25 CONECT 48 26 CONECT 49 27 CONECT 50 27 CONECT 51 28 CONECT 52 28 CONECT 53 29 CONECT 54 30 CONECT 55 30 CONECT 56 31 CONECT 57 31 MASTER 0 0 0 0 0 0 0 0 57 0 57 0 END $$$$