global_
_lib_name         ?
_lib_version      ?
_lib_update       ?
# ------------------------------------------------
#
# ---   LIST OF MONOMERS ---
#
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
ZOP      ZOP '(3Z)-N-ETHYL-N-METHYL-2-OXO-3-(PHENY' non-polymer        71  37 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_ZOP
#
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
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 ZOP           OBE    O    O         0.000      0.000    0.000    0.000
 ZOP           C21    C    C         0.000     -0.600    0.517    0.924
 ZOP           N25    N    N         0.000      0.066    1.275    1.817
 ZOP           C29    C    CH3       0.000     -0.627    1.787    3.003
 ZOP           H293   H    H         0.000     -1.402    1.119    3.278
 ZOP           H292   H    H         0.000      0.060    1.876    3.805
 ZOP           H291   H    H         0.000     -1.042    2.738    2.789
 ZOP           CAT    C    CH2       0.000      1.480    1.589    1.603
 ZOP           HAT1   H    H         0.000      1.954    0.773    1.054
 ZOP           HAT2   H    H         0.000      1.975    1.712    2.569
 ZOP           CAX    C    CH3       0.000      1.600    2.885    0.799
 ZOP           HAX3   H    H         0.000      1.120    2.768   -0.139
 ZOP           HAX2   H    H         0.000      1.141    3.679    1.331
 ZOP           HAX1   H    H         0.000      2.623    3.114    0.642
 ZOP           CBF    C    CR6       0.000     -2.053    0.313    1.066
 ZOP           CBA    C    CR16      0.000     -2.627   -0.907    0.688
 ZOP           HBA    H    H         0.000     -2.002   -1.698    0.293
 ZOP           CBB    C    CR16      0.000     -3.971   -1.102    0.816
 ZOP           HBB    H    H         0.000     -4.412   -2.047    0.522
 ZOP           CBG    C    CR16      0.000     -2.852    1.337    1.578
 ZOP           HBG    H    H         0.000     -2.406    2.280    1.870
 ZOP           CBH    C    CR56      0.000     -4.216    1.144    1.711
 ZOP           CBC    C    CR56      0.000     -4.778   -0.086    1.326
 ZOP           NBI    N    NR15      0.000     -5.239    1.963    2.175
 ZOP           HBI    H    H         0.000     -5.105    2.933    2.524
 ZOP           CBJ    C    CR5       0.000     -6.425    1.333    2.112
 ZOP           OBK    O    O         0.000     -7.497    1.806    2.448
 ZOP           CBD    C    CR5       0.000     -6.226    0.027    1.589
 ZOP           CAO    C    C         0.000     -7.198   -0.943    1.366
 ZOP           CAN    C    CR6       0.000     -6.843   -2.195    0.671
 ZOP           CAD    C    CR16      0.000     -6.200   -2.151   -0.569
 ZOP           HAD    H    H         0.000     -5.963   -1.197   -1.024
 ZOP           CAB    C    CR16      0.000     -5.867   -3.325   -1.212
 ZOP           HAB    H    H         0.000     -5.362   -3.293   -2.169
 ZOP           CAA    C    CR16      0.000     -6.178   -4.545   -0.636
 ZOP           HAA    H    H         0.000     -5.918   -5.464   -1.146
 ZOP           CAC    C    CR16      0.000     -6.820   -4.596    0.589
 ZOP           HAC    H    H         0.000     -7.061   -5.554    1.033
 ZOP           CAM    C    CR16      0.000     -7.154   -3.430    1.246
 ZOP           HAM    H    H         0.000     -7.657   -3.472    2.204
 ZOP           NAP    N    NH1       0.000     -8.483   -0.738    1.792
 ZOP           HAP    H    H         0.000     -8.672   -0.592    2.773
 ZOP           CAQ    C    CR6       0.000     -9.532   -0.730    0.869
 ZOP           CAR    C    CR16      0.000    -10.848   -0.677    1.311
