# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Mon Aug  2 15:45:57 2021
#   Inital geometry file: a 181 line input string
#   Ligand name: (2S)-2-({(2S)-3-[(R)-[(1R)-1-({(4S)-4-amino-5-[(2S)-2-cyanopyrrolidin-1-yl]-5-oxopentanoyl}amino)ethyl](hydroxy)phosphoryl]-2-benzylpropanoyl}amino)propanoic acid (non-preferred name)
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: C[C@H](NC(=O)[C@H](Cc1ccccc1)C[P@](O)(=O)[C@H](C)NC(=O)CC[C@H](N)C(=O)N2CCC[C@H]2C#N)C(O)=O
#
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
 I20  I20  '(2S)-2-({(2S)-3-[(R)-[(1R)-1-({(4S)-4-amino-5-[(2S)-2-cyanopyrrolidin-1-yl]-5-oxopentanoyl}amino)ethyl](hydroxy)phosphoryl]-2-benzylpropanoyl}amino)propanoic acid (non-preferred name)'  ligand  74  38  .  2021-08-11  2022-11-17
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as GRAND
;

data_comp_I20
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
 I20  C1    C  CH3   0  -0.687  28.4241  50.3103  31.7426
 I20  C2    C  CH1   0  -0.331  27.8028  49.4304  30.6677
 I20  O5    O  O     0  -0.700  25.3452  48.7784  29.5219
 I20  C7    C  CH2   0  -0.751  25.5828  48.3979  32.2573
 I20  C8    C  CH1   0  -0.386  24.0847  48.2836  32.5633
 I20  C9    C  CH2   0  -0.500  23.8478  47.2660  33.6943
 I20  C10   C  C     0   0.555  23.4550  49.6286  32.8994
 I20  C11   C  CR6   0   0.137  22.3901  47.1057  34.0225
 I20  C12   C  CR16  0  -0.309  21.8408  47.6971  35.1564
 I20  C13   C  CR16  0  -0.240  20.4855  47.5766  35.4371
 I20  C14   C  CR16  0  -0.272  19.6594  46.8585  34.5841
 I20  C15   C  CR16  0  -0.238  20.1979  46.2602  33.4510
 I20  C16   C  CR16  0  -0.309  21.5514  46.3852  33.1742
 I20  C27   C  CH2   0  -0.422  27.0419  49.5163  26.2542
 I20  N29   N  NH2   0  -0.780  28.0332  49.9292  24.0448
 I20  C30   C  C     0   0.547  28.3374  49.0421  28.3019
 I20  C32   C  CH2   0  -0.589  28.3923  49.7155  26.9510
 I20  C35   C  CH1   0  -0.230  23.6235  51.5587  34.4262
 I20  NZ    N  NS    0  -0.361  28.2190  55.2737  24.1601
 I20  CD    C  CR15  0  -0.240  26.0725  53.8703  24.2337
 I20  CG    C  CH2   0  -0.484  24.9137  54.2568  23.3208
 I20  CB    C  CH2   0  -0.466  24.4947  52.9350  22.6464
 I20  CA    C  CH2   0  -0.320  25.7088  52.0200  22.7657
 I20  N     N  NR5   0  -0.401  26.2700  52.4496  24.0426
 I20  C     C  C     0   0.652  26.6434  51.7046  25.0368
 I20  O     O  O     0  -0.562  26.8311  52.2931  26.1805
 I20  C28   C  CH1   0  -0.247  26.9019  50.2179  24.9050
 I20  O31   O  O     0  -0.491  28.4137  47.8302  28.4282
 I20  N3    N  NH1   0  -0.620  28.1611  49.8809  29.3451
 I20  P4    P  P     0   1.239  25.9615  49.3479  30.7546
 I20  O6    O  OH1   0  -0.790  25.4664  50.8601  30.9727
 I20  N34   N  NH1   0  -0.623  24.0170  50.2609  33.9522
