HEADER Model coordinates for PDB-CCD 3UQ COMPND 3UQ AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 RU 3UQ A 1 7.967 2.989 2.658 1.00 20.00 RU HETATM 2 CC1 3UQ A 1 7.247 2.427 4.665 1.00 20.00 C HETATM 3 CC2 3UQ A 1 8.155 3.525 4.783 1.00 20.00 C HETATM 4 CC3 3UQ A 1 7.601 4.638 4.070 1.00 20.00 C HETATM 5 CC4 3UQ A 1 6.134 2.862 3.880 1.00 20.00 C HETATM 6 CC5 3UQ A 1 6.350 4.227 3.513 1.00 20.00 C HETATM 7 CA1 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 8 CA2 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 9 CA3 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 10 CA4 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 11 CA5 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 12 CA6 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 13 CA7 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 14 CA8 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 15 CA9 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 16 CA0 3UQ A 1 0.000 0.000 0.000 1.00 20.00 C HETATM 17 HC1 3UQ A 1 7.482 1.380 4.908 1.00 20.00 H HETATM 18 HC2 3UQ A 1 9.194 3.454 5.136 1.00 20.00 H HETATM 19 HC3 3UQ A 1 8.151 5.549 3.792 1.00 20.00 H HETATM 20 HC4 3UQ A 1 5.385 2.197 3.425 1.00 20.00 H HETATM 21 HC5 3UQ A 1 5.794 4.770 2.735 1.00 20.00 H HETATM 22 HA1 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H HETATM 23 HA2 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H HETATM 24 HA3 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H HETATM 25 HA4 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H HETATM 26 HA7 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H HETATM 27 HA8 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H HETATM 28 HA9 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H HETATM 29 HA0 3UQ A 1 0.000 0.000 0.000 1.00 20.00 H CONECT 1 5 2 3 4 6 7 8 9 10 11 12 CONECT 2 3 3 5 17 CONECT 3 4 18 CONECT 4 6 6 19 CONECT 5 6 20 CONECT 6 21 CONECT 7 8 8 12 22 CONECT 8 9 23 CONECT 9 10 10 24 CONECT 10 11 25 CONECT 11 12 12 16 CONECT 12 13 CONECT 13 14 14 26 CONECT 14 15 27 CONECT 15 16 16 28 CONECT 16 29 END