 ZOP           HAR    H    H         0.000    -11.063   -0.641    2.372
 ZOP           CAS    C    CR16      0.000    -11.883   -0.670    0.396
 ZOP           HAS    H    H         0.000    -12.909   -0.630    0.740
 ZOP           CAE    C    CR16      0.000     -9.262   -0.779   -0.493
 ZOP           HAE    H    H         0.000     -8.237   -0.824   -0.841
 ZOP           CAF    C    CR16      0.000    -10.301   -0.771   -1.402
 ZOP           HAF    H    H         0.000    -10.091   -0.810   -2.464
 ZOP           CAG    C    CR6       0.000    -11.609   -0.714   -0.959
 ZOP           CAH    C    CH2       0.000    -12.741   -0.705   -1.954
 ZOP           HAH1   H    H         0.000    -13.617   -1.183   -1.511
 ZOP           HAH2   H    H         0.000    -12.441   -1.254   -2.849
 ZOP           NAI    N    NT        0.000    -13.066    0.681   -2.313
 ZOP           CAJ    C    CH2       0.000    -13.995    0.726   -3.450
 ZOP           HAJ2   H    H         0.000    -14.954    0.298   -3.152
 ZOP           HAJ1   H    H         0.000    -13.581    0.148   -4.279
 ZOP           CAK    C    CH2       0.000    -13.604    1.412   -1.159
 ZOP           HAK1   H    H         0.000    -12.906    1.333   -0.323
 ZOP           HAK2   H    H         0.000    -14.565    0.980   -0.872
 ZOP           CAV    C    CH2       0.000    -13.795    2.885   -1.530
 ZOP           HAV1   H    H         0.000    -12.831    3.321   -1.802
 ZOP           HAV2   H    H         0.000    -14.209    3.425   -0.676
 ZOP           CAW    C    CH2       0.000    -14.757    2.987   -2.716
 ZOP           HAW1   H    H         0.000    -14.863    4.033   -3.012
 ZOP           HAW2   H    H         0.000    -15.733    2.590   -2.431
 ZOP           CAL    C    CH2       0.000    -14.197    2.178   -3.889
 ZOP           HAL2   H    H         0.000    -13.240    2.602   -4.201
 ZOP           HAL1   H    H         0.000    -14.898    2.213   -4.725
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
 ZOP      OBE    n/a    C21    START
 ZOP      C21    OBE    CBF    .
 ZOP      N25    C21    CAT    .
 ZOP      C29    N25    H291   .
 ZOP      H293   C29    .      .
 ZOP      H292   C29    .      .
 ZOP      H291   C29    .      .
 ZOP      CAT    N25    CAX    .
 ZOP      HAT1   CAT    .      .
 ZOP      HAT2   CAT    .      .
 ZOP      CAX    CAT    HAX1   .
 ZOP      HAX3   CAX    .      .
 ZOP      HAX2   CAX    .      .
 ZOP      HAX1   CAX    .      .
 ZOP      CBF    C21    CBG    .
 ZOP      CBA    CBF    CBB    .
 ZOP      HBA    CBA    .      .
 ZOP      CBB    CBA    HBB    .
 ZOP      HBB    CBB    .      .
 ZOP      CBG    CBF    CBH    .
 ZOP      HBG    CBG    .      .
 ZOP      CBH    CBG    NBI    .
 ZOP      CBC    CBH    .      .
 ZOP      NBI    CBH    CBJ    .
 ZOP      HBI    NBI    .      .
 ZOP      CBJ    NBI    CBD    .
 ZOP      OBK    CBJ    .      .
 ZOP      CBD    CBJ    CAO    .
 ZOP      CAO    CBD    NAP    .
 ZOP      CAN    CAO    CAD    .
 ZOP      CAD    CAN    CAB    .
 ZOP      HAD    CAD    .      .
 ZOP      CAB    CAD    CAA    .
 ZOP      HAB    CAB    .      .
 ZOP      CAA    CAB    CAC    .
 ZOP      HAA    CAA    .      .
 ZOP      CAC    CAA    CAM    .
 ZOP      HAC    CAC    .      .
 ZOP      CAM    CAC    HAM    .
 ZOP      HAM    CAM    .      .
 ZOP      NAP    CAO    CAQ    .
 ZOP      HAP    NAP    .      .
 ZOP      CAQ    NAP    CAE    .
 ZOP      CAR    CAQ    CAS    .
 ZOP      HAR    CAR    .      .
 ZOP      CAS    CAR    HAS    .
 ZOP      HAS    CAS    .      .