 I20  C37   C  C     0   0.611  24.6498  52.5931  33.9880
 I20  O39   O  OH1   0  -0.569  24.4686  53.7577  34.5667
 I20  O38   O  O     0  -0.465  25.5329  52.3852  33.1842
 I20  C36   C  CH3   0  -0.661  23.4004  51.5458  35.9368
 I20  O33   O  O     0  -0.464  22.5189  50.0885  32.2715
 I20  H11   H  HCH3  0   0.247  28.1088  50.0053  32.7403
 I20  H12A  H  HCH3  0   0.265  29.5098  50.2324  31.7026
 I20  H13A  H  HCH3  0   0.242  28.1569  51.3592  31.6124
 I20  H2    H  HCH1  0   0.293  28.1632  48.4064  30.7863
 I20  H71   H  HCH2  0   0.307  25.9798  47.3959  32.0710
 I20  H72   H  HCH2  0   0.279  26.1499  48.7816  33.1100
 I20  H8    H  HCH1  0   0.289  23.5733  47.9210  31.6691
 I20  H91   H  HCH2  0   0.273  24.2692  46.3108  33.3728
 I20  H92   H  HCH2  0   0.252  24.4023  47.5604  34.5893
 I20  H12   H  HCR6  0   0.245  22.4787  48.2554  35.8317
 I20  H13   H  HCR6  0   0.255  20.0775  48.0428  36.3247
 I20  H14   H  HCR6  0   0.255  18.6037  46.7609  34.8019
 I20  H15   H  HCR6  0   0.255  19.5626  45.6922  32.7835
 I20  H16   H  HCR6  0   0.248  21.9622  45.9117  32.2895
 I20  H271  H  HCH2  0   0.258  26.2250  49.8128  26.9150
 I20  H272  H  HCH2  0   0.262  26.9069  48.4504  26.0648
 I20  H291  H  HNH2  0   0.373  27.8433  50.1641  23.0798
 I20  H292  H  HNH2  0   0.364  28.8572  50.4476  24.3211
 I20  H321  H  HCH2  0   0.267  29.1846  49.2474  26.3651
 I20  H322  H  HCH2  0   0.265  28.6400  50.7723  27.0528
 I20  H35   H  HCH1  0   0.314  22.6852  51.8258  33.9320
 I20  HG1   H  HCH2  0   0.238  25.2189  54.9902  22.5708
 I20  HG2   H  HCH2  0   0.241  24.0695  54.6895  23.8602
 I20  HB1   H  HCH2  0   0.251  23.6560  52.4857  23.1792
 I20  HB2   H  HCH2  0   0.261  24.1959  53.0702  21.6084
 I20  HA1   H  HCH2  0   0.278  25.4464  50.9643  22.7663
 I20  HA2   H  HCH2  0   0.276  26.4430  52.2053  21.9800
 I20  H28   H  HCH1  0   0.309  26.0151  49.7936  24.4262
 I20  HN3   H  HNH1  0   0.402  28.0664  50.8667  29.1553
 I20  HO6   H  HOH1  0   0.499  25.5530  51.2832  31.8559
 I20  HN34  H  HNH1  0   0.403  24.7631  49.8079  34.4573
 I20  HO39  H  HOH1  0   0.494  25.1150  54.4062  34.2460
 I20  H361  H  HCH3  0   0.254  22.6395  50.8052  36.1771
 I20  H362  H  HCH3  0   0.244  24.3141  51.2818  36.4705
 I20  H363  H  HCH3  0   0.258  23.0550  52.5100  36.3009
 I20  HD    H  HCR5  0   0.475  26.4643  53.2197  26.0548
 I20  CE    C  CSP   0   0.080  27.2581  54.6150  24.1546

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
 I20  CB   CG    single    1.542  0.020  1.542
 I20  CB   CA    single    1.525  0.020  1.525
 I20  CG   CD    single    1.525  0.020  1.525
 I20  CA   N     single    1.459  0.020  1.459
 I20  CD   CE    single    1.402  0.020  1.402
 I20  CD   N     single    1.447  0.020  1.447
 I20  CE   NZ    triple    1.165  0.020  1.165
