# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Mon Apr 27 17:54:33 2020
#   Inital geometry file: a 153 line input string
#   Ligand name: 2-[4-[4-[[2-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxidanyl-4-(trifluoromethyl)phenyl]methoxy]phenyl]phenyl]ethanoic acid
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CC(C)(C)OC(=O)c1c(O)c(ccc1COc2ccc(cc2)c3ccc(CC(O)=O)cc3)C(F)(F)F
#
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
_chem_comp.initial_date
_chem_comp.modified_date
_chem_comp.source
 4KQ  4KQ  '2-[4-[4-[[2-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxidanyl-4-(trifluoromethyl)phenyl]methoxy]phenyl]phenyl]ethanoic acid'  ligand  61  36  .  2021-08-05  2021-08-05  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_4KQ
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
_chem_comp_atom.partial_charge
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 4KQ  C20  C  CR16  0  -0.303   -5.9660   0.9066  -1.1875
 4KQ  C24  C  CR16  0  -0.301   -5.8687  -0.3694   0.8331
 4KQ  C15  C  CR16  0  -0.299   -2.8982  -0.4701   0.3344
 4KQ  C17  C  CR16  0  -0.294   -3.1471   1.7389  -0.5297
 4KQ  C21  C  CR16  0  -0.278   -7.3387   0.7258  -1.2338
 4KQ  C23  C  CR16  0  -0.284   -7.2426  -0.5494   0.7823
 4KQ  C29  C  CR16  0  -0.329    2.9696   1.9663   0.0893
 4KQ  C30  C  CR16  0  -0.274    4.2881   2.3783   0.0293
 4KQ  C14  C  CR16  0  -0.359   -1.5182  -0.3161   0.3663
 4KQ  C18  C  CR16  0  -0.334   -1.7772   1.9108  -0.5035
 4KQ  C19  C  CR6   0   0.084   -5.2039   0.3616  -0.1524
 4KQ  C16  C  CR6   0   0.068   -3.7405   0.5435  -0.1122
 4KQ  C2   C  CR6   0  -0.101    3.7142  -0.2975   0.3370
 4KQ  C22  C  CR6   0   0.133   -7.9976  -0.0059  -0.2511
 4KQ  C10  C  CR6   0   0.073    2.6708   0.6191   0.2518
 4KQ  C31  C  CR6   0  -0.314    5.3368   1.4724   0.1283
 4KQ  C13  C  CR6   0   0.394   -0.9493   0.8812  -0.0560
 4KQ  C1   C  CR6   0   0.383    5.0446   0.1114   0.2811
 4KQ  C26  C  C     0   0.557  -10.2395   0.9510   0.3212
 4KQ  C6   C  CH3   0  -0.676    1.9638  -4.2112  -0.4863
 4KQ  C7   C  CH3   0  -0.671    4.3522  -4.6281   0.2258
 4KQ  C8   C  CH3   0  -0.658    3.8142  -4.1426  -2.1612
 4KQ  C25  C  CH2   0  -0.690   -9.4830  -0.1954  -0.3042
 4KQ  C11  C  CH2   0  -0.228    1.2543   0.1212   0.3487
 4KQ  C32  C  CT    0   1.056    6.7481   1.9645   0.1331
 4KQ  C5   C  CT    0   0.174    3.4296  -3.8656  -0.7148
 4KQ  O9   O  O     0  -0.431    3.0040  -2.2032   1.5604
 4KQ  O27  O  O     0  -0.434   -9.7381   1.9360   0.7985