 ZOP      CAE    CAQ    CAF    .
 ZOP      HAE    CAE    .      .
 ZOP      CAF    CAE    CAG    .
 ZOP      HAF    CAF    .      .
 ZOP      CAG    CAF    CAH    .
 ZOP      CAH    CAG    NAI    .
 ZOP      HAH1   CAH    .      .
 ZOP      HAH2   CAH    .      .
 ZOP      NAI    CAH    CAK    .
 ZOP      CAJ    NAI    HAJ1   .
 ZOP      HAJ2   CAJ    .      .
 ZOP      HAJ1   CAJ    .      .
 ZOP      CAK    NAI    CAV    .
 ZOP      HAK1   CAK    .      .
 ZOP      HAK2   CAK    .      .
 ZOP      CAV    CAK    CAW    .
 ZOP      HAV1   CAV    .      .
 ZOP      HAV2   CAV    .      .
 ZOP      CAW    CAV    CAL    .
 ZOP      HAW1   CAW    .      .
 ZOP      HAW2   CAW    .      .
 ZOP      CAL    CAW    HAL1   .
 ZOP      HAL2   CAL    .      .
 ZOP      HAL1   CAL    .      END
 ZOP      CAJ    CAL    .    ADD
 ZOP      CAG    CAS    .    ADD
 ZOP      CAN    CAM    .    ADD
 ZOP      CBD    CBC    .    ADD
 ZOP      CBC    CBB    .    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
 ZOP      CAJ    CAL       single      1.524    0.020
 ZOP      CAJ    NAI       single      1.469    0.020
 ZOP      CAL    CAW       single      1.524    0.020
 ZOP      CAW    CAV       single      1.524    0.020
 ZOP      CAV    CAK       single      1.524    0.020
 ZOP      CAK    NAI       single      1.469    0.020
 ZOP      NAI    CAH       single      1.469    0.020
 ZOP      CAH    CAG       single      1.511    0.020
 ZOP      CAG    CAS       single      1.390    0.020
 ZOP      CAG    CAF       double      1.390    0.020
 ZOP      CAS    CAR       double      1.390    0.020
 ZOP      CAR    CAQ       single      1.390    0.020
 ZOP      CAF    CAE       single      1.390    0.020
 ZOP      CAE    CAQ       double      1.390    0.020
 ZOP      CAQ    NAP       single      1.350    0.020
 ZOP      NAP    CAO       single      1.330    0.020
 ZOP      CAN    CAO       single      1.500    0.020
 ZOP      CAO    CBD       double      1.490    0.020
 ZOP      CAN    CAM       single      1.390    0.020
 ZOP      CAD    CAN       double      1.390    0.020
 ZOP      CAM    CAC       double      1.390    0.020
 ZOP      CAC    CAA       single      1.390    0.020
 ZOP      CAA    CAB       double      1.390    0.020
 ZOP      CAB    CAD       single      1.390    0.020
 ZOP      CBD    CBC       single      1.490    0.020
 ZOP      CBD    CBJ       single      1.490    0.020
 ZOP      CBC    CBB       single      1.390    0.020
 ZOP      CBC    CBH       double      1.490    0.020
 ZOP      CBB    CBA       double      1.390    0.020
 ZOP      OBK    CBJ       double      1.285    0.020
 ZOP      CBJ    NBI       single      1.340    0.020
 ZOP      NBI    CBH       single      1.340    0.020
 ZOP      CBH    CBG       single      1.390    0.020
 ZOP      CBG    CBF       double      1.390    0.020
 ZOP      CBA    CBF       single      1.390    0.020
 ZOP      CBF    C21       single      1.500    0.020
 ZOP      C21    OBE       double      1.220    0.020
 ZOP      CAX    CAT       single      1.513    0.020
 ZOP      CAT    N25       single      1.455    0.020
 ZOP      N25    C21       single      1.330    0.020
 ZOP      C29    N25       single      1.455    0.020
 ZOP      HAJ1   CAJ       single      1.092    0.020
 ZOP      HAJ2   CAJ       single      1.092    0.020
