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
LG8      LG8 '3-(8-DIMETHYLAMINOMETHYL-6,7,8,9-TET' non-polymer        62  34 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_LG8
#
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
 LG8           OAB    O    O         0.000      0.000    0.000    0.000
 LG8           CAC    C    CR5       0.000     -1.205   -0.176   -0.008
 LG8           NAD    N    NR15      0.000     -1.901   -1.372   -0.052
 LG8           HAD    H    H         0.000     -1.423   -2.295   -0.085
 LG8           CAE    C    CR5       0.000     -3.281   -1.248   -0.048
 LG8           OAF    O    O         0.000     -4.121   -2.128   -0.080
 LG8           CAG    C    CR5       0.000     -2.255    0.880    0.030
 LG8           CAL    C    CR5       0.000     -1.961    2.181    0.078
 LG8           CAK    C    CR56      0.000     -0.679    2.867    0.104
 LG8           CAS    C    CR56      0.000     -0.994    4.239    0.155
 LG8           CAR    C    CR16      0.000     -0.010    5.211    0.192
 LG8           HAR    H    H         0.000     -0.259    6.264    0.231
 LG8           CAQ    C    CR16      0.000      1.319    4.778    0.176
 LG8           HAQ    H    H         0.000      2.117    5.510    0.203
 LG8           CAI    C    CR16      0.000      1.637    3.407    0.125
 LG8           HAI    H    H         0.000      2.676    3.101    0.114
 LG8           CAJ    C    CR16      0.000      0.632    2.435    0.089
 LG8           HAJ    H    H         0.000      0.874    1.380    0.050
 LG8           NAT    N    NR5       1.000     -2.401    4.425    0.162
 LG8           CBA    C    CH3       0.000     -3.016    5.749    0.211
 LG8           HBA3   H    H         0.000     -2.593    6.298    1.009
 LG8           HBA2   H    H         0.000     -2.837    6.249   -0.702
 LG8           HBA1   H    H         0.000     -4.057    5.642    0.362
 LG8           CAU    C    CR15      0.000     -2.963    3.261    0.119
 LG8           HAU    H    H         0.000     -4.035    3.101    0.113
 LG8           CAH    C    CR5       0.000     -3.535    0.219    0.006
 LG8           CAM    C    CR5       0.000     -4.765    0.731    0.025
 LG8           CAN    C    CR56      0.000     -6.054    0.049    0.000
 LG8           CAO    C    CR16      0.000     -6.422   -1.281   -0.070
 LG8           HAO    H    H         0.000     -5.677   -2.066   -0.113
 LG8           CAP    C    CR16      0.000     -7.787   -1.579   -0.083
 LG8           HAP    H    H         0.000     -8.107   -2.613   -0.136
 LG8           CAZ    C    CR16      0.000     -8.753   -0.557   -0.027
 LG8           HAZ    H    H         0.000     -9.804   -0.816   -0.039
 LG8           CAY    C    CR16      0.000     -8.377    0.787    0.042
 LG8           HAY    H    H         0.000     -9.117    1.577    0.083
 LG8           CAX    C    CR56      0.000     -7.023    1.069    0.058
 LG8           NAW    N    NR5       1.000     -6.400    2.340    0.124
 LG8           CBB    C    CH2       0.000     -7.155    3.598    0.175
 LG8           HBB2   H    H         0.000     -7.949    3.515    0.920
 LG8           HBB1   H    H         0.000     -7.595    3.796   -0.804
 LG8           CAV    C    CR5       0.000     -5.119    2.163    0.087
 LG8           C6     C    CH2       0.000     -4.183    3.329    0.151
 LG8           H6C1   H    H         0.000     -3.368    3.148   -0.553
 LG8           H6C2   H    H         0.000     -3.781    3.386    1.164
 LG8           CBF    C    CH1       0.000     -4.882    4.651   -0.200
 LG8           HBF    H    H         0.000     -5.090    4.659   -1.279
 LG8           CBD    C    CH2       0.000     -6.217    4.744    0.554
 LG8           HBD2   H    H         0.000     -6.688    5.698    0.307
 LG8           HBD1   H    H         0.000     -6.011    4.708    1.626
 LG8           CBG    C    CH2       0.000     -3.983    5.840    0.128
 LG8           HBG1   H    H         0.000     -3.055    5.758   -0.441
 LG8           HBG2   H    H         0.000     -3.755    5.835    1.196
 LG8           NBH    N    NT        0.000     -4.645    7.055   -0.213
 LG8           CBI    C    CH3       0.000     -3.838    8.239    0.143
 LG8           HBI3   H    H         0.000     -2.939    7.928    0.609
 LG8           HBI2   H    H         0.000     -3.609    8.788   -0.734
 LG8           HBI1   H    H         0.000     -4.385    8.854    0.810
 LG8           CBJ    C    CH3       0.000     -4.978    7.115   -1.649
 LG8           HBJ3   H    H         0.000     -5.120    8.124   -1.938
 LG8           HBJ2   H    H         0.000     -4.187    6.695   -2.214
 LG8           HBJ1   H    H         0.000     -5.868    6.569   -1.830
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
 LG8      OAB    n/a    CAC    START
 LG8      CAC    OAB    CAG    .
