# data_comp_list loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level W03 W03 '2,6-DIMETHYL-1-(3-[3-METHYL-5-ISOXAZ' non-polymer 46 24 M # data_comp_W03 # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.partial_charge W03 O1 O . 0.000 W03 N2 N . 0.000 W03 C3 C . 0.000 W03 CM3 C . 0.000 W03 C4 C . 0.000 W03 C5 C . 0.000 W03 C1C C . 0.000 W03 C2C C . 0.000 W03 C3C C . 0.000 W03 O1B O . 0.000 W03 C1B C . 0.000 W03 C2B C . 0.000 W03 CM2 C . 0.000 W03 C3B C . 0.000 W03 C4B C . 0.000 W03 C5B C . 0.000 W03 C6B C . 0.000 W03 CM6 C . 0.000 W03 C2A C . 0.000 W03 C1A C . 0.000 W03 N3A N . 0.000 W03 C4A C . 0.000 W03 CM4 C . 0.000 W03 O5A O . 0.000 W03 HM33 H . 0.000 W03 HM32 H . 0.000 W03 HM31 H . 0.000 W03 H4 H . 0.000 W03 H1C2 H . 0.000 W03 H1C1 H . 0.000 W03 H2C2 H . 0.000 W03 H2C1 H . 0.000 W03 H3C2 H . 0.000 W03 H3C1 H . 0.000 W03 HM23 H . 0.000 W03 HM22 H . 0.000 W03 HM21 H . 0.000 W03 H3B H . 0.000 W03 H5B H . 0.000 W03 HM63 H . 0.000 W03 HM62 H . 0.000 W03 HM61 H . 0.000 W03 H1A H . 0.000 W03 HM43 H . 0.000 W03 HM42 H . 0.000 W03 HM41 H . 0.000 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type W03 O1 N2 single W03 O1 C5 single W03 N2 C3 double W03 C3 CM3 single W03 C3 C4 single W03 CM3 HM33 single W03 CM3 HM32 single W03 CM3 HM31 single W03 C4 C5 double W03 C4 H4 single W03 C5 C1C single W03 C1C C2C single W03 C1C H1C2 single W03 C1C H1C1 single W03 C2C C3C single W03 C2C H2C2 single W03 C2C H2C1 single W03 C3C O1B single W03 C3C H3C2 single W03 C3C H3C1 single W03 O1B C1B single W03 C1B C2B AROM W03 C1B C6B AROM W03 C2B CM2 single W03 C2B C3B AROM W03 CM2 HM23 single W03 CM2 HM22 single W03 CM2 HM21 single W03 C3B C4B AROM W03 C3B H3B single W03 C4B C5B AROM W03 C4B C2A single W03 C5B C6B AROM W03 C5B H5B single W03 C6B CM6 single W03 CM6 HM63 single W03 CM6 HM62 single W03 CM6 HM61 single W03 C2A C1A double W03 C2A N3A single W03 C1A O5A single W03 C1A H1A single W03 N3A C4A double W03 C4A CM4 single W03 C4A O5A single W03 CM4 HM43 single W03 CM4 HM42 single W03 CM4 HM41 single