 4KQ  O36  O  OH1   0  -0.606    5.9517  -0.8668   0.4239
 4KQ  O28  O  OH1   0  -0.593  -11.5509   0.7429   0.2808
 4KQ  O12  O  O2    0  -0.477    0.3769   1.1337  -0.0714
 4KQ  O4   O  O2    0  -0.450    3.6440  -2.4228  -0.5872
 4KQ  F33  F  F     0  -0.321    7.5393   1.2338  -0.6781
 4KQ  F34  F  F     0  -0.292    6.8510   3.2294  -0.2689
 4KQ  F35  F  F     0  -0.308    7.2982   1.8928   1.3536
 4KQ  H1   H  HCR6  0   0.253   -5.4796   1.4585  -1.9824
 4KQ  H2   H  HCR6  0   0.252   -5.3133  -0.7911   1.6617
 4KQ  H3   H  HCR6  0   0.259   -3.3134  -1.4193   0.6487
 4KQ  H4   H  HCR6  0   0.257   -3.7652   2.5618  -0.8669
 4KQ  H5   H  HCR6  0   0.254   -7.9009   1.1498  -2.0574
 4KQ  H6   H  HCR6  0   0.254   -7.7320  -1.1182   1.5642
 4KQ  H7   H  HCR6  0   0.268    2.1854   2.7037   0.0102
 4KQ  H8   H  HCR6  0   0.282    4.4917   3.4333  -0.0891
 4KQ  H9   H  HCR6  0   0.278   -0.9171  -1.1447   0.7152
 4KQ  H10  H  HCR6  0   0.268   -1.3397   2.8471  -0.8262
 4KQ  H11  H  HCH3  0   0.244    1.7999  -5.2512  -0.7697
 4KQ  H12  H  HCH3  0   0.249    1.6615  -4.1003   0.5527
 4KQ  H13  H  HCH3  0   0.239    1.3112  -3.5958  -1.1082
 4KQ  H14  H  HCH3  0   0.242    4.2715  -5.6942   0.0101
 4KQ  H15  H  HCH3  0   0.240    5.3928  -4.3379   0.0742
 4KQ  H16  H  HCH3  0   0.248    4.0974  -4.4832   1.2734
 4KQ  H17  H  HCH3  0   0.241    3.1864  -3.5839  -2.8566
 4KQ  H18  H  HCH3  0   0.241    4.8564  -3.8833  -2.3505
 4KQ  H19  H  HCH3  0   0.234    3.6888  -5.2037  -2.3755
 4KQ  H20  H  HCH2  0   0.305   -9.8257  -0.3021  -1.3377
 4KQ  H21  H  HCH2  0   0.304   -9.7801  -1.1179   0.2021
 4KQ  H22  H  HCH2  0   0.240    1.1307  -0.7710  -0.2786
 4KQ  H23  H  HCH2  0   0.265    1.0432  -0.1738   1.3833
 4KQ  H24  H  HOH1  0   0.484    6.8392  -0.6178   0.1451
 4KQ  H25  H  HOH1  0   0.481  -12.0180   1.4926   0.6791
 4KQ  C3   C  C     0   0.504    3.4225  -1.7565   0.5222

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
_chem_comp_bond.value_dist_neutron
 4KQ  C8   C5   single    1.522  0.020  1.522
 4KQ  C6   C5   single    1.523  0.020  1.523
 4KQ  O27  C26  double    1.204  0.020  1.204
 4KQ  C5   O4   single    1.464  0.020  1.464
 4KQ  C5   C7   single    1.522  0.020  1.522
 4KQ  C26  O28  single    1.328  0.020  1.328
 4KQ  C26  C25  single    1.509  0.020  1.509
 4KQ  C17  C18  aromatic  1.381  0.020  1.381
 4KQ  C17  C16  aromatic  1.398  0.020  1.398
 4KQ  O4   C3   single    1.313  0.020  1.313
 4KQ  C18  C13  aromatic  1.395  0.020  1.395
 4KQ  C11  C10  single    1.505  0.020  1.505