 LG8      NAD    CAC    CAE    .
 LG8      HAD    NAD    .      .
 LG8      CAE    NAD    OAF    .
 LG8      OAF    CAE    .      .
 LG8      CAG    CAC    CAH    .
 LG8      CAL    CAG    CAK    .
 LG8      CAK    CAL    CAS    .
 LG8      CAS    CAK    NAT    .
 LG8      CAR    CAS    CAQ    .
 LG8      HAR    CAR    .      .
 LG8      CAQ    CAR    CAI    .
 LG8      HAQ    CAQ    .      .
 LG8      CAI    CAQ    CAJ    .
 LG8      HAI    CAI    .      .
 LG8      CAJ    CAI    HAJ    .
 LG8      HAJ    CAJ    .      .
 LG8      NAT    CAS    CAU    .
 LG8      CBA    NAT    HBA1   .
 LG8      HBA3   CBA    .      .
 LG8      HBA2   CBA    .      .
 LG8      HBA1   CBA    .      .
 LG8      CAU    NAT    HAU    .
 LG8      HAU    CAU    .      .
 LG8      CAH    CAG    CAM    .
 LG8      CAM    CAH    CAV    .
 LG8      CAN    CAM    CAX    .
 LG8      CAO    CAN    CAP    .
 LG8      HAO    CAO    .      .
 LG8      CAP    CAO    CAZ    .
 LG8      HAP    CAP    .      .
 LG8      CAZ    CAP    CAY    .
 LG8      HAZ    CAZ    .      .
 LG8      CAY    CAZ    HAY    .
 LG8      HAY    CAY    .      .
 LG8      CAX    CAN    NAW    .
 LG8      NAW    CAX    CBB    .
 LG8      CBB    NAW    HBB1   .
 LG8      HBB2   CBB    .      .
 LG8      HBB1   CBB    .      .
 LG8      CAV    CAM    C6     .
 LG8      C6     CAV    CBF    .
 LG8      H6C1   C6     .      .
 LG8      H6C2   C6     .      .
 LG8      CBF    C6     CBG    .
 LG8      HBF    CBF    .      .
 LG8      CBD    CBF    HBD1   .
 LG8      HBD2   CBD    .      .
 LG8      HBD1   CBD    .      .
 LG8      CBG    CBF    NBH    .
 LG8      HBG1   CBG    .      .
 LG8      HBG2   CBG    .      .
 LG8      NBH    CBG    CBJ    .
 LG8      CBI    NBH    HBI1   .
 LG8      HBI3   CBI    .      .
 LG8      HBI2   CBI    .      .
 LG8      HBI1   CBI    .      .
 LG8      CBJ    NBH    HBJ1   .
 LG8      HBJ3   CBJ    .      .
 LG8      HBJ2   CBJ    .      .
