# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sat Apr 18 16:30:41 2020
#   Inital geometry file: a 147 line input string
#   Ligand name: 5-[3-(tert-butylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CNC(=O)c1c(oc2ccc(cc12)c3cccc(c3)C(=O)NC(C)(C)C)c4ccc(F)cc4
#
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
 8XP  8XP  5-[3-(tert-butylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide  ligand  58  33  .  2021-08-06  2021-08-06  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_8XP
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
 8XP  C13  C  CR6   0   0.104  -2.1029  -0.4291   1.0450
 8XP  C18  C  CR16  0  -0.306  -2.2639  -1.7125   1.5697
 8XP  C17  C  CR16  0  -0.307  -4.6486  -1.5598   1.2960
 8XP  C16  C  CT    0   0.099  -8.0032   0.3923  -0.6214
 8XP  C19  C  CR16  0  -0.227  -3.5265  -2.2684   1.6994
 8XP  C20  C  CH3   0  -0.648  -8.6979   1.2091   0.4677
 8XP  C21  C  CH3   0  -0.681  -8.8689  -0.8196  -0.9630
 8XP  C22  C  CH3   0  -0.640  -7.7893   1.2388  -1.8773
 8XP  C23  C  CR6   0  -0.038   5.0933   0.8409  -0.3162
 8XP  C24  C  C     0   0.437   3.2014  -1.8723  -0.5210
 8XP  C12  C  CR6   0  -0.004  -4.5072  -0.2796   0.7664
 8XP  C27  C  CH3   0  -0.517   2.8895  -4.2214   0.0592
 8XP  C1   C  CR6   0   0.083  -0.7576   0.1639   0.8949
 8XP  C2   C  CR16  0  -0.319  -0.5480   1.5220   1.1980
 8XP  C3   C  CR16  0  -0.324   0.6910   2.1220   1.0610
 8XP  C4   C  CR56  0   0.348   1.7194   1.3136   0.6147
 8XP  C5   C  CR56  0   0.143   1.5594  -0.0347   0.3096
 8XP  C6   C  CR16  0  -0.439   0.3008  -0.6180   0.4469
 8XP  O7   O  O     0  -0.457   2.9955   1.6875   0.3894
 8XP  C8   C  CR5   0   0.416   3.6732   0.6065  -0.0753
 8XP  C9   C  CR5   0  -0.180   2.8536  -0.4830  -0.1410
 8XP  C10  C  C     0   0.537  -5.6801   0.5462   0.3268
 8XP  N11  N  NH1   0  -0.663  -6.7281  -0.1517  -0.1354
 8XP  C14  C  CR16  0  -0.341  -3.2382   0.2799   0.6604
 8XP  O15  O  O     0  -0.490  -5.6389   1.7677   0.3975
 8XP  O25  O  O     0  -0.477   3.8895  -2.1510  -1.4942
 8XP  N26  N  NH1   0  -0.629   2.6741  -2.8102   0.2801
 8XP  C28  C  CR16  0  -0.272   5.7626   0.2631  -1.3956
 8XP  C29  C  CR16  0  -0.399   7.1097   0.5090  -1.6072
 8XP  C30  C  CR6   0   0.532   7.7796   1.3419  -0.7330
 8XP  C31  C  CR16  0  -0.400   7.1469   1.9416   0.3400
 8XP  C32  C  CR16  0  -0.267   5.8010   1.6903   0.5412
 8XP  F33  F  F     0  -0.308   9.0825   1.5803  -0.9328
 8XP  H40  H  HCR6  0   0.260  -1.3989  -2.2730   1.9023
 8XP  H39  H  HCR6  0   0.260  -5.6272  -2.0044   1.4252