 ZOP      HAL1   CAL       single      1.092    0.020
 ZOP      HAL2   CAL       single      1.092    0.020
 ZOP      HAW1   CAW       single      1.092    0.020
 ZOP      HAW2   CAW       single      1.092    0.020
 ZOP      HAV1   CAV       single      1.092    0.020
 ZOP      HAV2   CAV       single      1.092    0.020
 ZOP      HAK1   CAK       single      1.092    0.020
 ZOP      HAK2   CAK       single      1.092    0.020
 ZOP      HAH1   CAH       single      1.092    0.020
 ZOP      HAH2   CAH       single      1.092    0.020
 ZOP      HAS    CAS       single      1.083    0.020
 ZOP      HAF    CAF       single      1.083    0.020
 ZOP      HAR    CAR       single      1.083    0.020
 ZOP      HAE    CAE       single      1.083    0.020
 ZOP      HAM    CAM       single      1.083    0.020
 ZOP      HAD    CAD       single      1.083    0.020
 ZOP      HAC    CAC       single      1.083    0.020
 ZOP      HAA    CAA       single      1.083    0.020
 ZOP      HAB    CAB       single      1.083    0.020
 ZOP      HBB    CBB       single      1.083    0.020
 ZOP      HBA    CBA       single      1.083    0.020
 ZOP      HBI    NBI       single      1.040    0.020
 ZOP      HBG    CBG       single      1.083    0.020
 ZOP      HAX1   CAX       single      1.059    0.020
 ZOP      HAX2   CAX       single      1.059    0.020
 ZOP      HAX3   CAX       single      1.059    0.020
 ZOP      HAT1   CAT       single      1.092    0.020
 ZOP      HAT2   CAT       single      1.092    0.020
 ZOP      H291   C29       single      1.059    0.020
 ZOP      H292   C29       single      1.059    0.020
 ZOP      H293   C29       single      1.059    0.020
 ZOP      HAP    NAP       single      1.010    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
 ZOP      OBE    C21    N25     123.000    3.000
 ZOP      OBE    C21    CBF     120.500    3.000
 ZOP      N25    C21    CBF     120.000    3.000
 ZOP      C21    N25    C29     127.000    3.000
 ZOP      C21    N25    CAT     127.000    3.000
 ZOP      C29    N25    CAT     120.000    3.000
 ZOP      N25    C29    H293    109.470    3.000
 ZOP      N25    C29    H292    109.470    3.000
 ZOP      N25    C29    H291    109.470    3.000
 ZOP      H293   C29    H292    109.470    3.000
 ZOP      H293   C29    H291    109.470    3.000
 ZOP      H292   C29    H291    109.470    3.000
 ZOP      N25    CAT    HAT1    109.470    3.000
 ZOP      N25    CAT    HAT2    109.470    3.000
 ZOP      N25    CAT    CAX     109.500    3.000
 ZOP      HAT1   CAT    HAT2    107.900    3.000
 ZOP      HAT1   CAT    CAX     109.470    3.000
 ZOP      HAT2   CAT    CAX     109.470    3.000
 ZOP      CAT    CAX    HAX3    109.470    3.000
 ZOP      CAT    CAX    HAX2    109.470    3.000
 ZOP      CAT    CAX    HAX1    109.470    3.000
 ZOP      HAX3   CAX    HAX2    109.470    3.000
 ZOP      HAX3   CAX    HAX1    109.470    3.000
 ZOP      HAX2   CAX    HAX1    109.470    3.000
 ZOP      C21    CBF    CBA     120.000    3.000
 ZOP      C21    CBF    CBG     120.000    3.000
 ZOP      CBA    CBF    CBG     120.000    3.000
 ZOP      CBF    CBA    HBA     120.000    3.000
 ZOP      CBF    CBA    CBB     120.000    3.000
 ZOP      HBA    CBA    CBB     120.000    3.000
 ZOP      CBA    CBB    HBB     120.000    3.000
