#
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
U10      .   'UBIQUINONE-10                       ' non-polymer       153  63 .
#
data_comp_U10
#
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
 U10           O5     O    O         0.000
 U10           C5     C    CR6       0.000
 U10           C4     C    CR6       0.000
 U10           O4     O    O2        0.000
 U10           C4M    C    CH3       0.000
 U10           H4M3   H    HCH3      0.000
 U10           H4M2   H    HCH3      0.000
 U10           H4M1   H    HCH3      0.000
 U10           C3     C    CR6       0.000
 U10           O3     O    O2        0.000
 U10           C3M    C    CH3       0.000
 U10           H3M3   H    HCH3      0.000
 U10           H3M2   H    HCH3      0.000
 U10           H3M1   H    HCH3      0.000
 U10           C2     C    CR6       0.000
 U10           O2     O    O         0.000
 U10           C1     C    CR6       0.000
 U10           C1M    C    CH3       0.000
 U10           H1M3   H    HCH3      0.000
 U10           H1M2   H    HCH3      0.000
 U10           H1M1   H    HCH3      0.000
 U10           C6     C    CR6       0.000
 U10           C7     C    CH2       0.000
 U10           H71    H    HCH2      0.000
 U10           H72    H    HCH2      0.000
 U10           C8     C    C1        0.000
 U10           H8     H    HC1       0.000
 U10           C9     C    C         0.000
 U10           C10    C    CH3       0.000
 U10           H103   H    HCH3      0.000
 U10           H102   H    HCH3      0.000
 U10           H101   H    HCH3      0.000
 U10           C11    C    CH2       0.000
 U10           H111   H    HCH2      0.000
 U10           H112   H    HCH2      0.000
 U10           C12    C    CH2       0.000
 U10           H121   H    HCH2      0.000
 U10           H122   H    HCH2      0.000
 U10           C13    C    C1        0.000
 U10           H13    H    HC1       0.000
 U10           C14    C    C         0.000
 U10           C15    C    CH3       0.000
 U10           H153   H    HCH3      0.000
 U10           H152   H    HCH3      0.000
 U10           H151   H    HCH3      0.000
 U10           C16    C    CH2       0.000
 U10           H161   H    HCH2      0.000
 U10           H162   H    HCH2      0.000
 U10           C17    C    CH2       0.000
 U10           H171   H    HCH2      0.000
 U10           H172   H    HCH2      0.000
 U10           C18    C    C1        0.000
 U10           H18    H    HC1       0.000
 U10           C19    C    C         0.000
 U10           C20    C    CH3       0.000
 U10           H203   H    HCH3      0.000
 U10           H202   H    HCH3      0.000
 U10           H201   H    HCH3      0.000
 U10           C21    C    CH2       0.000
 U10           H211   H    HCH2      0.000
 U10           H212   H    HCH2      0.000
 U10           C22    C    CH2       0.000
 U10           H221   H    HCH2      0.000
 U10           H222   H    HCH2      0.000
 U10           C23    C    C1        0.000
 U10           H23    H    HC1       0.000
 U10           C24    C    C         0.000
 U10           C25    C    CH3       0.000
 U10           H253   H    HCH3      0.000
 U10           H252   H    HCH3      0.000
 U10           H251   H    HCH3      0.000
 U10           C26    C    CH2       0.000
 U10           H261   H    HCH2      0.000
 U10           H262   H    HCH2      0.000
 U10           C27    C    CH2       0.000
 U10           H271   H    HCH2      0.000
 U10           H272   H    HCH2      0.000
 U10           C28    C    C1        0.000
 U10           H28    H    HC1       0.000
 U10           C29    C    C         0.000
 U10           C30    C    CH3       0.000
 U10           H303   H    HCH3      0.000
 U10           H302   H    HCH3      0.000
 U10           H301   H    HCH3      0.000
 U10           C31    C    CH2       0.000
 U10           H311   H    HCH2      0.000
 U10           H312   H    HCH2      0.000
 U10           C32    C    CH2       0.000
 U10           H321   H    HCH2      0.000
 U10           H322   H    HCH2      0.000
 U10           C33    C    C1        0.000
 U10           H33    H    HC1       0.000
 U10           C34    C    C         0.000
 U10           C35    C    CH3       0.000
 U10           H353   H    HCH3      0.000
 U10           H352   H    HCH3      0.000
 U10           H351   H    HCH3      0.000
 U10           C36    C    CH2       0.000
 U10           H361   H    HCH2      0.000
 U10           H362   H    HCH2      0.000
 U10           C37    C    CH2       0.000
 U10           H371   H    HCH2      0.000
 U10           H372   H    HCH2      0.000
 U10           C38    C    C1        0.000
 U10           H38    H    HC1       0.000
 U10           C39    C    C         0.000
 U10           C40    C    CH3       0.000
 U10           H403   H    HCH3      0.000
 U10           H402   H    HCH3      0.000
 U10           H401   H    HCH3      0.000
 U10           C41    C    CH2       0.000
 U10           H411   H    HCH2      0.000
 U10           H412   H    HCH2      0.000