 8XP  H41  H  HCR6  0   0.266  -3.6390  -3.2548   2.1291
 8XP  H44  H  HCH3  0   0.241  -8.1439   2.1103   0.7217
 8XP  H43  H  HCH3  0   0.229  -9.6867   1.5126   0.1209
 8XP  H42  H  HCH3  0   0.229  -8.8261   0.6164   1.3746
 8XP  H47  H  HCH3  0   0.239  -9.0568  -1.4330  -0.0792
 8XP  H45  H  HCH3  0   0.243  -9.8325  -0.4975  -1.3565
 8XP  H46  H  HCH3  0   0.237  -8.3937  -1.4467  -1.7205
 8XP  H48  H  HCH3  0   0.227  -7.2979   0.6572  -2.6585
 8XP  H50  H  HCH3  0   0.227  -8.7501   1.5807  -2.2649
 8XP  H49  H  HCH3  0   0.239  -7.1819   2.1175  -1.6688
 8XP  H54  H  HCH3  0   0.253   2.3112  -4.7732   0.7943
 8XP  H52  H  HCH3  0   0.244   2.5566  -4.5190  -0.9342
 8XP  H53  H  HCH3  0   0.240   3.9396  -4.4964   0.1682
 8XP  H34  H  HCR6  0   0.265  -1.3747   2.1163   1.5654
 8XP  H35  H  HCR6  0   0.278   0.8433   3.1663   1.2976
 8XP  H36  H  HCR6  0   0.263   0.1386  -1.6539   0.1776
 8XP  H37  H  HNH1  0   0.404  -6.5935  -1.1399  -0.2789
 8XP  H38  H  HCR6  0   0.258  -3.1328   1.2734   0.2431
 8XP  H51  H  HNH1  0   0.410   2.2306  -2.5295   1.1390
 8XP  H55  H  HCR6  0   0.278   5.2277  -0.3730  -2.0833
 8XP  H56  H  HCR6  0   0.286   7.6256   0.0642  -2.4474
 8XP  H57  H  HCR6  0   0.287   7.6951   2.5908   1.0096
 8XP  H58  H  HCR6  0   0.273   5.3095   2.1512   1.3872

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
 8XP  C20  C16  single    1.528  0.020  1.528
 8XP  C3   C2   aromatic  1.383  0.020  1.383
 8XP  C3   C4   aromatic  1.382  0.020  1.382
 8XP  C2   C1   aromatic  1.407  0.020  1.407
 8XP  C21  C16  single    1.528  0.020  1.528
 8XP  C16  N11  single    1.469  0.020  1.469
 8XP  C16  C22  single    1.530  0.020  1.530
 8XP  O7   C4   aromatic  1.349  0.020  1.349
 8XP  O7   C8   aromatic  1.358  0.020  1.358
 8XP  O15  C10  double    1.224  0.020  1.224
 8XP  C4   C5   aromatic  1.392  0.020  1.392
 8XP  C28  C29  aromatic  1.386  0.020  1.386
 8XP  C28  C23  aromatic  1.395  0.020  1.395
 8XP  C29  C30  aromatic  1.381  0.020  1.381
 8XP  N11  C10  single    1.341  0.020  1.341
 8XP  C10  C12  single    1.500  0.020  1.500
 8XP  C14  C12  aromatic  1.391  0.020  1.391
 8XP  C14  C13  aromatic  1.393  0.020  1.393
 8XP  C1   C13  single    1.478  0.020  1.478
 8XP  C1   C6   aromatic  1.390  0.020  1.390
 8XP  C12  C17  aromatic  1.393  0.020  1.393
 8XP  C13  C18  aromatic  1.396  0.020  1.396
 8XP  C8   C23  single    1.459  0.020  1.459
 8XP  C8   C9   aromatic  1.365  0.020  1.365
 8XP  C23  C32  aromatic  1.399  0.020  1.399
 8XP  C5   C6   aromatic  1.394  0.020  1.394