 LG8      HBJ1   CBJ    .      END
 LG8      CBD    CBB    .    ADD
 LG8      NAW    CAV    .    ADD
 LG8      CAX    CAY    .    ADD
 LG8      CAH    CAE    .    ADD
 LG8      CAL    CAU    .    ADD
 LG8      CAK    CAJ    .    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
 LG8      CBD    CBB       single      1.524    0.020
 LG8      CBD    CBF       single      1.524    0.020
 LG8      HBD1   CBD       single      1.092    0.020
 LG8      HBD2   CBD       single      1.092    0.020
 LG8      CBB    NAW       single      1.462    0.020
 LG8      HBB1   CBB       single      1.092    0.020
 LG8      HBB2   CBB       single      1.092    0.020
 LG8      NAW    CAV       double      1.337    0.020
 LG8      NAW    CAX       single      1.337    0.020
 LG8      CAV    CAM       single      1.490    0.020
 LG8      C6     CAV       single      1.510    0.020
 LG8      CAX    CAY       single      1.390    0.020
 LG8      CAX    CAN       double      1.490    0.020
 LG8      CAY    CAZ       double      1.390    0.020
 LG8      HAY    CAY       single      1.083    0.020
 LG8      CAZ    CAP       single      1.390    0.020
 LG8      HAZ    CAZ       single      1.083    0.020
 LG8      CAP    CAO       double      1.390    0.020
 LG8      HAP    CAP       single      1.083    0.020
 LG8      CAO    CAN       single      1.390    0.020
 LG8      HAO    CAO       single      1.083    0.020
 LG8      CAN    CAM       single      1.490    0.020
 LG8      CAM    CAH       double      1.490    0.020
 LG8      CAH    CAE       single      1.490    0.020
 LG8      CAH    CAG       single      1.490    0.020
 LG8      OAF    CAE       double      1.285    0.020
 LG8      CAE    NAD       single      1.340    0.020
 LG8      NAD    CAC       single      1.340    0.020
 LG8      HAD    NAD       single      1.040    0.020
 LG8      CAC    OAB       double      1.285    0.020
 LG8      CAG    CAC       single      1.490    0.020
 LG8      CAL    CAG       double      1.490    0.020
 LG8      CAL    CAU       single      1.387    0.020
 LG8      CAK    CAL       single      1.490    0.020
 LG8      CAU    NAT       double      1.337    0.020
 LG8      HAU    CAU       single      1.083    0.020
 LG8      CAK    CAJ       single      1.390    0.020
 LG8      CAS    CAK       double      1.490    0.020
 LG8      CAJ    CAI       double      1.390    0.020
 LG8      HAJ    CAJ       single      1.083    0.020
 LG8      CAI    CAQ       single      1.390    0.020
 LG8      HAI    CAI       single      1.083    0.020
 LG8      CAQ    CAR       double      1.390    0.020
 LG8      HAQ    CAQ       single      1.083    0.020
 LG8      CAR    CAS       single      1.390    0.020
 LG8      HAR    CAR       single      1.083    0.020
 LG8      NAT    CAS       single      1.337    0.020
 LG8      CBA    NAT       single      1.485    0.020
 LG8      HBA1   CBA       single      1.059    0.020
 LG8      HBA2   CBA       single      1.059    0.020
 LG8      HBA3   CBA       single      1.059    0.020
 LG8      CBG    CBF       single      1.524    0.020
 LG8      CBF    C6        single      1.524    0.020
 LG8      HBF    CBF       single      1.099    0.020
 LG8      NBH    CBG       single      1.469    0.020
 LG8      HBG1   CBG       single      1.092    0.020
 LG8      HBG2   CBG       single      1.092    0.020
 LG8      CBI    NBH       single      1.469    0.020
 LG8      CBJ    NBH       single      1.469    0.020
 LG8      H6C1   C6        single      1.092    0.020