 U10           C42    C    CH2       0.000
 U10           H421   H    HCH2      0.000
 U10           H422   H    HCH2      0.000
 U10           C43    C    C1        0.000
 U10           H43    H    HC1       0.000
 U10           C44    C    C         0.000
 U10           C45    C    CH3       0.000
 U10           H453   H    HCH3      0.000
 U10           H452   H    HCH3      0.000
 U10           H451   H    HCH3      0.000
 U10           C46    C    CH2       0.000
 U10           H461   H    HCH2      0.000
 U10           H462   H    HCH2      0.000
 U10           C47    C    CH2       0.000
 U10           H471   H    HCH2      0.000
 U10           H472   H    HCH2      0.000
 U10           C48    C    C1        0.000
 U10           H48    H    HC1       0.000
 U10           C49    C    C         0.000
 U10           C50    C    CH3       0.000
 U10           H503   H    HCH3      0.000
 U10           H502   H    HCH3      0.000
 U10           H501   H    HCH3      0.000
 U10           C51    C    CH2       0.000
 U10           H511   H    HCH2      0.000
 U10           H512   H    HCH2      0.000
 U10           C52    C    CH2       0.000
 U10           H521   H    HCH2      0.000
 U10           H522   H    HCH2      0.000
 U10           C53    C    C1        0.000
 U10           H53    H    HC1       0.000
 U10           C54    C    C         0.000
 U10           C56    C    CH3       0.000
 U10           H563   H    HCH3      0.000
 U10           H562   H    HCH3      0.000
 U10           H561   H    HCH3      0.000
 U10           C55    C    CH3       0.000
 U10           H553   H    HCH3      0.000
 U10           H552   H    HCH3      0.000
 U10           H551   H    HCH3      0.000
loop_
_chem_comp_tree.comp_id
_chem_comp_tree.atom_id
_chem_comp_tree.atom_back
_chem_comp_tree.atom_forward
_chem_comp_tree.connect_type
 U10      O5     n/a    C5     START
 U10      C5     O5     C6     .
 U10      C4     C5     C3     .
 U10      O4     C4     C4M    .
 U10      C4M    O4     H4M1   .
 U10      H4M3   C4M    .      .
 U10      H4M2   C4M    .      .
 U10      H4M1   C4M    .      .
 U10      C3     C4     C2     .
 U10      O3     C3     C3M    .
 U10      C3M    O3     H3M1   .
 U10      H3M3   C3M    .      .
 U10      H3M2   C3M    .      .
 U10      H3M1   C3M    .      .
 U10      C2     C3     C1     .
 U10      O2     C2     .      .
 U10      C1     C2     C1M    .
 U10      C1M    C1     H1M1   .
 U10      H1M3   C1M    .      .
 U10      H1M2   C1M    .      .
 U10      H1M1   C1M    .      .
 U10      C6     C5     C7     .
 U10      C7     C6     C8     .
 U10      H71    C7     .      .
 U10      H72    C7     .      .
 U10      C8     C7     C9     .
 U10      H8     C8     .      .
 U10      C9     C8     C11    .
 U10      C10    C9     H101   .
 U10      H103   C10    .      .
 U10      H102   C10    .      .
 U10      H101   C10    .      .
 U10      C11    C9     C12    .
 U10      H111   C11    .      .
 U10      H112   C11    .      .
 U10      C12    C11    C13    .
 U10      H121   C12    .      .
 U10      H122   C12    .      .
 U10      C13    C12    C14    .
 U10      H13    C13    .      .
 U10      C14    C13    C16    .
 U10      C15    C14    H151   .
 U10      H153   C15    .      .
 U10      H152   C15    .      .
 U10      H151   C15    .      .
 U10      C16    C14    C17    .
 U10      H161   C16    .      .
 U10      H162   C16    .      .
 U10      C17    C16    C18    .
 U10      H171   C17    .      .
 U10      H172   C17    .      .
 U10      C18    C17    C19    .
 U10      H18    C18    .      .
 U10      C19    C18    C21    .
 U10      C20    C19    H201   .
 U10      H203   C20    .      .
 U10      H202   C20    .      .
 U10      H201   C20    .      .
 U10      C21    C19    C22    .
 U10      H211   C21    .      .
 U10      H212   C21    .      .
 U10      C22    C21    C23    .
 U10      H221   C22    .      .
 U10      H222   C22    .      .
 U10      C23    C22    C24    .
 U10      H23    C23    .      .
 U10      C24    C23    C26    .
 U10      C25    C24    H251   .
 U10      H253   C25    .      .
 U10      H252   C25    .      .
 U10      H251   C25    .      .
 U10      C26    C24    C27    .
 U10      H261   C26    .      .
 U10      H262   C26    .      .
 U10      C27    C26    C28    .
 U10      H271   C27    .      .
 U10      H272   C27    .      .
 U10      C28    C27    C29    .
 U10      H28    C28    .      .
 U10      C29    C28    C31    .
 U10      C30    C29    H301   .
 U10      H303   C30    .      .
 U10      H302   C30    .      .
 U10      H301   C30    .      .
 U10      C31    C29    C32    .
 U10      H311   C31    .      .
 U10      H312   C31    .      .
 U10      C32    C31    C33    .
 U10      H321   C32    .      .
 U10      H322   C32    .      .
 U10      C33    C32    C34    .
 U10      H33    C33    .      .
 U10      C34    C33    C36    .
 U10      C35    C34    H351   .
 U10      H353   C35    .      .
 U10      H352   C35    .      .