 I20  N    C     single    1.297  0.020  1.297
 I20  C    C28   single    1.515  0.020  1.515
 I20  C    O     double    1.300  0.020  1.300
 I20  N29  C28   single    1.450  0.020  1.450
 I20  C28  C27   single    1.527  0.020  1.527
 I20  C27  C32   single    1.533  0.020  1.533
 I20  C32  C30   single    1.510  0.020  1.510
 I20  O31  C30   double    1.221  0.020  1.221
 I20  C30  N3    single    1.350  0.020  1.350
 I20  N3   C2    single    1.442  0.020  1.442
 I20  O5   P4    double    1.491  0.020  1.491
 I20  C2   P4    single    1.845  0.020  1.845
 I20  C2   C1    single    1.522  0.020  1.522
 I20  P4   O6    single    1.606  0.020  1.606
 I20  P4   C7    single    1.818  0.020  1.818
 I20  C7   C8    single    1.533  0.020  1.533
 I20  C8   C9    single    1.540  0.020  1.540
 I20  C8   C10   single    1.523  0.020  1.523
 I20  C9   C11   single    1.503  0.020  1.503
 I20  C10  O33   double    1.217  0.020  1.217
 I20  C10  N34   single    1.351  0.020  1.351
 I20  C16  C11   aromatic  1.394  0.020  1.394
 I20  C16  C15   aromatic  1.387  0.020  1.387
 I20  N34  C35   single    1.437  0.020  1.437
 I20  O38  C37   double    1.212  0.020  1.212
 I20  C11  C12   aromatic  1.392  0.020  1.392
 I20  C15  C14   aromatic  1.390  0.020  1.390
 I20  C37  C35   single    1.522  0.020  1.522
 I20  C37  O39   single    1.313  0.020  1.313
 I20  C35  C36   single    1.527  0.020  1.527
 I20  C12  C13   aromatic  1.389  0.020  1.389
 I20  C14  C13   aromatic  1.388  0.020  1.388
 I20  C1   H11   single    0.970  0.020  1.090
 I20  C1   H12A  single    0.970  0.020  1.090
 I20  C1   H13A  single    0.970  0.020  1.090
 I20  C2   H2    single    0.970  0.020  1.090
 I20  C7   H71   single    0.970  0.020  1.090
 I20  C7   H72   single    0.970  0.020  1.090
 I20  C8   H8    single    0.970  0.020  1.090
 I20  C9   H91   single    0.970  0.020  1.090
 I20  C9   H92   single    0.970  0.020  1.090
 I20  C12  H12   single    0.930  0.020  1.080
 I20  C13  H13   single    0.930  0.020  1.080
 I20  C14  H14   single    0.930  0.020  1.080
 I20  C15  H15   single    0.930  0.020  1.080
 I20  C16  H16   single    0.930  0.020  1.080
 I20  C27  H271  single    0.970  0.020  1.090
 I20  C27  H272  single    0.970  0.020  1.090
 I20  N29  H291  single    0.890  0.020  1.040
 I20  N29  H292  single    0.890  0.020  1.040
 I20  C32  H321  single    0.970  0.020  1.090
 I20  C32  H322  single    0.970  0.020  1.090
 I20  C35  H35   single    0.970  0.020  1.090
 I20  CD   HD    single    0.970  0.020  1.090
 I20  CG   HG1   single    0.970  0.020  1.090
 I20  CG   HG2   single    0.970  0.020  1.090
 I20  CB   HB1   single    0.970  0.020  1.090
 I20  CB   HB2   single    0.970  0.020  1.090
 I20  CA   HA1   single    0.970  0.020  1.090