 ZOP      CBA    CBB    CBC     120.000    3.000
 ZOP      HBB    CBB    CBC     120.000    3.000
 ZOP      CBF    CBG    HBG     120.000    3.000
 ZOP      CBF    CBG    CBH     120.000    3.000
 ZOP      HBG    CBG    CBH     120.000    3.000
 ZOP      CBG    CBH    CBC     120.000    3.000
 ZOP      CBG    CBH    NBI     132.000    3.000
 ZOP      CBC    CBH    NBI     108.000    3.000
 ZOP      CBH    CBC    CBD     108.000    3.000
 ZOP      CBH    CBC    CBB     120.000    3.000
 ZOP      CBD    CBC    CBB     126.000    3.000
 ZOP      CBH    NBI    HBI     126.000    3.000
 ZOP      CBH    NBI    CBJ     108.000    3.000
 ZOP      HBI    NBI    CBJ     126.000    3.000
 ZOP      NBI    CBJ    OBK     108.000    3.000
 ZOP      NBI    CBJ    CBD     108.000    3.000
 ZOP      OBK    CBJ    CBD     108.000    3.000
 ZOP      CBJ    CBD    CAO     117.000    3.000
 ZOP      CBJ    CBD    CBC     108.000    3.000
 ZOP      CAO    CBD    CBC     108.000    3.000
 ZOP      CBD    CAO    CAN     120.000    3.000
 ZOP      CBD    CAO    NAP     120.000    3.000
 ZOP      CAN    CAO    NAP     120.000    3.000
 ZOP      CAO    CAN    CAD     120.000    3.000
 ZOP      CAO    CAN    CAM     120.000    3.000
 ZOP      CAD    CAN    CAM     120.000    3.000
 ZOP      CAN    CAD    HAD     120.000    3.000
 ZOP      CAN    CAD    CAB     120.000    3.000
 ZOP      HAD    CAD    CAB     120.000    3.000
 ZOP      CAD    CAB    HAB     120.000    3.000
 ZOP      CAD    CAB    CAA     120.000    3.000
 ZOP      HAB    CAB    CAA     120.000    3.000
 ZOP      CAB    CAA    HAA     120.000    3.000
 ZOP      CAB    CAA    CAC     120.000    3.000
 ZOP      HAA    CAA    CAC     120.000    3.000
 ZOP      CAA    CAC    HAC     120.000    3.000
 ZOP      CAA    CAC    CAM     120.000    3.000
 ZOP      HAC    CAC    CAM     120.000    3.000
 ZOP      CAC    CAM    HAM     120.000    3.000
 ZOP      CAC    CAM    CAN     120.000    3.000
 ZOP      HAM    CAM    CAN     120.000    3.000
 ZOP      CAO    NAP    HAP     120.000    3.000
 ZOP      CAO    NAP    CAQ     120.000    3.000
 ZOP      HAP    NAP    CAQ     120.000    3.000
 ZOP      NAP    CAQ    CAR     120.000    3.000
 ZOP      NAP    CAQ    CAE     120.000    3.000
 ZOP      CAR    CAQ    CAE     120.000    3.000
 ZOP      CAQ    CAR    HAR     120.000    3.000
 ZOP      CAQ    CAR    CAS     120.000    3.000
 ZOP      HAR    CAR    CAS     120.000    3.000
 ZOP      CAR    CAS    HAS     120.000    3.000
 ZOP      CAR    CAS    CAG     120.000    3.000
 ZOP      HAS    CAS    CAG     120.000    3.000
 ZOP      CAQ    CAE    HAE     120.000    3.000
 ZOP      CAQ    CAE    CAF     120.000    3.000
 ZOP      HAE    CAE    CAF     120.000    3.000
 ZOP      CAE    CAF    HAF     120.000    3.000
 ZOP      CAE    CAF    CAG     120.000    3.000
 ZOP      HAF    CAF    CAG     120.000    3.000
 ZOP      CAF    CAG    CAH     120.000    3.000
 ZOP      CAF    CAG    CAS     120.000    3.000
 ZOP      CAH    CAG    CAS     120.000    3.000
 ZOP      CAG    CAH    HAH1    109.470    3.000
 ZOP      CAG    CAH    HAH2    109.470    3.000
 ZOP      CAG    CAH    NAI     109.500    3.000
 ZOP      HAH1   CAH    HAH2    107.900    3.000
 ZOP      HAH1   CAH    NAI     109.470    3.000
 ZOP      HAH2   CAH    NAI     109.470    3.000
