# 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 W42 W42 '5-(5-(2,6-DICHLORO-4-(4,5-DIHYDRO-2-' non-polymer 57 31 M # data_comp_W42 # 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 W42 O1D O . 0.000 W42 C2D C . 0.000 W42 C3D C . 0.000 W42 O4D O . 0.000 W42 C5D C . 0.000 W42 O6D O . 0.000 W42 O1 O . 0.000 W42 N2 N . 0.000 W42 C3 C . 0.000 W42 C31 C . 0.000 W42 C4 C . 0.000 W42 C5 C . 0.000 W42 C1C C . 0.000 W42 C2C C . 0.000 W42 C3C C . 0.000 W42 C4C C . 0.000 W42 C5C C . 0.000 W42 O1B O . 0.000 W42 C1B C . 0.000 W42 C2B C . 0.000 W42 C3B C . 0.000 W42 C4B C . 0.000 W42 C5B C . 0.000 W42 C6B C . 0.000 W42 CL1 CL . 0.000 W42 CL2 CL . 0.000 W42 C2A C . 0.000 W42 N3A N . 0.000 W42 C4A C . 0.000 W42 C5A C . 0.000 W42 O1A O . 0.000 W42 HOD1 H . 0.000 W42 H2D1 H . 0.000 W42 H2D2 H . 0.000 W42 H3D1 H . 0.000 W42 H3D2 H . 0.000 W42 H5D1 H . 0.000 W42 H5D2 H . 0.000 W42 H4 H . 0.000 W42 H311 H . 0.000 W42 H312 H . 0.000 W42 H1C1 H . 0.000 W42 H1C2 H . 0.000 W42 H2C1 H . 0.000 W42 H2C2 H . 0.000 W42 H3C1 H . 0.000 W42 H3C2 H . 0.000 W42 H4C1 H . 0.000 W42 H4C2 H . 0.000 W42 H5C1 H . 0.000 W42 H5C2 H . 0.000 W42 H3B H . 0.000 W42 H5B H . 0.000 W42 H4A1 H . 0.000 W42 H4A2 H . 0.000 W42 H5A1 H . 0.000 W42 H5A2 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 W42 O1D C2D single W42 O1D HOD1 single W42 C2D C3D single W42 C2D H2D1 single W42 C2D H2D2 single W42 C3D O4D single W42 C3D H3D1 single W42 C3D H3D2 single W42 O4D C5D single W42 C5D O6D single W42 C5D H5D1 single W42 C5D H5D2 single W42 O6D C31 single W42 O1 C5 single W42 O1 N2 single W42 N2 C3 double W42 C3 C31 single W42 C3 C4 single W42 C31 H311 single W42 C31 H312 single W42 C4 C5 double W42 C4 H4 single W42 C5 C1C single W42 C1C C2C single W42 C1C H1C1 single W42 C1C H1C2 single W42 C2C C3C single W42 C2C H2C1 single W42 C2C H2C2 single W42 C3C C4C single W42 C3C H3C1 single W42 C3C H3C2 single W42 C4C C5C single W42 C4C H4C1 single W42 C4C H4C2 single W42 C5C O1B single W42 C5C H5C1 single W42 C5C H5C2 single W42 O1B C1B single W42 C1B C2B double W42 C1B C6B single W42 C2B C3B single W42 C2B CL2 single W42 C3B C4B double W42 C3B H3B single W42 C4B C5B single W42 C4B C2A single W42 C5B C6B double W42 C5B H5B single W42 C6B CL1 single W42 C2A O1A single W42 C2A N3A double W42 N3A C4A single W42 C4A C5A single W42 C4A H4A1 single W42 C4A H4A2 single W42 C5A O1A single W42 C5A H5A1 single W42 C5A H5A2 single