 U10      H351   C35    .      .
 U10      C36    C34    C37    .
 U10      H361   C36    .      .
 U10      H362   C36    .      .
 U10      C37    C36    C38    .
 U10      H371   C37    .      .
 U10      H372   C37    .      .
 U10      C38    C37    C39    .
 U10      H38    C38    .      .
 U10      C39    C38    C41    .
 U10      C40    C39    H401   .
 U10      H403   C40    .      .
 U10      H402   C40    .      .
 U10      H401   C40    .      .
 U10      C41    C39    C42    .
 U10      H411   C41    .      .
 U10      H412   C41    .      .
 U10      C42    C41    C43    .
 U10      H421   C42    .      .
 U10      H422   C42    .      .
 U10      C43    C42    C44    .
 U10      H43    C43    .      .
 U10      C44    C43    C46    .
 U10      C45    C44    H451   .
 U10      H453   C45    .      .
 U10      H452   C45    .      .
 U10      H451   C45    .      .
 U10      C46    C44    C47    .
 U10      H461   C46    .      .
 U10      H462   C46    .      .
 U10      C47    C46    C48    .
 U10      H471   C47    .      .
 U10      H472   C47    .      .
 U10      C48    C47    C49    .
 U10      H48    C48    .      .
 U10      C49    C48    C51    .
 U10      C50    C49    H501   .
 U10      H503   C50    .      .
 U10      H502   C50    .      .
 U10      H501   C50    .      .
 U10      C51    C49    C52    .
 U10      H511   C51    .      .
 U10      H512   C51    .      .
 U10      C52    C51    C53    .
 U10      H521   C52    .      .
 U10      H522   C52    .      .
 U10      C53    C52    C54    .
 U10      H53    C53    .      .
 U10      C54    C53    C55    .
 U10      C56    C54    H561   .
 U10      H563   C56    .      .
 U10      H562   C56    .      .
 U10      H561   C56    .      .
 U10      C55    C54    H551   .
 U10      H553   C55    .      .
 U10      H552   C55    .      .
 U10      H551   C55    .      END
 U10      C1     C6     .    ADD
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
 U10      C5     O5        coval       1.230    0.020
 U10      C4     C5        coval       1.390    0.020
 U10      O4     C4        coval       1.230    0.020
 U10      C4M    O4        coval       1.410    0.020
 U10      H4M3   C4M       coval       1.090    0.020
 U10      H4M2   C4M       coval       1.090    0.020
 U10      H4M1   C4M       coval       1.090    0.020
 U10      C3     C4        coval       1.390    0.020
 U10      O3     C3        coval       1.230    0.020
 U10      C3M    O3        coval       1.410    0.020
 U10      H3M3   C3M       coval       1.090    0.020
 U10      H3M2   C3M       coval       1.090    0.020
 U10      H3M1   C3M       coval       1.090    0.020
 U10      C2     C3        coval       1.390    0.020
 U10      O2     C2        coval       1.230    0.020
 U10      C1     C2        coval       1.390    0.020
 U10      C1     C6        coval       1.390    0.020
 U10      C1M    C1        coval       1.500    0.020
 U10      H1M3   C1M       coval       1.090    0.020
 U10      H1M2   C1M       coval       1.090    0.020
 U10      H1M1   C1M       coval       1.090    0.020
 U10      C6     C5        coval       1.390    0.020
 U10      C7     C6        coval       1.511    0.020
 U10      H71    C7        coval       1.090    0.020
 U10      H72    C7        coval       1.090    0.020
 U10      C8     C7        coval       1.510    0.020
 U10      H8     C8        coval       1.090    0.020
 U10      C9     C8        coval       1.470    0.020
 U10      C10    C9        coval       1.500    0.020
 U10      H103   C10       coval       1.090    0.020
 U10      H102   C10       coval       1.090    0.020
 U10      H101   C10       coval       1.090    0.020
 U10      C11    C9        coval       1.510    0.020
 U10      H111   C11       coval       1.090    0.020
 U10      H112   C11       coval       1.090    0.020
 U10      C12    C11       coval       1.524    0.020
 U10      H121   C12       coval       1.090    0.020
 U10      H122   C12       coval       1.090    0.020
 U10      C13    C12       coval       1.510    0.020
 U10      H13    C13       coval       1.090    0.020
 U10      C14    C13       coval       1.470    0.020
 U10      C15    C14       coval       1.500    0.020
 U10      H153   C15       coval       1.090    0.020
 U10      H152   C15       coval       1.090    0.020
 U10      H151   C15       coval       1.090    0.020
 U10      C16    C14       coval       1.510    0.020
 U10      H161   C16       coval       1.090    0.020
 U10      H162   C16       coval       1.090    0.020
 U10      C17    C16       coval       1.524    0.020
 U10      H171   C17       coval       1.090    0.020
 U10      H172   C17       coval       1.090    0.020
 U10      C18    C17       coval       1.510    0.020
 U10      H18    C18       coval       1.090    0.020
 U10      C19    C18       coval       1.470    0.020
 U10      C20    C19       coval       1.500    0.020
 U10      H203   C20       coval       1.090    0.020
