#
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
NHM      NHM 'S-(2-OXO)PENTADECYLCOA              ' non-polymer       128  64 M
#
data_comp_NHM
#
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
 NHM           N6A    N    .         0.000
 NHM           C6A    C    .         0.000
 NHM           N1A    N    .         0.000
 NHM           C2A    C    .         0.000
 NHM           N3A    N    .         0.000
 NHM           C4A    C    .         0.000
 NHM           C5A    C    .         0.000
 NHM           N9A    N    .         0.000
 NHM           N7A    N    .         0.000
 NHM           C8A    C    .         0.000
 NHM           CEM    C    .         0.000
 NHM           CAM    C    .         0.000
 NHM           CBM    C    .         0.000
 NHM           CCM    C    .         0.000
 NHM           CDM    C    .         0.000
 NHM           C9M    C    .         0.000
 NHM           C8M    C    .         0.000
 NHM           C7M    C    .         0.000
 NHM           C6M    C    .         0.000
 NHM           C2M    C    .         0.000
 NHM           C3M    C    .         0.000
 NHM           C4M    C    .         0.000
 NHM           C5M    C    .         0.000
 NHM           C1M    C    .         0.000
 NHM           O1M    O    .         0.000
 NHM           CP     C    .         0.000
 NHM           P3X    P    .         0.000
 NHM           O7A    O    .         0.000
 NHM           O8A    O    .         0.000
 NHM           O9A    O    .         0.000
 NHM           O3X    O    .         0.000
 NHM           S1     S    .         0.000
 NHM           N4     N    .         0.000
 NHM           C5     C    .         0.000
 NHM           O5     O    .         0.000
 NHM           C6     C    .         0.000
 NHM           C7     C    .         0.000
 NHM           N8     N    .         0.000
 NHM           C9     C    .         0.000
 NHM           O9     O    .         0.000
 NHM           C13    C    .         0.000
 NHM           C11    C    .         0.000
 NHM           C14    C    .         0.000
 NHM           C12    C    .         0.000
 NHM           P1A    P    .         0.000
 NHM           O2A    O    .         0.000
 NHM           O1A    O    .         0.000
 NHM           O3A    O    .         0.000
 NHM           O5X    O    .         0.000
 NHM           C4X    C    .         0.000
 NHM           O4X    O    .         0.000
 NHM           C1X    C    .         0.000
 NHM           C2X    C    .         0.000
 NHM           O2X    O    .         0.000
 NHM           C3X    C    .         0.000
 NHM           C5X    C    .         0.000
 NHM           P2A    P    .         0.000
 NHM           O4A    O    .         0.000
 NHM           O5A    O    .         0.000
 NHM           O6A    O    .         0.000
 NHM           C10    C    .         0.000
 NHM           O10    O    .         0.000
 NHM           C3     C    .         0.000
 NHM           C2     C    .         0.000
 NHM           H2A    H    .         0.000
 NHM           HN61   H    .         0.000
 NHM           HN62   H    .         0.000
 NHM           H8A    H    .         0.000
 NHM           HEM1   H    .         0.000
 NHM           HEM2   H    .         0.000
 NHM           HEM3   H    .         0.000
 NHM           HAM1   H    .         0.000
 NHM           HAM2   H    .         0.000
 NHM           HBM1   H    .         0.000
 NHM           HBM2   H    .         0.000
 NHM           HCM1   H    .         0.000
 NHM           HCM2   H    .         0.000
 NHM           HDM1   H    .         0.000
 NHM           HDM2   H    .         0.000
 NHM           H9M1   H    .         0.000
 NHM           H9M2   H    .         0.000
 NHM           H8M1   H    .         0.000
 NHM           H8M2   H    .         0.000
 NHM           H7M1   H    .         0.000
 NHM           H7M2   H    .         0.000
 NHM           H6M1   H    .         0.000
 NHM           H6M2   H    .         0.000
 NHM           H2M1   H    .         0.000
 NHM           H2M2   H    .         0.000
 NHM           H3M1   H    .         0.000
 NHM           H3M2   H    .         0.000
 NHM           H4M1   H    .         0.000
 NHM           H4M2   H    .         0.000
 NHM           H5M1   H    .         0.000
 NHM           H5M2   H    .         0.000
 NHM           HP1    H    .         0.000
 NHM           HP2    H    .         0.000
 NHM           AHO7   H    .         0.000
 NHM           AHO8   H    .         0.000
 NHM           HN4    H    .         0.000
 NHM           H61    H    .         0.000
 NHM           H62    H    .         0.000
 NHM           H71    H    .         0.000
 NHM           H72    H    .         0.000
 NHM           HN8    H    .         0.000
 NHM           H131   H    .         0.000
 NHM           H132   H    .         0.000
 NHM           H133   H    .         0.000
 NHM           H141   H    .         0.000
 NHM           H142   H    .         0.000
 NHM           H143   H    .         0.000
 NHM           H121   H    .         0.000
 NHM           H122   H    .         0.000
 NHM           AHO1   H    .         0.000
 NHM           H4X    H    .         0.000
 NHM           H1X    H    .         0.000