 8XP  C5   C9   aromatic  1.442  0.020  1.442
 8XP  C30  F33  single    1.340  0.020  1.340
 8XP  C30  C31  aromatic  1.382  0.020  1.382
 8XP  C17  C19  aromatic  1.387  0.020  1.387
 8XP  C18  C19  aromatic  1.386  0.020  1.386
 8XP  C9   C24  single    1.482  0.020  1.482
 8XP  C32  C31  aromatic  1.384  0.020  1.384
 8XP  C24  N26  single    1.342  0.020  1.342
 8XP  C24  O25  double    1.224  0.020  1.224
 8XP  N26  C27  single    1.444  0.020  1.444
 8XP  C18  H40  single    0.930  0.020  1.080
 8XP  C17  H39  single    0.930  0.020  1.080
 8XP  C19  H41  single    0.930  0.020  1.080
 8XP  C20  H44  single    0.970  0.020  1.090
 8XP  C20  H43  single    0.970  0.020  1.090
 8XP  C20  H42  single    0.970  0.020  1.090
 8XP  C21  H47  single    0.970  0.020  1.090
 8XP  C21  H45  single    0.970  0.020  1.090
 8XP  C21  H46  single    0.970  0.020  1.090
 8XP  C22  H48  single    0.970  0.020  1.090
 8XP  C22  H50  single    0.970  0.020  1.090
 8XP  C22  H49  single    0.970  0.020  1.090
 8XP  C27  H54  single    0.970  0.020  1.090
 8XP  C27  H52  single    0.970  0.020  1.090
 8XP  C27  H53  single    0.970  0.020  1.090
 8XP  C2   H34  single    0.930  0.020  1.080
 8XP  C3   H35  single    0.930  0.020  1.080
 8XP  C6   H36  single    0.930  0.020  1.080
 8XP  N11  H37  single    0.860  0.020  1.020
 8XP  C14  H38  single    0.930  0.020  1.080
 8XP  N26  H51  single    0.860  0.020  1.020
 8XP  C28  H55  single    0.930  0.020  1.080
 8XP  C29  H56  single    0.930  0.020  1.080
 8XP  C31  H57  single    0.930  0.020  1.080
 8XP  C32  H58  single    0.930  0.020  1.080

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
 8XP  C14  C13  C1   120.65  3.000
 8XP  C1   C13  C18  120.80  3.000
 8XP  C14  C13  C18  118.55  3.000
 8XP  H40  C18  C19  119.43  3.000
 8XP  H40  C18  C13  119.95  3.000
 8XP  C19  C18  C13  120.60  3.000
 8XP  H39  C17  C12  120.98  3.000
 8XP  H39  C17  C19  119.13  3.000
 8XP  C12  C17  C19  119.87  3.000
 8XP  N11  C16  C22  110.81  3.000
 8XP  C22  C16  C21  109.55  3.000
 8XP  N11  C16  C21  105.78  3.000
 8XP  C22  C16  C20  110.66  3.000
 8XP  N11  C16  C20  110.90  3.000
 8XP  C21  C16  C20  109.01  3.000
 8XP  H41  C19  C17  119.81  3.000
 8XP  H41  C19  C18  119.85  3.000
 8XP  C17  C19  C18  120.34  3.000
 8XP  H42  C20  H43  107.99  3.000
 8XP  H42  C20  H44  108.41  3.000
 8XP  H43  C20  H44  107.78  3.000
 8XP  H42  C20  C16  110.82  3.000
 8XP  H43  C20  C16  109.52  3.000
 8XP  H44  C20  C16  112.18  3.000
 8XP  H46  C21  H45  107.70  3.000
 8XP  H46  C21  H47  108.28  3.000