 U10      H202   C20       coval       1.090    0.020
 U10      H201   C20       coval       1.090    0.020
 U10      C21    C19       coval       1.510    0.020
 U10      H211   C21       coval       1.090    0.020
 U10      H212   C21       coval       1.090    0.020
 U10      C22    C21       coval       1.524    0.020
 U10      H221   C22       coval       1.090    0.020
 U10      H222   C22       coval       1.090    0.020
 U10      C23    C22       coval       1.510    0.020
 U10      H23    C23       coval       1.090    0.020
 U10      C24    C23       coval       1.470    0.020
 U10      C25    C24       coval       1.500    0.020
 U10      H253   C25       coval       1.090    0.020
 U10      H252   C25       coval       1.090    0.020
 U10      H251   C25       coval       1.090    0.020
 U10      C26    C24       coval       1.510    0.020
 U10      H261   C26       coval       1.090    0.020
 U10      H262   C26       coval       1.090    0.020
 U10      C27    C26       coval       1.524    0.020
 U10      H271   C27       coval       1.090    0.020
 U10      H272   C27       coval       1.090    0.020
 U10      C28    C27       coval       1.510    0.020
 U10      H28    C28       coval       1.090    0.020
 U10      C29    C28       coval       1.470    0.020
 U10      C30    C29       coval       1.500    0.020
 U10      H303   C30       coval       1.090    0.020
 U10      H302   C30       coval       1.090    0.020
 U10      H301   C30       coval       1.090    0.020
 U10      C31    C29       coval       1.510    0.020
 U10      H311   C31       coval       1.090    0.020
 U10      H312   C31       coval       1.090    0.020
 U10      C32    C31       coval       1.524    0.020
 U10      H321   C32       coval       1.090    0.020
 U10      H322   C32       coval       1.090    0.020
 U10      C33    C32       coval       1.510    0.020
 U10      H33    C33       coval       1.090    0.020
 U10      C34    C33       coval       1.470    0.020
 U10      C35    C34       coval       1.500    0.020
 U10      H353   C35       coval       1.090    0.020
 U10      H352   C35       coval       1.090    0.020
 U10      H351   C35       coval       1.090    0.020
 U10      C36    C34       coval       1.510    0.020
 U10      H361   C36       coval       1.090    0.020
 U10      H362   C36       coval       1.090    0.020
 U10      C37    C36       coval       1.524    0.020
 U10      H371   C37       coval       1.090    0.020
 U10      H372   C37       coval       1.090    0.020
 U10      C38    C37       coval       1.510    0.020
 U10      H38    C38       coval       1.090    0.020
 U10      C39    C38       coval       1.470    0.020
 U10      C40    C39       coval       1.500    0.020
 U10      H403   C40       coval       1.090    0.020
 U10      H402   C40       coval       1.090    0.020
 U10      H401   C40       coval       1.090    0.020
 U10      C41    C39       coval       1.510    0.020
 U10      H411   C41       coval       1.090    0.020
 U10      H412   C41       coval       1.090    0.020
 U10      C42    C41       coval       1.524    0.020
 U10      H421   C42       coval       1.090    0.020
 U10      H422   C42       coval       1.090    0.020
 U10      C43    C42       coval       1.510    0.020
 U10      H43    C43       coval       1.090    0.020
 U10      C44    C43       coval       1.470    0.020
 U10      C45    C44       coval       1.500    0.020
 U10      H453   C45       coval       1.090    0.020
 U10      H452   C45       coval       1.090    0.020
 U10      H451   C45       coval       1.090    0.020
 U10      C46    C44       coval       1.510    0.020
 U10      H461   C46       coval       1.090    0.020
 U10      H462   C46       coval       1.090    0.020
 U10      C47    C46       coval       1.524    0.020
 U10      H471   C47       coval       1.090    0.020
 U10      H472   C47       coval       1.090    0.020
 U10      C48    C47       coval       1.510    0.020
 U10      H48    C48       coval       1.090    0.020
 U10      C49    C48       coval       1.470    0.020
 U10      C50    C49       coval       1.500    0.020
 U10      H503   C50       coval       1.090    0.020
 U10      H502   C50       coval       1.090    0.020
 U10      H501   C50       coval       1.090    0.020
 U10      C51    C49       coval       1.510    0.020
 U10      H511   C51       coval       1.090    0.020
 U10      H512   C51       coval       1.090    0.020
 U10      C52    C51       coval       1.524    0.020
 U10      H521   C52       coval       1.090    0.020
 U10      H522   C52       coval       1.090    0.020
 U10      C53    C52       coval       1.510    0.020
 U10      H53    C53       coval       1.090    0.020
 U10      C54    C53       coval       1.470    0.020
 U10      C56    C54       coval       1.500    0.020
 U10      H563   C56       coval       1.090    0.020
 U10      H562   C56       coval       1.090    0.020
 U10      H561   C56       coval       1.090    0.020