 I20  CA   HA2   single    0.970  0.020  1.090
 I20  C28  H28   single    0.970  0.020  1.090
 I20  N3   HN3   single    0.860  0.020  1.020
 I20  O6   HO6   single    0.850  0.020  0.980
 I20  N34  HN34  single    0.860  0.020  1.020
 I20  O39  HO39  single    0.850  0.020  0.980
 I20  C36  H361  single    0.970  0.020  1.090
 I20  C36  H362  single    0.970  0.020  1.090
 I20  C36  H363  single    0.970  0.020  1.090

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
 I20  H13A  C1   H12A  107.99  3.000
 I20  H13A  C1   H11   107.91  3.000
 I20  H12A  C1   H11   107.58  3.000
 I20  H13A  C1   C2    111.83  3.000
 I20  H12A  C1   C2    109.86  3.000
 I20  H11   C1   C2    111.51  3.000
 I20  H2    C2   P4    106.40  3.000
 I20  H2    C2   N3    108.09  3.000
 I20  P4    C2   N3    107.76  3.000
 I20  H2    C2   C1    109.31  3.000
 I20  P4    C2   C1    113.58  3.000
 I20  N3    C2   C1    111.45  3.000
 I20  H72   C7   H71   105.43  3.000
 I20  H72   C7   P4    110.68  3.000
 I20  H71   C7   P4    105.21  3.000
 I20  H72   C7   C8    112.17  3.000
 I20  H71   C7   C8    108.69  3.000
 I20  P4    C7   C8    114.05  3.000
 I20  H8    C8   C10   106.28  3.000
 I20  H8    C8   C9    108.05  3.000
 I20  C10   C8   C9    110.98  3.000
 I20  H8    C8   C7    108.60  3.000
 I20  C10   C8   C7    112.48  3.000
 I20  C9    C8   C7    110.25  3.000
 I20  H92   C9   H91   106.30  3.000
 I20  H92   C9   C11   110.00  3.000
 I20  H91   C9   C11   110.19  3.000
 I20  H92   C9   C8    110.20  3.000
 I20  H91   C9   C8    107.60  3.000
 I20  C11   C9   C8    112.35  3.000
 I20  O33   C10  N34   123.04  3.000
 I20  N34   C10  C8    114.43  3.000
 I20  O33   C10  C8    122.54  3.000
 I20  C16   C11  C12   118.56  3.000
 I20  C12   C11  C9    121.02  3.000
 I20  C16   C11  C9    120.40  3.000
 I20  H12   C12  C13   119.53  3.000
 I20  H12   C12  C11   119.62  3.000
 I20  C13   C12  C11   120.85  3.000
 I20  H13   C13  C14   120.17  3.000
 I20  H13   C13  C12   119.74  3.000
 I20  C14   C13  C12   120.10  3.000
 I20  H14   C14  C15   120.21  3.000
 I20  H14   C14  C13   120.24  3.000
 I20  C15   C14  C13   119.55  3.000
 I20  H15   C15  C16   119.79  3.000
 I20  H15   C15  C14   120.08  3.000
 I20  C16   C15  C14   120.13  3.000
 I20  H16   C16  C15   119.55  3.000
 I20  H16   C16  C11   119.63  3.000
 I20  C15   C16  C11   120.82  3.000
 I20  H272  C27  H271  106.13  3.000
 I20  H272  C27  C28   106.51  3.000
 I20  H271  C27  C28   109.96  3.000
 I20  H272  C27  C32   108.36  3.000
 I20  H271  C27  C32   110.41  3.000
 I20  C28   C27  C32   115.01  3.000
 I20  H292  N29  H291  107.12  3.000
 I20  H292  N29  C28   111.79  3.000
 I20  H291  N29  C28   111.92  3.000
 I20  N3    C30  O31   123.02  3.000
 I20  N3    C30  C32   114.76  3.000