 8XP  H45  C21  H47  107.83  3.000
 8XP  H46  C21  C16  111.34  3.000
 8XP  H45  C21  C16  110.32  3.000
 8XP  H47  C21  C16  111.22  3.000
 8XP  H49  C22  H50  107.85  3.000
 8XP  H49  C22  H48  108.44  3.000
 8XP  H50  C22  H48  108.02  3.000
 8XP  H49  C22  C16  111.57  3.000
 8XP  H50  C22  C16  110.00  3.000
 8XP  H48  C22  C16  110.85  3.000
 8XP  C32  C23  C28  118.87  3.000
 8XP  C32  C23  C8   119.25  3.000
 8XP  C28  C23  C8   121.87  3.000
 8XP  N26  C24  O25  122.45  3.000
 8XP  O25  C24  C9   123.32  3.000
 8XP  N26  C24  C9   114.21  3.000
 8XP  C14  C12  C10  118.00  3.000
 8XP  C14  C12  C17  119.43  3.000
 8XP  C10  C12  C17  122.55  3.000
 8XP  H53  C27  H52  108.45  3.000
 8XP  H53  C27  H54  108.47  3.000
 8XP  H52  C27  H54  108.41  3.000
 8XP  H53  C27  N26  112.00  3.000
 8XP  H52  C27  N26  111.15  3.000
 8XP  H54  C27  N26  108.27  3.000
 8XP  C6   C1   C2   119.93  3.000
 8XP  C6   C1   C13  120.01  3.000
 8XP  C2   C1   C13  120.06  3.000
 8XP  H34  C2   C3   118.65  3.000
 8XP  H34  C2   C1   119.29  3.000
 8XP  C3   C2   C1   122.05  3.000
 8XP  H35  C3   C4   122.05  3.000
 8XP  H35  C3   C2   121.55  3.000
 8XP  C4   C3   C2   116.40  3.000
 8XP  O7   C4   C5   109.92  3.000
 8XP  C5   C4   C3   123.50  3.000
 8XP  O7   C4   C3   126.57  3.000
 8XP  C9   C5   C6   135.33  3.000
 8XP  C9   C5   C4   105.46  3.000
 8XP  C6   C5   C4   119.18  3.000
 8XP  H36  C6   C5   120.74  3.000
 8XP  H36  C6   C1   120.29  3.000
 8XP  C5   C6   C1   118.94  3.000
 8XP  C8   O7   C4   107.98  3.000
 8XP  C9   C8   O7   110.62  3.000
 8XP  C9   C8   C23  134.80  3.000
 8XP  O7   C8   C23  114.47  3.000
 8XP  C8   C9   C5   106.01  3.000
 8XP  C5   C9   C24  125.61  3.000
 8XP  C8   C9   C24  128.30  3.000
 8XP  O15  C10  N11  124.43  3.000
 8XP  N11  C10  C12  115.18  3.000
 8XP  O15  C10  C12  120.39  3.000
 8XP  H37  N11  C10  117.07  3.000
 8XP  H37  N11  C16  115.60  3.000
 8XP  C10  N11  C16  126.83  3.000
 8XP  H38  C14  C12  119.16  3.000
 8XP  H38  C14  C13  119.61  3.000
 8XP  C12  C14  C13  121.20  3.000
 8XP  H51  N26  C27  117.95  3.000
 8XP  H51  N26  C24  119.19  3.000
 8XP  C27  N26  C24  122.21  3.000
 8XP  H55  C28  C29  119.30  3.000
 8XP  H55  C28  C23  119.97  3.000
 8XP  C29  C28  C23  120.73  3.000
 8XP  H56  C29  C30  120.56  3.000
 8XP  H56  C29  C28  120.62  3.000
 8XP  C30  C29  C28  118.82  3.000
 8XP  F33  C30  C31  118.92  3.000
 8XP  C31  C30  C29  122.07  3.000
 8XP  F33  C30  C29  119.00  3.000
 8XP  H57  C31  C32  120.78  3.000
 8XP  H57  C31  C30  120.59  3.000
 8XP  C32  C31  C30  118.63  3.000
