HEADER Ideal coordinates for PDB-CCD ZLG COMPND ZLG AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 CAA ZLG A 1 8.771 -2.800 0.639 1.00 20.00 C HETATM 2 CAB ZLG A 1 8.324 -3.793 -0.183 1.00 20.00 C HETATM 3 CAC ZLG A 1 7.107 -3.671 -0.856 1.00 20.00 C HETATM 4 CAD ZLG A 1 6.334 -2.562 -0.713 1.00 20.00 C HETATM 5 CAE ZLG A 1 6.761 -1.515 0.127 1.00 20.00 C HETATM 6 CAF ZLG A 1 7.996 -1.644 0.815 1.00 20.00 C HETATM 7 CAG ZLG A 1 8.425 -0.599 1.656 1.00 20.00 C HETATM 8 CAI ZLG A 1 6.408 0.559 1.083 1.00 20.00 C HETATM 9 CAJ ZLG A 1 7.623 0.498 1.783 1.00 20.00 C HETATM 10 CAK ZLG A 1 5.551 1.760 1.224 1.00 20.00 C HETATM 11 CAN ZLG A 1 3.545 3.032 0.681 1.00 20.00 C HETATM 12 CAQ ZLG A 1 2.318 2.878 -0.182 1.00 20.00 C HETATM 13 CAR ZLG A 1 1.107 2.417 0.209 1.00 20.00 C HETATM 14 CAT ZLG A 1 -1.031 2.066 -0.961 1.00 20.00 C HETATM 15 CAU ZLG A 1 -1.938 2.550 -0.028 1.00 20.00 C HETATM 16 CAV ZLG A 1 -1.460 1.202 -1.959 1.00 20.00 C HETATM 17 CAW ZLG A 1 -2.786 0.822 -2.019 1.00 20.00 C HETATM 18 CAX ZLG A 1 -3.687 1.302 -1.085 1.00 20.00 C HETATM 19 CAY ZLG A 1 -3.264 2.166 -0.093 1.00 20.00 C HETATM 20 CAZ ZLG A 1 -1.478 3.492 1.054 1.00 20.00 C HETATM 21 CBA ZLG A 1 -1.551 2.997 2.500 1.00 20.00 C HETATM 22 CBB ZLG A 1 -2.540 4.054 2.001 1.00 20.00 C HETATM 23 CBC ZLG A 1 -0.479 0.680 -2.977 1.00 20.00 C HETATM 24 CBD ZLG A 1 -0.681 1.102 -4.434 1.00 20.00 C HETATM 25 CBE ZLG A 1 -0.996 -0.331 -4.002 1.00 20.00 C HETATM 26 CBF ZLG A 1 -5.134 0.886 -1.153 1.00 20.00 C HETATM 27 CBG ZLG A 1 -5.336 -0.364 -0.335 1.00 20.00 C HETATM 28 CBJ ZLG A 1 -6.756 -2.137 0.546 1.00 20.00 C HETATM 29 CBK ZLG A 1 -9.105 -1.438 1.032 1.00 20.00 C HETATM 30 CBL ZLG A 1 -8.225 -2.559 0.477 1.00 20.00 C HETATM 31 CBM ZLG A 1 -6.373 -1.861 2.001 1.00 20.00 C HETATM 32 CBN ZLG A 1 -7.253 -0.739 2.557 1.00 20.00 C HETATM 33 CBO ZLG A 1 -8.722 -1.162 2.488 1.00 20.00 C HETATM 34 CBP ZLG A 1 -5.890 -3.241 -0.001 1.00 20.00 C HETATM 35 FBS ZLG A 1 9.068 -4.908 -0.347 1.00 20.00 F HETATM 36 NAH ZLG A 1 6.023 -0.417 0.285 1.00 20.00 N HETATM 37 NAL ZLG A 1 4.392 1.845 0.541 1.00 20.00 N HETATM 38 NAO ZLG A 1 1.016 2.912 -1.876 1.00 20.00 N HETATM 39 NAP ZLG A 1 2.212 3.175 -1.481 1.00 20.00 N HETATM 40 NAS ZLG A 1 0.315 2.454 -0.898 1.00 20.00 N HETATM 41 NBH ZLG A 1 -6.560 -0.922 -0.249 1.00 20.00 N HETATM 42 OAM ZLG A 1 5.892 2.668 1.956 1.00 20.00 O HETATM 43 OBI ZLG A 1 -4.398 -0.867 0.246 1.00 20.00 O HETATM 44 OBQ ZLG A 1 -6.283 -4.383 0.017 1.00 20.00 O HETATM 45 OBR ZLG A 1 -4.680 -2.956 -0.509 1.00 20.00 O HETATM 