 4KQ  C11  O12  single    1.404  0.020  1.404
 4KQ  C24  C23  aromatic  1.387  0.020  1.387
 4KQ  C24  C19  aromatic  1.396  0.020  1.396
 4KQ  C3   C2   single    1.499  0.020  1.499
 4KQ  C3   O9   double    1.205  0.020  1.205
 4KQ  C23  C22  aromatic  1.390  0.020  1.390
 4KQ  C19  C16  single    1.475  0.020  1.475
 4KQ  C19  C20  aromatic  1.396  0.020  1.396
 4KQ  C10  C2   aromatic  1.391  0.020  1.391
 4KQ  C10  C29  aromatic  1.389  0.020  1.389
 4KQ  C16  C15  aromatic  1.392  0.020  1.392
 4KQ  C22  C25  single    1.498  0.020  1.498
 4KQ  C22  C21  aromatic  1.391  0.020  1.391
 4KQ  C2   C1   aromatic  1.393  0.020  1.393
 4KQ  C13  O12  single    1.350  0.020  1.350
 4KQ  C13  C14  aromatic  1.391  0.020  1.391
 4KQ  C20  C21  aromatic  1.385  0.020  1.385
 4KQ  C29  C30  aromatic  1.383  0.020  1.383
 4KQ  F35  C32  single    1.341  0.020  1.341
 4KQ  C1   O36  single    1.342  0.020  1.342
 4KQ  C1   C31  aromatic  1.400  0.020  1.400
 4KQ  C30  C31  aromatic  1.389  0.020  1.389
 4KQ  C31  C32  single    1.495  0.020  1.495
 4KQ  F33  C32  single    1.348  0.020  1.348
 4KQ  C15  C14  aromatic  1.389  0.020  1.389
 4KQ  C32  F34  single    1.331  0.020  1.331
 4KQ  C20  H1   single    0.930  0.020  1.080
 4KQ  C24  H2   single    0.930  0.020  1.080
 4KQ  C15  H3   single    0.930  0.020  1.080
 4KQ  C17  H4   single    0.930  0.020  1.080
 4KQ  C21  H5   single    0.930  0.020  1.080
 4KQ  C23  H6   single    0.930  0.020  1.080
 4KQ  C29  H7   single    0.930  0.020  1.080
 4KQ  C30  H8   single    0.930  0.020  1.080
 4KQ  C14  H9   single    0.930  0.020  1.080
 4KQ  C18  H10  single    0.930  0.020  1.080
 4KQ  C6   H11  single    0.970  0.020  1.090
 4KQ  C6   H12  single    0.970  0.020  1.090
 4KQ  C6   H13  single    0.970  0.020  1.090
 4KQ  C7   H14  single    0.970  0.020  1.090
 4KQ  C7   H15  single    0.970  0.020  1.090
 4KQ  C7   H16  single    0.970  0.020  1.090
 4KQ  C8   H17  single    0.970  0.020  1.090
 4KQ  C8   H18  single    0.970  0.020  1.090
 4KQ  C8   H19  single    0.970  0.020  1.090
 4KQ  C25  H20  single    0.970  0.020  1.090
 4KQ  C25  H21  single    0.970  0.020  1.090
 4KQ  C11  H22  single    0.970  0.020  1.090
 4KQ  C11  H23  single    0.970  0.020  1.090
 4KQ  O36  H24  single    0.850  0.020  0.980
 4KQ  O28  H25  single    0.850  0.020  0.980

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
 4KQ  H1   C20  C19  119.86  3.000
 4KQ  H1   C20  C21  119.14  3.000
 4KQ  C19  C20  C21  120.98  3.000
 4KQ  H2   C24  C19  119.99  3.000
