HEADER Model coordinates for PDB-CCD MMA COMPND MMA AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 C1 MMA A 1 27.954 130.673 -21.534 1.00 20.00 C HETATM 2 C2 MMA A 1 27.176 129.426 -22.032 1.00 20.00 C HETATM 3 C3 MMA A 1 26.291 128.921 -20.904 1.00 20.00 C HETATM 4 C4 MMA A 1 27.192 128.585 -19.724 1.00 20.00 C HETATM 5 C5 MMA A 1 27.994 129.808 -19.274 1.00 20.00 C HETATM 6 C6 MMA A 1 28.946 129.339 -18.168 1.00 20.00 C HETATM 7 C7 MMA A 1 27.761 132.865 -20.716 1.00 20.00 C HETATM 8 O1 MMA A 1 27.050 131.757 -21.194 1.00 20.00 O HETATM 9 O2 MMA A 1 28.054 128.386 -22.449 1.00 20.00 O HETATM 10 O3 MMA A 1 25.608 127.723 -21.315 1.00 20.00 O HETATM 11 O4 MMA A 1 26.278 128.214 -18.723 1.00 20.00 O HETATM 12 O5 MMA A 1 28.780 130.287 -20.391 1.00 20.00 O HETATM 13 O6 MMA A 1 29.919 128.483 -18.730 1.00 20.00 O HETATM 14 H1 MMA A 1 28.611 131.050 -22.351 1.00 20.00 H HETATM 15 H2 MMA A 1 26.562 129.723 -22.914 1.00 20.00 H HETATM 16 H3 MMA A 1 25.538 129.697 -20.632 1.00 20.00 H HETATM 17 H4 MMA A 1 27.941 127.795 -19.965 1.00 20.00 H HETATM 18 H5 MMA A 1 27.322 130.621 -18.912 1.00 20.00 H HETATM 19 H61 MMA A 1 29.401 130.190 -17.610 1.00 20.00 H HETATM 20 H62 MMA A 1 28.405 128.865 -17.315 1.00 20.00 H HETATM 21 H71 MMA A 1 27.066 133.697 -20.454 1.00 20.00 H HETATM 22 H72 MMA A 1 28.421 132.593 -19.859 1.00 20.00 H HETATM 23 H73 MMA A 1 28.546 133.193 -21.435 1.00 20.00 H HETATM 24 HO2 MMA A 1 27.577 127.622 -22.753 1.00 20.00 H HETATM 25 HO3 MMA A 1 25.054 127.407 -20.610 1.00 20.00 H HETATM 26 HO4 MMA A 1 26.840 128.004 -17.986 1.00 20.00 H HETATM 27 HO6 MMA A 1 30.509 128.192 -18.044 1.00 20.00 H CONECT 1 2 8 12 14 CONECT 2 3 9 15 CONECT 3 4 10 16 CONECT 4 5 11 17 CONECT 5 6 12 18 CONECT 6 13 19 20 CONECT 7 8 21 22 23 CONECT 9 24 CONECT 10 25 CONECT 11 26 CONECT 13 27 END