46 H1 ZLG A 1 9.714 -2.906 1.155 1.00 20.00 H HETATM 47 H2 ZLG A 1 6.774 -4.470 -1.502 1.00 20.00 H HETATM 48 H3 ZLG A 1 5.396 -2.483 -1.242 1.00 20.00 H HETATM 49 H4 ZLG A 1 9.363 -0.663 2.186 1.00 20.00 H HETATM 50 H5 ZLG A 1 7.922 1.317 2.420 1.00 20.00 H HETATM 51 H6 ZLG A 1 4.101 3.915 0.366 1.00 20.00 H HETATM 52 H7 ZLG A 1 3.245 3.144 1.723 1.00 20.00 H HETATM 53 H8 ZLG A 1 0.826 2.086 1.198 1.00 20.00 H HETATM 54 H9 ZLG A 1 -3.121 0.150 -2.795 1.00 20.00 H HETATM 55 H10 ZLG A 1 -3.970 2.542 0.633 1.00 20.00 H HETATM 56 H11 ZLG A 1 -0.646 4.144 0.787 1.00 20.00 H HETATM 57 H12 ZLG A 1 -1.933 1.990 2.669 1.00 20.00 H HETATM 58 H13 ZLG A 1 -0.768 3.324 3.184 1.00 20.00 H HETATM 59 H14 ZLG A 1 -2.407 5.075 2.358 1.00 20.00 H HETATM 60 H15 ZLG A 1 -3.572 3.742 1.842 1.00 20.00 H HETATM 61 H16 ZLG A 1 0.546 0.561 -2.625 1.00 20.00 H HETATM 62 H17 ZLG A 1 -1.523 1.758 -4.656 1.00 20.00 H HETATM 63 H18 ZLG A 1 0.211 1.261 -5.040 1.00 20.00 H HETATM 64 H19 ZLG A 1 -0.312 -1.116 -4.324 1.00 20.00 H HETATM 65 H20 ZLG A 1 -2.046 -0.619 -3.940 1.00 20.00 H HETATM 66 H21 ZLG A 1 -5.761 1.685 -0.757 1.00 20.00 H HETATM 67 H22 ZLG A 1 -5.407 0.689 -2.190 1.00 20.00 H HETATM 68 H23 ZLG A 1 -8.959 -0.534 0.441 1.00 20.00 H HETATM 69 H24 ZLG A 1 -10.152 -1.739 0.983 1.00 20.00 H HETATM 70 H25 ZLG A 1 -8.498 -2.756 -0.560 1.00 20.00 H HETATM 71 H26 ZLG A 1 -8.372 -3.463 1.069 1.00 20.00 H HETATM 72 H27 ZLG A 1 -6.519 -2.765 2.593 1.00 20.00 H HETATM 73 H28 ZLG A 1 -5.326 -1.560 2.050 1.00 20.00 H HETATM 74 H29 ZLG A 1 -6.980 -0.543 3.594 1.00 20.00 H HETATM 75 H30 ZLG A 1 -7.107 0.164 1.965 1.00 20.00 H HETATM 76 H31 ZLG A 1 -9.349 -0.363 2.884 1.00 20.00 H HETATM 77 H32 ZLG A 1 -8.868 -2.066 3.079 1.00 20.00 H HETATM 78 H33 ZLG A 1 4.119 1.120 -0.043 1.00 20.00 H HETATM 79 H34 ZLG A 1 -7.310 -0.520 -0.714 1.00 20.00 H HETATM 80 H35 ZLG A 1 -4.160 -3.698 -0.848 1.00 20.00 H CONECT 1 6 6 2 46 CONECT 2 35 3 3 CONECT 3 4 47 CONECT 4 5 5 48 CONECT 5 6 36 CONECT 6 7 CONECT 7 9 9 49 CONECT 8 9 10 36 36 CONECT 9 50 CONECT 10 42 42 37 CONECT 11 12 37 51 52 CONECT 12 13 13 39 CONECT 13 40 53 CONECT 14 15 40 16 16 CONECT 15 20 19 19 CONECT 16 17 23 CONECT 17 18 18 54 CONECT 18 19 26 CONECT 19 55 CONECT 20 22 21 56 CONECT 21 22 57 58 CONECT 22 59 60 CONECT 23 24 25 61 CONECT 24 25 62 63 CONECT 25 64 65 CONECT 26 27 66 67 CONECT 27 41 43 43 CONECT 28 31 34 30 41 CONECT 29 33 30 68 69 CONECT 30 70 71 CONECT 31 32 72 73 CONECT 32 33 74 75 CONECT 33 76 77 CONECT 34 44 44 45 CONECT 37 78 CONECT 38 40 39 39 CONECT 41 79 CONECT 45 80 END