 4KQ  H2   C24  C23  119.05  3.000
 4KQ  C19  C24  C23  120.94  3.000
 4KQ  H3   C15  C16  119.97  3.000
 4KQ  H3   C15  C14  118.14  3.000
 4KQ  C16  C15  C14  121.87  3.000
 4KQ  H4   C17  C16  120.02  3.000
 4KQ  H4   C17  C18  118.53  3.000
 4KQ  C16  C17  C18  121.45  3.000
 4KQ  H5   C21  C22  119.80  3.000
 4KQ  H5   C21  C20  119.24  3.000
 4KQ  C22  C21  C20  120.95  3.000
 4KQ  H6   C23  C22  119.75  3.000
 4KQ  H6   C23  C24  119.28  3.000
 4KQ  C22  C23  C24  120.97  3.000
 4KQ  H7   C29  C10  120.98  3.000
 4KQ  H7   C29  C30  119.08  3.000
 4KQ  C10  C29  C30  119.94  3.000
 4KQ  H8   C30  C31  120.13  3.000
 4KQ  H8   C30  C29  118.38  3.000
 4KQ  C31  C30  C29  121.49  3.000
 4KQ  H9   C14  C13  122.00  3.000
 4KQ  H9   C14  C15  118.34  3.000
 4KQ  C13  C14  C15  119.66  3.000
 4KQ  H10  C18  C13  119.61  3.000
 4KQ  H10  C18  C17  120.19  3.000
 4KQ  C13  C18  C17  120.20  3.000
 4KQ  C16  C19  C24  121.20  3.000
 4KQ  C16  C19  C20  120.90  3.000
 4KQ  C24  C19  C20  117.90  3.000
 4KQ  C19  C16  C17  121.21  3.000
 4KQ  C19  C16  C15  121.29  3.000
 4KQ  C17  C16  C15  117.49  3.000
 4KQ  C3   C2   C1   118.45  3.000
 4KQ  C1   C2   C10  121.36  3.000
 4KQ  C3   C2   C10  120.18  3.000
 4KQ  C25  C22  C23  121.01  3.000
 4KQ  C25  C22  C21  120.73  3.000
 4KQ  C23  C22  C21  118.26  3.000
 4KQ  C11  C10  C2   118.95  3.000
 4KQ  C2   C10  C29  118.98  3.000
 4KQ  C11  C10  C29  122.07  3.000
 4KQ  C32  C31  C1   121.11  3.000
 4KQ  C32  C31  C30  119.88  3.000
 4KQ  C1   C31  C30  118.95  3.000
 4KQ  O12  C13  C18  116.19  3.000
 4KQ  O12  C13  C14  124.48  3.000
 4KQ  C18  C13  C14  119.33  3.000
 4KQ  O36  C1   C31  125.39  3.000
 4KQ  C31  C1   C2   119.27  3.000
 4KQ  O36  C1   C2   115.31  3.000
 4KQ  O28  C26  O27  123.46  3.000
 4KQ  O28  C26  C25  111.30  3.000
 4KQ  O27  C26  C25  125.24  3.000
 4KQ  H13  C6   H12  108.70  3.000
 4KQ  H13  C6   H11  107.45  3.000
 4KQ  H12  C6   H11  107.68  3.000
 4KQ  H13  C6   C5   111.22  3.000
 4KQ  H12  C6   C5   112.80  3.000
 4KQ  H11  C6   C5   108.79  3.000
 4KQ  H16  C7   H15  108.77  3.000
 4KQ  H16  C7   H14  107.66  3.000
 4KQ  H15  C7   H14  107.64  3.000
 4KQ  H16  C7   C5   112.73  3.000
 4KQ  H15  C7   C5   111.04  3.000
 4KQ  H14  C7   C5   108.82  3.000
 4KQ  H19  C8   H18  107.90  3.000
 4KQ  H19  C8   H17  107.89  3.000
 4KQ  H18  C8   H17  108.52  3.000
 4KQ  H19  C8   C5   109.57  3.000
 4KQ  H18  C8   C5   111.29  3.000
 4KQ  H17  C8   C5   111.54  3.000
 4KQ  H21  C25  H20  105.67  3.000