 LG8      H6C2   C6        single      1.092    0.020
 LG8      HBI1   CBI       single      1.059    0.020
 LG8      HBI2   CBI       single      1.059    0.020
 LG8      HBI3   CBI       single      1.059    0.020
 LG8      HBJ1   CBJ       single      1.059    0.020
 LG8      HBJ2   CBJ       single      1.059    0.020
 LG8      HBJ3   CBJ       single      1.059    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
 LG8      OAB    CAC    NAD     108.000    3.000
 LG8      OAB    CAC    CAG     108.000    3.000
 LG8      NAD    CAC    CAG     108.000    3.000
 LG8      CAC    NAD    HAD     126.000    3.000
 LG8      CAC    NAD    CAE     108.000    3.000
 LG8      HAD    NAD    CAE     126.000    3.000
 LG8      NAD    CAE    OAF     108.000    3.000
 LG8      NAD    CAE    CAH     108.000    3.000
 LG8      OAF    CAE    CAH     108.000    3.000
 LG8      CAC    CAG    CAL     108.000    3.000
 LG8      CAC    CAG    CAH     108.000    3.000
 LG8      CAL    CAG    CAH     108.000    3.000
 LG8      CAG    CAL    CAK     108.000    3.000
 LG8      CAG    CAL    CAU     108.000    3.000
 LG8      CAK    CAL    CAU     108.000    3.000
 LG8      CAL    CAK    CAS     108.000    3.000
 LG8      CAL    CAK    CAJ     126.000    3.000
 LG8      CAS    CAK    CAJ     120.000    3.000
 LG8      CAK    CAS    CAR     120.000    3.000
 LG8      CAK    CAS    NAT     108.000    3.000
 LG8      CAR    CAS    NAT     132.000    3.000
 LG8      CAS    CAR    HAR     120.000    3.000
 LG8      CAS    CAR    CAQ     120.000    3.000
 LG8      HAR    CAR    CAQ     120.000    3.000
 LG8      CAR    CAQ    HAQ     120.000    3.000
 LG8      CAR    CAQ    CAI     120.000    3.000
 LG8      HAQ    CAQ    CAI     120.000    3.000
 LG8      CAQ    CAI    HAI     120.000    3.000
 LG8      CAQ    CAI    CAJ     120.000    3.000
 LG8      HAI    CAI    CAJ     120.000    3.000
 LG8      CAI    CAJ    HAJ     120.000    3.000
 LG8      CAI    CAJ    CAK     120.000    3.000
 LG8      HAJ    CAJ    CAK     120.000    3.000
 LG8      CAS    NAT    CBA     126.000    3.000
 LG8      CAS    NAT    CAU     108.000    3.000
 LG8      CBA    NAT    CAU     126.000    3.000
 LG8      NAT    CBA    HBA3    109.470    3.000
 LG8      NAT    CBA    HBA2    109.470    3.000
 LG8      NAT    CBA    HBA1    109.470    3.000
 LG8      HBA3   CBA    HBA2    109.470    3.000
 LG8      HBA3   CBA    HBA1    109.470    3.000
 LG8      HBA2   CBA    HBA1    109.470    3.000
 LG8      NAT    CAU    HAU     126.000    3.000
 LG8      NAT    CAU    CAL     108.000    3.000
 LG8      HAU    CAU    CAL     126.000    3.000
 LG8      CAG    CAH    CAM     108.000    3.000
 LG8      CAG    CAH    CAE     108.000    3.000
 LG8      CAM    CAH    CAE     108.000    3.000
 LG8      CAH    CAM    CAN     108.000    3.000
 LG8      CAH    CAM    CAV     108.000    3.000
 LG8      CAN    CAM    CAV     108.000    3.000
 LG8      CAM    CAN    CAO     126.000    3.000
 LG8      CAM    CAN    CAX     108.000    3.000
 LG8      CAO    CAN    CAX     120.000    3.000
 LG8      CAN    CAO    HAO     120.000    3.000
 LG8      CAN    CAO    CAP     120.000    3.000
 LG8      HAO    CAO    CAP     120.000    3.000
 LG8      CAO    CAP    HAP     120.000    3.000
 LG8      CAO    CAP    CAZ     120.000    3.000
 LG8      HAP    CAP    CAZ     120.000    3.000
 LG8      CAP    CAZ    HAZ     120.000    3.000
 LG8      CAP    CAZ    CAY     120.000    3.000
 LG8      HAZ    CAZ    CAY     120.000    3.000