 ZOP      CAH    NAI    CAJ     109.470    3.000
 ZOP      CAH    NAI    CAK     109.470    3.000
 ZOP      CAJ    NAI    CAK     109.470    3.000
 ZOP      NAI    CAJ    HAJ2    109.470    3.000
 ZOP      NAI    CAJ    HAJ1    109.470    3.000
 ZOP      NAI    CAJ    CAL     109.470    3.000
 ZOP      HAJ2   CAJ    HAJ1    107.900    3.000
 ZOP      HAJ2   CAJ    CAL     109.470    3.000
 ZOP      HAJ1   CAJ    CAL     109.470    3.000
 ZOP      NAI    CAK    HAK1    109.470    3.000
 ZOP      NAI    CAK    HAK2    109.470    3.000
 ZOP      NAI    CAK    CAV     109.470    3.000
 ZOP      HAK1   CAK    HAK2    107.900    3.000
 ZOP      HAK1   CAK    CAV     109.470    3.000
 ZOP      HAK2   CAK    CAV     109.470    3.000
 ZOP      CAK    CAV    HAV1    109.470    3.000
 ZOP      CAK    CAV    HAV2    109.470    3.000
 ZOP      CAK    CAV    CAW     111.000    3.000
 ZOP      HAV1   CAV    HAV2    107.900    3.000
 ZOP      HAV1   CAV    CAW     109.470    3.000
 ZOP      HAV2   CAV    CAW     109.470    3.000
 ZOP      CAV    CAW    HAW1    109.470    3.000
 ZOP      CAV    CAW    HAW2    109.470    3.000
 ZOP      CAV    CAW    CAL     111.000    3.000
 ZOP      HAW1   CAW    HAW2    107.900    3.000
 ZOP      HAW1   CAW    CAL     109.470    3.000
 ZOP      HAW2   CAW    CAL     109.470    3.000
 ZOP      CAW    CAL    HAL2    109.470    3.000
 ZOP      CAW    CAL    HAL1    109.470    3.000
 ZOP      CAW    CAL    CAJ     111.000    3.000
 ZOP      HAL2   CAL    HAL1    107.900    3.000
 ZOP      HAL2   CAL    CAJ     109.470    3.000
 ZOP      HAL1   CAL    CAJ     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
 ZOP      CONST_1  OBE    C21    N25    CAT        0.000    0.000   0
 ZOP      var_1    C21    N25    C29    H291     -90.693   20.000   1
 ZOP      var_2    C21    N25    CAT    CAX       89.964   20.000   1
 ZOP      var_3    N25    CAT    CAX    HAX1    -179.984   20.000   3
 ZOP      var_4    OBE    C21    CBF    CBG     -146.084   20.000   1
 ZOP      CONST_2  C21    CBF    CBA    CBB      180.000    0.000   0
 ZOP      CONST_3  CBF    CBA    CBB    CBC        0.000    0.000   0
 ZOP      CONST_4  C21    CBF    CBG    CBH      180.000    0.000   0
 ZOP      CONST_5  CBF    CBG    CBH    NBI      180.000    0.000   0
 ZOP      CONST_6  CBG    CBH    CBC    CBD      180.000    0.000   0
 ZOP      CONST_7  CBH    CBC    CBB    CBA        0.000    0.000   0
 ZOP      CONST_8  CBG    CBH    NBI    CBJ      180.000    0.000   0
 ZOP      CONST_9  CBH    NBI    CBJ    CBD        0.000    0.000   0
 ZOP      CONST_10 NBI    CBJ    CBD    CAO      180.000    0.000   0
 ZOP      CONST_11 CBJ    CBD    CBC    CBH        0.000    0.000   0
 ZOP      CONST_12 CBJ    CBD    CAO    NAP       -7.139    0.000   0
 ZOP      var_5    CBD    CAO    CAN    CAD      -52.932   20.000   1
 ZOP      CONST_13 CAO    CAN    CAM    CAC      180.000    0.000   0
 ZOP      CONST_14 CAO    CAN    CAD    CAB      180.000    0.000   0
 ZOP      CONST_15 CAN    CAD    CAB    CAA        0.000    0.000   0
 ZOP      CONST_16 CAD    CAB    CAA    CAC        0.000    0.000   0
 ZOP      CONST_17 CAB    CAA    CAC    CAM        0.000    0.000   0
 ZOP      CONST_18 CAA    CAC    CAM    CAN        0.000    0.000   0
 ZOP      CONST_19 CBD    CAO    NAP    CAQ      180.000    0.000   0