 4KQ  H21  C25  C26  108.23  3.000
 4KQ  H20  C25  C26  107.97  3.000
 4KQ  H21  C25  C22  111.07  3.000
 4KQ  H20  C25  C22  110.88  3.000
 4KQ  C26  C25  C22  112.72  3.000
 4KQ  H23  C11  H22  107.39  3.000
 4KQ  H23  C11  O12  110.86  3.000
 4KQ  H22  C11  O12  110.16  3.000
 4KQ  H23  C11  C10  109.33  3.000
 4KQ  H22  C11  C10  109.77  3.000
 4KQ  O12  C11  C10  109.29  3.000
 4KQ  F35  C32  F34  107.09  3.000
 4KQ  F34  C32  F33  106.73  3.000
 4KQ  F35  C32  F33  106.14  3.000
 4KQ  F34  C32  C31  112.64  3.000
 4KQ  F33  C32  C31  111.95  3.000
 4KQ  F35  C32  C31  111.89  3.000
 4KQ  O4   C5   C8   103.01  3.000
 4KQ  O4   C5   C7   110.55  3.000
 4KQ  C8   C5   C7   110.05  3.000
 4KQ  C7   C5   C6   112.14  3.000
 4KQ  O4   C5   C6   110.58  3.000
 4KQ  C8   C5   C6   110.14  3.000
 4KQ  H24  O36  C1   113.81  3.000
 4KQ  H25  O28  C26  110.02  3.000
 4KQ  C11  O12  C13  118.40  3.000
 4KQ  C5   O4   C3   123.30  3.000
 4KQ  O4   C3   O9   126.75  3.000
 4KQ  O9   C3   C2   122.32  3.000
 4KQ  O4   C3   C2   110.89  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
 4KQ  CONST_01  C23  C24  C19  C20    0.00   0.0  0
 4KQ  CONST_04  C23  C22  C21  C20    0.00   0.0  0
 4KQ  CONST_05  C21  C22  C23  C24    0.00   0.0  0
 4KQ  CONST_08  C21  C20  C19  C24    0.00   0.0  0
 4KQ  CONST_09  C18  C17  C16  C15    0.00   0.0  0
 4KQ  CONST_10  C18  C13  C14  C15    0.00   0.0  0
 4KQ  CONST_11  C14  C13  C18  C17    0.00   0.0  0
 4KQ  CONST_12  C14  C15  C16  C17    0.00   0.0  0
 4KQ  CONST_13  C16  C19  C20  C21  180.00   0.0  0
 4KQ  CONST_14  C16  C19  C24  C23  180.00   0.0  0
 4KQ  CONST_15  C1   C2   C10  C29    0.00   0.0  0
 4KQ  CONST_16  C1   C31  C30  C29    0.00   0.0  0
 4KQ  CONST_17  C2   C10  C29  C30    0.00   0.0  0
 4KQ  CONST_18  C2   C1   C31  C30    0.00   0.0  0
 4KQ  CONST_19  C19  C16  C15  C14  180.00   0.0  0
 4KQ  CONST_20  C19  C16  C17  C18  180.00   0.0  0
 4KQ  CONST_21  C22  C23  C24  C19    0.00   0.0  0
 4KQ  CONST_22  C22  C21  C20  C19    0.00   0.0  0
 4KQ  CONST_23  C13  C18  C17  C16    0.00   0.0  0
 4KQ  CONST_24  C13  C14  C15  C16    0.00   0.0  0
 4KQ  CONST_25  C31  C1   C2   C10    0.00   0.0  0
 4KQ  CONST_26  C31  C30  C29  C10    0.00   0.0  0
 4KQ  CONST_27  C25  C22  C21  C20  180.00   0.0  0
 4KQ  CONST_28  C25  C22  C23  C24  180.00   0.0  0
 4KQ  CONST_29  O12  C13  C14  C15  180.00   0.0  0
 4KQ  CONST_30  O12  C13  C18  C17  180.00   0.0  0
 4KQ  CONST_31  C3   C2   C10  C29  180.00   0.0  0
 4KQ  CONST_32  C32  C31  C30  C29  180.00   0.0  0