 U10      C55    C54       coval       1.500    0.020
 U10      H553   C55       coval       1.090    0.020
 U10      H552   C55       coval       1.090    0.020
 U10      H551   C55       coval       1.090    0.020
loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
 U10      O5     C5     C4      120.000    3.000
 U10      O5     C5     C6      120.000    3.000
 U10      C4     C5     C6      120.000    3.000
 U10      C5     C4     O4      120.000    3.000
 U10      C5     C4     C3      120.000    3.000
 U10      O4     C4     C3      120.000    3.000
 U10      C4     O4     C4M     120.000    3.000
 U10      O4     C4M    H4M3    109.470    3.000
 U10      O4     C4M    H4M2    109.470    3.000
 U10      O4     C4M    H4M1    109.470    3.000
 U10      H4M3   C4M    H4M2    109.470    3.000
 U10      H4M3   C4M    H4M1    109.470    3.000
 U10      H4M2   C4M    H4M1    109.470    3.000
 U10      C4     C3     O3      120.000    3.000
 U10      C4     C3     C2      120.000    3.000
 U10      O3     C3     C2      120.000    3.000
 U10      C3     O3     C3M     120.000    3.000
 U10      O3     C3M    H3M3    109.470    3.000
 U10      O3     C3M    H3M2    109.470    3.000
 U10      O3     C3M    H3M1    109.470    3.000
 U10      H3M3   C3M    H3M2    109.470    3.000
 U10      H3M3   C3M    H3M1    109.470    3.000
 U10      H3M2   C3M    H3M1    109.470    3.000
 U10      C3     C2     O2      120.000    3.000
 U10      C3     C2     C1      120.000    3.000
 U10      O2     C2     C1      120.000    3.000
 U10      C2     C1     C1M     120.000    3.000
 U10      C2     C1     C6      120.000    3.000
 U10      C1M    C1     C6      120.000    3.000
 U10      C1     C1M    H1M3    109.470    3.000
 U10      C1     C1M    H1M2    109.470    3.000
 U10      C1     C1M    H1M1    109.470    3.000
 U10      H1M3   C1M    H1M2    109.470    3.000
 U10      H1M3   C1M    H1M1    109.470    3.000
 U10      H1M2   C1M    H1M1    109.470    3.000
 U10      C5     C6     C7      120.000    3.000
 U10      C5     C6     C1      120.000    3.000
 U10      C7     C6     C1      120.000    3.000
 U10      C6     C7     H71     109.470    3.000
 U10      C6     C7     H72     109.470    3.000
 U10      C6     C7     C8      109.470    3.000
 U10      H71    C7     H72     107.900    3.000
 U10      H71    C7     C8      109.470    3.000
 U10      H72    C7     C8      109.470    3.000
 U10      C7     C8     H8      120.000    3.000
 U10      C7     C8     C9      120.500    3.000
 U10      H8     C8     C9      120.000    3.000
 U10      C8     C9     C10     120.000    3.000
 U10      C8     C9     C11     120.000    3.000
 U10      C10    C9     C11     120.000    3.000
 U10      C9     C10    H103    109.470    3.000
 U10      C9     C10    H102    109.470    3.000
 U10      C9     C10    H101    109.470    3.000
 U10      H103   C10    H102    109.470    3.000
 U10      H103   C10    H101    109.470    3.000
 U10      H102   C10    H101    109.470    3.000
 U10      C9     C11    H111    109.470    3.000
 U10      C9     C11    H112    109.470    3.000
 U10      C9     C11    C12     109.470    3.000
 U10      H111   C11    H112    107.900    3.000
 U10      H111   C11    C12     109.470    3.000
 U10      H112   C11    C12     109.470    3.000
 U10      C11    C12    H121    109.470    3.000
 U10      C11    C12    H122    109.470    3.000
 U10      C11    C12    C13     109.470    3.000
 U10      H121   C12    H122    107.900    3.000
 U10      H121   C12    C13     109.470    3.000
 U10      H122   C12    C13     109.470    3.000
 U10      C12    C13    H13     120.000    3.000
 U10      C12    C13    C14     120.500    3.000
 U10      H13    C13    C14     120.000    3.000
 U10      C13    C14    C15     120.000    3.000
 U10      C13    C14    C16     120.000    3.000
 U10      C15    C14    C16     120.000    3.000
 U10      C14    C15    H153    109.470    3.000
 U10      C14    C15    H152    109.470    3.000
 U10      C14    C15    H151    109.470    3.000
 U10      H153   C15    H152    109.470    3.000
 U10      H153   C15    H151    109.470    3.000
 U10      H152   C15    H151    109.470    3.000
 U10      C14    C16    H161    109.470    3.000
 U10      C14    C16    H162    109.470    3.000
 U10      C14    C16    C17     109.470    3.000
 U10      H161   C16    H162    107.900    3.000
 U10      H161   C16    C17     109.470    3.000
 U10      H162   C16    C17     109.470    3.000
 U10      C16    C17    H171    109.470    3.000
 U10      C16    C17    H172    109.470    3.000
 U10      C16    C17    C18     109.470    3.000
 U10      H171   C17    H172    107.900    3.000
 U10      H171   C17    C18     109.470    3.000
 U10      H172   C17    C18     109.470    3.000
 U10      C17    C18    H18     120.000    3.000
 U10      C17    C18    C19     120.500    3.000
 U10      H18    C18    C19     120.000    3.000
 U10      C18    C19    C20     120.000    3.000
 U10      C18    C19    C21     120.000    3.000