 NHM           H2X    H    .         0.000
 NHM           XHO2   H    .         0.000
 NHM           H3X    H    .         0.000
 NHM           H5X1   H    .         0.000
 NHM           H5X2   H    .         0.000
 NHM           AHO5   H    .         0.000
 NHM           H10    H    .         0.000
 NHM           HOA    H    .         0.000
 NHM           H31    H    .         0.000
 NHM           H32    H    .         0.000
 NHM           H21    H    .         0.000
 NHM           H22    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
 NHM        N6A    C6A       single
 NHM        N6A    HN61      single
 NHM        N6A    HN62      single
 NHM        C6A    N1A       double
 NHM        C6A    C5A       single
 NHM        N1A    C2A       single
 NHM        C2A    N3A       double
 NHM        C2A    H2A       single
 NHM        N3A    C4A       single
 NHM        C4A    C5A       double
 NHM        C4A    N9A       single
 NHM        C5A    N7A       single
 NHM        N9A    C8A       single
 NHM        N9A    C1X       single
 NHM        N7A    C8A       double
 NHM        C8A    H8A       single
 NHM        CEM    CDM       single
 NHM        CEM    HEM1      single
 NHM        CEM    HEM2      single
 NHM        CEM    HEM3      single
 NHM        CAM    CBM       single
 NHM        CAM    C9M       single
 NHM        CAM    HAM1      single
 NHM        CAM    HAM2      single
 NHM        CBM    CCM       single
 NHM        CBM    HBM1      single
 NHM        CBM    HBM2      single
 NHM        CCM    CDM       single
 NHM        CCM    HCM1      single
 NHM        CCM    HCM2      single
 NHM        CDM    HDM1      single
 NHM        CDM    HDM2      single
 NHM        C9M    C8M       single
 NHM        C9M    H9M1      single
 NHM        C9M    H9M2      single
 NHM        C8M    C7M       single
 NHM        C8M    H8M1      single
 NHM        C8M    H8M2      single
 NHM        C7M    C6M       single
 NHM        C7M    H7M1      single
 NHM        C7M    H7M2      single
 NHM        C6M    C5M       single
 NHM        C6M    H6M1      single
 NHM        C6M    H6M2      single
 NHM        C2M    C3M       single
 NHM        C2M    C1M       single
 NHM        C2M    H2M1      single
 NHM        C2M    H2M2      single
 NHM        C3M    C4M       single
 NHM        C3M    H3M1      single
 NHM        C3M    H3M2      single
 NHM        C4M    C5M       single
 NHM        C4M    H4M1      single
 NHM        C4M    H4M2      single
 NHM        C5M    H5M1      single
 NHM        C5M    H5M2      single
 NHM        C1M    O1M       double
 NHM        C1M    CP        single
 NHM        CP     S1        single
 NHM        CP     HP1       single
 NHM        CP     HP2       single
 NHM        P3X    O7A       single
 NHM        P3X    O8A       single
 NHM        P3X    O9A       double
 NHM        P3X    O3X       single
 NHM        O7A    AHO7      single
 NHM        O8A    AHO8      single
 NHM        O3X    C3X       single
 NHM        S1     C2        single
 NHM        N4     C5        single
 NHM        N4     C3        single
 NHM        N4     HN4       single
 NHM        C5     O5        double
 NHM        C5     C6        single
 NHM        C6     C7        single
 NHM        C6     H61       single
 NHM        C6     H62       single
 NHM        C7     N8        single
 NHM        C7     H71       single
 NHM        C7     H72       single
 NHM        N8     C9        single
 NHM        N8     HN8       single
 NHM        C9     O9        double
 NHM        C9     C10       single
 NHM        C13    C11       single
 NHM        C13    H131      single
 NHM        C13    H132      single
 NHM        C13    H133      single
 NHM        C11    C14       single
 NHM        C11    C12       single
 NHM        C11    C10       single
 NHM        C14    H141      single
 NHM        C14    H142      single
 NHM        C14    H143      single
 NHM        C12    O6A       single
 NHM        C12    H121      single
 NHM        C12    H122      single
 NHM        P1A    O2A       double
 NHM        P1A    O1A       single
 NHM        P1A    O3A       single
 NHM        P1A    O5X       single
 NHM        O1A    AHO1      single
 NHM        O3A    P2A       single
 NHM        O5X    C5X       single
 NHM        C4X    O4X       single
 NHM        C4X    C3X       single
 NHM        C4X    C5X       single
 NHM        C4X    H4X       single
 NHM        O4X    C1X       single
 NHM        C1X    C2X       single
 NHM        C1X    H1X       single
 NHM        C2X    O2X       single
 NHM        C2X    C3X       single
 NHM        C2X    H2X       single
 NHM        O2X    XHO2      single
 NHM        C3X    H3X       single
 NHM        C5X    H5X1      single
 NHM        C5X    H5X2      single
 NHM        P2A    O4A       double
 NHM        P2A    O5A       single
 NHM        P2A    O6A       single
 NHM        O5A    AHO5      single
 NHM        C10    O10       single
 NHM        C10    H10       single
 NHM        O10    HOA       single
 NHM        C3     C2        single
 NHM        C3     H31       single
 NHM        C3     H32       single
 NHM        C2     H21       single
 NHM        C2     H22       single