 LG8      CAZ    CAY    HAY     120.000    3.000
 LG8      CAZ    CAY    CAX     120.000    3.000
 LG8      HAY    CAY    CAX     120.000    3.000
 LG8      CAN    CAX    NAW     108.000    3.000
 LG8      CAN    CAX    CAY     120.000    3.000
 LG8      NAW    CAX    CAY     132.000    3.000
 LG8      CAX    NAW    CBB     126.000    3.000
 LG8      CAX    NAW    CAV     108.000    3.000
 LG8      CBB    NAW    CAV     126.000    3.000
 LG8      NAW    CBB    HBB2    109.500    3.000
 LG8      NAW    CBB    HBB1    109.500    3.000
 LG8      NAW    CBB    CBD     109.500    3.000
 LG8      HBB2   CBB    HBB1    107.900    3.000
 LG8      HBB2   CBB    CBD     109.470    3.000
 LG8      HBB1   CBB    CBD     109.470    3.000
 LG8      CAM    CAV    C6      126.000    3.000
 LG8      CAM    CAV    NAW     108.000    3.000
 LG8      C6     CAV    NAW     126.000    3.000
 LG8      CAV    C6     H6C1    109.470    3.000
 LG8      CAV    C6     H6C2    109.470    3.000
 LG8      CAV    C6     CBF     109.470    3.000
 LG8      H6C1   C6     H6C2    107.900    3.000
 LG8      H6C1   C6     CBF     109.470    3.000
 LG8      H6C2   C6     CBF     109.470    3.000
 LG8      C6     CBF    HBF     108.340    3.000
 LG8      C6     CBF    CBD     109.470    3.000
 LG8      C6     CBF    CBG     109.470    3.000
 LG8      HBF    CBF    CBD     108.340    3.000
 LG8      HBF    CBF    CBG     108.340    3.000
 LG8      CBD    CBF    CBG     109.470    3.000
 LG8      CBF    CBD    HBD2    109.470    3.000
 LG8      CBF    CBD    HBD1    109.470    3.000
 LG8      CBF    CBD    CBB     111.000    3.000
 LG8      HBD2   CBD    HBD1    107.900    3.000
 LG8      HBD2   CBD    CBB     109.470    3.000
 LG8      HBD1   CBD    CBB     109.470    3.000
 LG8      CBF    CBG    HBG1    109.470    3.000
 LG8      CBF    CBG    HBG2    109.470    3.000
 LG8      CBF    CBG    NBH     109.500    3.000
 LG8      HBG1   CBG    HBG2    107.900    3.000
 LG8      HBG1   CBG    NBH     109.470    3.000
 LG8      HBG2   CBG    NBH     109.470    3.000
 LG8      CBG    NBH    CBI     109.470    3.000
 LG8      CBG    NBH    CBJ     109.470    3.000
 LG8      CBI    NBH    CBJ     109.470    3.000
 LG8      NBH    CBI    HBI3    109.470    3.000
 LG8      NBH    CBI    HBI2    109.470    3.000
 LG8      NBH    CBI    HBI1    109.470    3.000
 LG8      HBI3   CBI    HBI2    109.470    3.000
 LG8      HBI3   CBI    HBI1    109.470    3.000
 LG8      HBI2   CBI    HBI1    109.470    3.000
 LG8      NBH    CBJ    HBJ3    109.470    3.000
 LG8      NBH    CBJ    HBJ2    109.470    3.000
 LG8      NBH    CBJ    HBJ1    109.470    3.000
 LG8      HBJ3   CBJ    HBJ2    109.470    3.000
 LG8      HBJ3   CBJ    HBJ1    109.470    3.000
 LG8      HBJ2   CBJ    HBJ1    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
 LG8      CONST_1  OAB    CAC    NAD    CAE      180.000    0.000   0
 LG8      CONST_2  CAC    NAD    CAE    OAF      180.000    0.000   0
 LG8      CONST_3  OAB    CAC    CAG    CAH      180.000    0.000   0
 LG8      CONST_4  CAC    CAG    CAL    CAK        0.000    0.000   0
 LG8      CONST_5  CAG    CAL    CAU    NAT      180.000    0.000   0
 LG8      CONST_6  CAG    CAL    CAK    CAS      180.000    0.000   0
 LG8      CONST_7  CAL    CAK    CAJ    CAI      180.000    0.000   0
 LG8      CONST_8  CAL    CAK    CAS    NAT        0.000    0.000   0
 LG8      CONST_9  CAK    CAS    CAR    CAQ        0.000    0.000   0
 LG8      CONST_10 CAS    CAR    CAQ    CAI        0.000    0.000   0