 U10      C20    C19    C21     120.000    3.000
 U10      C19    C20    H203    109.470    3.000
 U10      C19    C20    H202    109.470    3.000
 U10      C19    C20    H201    109.470    3.000
 U10      H203   C20    H202    109.470    3.000
 U10      H203   C20    H201    109.470    3.000
 U10      H202   C20    H201    109.470    3.000
 U10      C19    C21    H211    109.470    3.000
 U10      C19    C21    H212    109.470    3.000
 U10      C19    C21    C22     109.470    3.000
 U10      H211   C21    H212    107.900    3.000
 U10      H211   C21    C22     109.470    3.000
 U10      H212   C21    C22     109.470    3.000
 U10      C21    C22    H221    109.470    3.000
 U10      C21    C22    H222    109.470    3.000
 U10      C21    C22    C23     109.470    3.000
 U10      H221   C22    H222    107.900    3.000
 U10      H221   C22    C23     109.470    3.000
 U10      H222   C22    C23     109.470    3.000
 U10      C22    C23    H23     120.000    3.000
 U10      C22    C23    C24     120.500    3.000
 U10      H23    C23    C24     120.000    3.000
 U10      C23    C24    C25     120.000    3.000
 U10      C23    C24    C26     120.000    3.000
 U10      C25    C24    C26     120.000    3.000
 U10      C24    C25    H253    109.470    3.000
 U10      C24    C25    H252    109.470    3.000
 U10      C24    C25    H251    109.470    3.000
 U10      H253   C25    H252    109.470    3.000
 U10      H253   C25    H251    109.470    3.000
 U10      H252   C25    H251    109.470    3.000
 U10      C24    C26    H261    109.470    3.000
 U10      C24    C26    H262    109.470    3.000
 U10      C24    C26    C27     109.470    3.000
 U10      H261   C26    H262    107.900    3.000
 U10      H261   C26    C27     109.470    3.000
 U10      H262   C26    C27     109.470    3.000
 U10      C26    C27    H271    109.470    3.000
 U10      C26    C27    H272    109.470    3.000
 U10      C26    C27    C28     109.470    3.000
 U10      H271   C27    H272    107.900    3.000
 U10      H271   C27    C28     109.470    3.000
 U10      H272   C27    C28     109.470    3.000
 U10      C27    C28    H28     120.000    3.000
 U10      C27    C28    C29     120.500    3.000
 U10      H28    C28    C29     120.000    3.000
 U10      C28    C29    C30     120.000    3.000
 U10      C28    C29    C31     120.000    3.000
 U10      C30    C29    C31     120.000    3.000
 U10      C29    C30    H303    109.470    3.000
 U10      C29    C30    H302    109.470    3.000
 U10      C29    C30    H301    109.470    3.000
 U10      H303   C30    H302    109.470    3.000
 U10      H303   C30    H301    109.470    3.000
 U10      H302   C30    H301    109.470    3.000
 U10      C29    C31    H311    109.470    3.000
 U10      C29    C31    H312    109.470    3.000
 U10      C29    C31    C32     109.470    3.000
 U10      H311   C31    H312    107.900    3.000
 U10      H311   C31    C32     109.470    3.000
 U10      H312   C31    C32     109.470    3.000
 U10      C31    C32    H321    109.470    3.000
 U10      C31    C32    H322    109.470    3.000
 U10      C31    C32    C33     109.470    3.000
 U10      H321   C32    H322    107.900    3.000
 U10      H321   C32    C33     109.470    3.000
 U10      H322   C32    C33     109.470    3.000
 U10      C32    C33    H33     120.000    3.000
 U10      C32    C33    C34     120.500    3.000
 U10      H33    C33    C34     120.000    3.000
 U10      C33    C34    C35     120.000    3.000
 U10      C33    C34    C36     120.000    3.000
 U10      C35    C34    C36     120.000    3.000
 U10      C34    C35    H353    109.470    3.000
 U10      C34    C35    H352    109.470    3.000
 U10      C34    C35    H351    109.470    3.000
 U10      H353   C35    H352    109.470    3.000
 U10      H353   C35    H351    109.470    3.000
 U10      H352   C35    H351    109.470    3.000
 U10      C34    C36    H361    109.470    3.000
 U10      C34    C36    H362    109.470    3.000
 U10      C34    C36    C37     109.470    3.000
 U10      H361   C36    H362    107.900    3.000
 U10      H361   C36    C37     109.470    3.000
 U10      H362   C36    C37     109.470    3.000
 U10      C36    C37    H371    109.470    3.000
 U10      C36    C37    H372    109.470    3.000
 U10      C36    C37    C38     109.470    3.000
 U10      H371   C37    H372    107.900    3.000
 U10      H371   C37    C38     109.470    3.000
 U10      H372   C37    C38     109.470    3.000
 U10      C37    C38    H38     120.000    3.000
 U10      C37    C38    C39     120.500    3.000
 U10      H38    C38    C39     120.000    3.000
 U10      C38    C39    C40     120.000    3.000
 U10      C38    C39    C41     120.000    3.000
 U10      C40    C39    C41     120.000    3.000
 U10      C39    C40    H403    109.470    3.000
 U10      C39    C40    H402    109.470    3.000
 U10      C39    C40    H401    109.470    3.000
 U10      H403   C40    H402    109.470    3.000
 U10      H403   C40    H401    109.470    3.000