 4KQ  CONST_33  C11  C10  C29  C30  180.00   0.0  0
 4KQ  CONST_34  O36  C1   C31  C30  180.00   0.0  0
 4KQ  CONST_35  C32  C31  C1   C2   180.00   0.0  0
 4KQ  CONST_36  O36  C1   C2   C10  180.00   0.0  0
 4KQ  CONST_37  C3   C2   C1   C31  180.00   0.0  0
 4KQ  CONST_38  C11  C10  C2   C1   180.00   0.0  0
 4KQ  CONST_39  H2   C24  C19  C20  180.00   0.0  0
 4KQ  CONST_40  H1   C20  C19  C24  180.00   0.0  0
 4KQ  CONST_41  H4   C17  C16  C15  180.00   0.0  0
 4KQ  CONST_42  H3   C15  C16  C17  180.00   0.0  0
 4KQ  CONST_43  H6   C23  C22  C21  180.00   0.0  0
 4KQ  CONST_44  H5   C21  C22  C23  180.00   0.0  0
 4KQ  CONST_45  H10  C18  C13  C14  180.00   0.0  0
 4KQ  CONST_46  H9   C14  C13  C18  180.00   0.0  0
 4KQ  CONST_47  H7   C29  C10  C2   180.00   0.0  0
 4KQ  CONST_48  H8   C30  C29  C10  180.00   0.0  0
 4KQ  CONST_49  H25  O28  C26  C25  180.00   0.0  0
 4KQ  Var_01    C26  C25  C22  C21  -85.17  30.0  2
 4KQ  Var_02    O12  C11  C10  C29   14.27  30.0  1
 4KQ  Var_03    F35  C32  C31  C30  106.15  30.0  2
 4KQ  Var_04    O4   C3   C2   C10  106.53  30.0  2
 4KQ  Var_05    O27  C26  C25  C22    1.25  30.0  1
 4KQ  Var_06    C8   C5   O4   C3   179.70  30.0  3
 4KQ  Var_07    H17  C8   C5   C6    57.56  30.0  3
 4KQ  Var_08    H14  C7   C5   C6    63.96  30.0  3
 4KQ  Var_09    H11  C6   C5   C7   -66.65  30.0  3

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
 4KQ  plan-1  C20  0.020
 4KQ  plan-1  C24  0.020
 4KQ  plan-1  C21  0.020
 4KQ  plan-1  C23  0.020
 4KQ  plan-1  C19  0.020
 4KQ  plan-1  C16  0.020
 4KQ  plan-1  C22  0.020
 4KQ  plan-1  C25  0.020
 4KQ  plan-1  H1   0.020
 4KQ  plan-1  H2   0.020
 4KQ  plan-1  H5   0.020
 4KQ  plan-1  H6   0.020
 4KQ  plan-2  C15  0.020
 4KQ  plan-2  C17  0.020
 4KQ  plan-2  C14  0.020
 4KQ  plan-2  C18  0.020
 4KQ  plan-2  C19  0.020
 4KQ  plan-2  C16  0.020
 4KQ  plan-2  C13  0.020
 4KQ  plan-2  O12  0.020
 4KQ  plan-2  H3   0.020
 4KQ  plan-2  H4   0.020
 4KQ  plan-2  H9   0.020
 4KQ  plan-2  H10  0.020
 4KQ  plan-3  C29  0.020
 4KQ  plan-3  C30  0.020
 4KQ  plan-3  C2   0.020
 4KQ  plan-3  C10  0.020
 4KQ  plan-3  C31  0.020
 4KQ  plan-3  C1   0.020
 4KQ  plan-3  C11  0.020
 4KQ  plan-3  C32  0.020
 4KQ  plan-3  O36  0.020
 4KQ  plan-3  H7   0.020
 4KQ  plan-3  H8   0.020
 4KQ  plan-3  C3   0.020
 4KQ  plan-4  C26  0.020
 4KQ  plan-4  C25  0.020
 4KQ  plan-4  O27  0.020
 4KQ  plan-4  O28  0.020
 4KQ  plan-4  H25  0.020
 4KQ  plan-5  C2   0.020
 4KQ  plan-5  O9   0.020
 4KQ  plan-5  O4   0.020
 4KQ  plan-5  C3   0.020