 I20  O31   C30  C32   122.20  3.000
 I20  H322  C32  H321  107.52  3.000
 I20  H322  C32  C30   110.91  3.000
 I20  H321  C32  C30   108.39  3.000
 I20  H322  C32  C27   111.63  3.000
 I20  H321  C32  C27   109.87  3.000
 I20  C30   C32  C27   108.46  3.000
 I20  H35   C35  C36   108.89  3.000
 I20  H35   C35  C37   106.41  3.000
 I20  C36   C35  C37   112.90  3.000
 I20  H35   C35  N34   107.85  3.000
 I20  C36   C35  N34   111.03  3.000
 I20  C37   C35  N34   109.53  3.000
 I20  HD    CD   N      76.77  3.000
 I20  HD    CD   CG    141.90  3.000
 I20  N     CD   CG    105.87  3.000
 I20  HD    CD   CE     93.40  3.000
 I20  N     CD   CE    113.49  3.000
 I20  CG    CD   CE    118.29  3.000
 I20  HG2   CG   HG1   106.82  3.000
 I20  HG2   CG   CB    110.23  3.000
 I20  HG1   CG   CB    110.55  3.000
 I20  HG2   CG   CD    113.11  3.000
 I20  HG1   CG   CD    111.64  3.000
 I20  CB    CG   CD    104.54  3.000
 I20  HB2   CB   HB1   107.81  3.000
 I20  HB2   CB   CA    111.57  3.000
 I20  HB1   CB   CA    109.08  3.000
 I20  HB2   CB   CG    112.66  3.000
 I20  HB1   CB   CG    110.39  3.000
 I20  CA    CB   CG    105.30  3.000
 I20  HA2   CA   HA1   109.12  3.000
 I20  HA2   CA   N     108.74  3.000
 I20  HA1   CA   N     112.21  3.000
 I20  HA2   CA   CB    112.17  3.000
 I20  HA1   CA   CB    112.97  3.000
 I20  N     CA   CB    101.42  3.000
 I20  C     N    CA    127.75  3.000
 I20  C     N    CD    120.12  3.000
 I20  CA    N    CD    110.62  3.000
 I20  C28   C    O     119.75  3.000
 I20  O     C    N     117.13  3.000
 I20  C28   C    N     123.10  3.000
 I20  H28   C28  C     106.29  3.000
 I20  H28   C28  N29   107.20  3.000
 I20  C     C28  N29   112.34  3.000
 I20  H28   C28  C27   106.43  3.000
 I20  N29   C28  C27   111.17  3.000
 I20  C     C28  C27   112.93  3.000
 I20  HN3   N3   C30   118.31  3.000
 I20  HN3   N3   C2    117.04  3.000
 I20  C30   N3   C2    123.15  3.000
 I20  O6    P4   C7    108.40  3.000
 I20  C7    P4   O5    113.43  3.000
 I20  O6    P4   O5    110.15  3.000
 I20  C7    P4   C2    105.68  3.000
 I20  O6    P4   C2    105.78  3.000
 I20  O5    P4   C2    112.99  3.000
 I20  HO6   O6   P4    120.00  3.000
 I20  HN34  N34  C35   116.31  3.000
 I20  HN34  N34  C10   119.21  3.000
 I20  C35   N34  C10   124.48  3.000
 I20  O38   C37  O39   123.02  3.000
 I20  O39   C37  C35   112.52  3.000
 I20  O38   C37  C35   124.46  3.000
 I20  HO39  O39  C37   110.81  3.000
 I20  H363  C36  H362  108.48  3.000
 I20  H363  C36  H361  107.90  3.000
 I20  H362  C36  H361  108.24  3.000
 I20  H363  C36  C35   111.73  3.000
 I20  H362  C36  C35   111.33  3.000
 I20  H361  C36  C35   109.04  3.000
 I20  CD    CE   NZ    180.00  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
 I20  CONST_01  C14   C15  C16  C11    0.00   0.0  0