 ZOP      var_6    CAO    NAP    CAQ    CAE       -7.241   20.000   1
 ZOP      CONST_20 NAP    CAQ    CAR    CAS      180.000    0.000   0
 ZOP      CONST_21 CAQ    CAR    CAS    CAG        0.000    0.000   0
 ZOP      CONST_22 NAP    CAQ    CAE    CAF      180.000    0.000   0
 ZOP      CONST_23 CAQ    CAE    CAF    CAG        0.000    0.000   0
 ZOP      CONST_24 CAE    CAF    CAG    CAH      180.000    0.000   0
 ZOP      CONST_25 CAF    CAG    CAS    CAR        0.000    0.000   0
 ZOP      var_7    CAF    CAG    CAH    NAI      -90.295   20.000   2
 ZOP      var_8    CAG    CAH    NAI    CAK      -65.787   20.000   1
 ZOP      var_9    CAH    NAI    CAJ    CAL      180.000   20.000   1
 ZOP      var_10   NAI    CAJ    CAL    CAW      -60.000   20.000   3
 ZOP      var_11   CAH    NAI    CAK    CAV      180.000   20.000   1
 ZOP      var_12   NAI    CAK    CAV    CAW       60.000   20.000   3
 ZOP      var_13   CAK    CAV    CAW    CAL      -60.000   20.000   3
 ZOP      var_14   CAV    CAW    CAL    CAJ       60.000   20.000   3
loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
 ZOP      chir_01  NAI    CAJ    CAK    CAH       negativ
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
 ZOP      plan-1    CAG       0.020
 ZOP      plan-1    CAH       0.020
 ZOP      plan-1    CAS       0.020
 ZOP      plan-1    CAF       0.020
 ZOP      plan-1    CAR       0.020
 ZOP      plan-1    CAE       0.020
 ZOP      plan-1    CAQ       0.020
 ZOP      plan-1    HAS       0.020
 ZOP      plan-1    HAR       0.020
 ZOP      plan-1    HAF       0.020
 ZOP      plan-1    HAE       0.020
 ZOP      plan-1    NAP       0.020
 ZOP      plan-1    HAP       0.020
 ZOP      plan-2    NAP       0.020
 ZOP      plan-2    CAQ       0.020
 ZOP      plan-2    CAO       0.020
 ZOP      plan-2    HAP       0.020
 ZOP      plan-3    CAO       0.020
 ZOP      plan-3    NAP       0.020
 ZOP      plan-3    CAN       0.020
 ZOP      plan-3    CBD       0.020
 ZOP      plan-3    CBC       0.020
 ZOP      plan-3    CBJ       0.020
 ZOP      plan-3    NBI       0.020
 ZOP      plan-3    CBB       0.020
 ZOP      plan-3    CBH       0.020
 ZOP      plan-3    CBG       0.020
 ZOP      plan-3    CBF       0.020
 ZOP      plan-3    CBA       0.020
 ZOP      plan-3    HBB       0.020
 ZOP      plan-3    OBK       0.020
 ZOP      plan-3    HBI       0.020
 ZOP      plan-3    HBG       0.020
 ZOP      plan-3    C21       0.020
 ZOP      plan-3    HBA       0.020
 ZOP      plan-3    HAP       0.020
 ZOP      plan-4    CAN       0.020
 ZOP      plan-4    CAO       0.020
 ZOP      plan-4    CAM       0.020
 ZOP      plan-4    CAD       0.020
 ZOP      plan-4    CAC       0.020
 ZOP      plan-4    CAA       0.020
 ZOP      plan-4    CAB       0.020
 ZOP      plan-4    HAM       0.020
 ZOP      plan-4    HAC       0.020
 ZOP      plan-4    HAA       0.020
 ZOP      plan-4    HAB       0.020
 ZOP      plan-4    HAD       0.020
 ZOP      plan-5    C21       0.020
 ZOP      plan-5    CBF       0.020
 ZOP      plan-5    OBE       0.020
 ZOP      plan-5    N25       0.020
 ZOP      plan-6    N25       0.020
 ZOP      plan-6    CAT       0.020
 ZOP      plan-6    C21       0.020
 ZOP      plan-6    C29       0.020
# ------------------------------------------------------