 U10      H402   C40    H401    109.470    3.000
 U10      C39    C41    H411    109.470    3.000
 U10      C39    C41    H412    109.470    3.000
 U10      C39    C41    C42     109.470    3.000
 U10      H411   C41    H412    107.900    3.000
 U10      H411   C41    C42     109.470    3.000
 U10      H412   C41    C42     109.470    3.000
 U10      C41    C42    H421    109.470    3.000
 U10      C41    C42    H422    109.470    3.000
 U10      C41    C42    C43     109.470    3.000
 U10      H421   C42    H422    107.900    3.000
 U10      H421   C42    C43     109.470    3.000
 U10      H422   C42    C43     109.470    3.000
 U10      C42    C43    H43     120.000    3.000
 U10      C42    C43    C44     120.500    3.000
 U10      H43    C43    C44     120.000    3.000
 U10      C43    C44    C45     120.000    3.000
 U10      C43    C44    C46     120.000    3.000
 U10      C45    C44    C46     120.000    3.000
 U10      C44    C45    H453    109.470    3.000
 U10      C44    C45    H452    109.470    3.000
 U10      C44    C45    H451    109.470    3.000
 U10      H453   C45    H452    109.470    3.000
 U10      H453   C45    H451    109.470    3.000
 U10      H452   C45    H451    109.470    3.000
 U10      C44    C46    H461    109.470    3.000
 U10      C44    C46    H462    109.470    3.000
 U10      C44    C46    C47     109.470    3.000
 U10      H461   C46    H462    107.900    3.000
 U10      H461   C46    C47     109.470    3.000
 U10      H462   C46    C47     109.470    3.000
 U10      C46    C47    H471    109.470    3.000
 U10      C46    C47    H472    109.470    3.000
 U10      C46    C47    C48     109.470    3.000
 U10      H471   C47    H472    107.900    3.000
 U10      H471   C47    C48     109.470    3.000
 U10      H472   C47    C48     109.470    3.000
 U10      C47    C48    H48     120.000    3.000
 U10      C47    C48    C49     120.500    3.000
 U10      H48    C48    C49     120.000    3.000
 U10      C48    C49    C50     120.000    3.000
 U10      C48    C49    C51     120.000    3.000
 U10      C50    C49    C51     120.000    3.000
 U10      C49    C50    H503    109.470    3.000
 U10      C49    C50    H502    109.470    3.000
 U10      C49    C50    H501    109.470    3.000
 U10      H503   C50    H502    109.470    3.000
 U10      H503   C50    H501    109.470    3.000
 U10      H502   C50    H501    109.470    3.000
 U10      C49    C51    H511    109.470    3.000
 U10      C49    C51    H512    109.470    3.000
 U10      C49    C51    C52     109.470    3.000
 U10      H511   C51    H512    107.900    3.000
 U10      H511   C51    C52     109.470    3.000
 U10      H512   C51    C52     109.470    3.000
 U10      C51    C52    H521    109.470    3.000
 U10      C51    C52    H522    109.470    3.000
 U10      C51    C52    C53     109.470    3.000
 U10      H521   C52    H522    107.900    3.000
 U10      H521   C52    C53     109.470    3.000
 U10      H522   C52    C53     109.470    3.000
 U10      C52    C53    H53     120.000    3.000
 U10      C52    C53    C54     120.500    3.000
 U10      H53    C53    C54     120.000    3.000
 U10      C53    C54    C56     120.000    3.000
 U10      C53    C54    C55     120.000    3.000
 U10      C56    C54    C55     120.000    3.000
 U10      C54    C56    H563    109.470    3.000
 U10      C54    C56    H562    109.470    3.000
 U10      C54    C56    H561    109.470    3.000
 U10      H563   C56    H562    109.470    3.000
 U10      H563   C56    H561    109.470    3.000
 U10      H562   C56    H561    109.470    3.000
 U10      C54    C55    H553    109.470    3.000
 U10      C54    C55    H552    109.470    3.000
 U10      C54    C55    H551    109.470    3.000
 U10      H553   C55    H552    109.470    3.000
 U10      H553   C55    H551    109.470    3.000
 U10      H552   C55    H551    109.470    3.000
loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
 U10      CONST_1  O5     C5     C4     C3       180.000    0.000   0
 U10      var_1    C5     C4     O4     C4M      175.832   20.000   1
 U10      var_2    C4     O4     C4M    H4M1       0.000   20.000   1
 U10      CONST_2  C5     C4     C3     C2         0.000    0.000   0
 U10      var_3    C4     C3     O3     C3M      115.621   20.000   1
 U10      var_4    C3     O3     C3M    H3M1       0.000   20.000   1
 U10      CONST_3  C4     C3     C2     C1         0.000    0.000   0
 U10      CONST_4  C3     C2     C1     C1M      180.000    0.000   0
 U10      CONST_5  C3     C2     C1     C6         0.000    0.000   0
 U10      var_5    C2     C1     C1M    H1M1       0.000   20.000   1
 U10      CONST_6  O5     C5     C6     C7         0.000    0.000   0
 U10      CONST_7  O5     C5     C6     C1       180.000    0.000   0
 U10      var_6    C5     C6     C7     C8      -101.341   20.000   2
 U10      var_7    C6     C7     C8     C9       101.515   20.000   1
 U10      var_8    C7     C8     C9     C11      179.952   20.000   1