 LG8      CONST_11 CAR    CAQ    CAI    CAJ        0.000    0.000   0
 LG8      CONST_12 CAQ    CAI    CAJ    CAK        0.000    0.000   0
 LG8      CONST_13 CAK    CAS    NAT    CAU        0.000    0.000   0
 LG8      var_1    CAS    NAT    CBA    HBA1    -171.062   20.000   1
 LG8      CONST_14 CAS    NAT    CAU    CAL        0.000    0.000   0
 LG8      CONST_15 CAC    CAG    CAH    CAM      180.000    0.000   0
 LG8      CONST_16 CAG    CAH    CAE    NAD        0.000    0.000   0
 LG8      CONST_17 CAG    CAH    CAM    CAV        0.000    0.000   0
 LG8      CONST_18 CAH    CAM    CAN    CAX      180.000    0.000   0
 LG8      CONST_19 CAM    CAN    CAO    CAP      180.000    0.000   0
 LG8      CONST_20 CAN    CAO    CAP    CAZ        0.000    0.000   0
 LG8      CONST_21 CAO    CAP    CAZ    CAY        0.000    0.000   0
 LG8      CONST_22 CAP    CAZ    CAY    CAX        0.000    0.000   0
 LG8      CONST_23 CAM    CAN    CAX    NAW        0.000    0.000   0
 LG8      CONST_24 CAN    CAX    CAY    CAZ        0.000    0.000   0
 LG8      CONST_25 CAN    CAX    NAW    CBB      180.000    0.000   0
 LG8      CONST_26 CAX    NAW    CAV    CAM        0.000    0.000   0
 LG8      var_2    CAX    NAW    CBB    CBD      180.000   20.000   1
 LG8      CONST_27 CAH    CAM    CAV    C6         0.000    0.000   0
 LG8      var_3    CAM    CAV    C6     CBF      150.000   20.000   2
 LG8      var_4    CAV    C6     CBF    CBG      180.000   20.000   3
 LG8      var_5    C6     CBF    CBD    CBB      -60.000   20.000   3
 LG8      var_6    CBF    CBD    CBB    NAW       30.000   20.000   3
 LG8      var_7    C6     CBF    CBG    NBH      179.640   20.000   3
 LG8      var_8    CBF    CBG    NBH    CBJ      -59.980   20.000   1
 LG8      var_9    CBG    NBH    CBI    HBI1    -121.728   20.000   1
 LG8      var_10   CBG    NBH    CBJ    HBJ1      81.272   20.000   1
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
 LG8      chir_01  CBF    CBD    CBG    C6        negativ
 LG8      chir_02  NBH    CBG    CBI    CBJ       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
 LG8      plan-1    NAW       0.020
 LG8      plan-1    CBB       0.020
 LG8      plan-1    CAV       0.020
 LG8      plan-1    CAX       0.020
 LG8      plan-1    CAM       0.020
 LG8      plan-1    C6        0.020
 LG8      plan-1    CAY       0.020
 LG8      plan-1    CAN       0.020
 LG8      plan-1    CAZ       0.020
 LG8      plan-1    CAP       0.020
 LG8      plan-1    CAO       0.020
 LG8      plan-1    HAY       0.020
 LG8      plan-1    HAZ       0.020
 LG8      plan-1    HAP       0.020
 LG8      plan-1    HAO       0.020
 LG8      plan-1    CAH       0.020
 LG8      plan-1    CAE       0.020
 LG8      plan-1    CAG       0.020
 LG8      plan-1    NAD       0.020
 LG8      plan-1    CAC       0.020
 LG8      plan-1    OAF       0.020
 LG8      plan-1    HAD       0.020
 LG8      plan-1    OAB       0.020
 LG8      plan-1    CAL       0.020
 LG8      plan-1    CAU       0.020
 LG8      plan-1    CAK       0.020
 LG8      plan-1    NAT       0.020
 LG8      plan-1    HAU       0.020
 LG8      plan-1    CAJ       0.020
 LG8      plan-1    CAS       0.020
 LG8      plan-1    CAI       0.020
 LG8      plan-1    CAQ       0.020
 LG8      plan-1    CAR       0.020
 LG8      plan-1    HAJ       0.020
 LG8      plan-1    HAI       0.020
 LG8      plan-1    HAQ       0.020
 LG8      plan-1    HAR       0.020
 LG8      plan-1    CBA       0.020
# ------------------------------------------------------