 8XP  H58  C32  C31  118.58  3.000
 8XP  H58  C32  C23  120.54  3.000
 8XP  C31  C32  C23  120.87  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
 8XP  CONST_01  C17  C12  C14  C13     0.00   0.0  0
 8XP  CONST_02  C3   C2   C1   C13   180.00   0.0  0
 8XP  CONST_03  C5   C6   C1   C13   180.00   0.0  0
 8XP  CONST_04  C17  C19  C18  C13     0.00   0.0  0
 8XP  CONST_05  C12  C14  C13  C18     0.00   0.0  0
 8XP  CONST_08  C12  C17  C19  C18     0.00   0.0  0
 8XP  CONST_09  C14  C12  C17  C19     0.00   0.0  0
 8XP  CONST_10  C14  C13  C18  C19     0.00   0.0  0
 8XP  CONST_11  C1   C13  C18  C19   180.00   0.0  0
 8XP  CONST_12  C30  C29  C28  C23     0.00   0.0  0
 8XP  CONST_13  C4   O7   C8   C23   180.00   0.0  0
 8XP  CONST_14  C5   C9   C8   C23   180.00   0.0  0
 8XP  CONST_15  C30  C31  C32  C23     0.00   0.0  0
 8XP  CONST_16  C1   C13  C14  C12   180.00   0.0  0
 8XP  CONST_17  C4   C3   C2   C1      0.00   0.0  0
 8XP  CONST_18  C4   C5   C6   C1      0.00   0.0  0
 8XP  CONST_19  C9   C5   C6   C1    180.00   0.0  0
 8XP  CONST_20  O7   C4   C3   C2    180.00   0.0  0
 8XP  CONST_21  C5   C4   C3   C2      0.00   0.0  0
 8XP  CONST_23  C5   C6   C1   C2      0.00   0.0  0
 8XP  CONST_24  C6   C1   C2   C3      0.00   0.0  0
 8XP  CONST_25  C8   O7   C4   C3    180.00   0.0  0
 8XP  CONST_26  C6   C5   C4   C3      0.00   0.0  0
 8XP  CONST_27  C9   C5   C4   C3    180.00   0.0  0
 8XP  CONST_28  C9   C8   O7   C4      0.00   0.0  0
 8XP  CONST_29  C8   C9   C5   C4      0.00   0.0  0
 8XP  CONST_30  C8   O7   C4   C5      0.00   0.0  0
 8XP  CONST_31  O7   C8   C9   C5      0.00   0.0  0
 8XP  CONST_33  O7   C4   C5   C6    180.00   0.0  0
 8XP  CONST_34  C8   C9   C5   C6    180.00   0.0  0
 8XP  CONST_35  C9   C5   C4   O7      0.00   0.0  0
 8XP  CONST_38  C29  C28  C23  C8    180.00   0.0  0
 8XP  CONST_39  C31  C32  C23  C8    180.00   0.0  0
 8XP  CONST_42  C31  C30  C29  C28     0.00   0.0  0
 8XP  CONST_43  C31  C32  C23  C28     0.00   0.0  0
 8XP  CONST_44  C32  C23  C28  C29     0.00   0.0  0
 8XP  CONST_45  C32  C31  C30  C29     0.00   0.0  0
 8XP  CONST_46  C10  C12  C14  C13   180.00   0.0  0
 8XP  CONST_47  C10  C12  C17  C19   180.00   0.0  0
 8XP  CONST_48  C24  C9   C8   C23     0.00   0.0  0
 8XP  CONST_49  O7   C8   C9   C24   180.00   0.0  0
 8XP  CONST_50  C4   C5   C9   C24   180.00   0.0  0
 8XP  CONST_51  C6   C5   C9   C24     0.00   0.0  0
 8XP  CONST_52  F33  C30  C29  C28   180.00   0.0  0
 8XP  CONST_53  F33  C30  C31  C32   180.00   0.0  0