 U10      var_9    C8     C9     C10    H101       0.000   20.000   1
 U10      var_10   C8     C9     C11    C12     -108.298   20.000   3
 U10      var_11   C9     C11    C12    C13       60.448   20.000   3
 U10      var_12   C11    C12    C13    C14      126.679   20.000   1
 U10      var_13   C12    C13    C14    C16      178.797   20.000   1
 U10      var_14   C13    C14    C15    H151       0.000   20.000   1
 U10      var_15   C13    C14    C16    C17     -122.500   20.000   3
 U10      var_16   C14    C16    C17    C18       95.802   20.000   3
 U10      var_17   C16    C17    C18    C19     -160.215   20.000   1
 U10      var_18   C17    C18    C19    C21      179.221   20.000   1
 U10      var_19   C18    C19    C20    H201       0.000   20.000   1
 U10      var_20   C18    C19    C21    C22      102.586   20.000   3
 U10      var_21   C19    C21    C22    C23     -179.117   20.000   3
 U10      var_22   C21    C22    C23    C24      146.171   20.000   1
 U10      var_23   C22    C23    C24    C26     -178.107   20.000   1
 U10      var_24   C23    C24    C25    H251       0.000   20.000   1
 U10      var_25   C23    C24    C26    C27      -48.413   20.000   3
 U10      var_26   C24    C26    C27    C28     -142.927   20.000   3
 U10      var_27   C26    C27    C28    C29      172.595   20.000   1
 U10      var_28   C27    C28    C29    C31     -178.281   20.000   1
 U10      var_29   C28    C29    C30    H301       0.000   20.000   1
 U10      var_30   C28    C29    C31    C32       41.183   20.000   3
 U10      var_31   C29    C31    C32    C33     -154.899   20.000   3
 U10      var_32   C31    C32    C33    C34      -97.883   20.000   1
 U10      var_33   C32    C33    C34    C36     -175.085   20.000   1
 U10      var_34   C33    C34    C35    H351       0.000   20.000   1
 U10      var_35   C33    C34    C36    C37      -32.034   20.000   3
 U10      var_36   C34    C36    C37    C38      -68.023   20.000   3
 U10      var_37   C36    C37    C38    C39      -77.914   20.000   1
 U10      var_38   C37    C38    C39    C41       -5.628   20.000   1
 U10      var_39   C38    C39    C40    H401       0.000   20.000   1
 U10      var_40   C38    C39    C41    C42      180.000   20.000   3
 U10      var_41   C39    C41    C42    C43      180.000   20.000   3
 U10      var_42   C41    C42    C43    C44      180.000   20.000   1
 U10      var_43   C42    C43    C44    C46      180.000   20.000   1
 U10      var_44   C43    C44    C45    H451       0.000   20.000   1
 U10      var_45   C43    C44    C46    C47      180.000   20.000   3
 U10      var_46   C44    C46    C47    C48      180.000   20.000   3
 U10      var_47   C46    C47    C48    C49      180.000   20.000   1
 U10      var_48   C47    C48    C49    C51     -175.085   20.000   1
 U10      var_49   C48    C49    C50    H501       0.000   20.000   1
 U10      var_50   C48    C49    C51    C52      -32.034   20.000   3
 U10      var_51   C49    C51    C52    C53      -68.023   20.000   3
 U10      var_52   C51    C52    C53    C54      -77.914   20.000   1
 U10      var_53   C52    C53    C54    C55      166.676   20.000   1
 U10      var_54   C53    C54    C56    H561       0.000   20.000   1
 U10      var_55   C53    C54    C55    H551       0.000   20.000   1
loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
 U10      plan-1    C1        0.020
 U10      plan-1    C2        0.020
 U10      plan-1    C6        0.020
 U10      plan-1    C1M       0.020
 U10      plan-1    C3        0.020
 U10      plan-1    C4        0.020
 U10      plan-1    C5        0.020
 U10      plan-2    C9        0.020
 U10      plan-2    C8        0.020
 U10      plan-2    C10       0.020
 U10      plan-2    C11       0.020
 U10      plan-3    C14       0.020
 U10      plan-3    C13       0.020
 U10      plan-3    C15       0.020
 U10      plan-3    C16       0.020
 U10      plan-4    C19       0.020
 U10      plan-4    C18       0.020
 U10      plan-4    C20       0.020
 U10      plan-4    C21       0.020
 U10      plan-5    C24       0.020
 U10      plan-5    C23       0.020
 U10      plan-5    C25       0.020
 U10      plan-5    C26       0.020
 U10      plan-6    C29       0.020
 U10      plan-6    C28       0.020
 U10      plan-6    C30       0.020
 U10      plan-6    C31       0.020
 U10      plan-7    C34       0.020
 U10      plan-7    C33       0.020
 U10      plan-7    C35       0.020
 U10      plan-7    C36       0.020
 U10      plan-8    C39       0.020
 U10      plan-8    C38       0.020
 U10      plan-8    C40       0.020
 U10      plan-8    C41       0.020
 U10      plan-9    C49       0.020
 U10      plan-9    C48       0.020
 U10      plan-9    C50       0.020
 U10      plan-9    C51       0.020
 U10      plan-10   C54       0.020
 U10      plan-10   C53       0.020
 U10      plan-10   C55       0.020
 U10      plan-10   C56       0.020
 U10      plan-11   C44       0.020
 U10      plan-11   C43       0.020
 U10      plan-11   C45       0.020
 U10      plan-11   C46       0.020
