HEADER Model coordinates for PDB-CCD D7C COMPND D7C AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 C10 D7C A 1 26.907 4.229 56.403 1.00 20.00 C HETATM 2 C11 D7C A 1 26.763 4.631 55.091 1.00 20.00 C HETATM 3 C9 D7C A 1 25.887 4.335 57.323 1.00 20.00 C HETATM 4 C12 D7C A 1 25.591 5.163 54.601 1.00 20.00 C HETATM 5 C8 D7C A 1 24.689 4.862 56.863 1.00 20.00 C HETATM 6 C7 D7C A 1 24.581 5.255 55.534 1.00 20.00 C HETATM 7 C16 D7C A 1 19.874 4.258 59.376 1.00 20.00 C HETATM 8 C19 D7C A 1 18.650 3.556 60.909 1.00 20.00 C HETATM 9 C5 D7C A 1 22.719 5.584 56.659 1.00 20.00 C HETATM 10 C22 D7C A 1 16.325 2.003 60.645 1.00 20.00 C HETATM 11 C21 D7C A 1 17.002 2.371 59.557 1.00 20.00 C HETATM 12 C23 D7C A 1 16.929 2.493 61.913 1.00 20.00 C HETATM 13 C13 D7C A 1 20.436 5.548 57.331 1.00 20.00 C HETATM 14 C1 D7C A 1 22.458 6.263 54.430 1.00 20.00 C HETATM 15 C2 D7C A 1 21.260 6.665 55.254 1.00 20.00 C HETATM 16 C25 D7C A 1 16.575 1.987 58.175 1.00 20.00 C HETATM 17 C26 D7C A 1 16.214 2.117 63.173 1.00 20.00 C HETATM 18 C27 D7C A 1 21.289 8.166 55.402 1.00 20.00 C HETATM 19 C15 D7C A 1 20.945 4.923 58.618 1.00 20.00 C HETATM 20 N6 D7C A 1 23.521 5.075 57.563 1.00 20.00 N HETATM 21 N18 D7C A 1 19.746 4.273 60.740 1.00 20.00 N HETATM 22 N17 D7C A 1 18.930 3.580 58.724 1.00 20.00 N HETATM 23 N24 D7C A 1 18.006 3.212 62.048 1.00 20.00 N HETATM 24 N4 D7C A 1 23.299 5.707 55.456 1.00 20.00 N HETATM 25 N20 D7C A 1 18.140 3.128 59.706 1.00 20.00 N HETATM 26 N3 D7C A 1 21.457 6.059 56.550 1.00 20.00 N HETATM 27 O14 D7C A 1 19.251 5.601 57.017 1.00 20.00 O HETATM 28 H1 D7C A 1 27.853 3.816 56.720 1.00 20.00 H HETATM 29 H2 D7C A 1 27.603 4.524 54.421 1.00 20.00 H HETATM 30 H3 D7C A 1 26.014 4.024 58.349 1.00 20.00 H HETATM 31 H4 D7C A 1 25.474 5.480 53.575 1.00 20.00 H HETATM 32 H5 D7C A 1 15.425 1.407 60.609 1.00 20.00 H HETATM 33 H6 D7C A 1 22.196 5.514 53.668 1.00 20.00 H HETATM 34 H7 D7C A 1 22.928 7.131 53.944 1.00 20.00 H HETATM 35 H8 D7C A 1 20.325 6.332 54.780 1.00 20.00 H HETATM 36 H9 D7C A 1 17.039 1.028 57.900 1.00 20.00 H HETATM 37 H10 D7C A 1 15.480 1.886 58.144 1.00 20.00 H HETATM 38 H11 D7C A 1 16.892 2.765 57.464 1.00 20.00 H HETATM 39 H12 D7C A 1 16.750 2.535 64.038 1.00 20.00 H HETATM 40 H13 D7C A 1 15.190 2.519 63.147 1.00 20.00 H HETATM 41 H14 D7C A 1 16.176 1.021 63.260 1.00 20.00 H HETATM 42 H15 D7C A 1 20.426 8.493 56.000 1.00 20.00 H HETATM 43 H16 D7C A 1 22.219 8.467 55.906 1.00 20.00 H HETATM 44 H17 D7C A 1 21.244 8.633 54.407 1.00 20.00 H HETATM 45 H18 D7C A 1 21.717 4.180 58.369 1.00 20.00 H HETATM 46 H19 D7C A 1 21.385 5.712 59.245 1.00 20.00 H CONECT 1 2 2 3 28 CONECT 2 4 29 CONECT 3 5 5 30 CONECT 4 6 6 31 CONECT 5 6 20 CONECT 6 24 CONECT 7 19 22 22 21 CONECT 8 25 21 21 23 CONECT 9 24 26 20 20 CONECT 10 11 11 12 32 CONECT 11 16 25 CONECT 12 23 23 17 CONECT 13 26 27 27 19 CONECT 14 15 24 33 34 CONECT 15 18 26 35 CONECT 16 36 37 38 CONECT 17 39 40 41 CONECT 18 42 43 44 CONECT 19 45 46 CONECT 22 25 END