# 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 X X '2"-DEOXY-N7-(8,9-DIHYDRO-9-HYDROXY-1' non-polymer 74 47 M # data_comp_X # 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 X P P . 0.000 X O1P O . 0.000 X O2P O . 0.000 X O3P O . 0.000 X O5* O . 0.000 X C5* C . 0.000 X C4* C . 0.000 X O4* O . 0.000 X C3* C . 0.000 X O3* O . 0.000 X C2* C . 0.000 X C1* C . 0.000 X N9 N . 0.000 X C8 C . 0.000 X N7 N . 1.000 X C5 C . 0.000 X C6 C . 0.000 X O6 O . 0.000 X N1 N . 0.000 X C2 C . 0.000 X N2 N . 0.000 X N3 N . 0.000 X C4 C . 0.000 X C1 C . 0.000 X O1 O . 0.000 X C2A C . 0.000 X C3 C . 0.000 X C3A C . 0.000 X C4A C . 0.000 X C4B C . 0.000 X O4 O . 0.000 X CM C . 0.000 X C5B C . 0.000 X C5M C . 0.000 X O6A O . 0.000 X C6A C . 0.000 X O7 O . 0.000 X C8A C . 0.000 X C9 C . 0.000 X O9 O . 0.000 X C9A C . 0.000 X C9B C . 0.000 X C10 C . 0.000 X O10 O . 0.000 X C11 C . 0.000 X O11 O . 0.000 X C12 C . 0.000 X HOP3 H . 0.000 X HOP2 H . 0.000 X H1* H . 0.000 X H2*1 H . 0.000 X H2*2 H . 0.000 X H3* H . 0.000 X H4* H . 0.000 X HO3* H . 0.000 X H5*1 H . 0.000 X H5*2 H . 0.000 X H8 H . 0.000 X H1 H . 0.000 X H21 H . 0.000 X H22 H . 0.000 X H2A1 H . 0.000 X H2A2 H . 0.000 X H31 H . 0.000 X H32 H . 0.000 X HM1 H . 0.000 X HM2 H . 0.000 X HM3 H . 0.000 X H5B H . 0.000 X H6A H . 0.000 X H8A H . 0.000 X HO9 H . 0.000 X H9 H . 0.000 X H9A 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 X P O1P double X P O2P single X P O3P single X P O5* single X O2P HOP2 single X O3P HOP3 single X O5* C5* single X C5* C4* single X C5* H5*1 single X C5* H5*2 single X C4* O4* single X C4* C3* single X C4* H4* single X O4* C1* single X C3* O3* single X C3* C2* single X C3* H3* single X O3* HO3* single X C2* C1* single X C2* H2*1 single X C2* H2*2 single X C1* N9 single X C1* H1* single X N9 C8 single X N9 C4 single X C8 N7 double X C8 H8 single X N7 C5 single X N7 C8A single X C5 C6 single X C5 C4 double X C6 O6 double X C6 N1 single X N1 C2 single X N1 H1 single X C2 N2 single X C2 N3 double X N2 H21 single X N2 H22 single X N3 C4 single X C1 C2A single X C1 C12 single X C1 O1 double X C2A C3 single X C2A H2A1 single X C2A H2A2 single X C3 C3A single X C3 H31 single X C3 H32 single X C3A C4A single X C3A C12 double X C4A C4B single X C4A C10 double X C4B C5B double X C4B O4 single X O4 CM single X CM HM1 single X CM HM2 single X CM HM3 single X C5B C5M single X C5B H5B single X C5M C9B double X C5M O6A single X O6A C6A single X C6A C9A single X C6A O7 single X C6A H6A single X O7 C8A single X C8A C9 single X C8A H8A single X C9 C9A single X C9 O9 single X C9 H9 single X O9 HO9 single X C9A C9B single X C9A H9A single X C9B C10 single X C10 O10 single X O10 C11 single X C11 C12 single X C11 O11 double