 I20  CONST_02  C14   C13  C12  C11    0.00   0.0  0
 I20  CONST_03  C15   C16  C11  C12    0.00   0.0  0
 I20  CONST_04  C15   C14  C13  C12    0.00   0.0  0
 I20  CONST_05  C16   C11  C12  C13    0.00   0.0  0
 I20  CONST_06  C16   C15  C14  C13    0.00   0.0  0
 I20  CONST_07  C15   C16  C11  C9   180.00   0.0  0
 I20  CONST_08  C13   C12  C11  C9   180.00   0.0  0
 I20  CONST_09  H15   C15  C16  C11  180.00   0.0  0
 I20  CONST_10  H13   C13  C12  C11  180.00   0.0  0
 I20  CONST_11  H16   C16  C11  C12  180.00   0.0  0
 I20  CONST_12  H14   C14  C13  C12  180.00   0.0  0
 I20  CONST_13  H12   C12  C13  C14  180.00   0.0  0
 I20  CONST_14  C28   C    N    CD   180.00   0.0  0
 I20  CONST_15  O     C    N    CD     0.00   0.0  0
 I20  CONST_18  C32   C30  N3   C2   180.00   0.0  0
 I20  CONST_19  O31   C30  N3   C2     0.00   0.0  0
 I20  CONST_20  C35   N34  C10  C8   180.00   0.0  0
 I20  CONST_21  O33   C10  N34  C35    0.00   0.0  0
 I20  CONST_22  HN34  N34  C10  C8     0.00   0.0  0
 I20  CONST_23  HN3   N3   C30  C32    0.00   0.0  0
 I20  CONST_24  HO39  O39  C37  C35  180.00   0.0  0
 I20  Var_01    CA    CB   CG   CD   -21.26  30.0  1
 I20  Var_02    CB    CA   N    CD   -34.39  30.0  1
 I20  Var_03    N     CA   CB   CG    33.13  30.0  1
 I20  Var_04    C16   C11  C9   C8    75.10  30.0  2
 I20  Var_05    C8    C7   P4   C2   176.51  30.0  3
 I20  Var_06    O31   C30  C32  C27   75.89  30.0  3
 I20  Var_07    C28   C27  C32  C30  176.27  30.0  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
 I20  chir_01  C2   N3   P4   C1   positiv
 I20  chir_02  C8   C10  C9   C7   positiv
 I20  chir_03  C35  N34  C37  C36  positiv
 I20  chir_04  CD   CG   CE   N    positiv
 I20  chir_05  C28  N29  C27  C    negativ
 I20  chir_06  P4   C2   O6   C7   both

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
 I20  plan-1  C9    0.020
 I20  plan-1  C11   0.020
 I20  plan-1  C12   0.020
 I20  plan-1  C13   0.020
 I20  plan-1  C14   0.020
 I20  plan-1  C15   0.020
 I20  plan-1  C16   0.020
 I20  plan-1  H12   0.020
 I20  plan-1  H13   0.020
 I20  plan-1  H14   0.020
 I20  plan-1  H15   0.020
 I20  plan-1  H16   0.020
 I20  plan-2  C2    0.020
 I20  plan-2  C30   0.020
 I20  plan-2  C32   0.020
 I20  plan-2  O31   0.020
 I20  plan-2  N3    0.020
 I20  plan-2  HN3   0.020
 I20  plan-3  CD    0.020
 I20  plan-3  CA    0.020
 I20  plan-3  N     0.020
 I20  plan-3  C     0.020
 I20  plan-3  O     0.020
 I20  plan-3  C28   0.020
 I20  plan-4  C8    0.020
 I20  plan-4  C10   0.020
 I20  plan-4  C35   0.020
 I20  plan-4  N34   0.020
 I20  plan-4  O33   0.020
 I20  plan-4  HN34  0.020
 I20  plan-5  C35   0.020
 I20  plan-5  C37   0.020
 I20  plan-5  O39   0.020
 I20  plan-5  O38   0.020
 I20  plan-5  HO39  0.020