 8XP  CONST_54  H34  C2   C1   C13     0.00   0.0  0
 8XP  CONST_55  H36  C6   C1   C13     0.00   0.0  0
 8XP  CONST_56  H41  C19  C18  C13   180.00   0.0  0
 8XP  CONST_57  H38  C14  C13  C18   180.00   0.0  0
 8XP  CONST_58  H39  C17  C19  C18   180.00   0.0  0
 8XP  CONST_59  H40  C18  C19  C17   180.00   0.0  0
 8XP  CONST_60  H56  C29  C28  C23   180.00   0.0  0
 8XP  CONST_61  H57  C31  C32  C23   180.00   0.0  0
 8XP  CONST_62  H35  C3   C2   C1    180.00   0.0  0
 8XP  CONST_63  H55  C28  C23  C8      0.00   0.0  0
 8XP  CONST_64  H58  C32  C23  C8      0.00   0.0  0
 8XP  CONST_65  C12  C10  N11  C16   180.00   0.0  0
 8XP  CONST_66  C9   C24  N26  C27   180.00   0.0  0
 8XP  CONST_67  H37  N11  C10  C12     0.00   0.0  0
 8XP  CONST_68  H51  N26  C24  C9      0.00   0.0  0
 8XP  CONST_69  O15  C10  N11  C16     0.00   0.0  0
 8XP  CONST_70  O25  C24  N26  C27     0.00   0.0  0
 8XP  Var_01    O15  C10  C12  C17   149.50  30.0  2
 8XP  Var_02    N26  C24  C9   C5    -40.84  30.0  2
 8XP  Var_03    C10  N11  C16  C20   -59.25  30.0  3
 8XP  Var_04    H47  C21  C16  C20   -57.57  30.0  3
 8XP  Var_05    H48  C22  C16  C20  -179.72  30.0  3
 8XP  Var_06    H44  C20  C16  C21  -177.59  30.0  3
 8XP  Var_07    H54  C27  N26  C24  -176.30  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
 8XP  plan-1  C13  0.020
 8XP  plan-1  C18  0.020
 8XP  plan-1  C17  0.020
 8XP  plan-1  C19  0.020
 8XP  plan-1  C12  0.020
 8XP  plan-1  C1   0.020
 8XP  plan-1  C10  0.020
 8XP  plan-1  C14  0.020
 8XP  plan-1  H40  0.020
 8XP  plan-1  H39  0.020
 8XP  plan-1  H41  0.020
 8XP  plan-1  H38  0.020
 8XP  plan-2  C23  0.020
 8XP  plan-2  C8   0.020
 8XP  plan-2  C28  0.020
 8XP  plan-2  C29  0.020
 8XP  plan-2  C30  0.020
 8XP  plan-2  C31  0.020
 8XP  plan-2  C32  0.020
 8XP  plan-2  F33  0.020
 8XP  plan-2  H55  0.020
 8XP  plan-2  H56  0.020
 8XP  plan-2  H57  0.020
 8XP  plan-2  H58  0.020
 8XP  plan-3  C13  0.020
 8XP  plan-3  C23  0.020
 8XP  plan-3  C24  0.020
 8XP  plan-3  C1   0.020
 8XP  plan-3  C2   0.020
 8XP  plan-3  C3   0.020
 8XP  plan-3  C4   0.020
 8XP  plan-3  C5   0.020
 8XP  plan-3  C6   0.020
 8XP  plan-3  O7   0.020
 8XP  plan-3  C8   0.020
 8XP  plan-3  C9   0.020
 8XP  plan-3  H34  0.020
 8XP  plan-3  H35  0.020
 8XP  plan-3  H36  0.020
 8XP  plan-4  C24  0.020
 8XP  plan-4  C27  0.020
 8XP  plan-4  C9   0.020
 8XP  plan-4  O25  0.020
 8XP  plan-4  N26  0.020
 8XP  plan-4  H51  0.020
 8XP  plan-5  C16  0.020
 8XP  plan-5  C12  0.020
 8XP  plan-5  C10  0.020
 8XP  plan-5  N11  0.020
 8XP  plan-5  O15  0.020
 8XP  plan-5  H37  0.020

