# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Fri May  8 11:24:50 2020
#   Inital geometry file: a 167 line input string
#   Ligand name: 5-[(1R)-3-amino-4-fluoro-1-{3-[5-(prop-1-yn-1-yl)pyridin-3-yl]phenyl}-1H-isoindol-1-yl]-1-ethyl-3-methylpyridin-2(1H)-one
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CCN1C=C(C=C(C)C1=O)[C@@]2(N=C(N)c3c(F)cccc23)c4cccc(c4)c5cncc(c5)C#CC
#
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
 I6X  I6X  5-[(1R)-3-amino-4-fluoro-1-{3-[5-(prop-1-yn-1-yl)pyridin-3-yl]phenyl}-1H-isoindol-1-yl]-1-ethyl-3-methylpyridin-2(1H)-one  ligand  61  36  .  2021-08-11  2021-08-11  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as GRAND
;

data_comp_I6X
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
 I6X  C1    C  CH3   0  -0.660   4.4192   3.4456   1.9281
 I6X  C2    C  CH2   0  -0.323   2.9038   3.4189   2.0203
 I6X  N3    N  NR6   0  -0.509   2.2994   2.6981   0.8990
 I6X  C4    C  CR16  0   0.005   2.1003   1.3598   1.0289
 I6X  C5    C  CR6   0   0.011   1.5929   0.6059   0.0248
 I6X  C6    C  CR16  0  -0.183   1.2541   1.2765  -1.1788
 I6X  C7    C  CR6   0  -0.123   1.4525   2.6109  -1.3390
 I6X  C8    C  CR6   0   0.547   2.0268   3.3940  -0.2651
 I6X  O9    O  O     0  -0.510   2.2578   4.5991  -0.3495
 I6X  C10   C  CH3   0  -0.709   1.1025   3.3373  -2.5969
 I6X  C11   C  CR5   0  -0.158   1.4224  -0.8975   0.1631
 I6X  C12   C  CR56  0   0.133   2.5467  -1.5928  -0.5871
 I6X  C13   C  CR16  0  -0.335   2.9201  -1.5669  -1.9181
 I6X  C14   C  CR16  0  -0.232   4.0427  -2.2941  -2.3000
 I6X  C15   C  CR16  0  -0.420   4.7805  -3.0279  -1.3762
 I6X  C16   C  CR6   0   0.552   4.3816  -3.0334  -0.0541
 I6X  C17   C  CR56  0  -0.201   3.2665  -2.3239   0.3466
 I6X  C18   C  CR5   0   0.429   2.5988  -2.1051   1.6396
 I6X  N19   N  N     0  -0.432   1.5868  -1.3144   1.5480
 I6X  N20   N  NH2   0  -0.839   3.0384  -2.6373   2.7939
 I6X  F21   F  F     0  -0.304   5.0863  -3.7369   0.8434
 I6X  C22   C  CR6   0   0.231   0.0282  -1.3229  -0.2887
 I6X  C23   C  CR16  0  -0.335  -0.1928  -2.4115  -1.1223
 I6X  C24   C  CR16  0  -0.224  -1.4891  -2.7831  -1.4607
 I6X  C25   C  CR16  0  -0.324  -2.5726  -2.0759  -0.9721
 I6X  C26   C  CR6   0   0.101  -2.3707  -0.9816  -0.1282
 I6X  C27   C  CR16  0  -0.346  -1.0684  -0.6211   0.2040
 I6X  C28   C  CR6   0   0.005  -3.5163  -0.2186   0.3996
 I6X  C29   C  CR16  0  -0.237  -4.6466   0.0240  -0.3718
 I6X  C30   C  CR6   0  -0.161  -5.7080   0.7496   0.1648
 I6X  C31   C  CR16  0  -0.099  -5.5807   1.2128   1.4770
 I6X  N32   N  N     0  -0.388  -4.5116   0.9850   2.2216
 I6X  C33   C  CR16  0  -0.099  -3.5120   0.2883   1.6998
 I6X  C34   C  CSP   0   0.200  -6.8825   1.0211  -0.5933
 I6X  C35   C  CSP   0  -0.043  -7.8807   1.2485  -1.2292
 I6X  C36   C  CH3   0  -0.822  -9.0820   1.5188  -1.9992
 I6X  H11C  H  HCH3  0   0.242   4.8326   3.9763   2.7854
 I6X  H12C  H  HCH3  0   0.232   4.8297   2.4354   1.9287
 I6X  H13C  H  HCH3  0   0.238   4.7530   3.9528   1.0238
 I6X  H21C  H  HCH2  0   0.260   2.5841   2.9247   2.9367
 I6X  H22C  H  HCH2  0   0.264   2.4991   4.4277   2.0399
 I6X  H4    H  HCR6  0   0.297   2.3667   0.9352   1.9862
 I6X  H6    H  HCR6  0   0.260   0.8084   0.7167  -1.9944
 I6X  H101  H  HCH3  0   0.243   0.3921   4.1437  -2.4071
 I6X  H102  H  HCH3  0   0.244   1.9827   3.7928  -3.0538
 I6X  H103  H  HCH3  0   0.242   0.6571   2.6610  -3.3246
 I6X  H13   H  HCR6  0   0.262   2.3627  -1.0074  -2.6570
 I6X  H14   H  HCR6  0   0.277   4.3545  -2.2932  -3.3357
 I6X  H15   H  HCR6  0   0.288   5.6552  -3.5853  -1.6838
 I6X  H201  H  HNH2  0   0.400   3.6484  -3.4349   2.7820
 I6X  H202  H  HNH2  0   0.396   2.4518  -2.5489   3.6070
 I6X  H23   H  HCR6  0   0.258   0.6375  -2.9812  -1.5176
 I6X  H27   H  HCR6  0   0.254  -0.9005   0.2373   0.8439
 I6X  H24   H  HCR6  0   0.261  -1.6495  -3.6359  -2.1070
 I6X  H25   H  HCR6  0   0.259  -3.5769  -2.3873  -1.2307
 I6X  H29   H  HCR6  0   0.272  -4.7045  -0.3313  -1.3927
 I6X  H33   H  HCR6  0   0.267  -2.6637   0.1060   2.3511
 I6X  H31   H  HCR6  0   0.268  -6.3833   1.7858   1.9271
 I6X  H361  H  HCH3  0   0.272  -9.5792   2.4213  -1.6437
 I6X  H362  H  HCH3  0   0.272  -8.8455   1.6570  -3.0543
 I6X  H363  H  HCH3  0   0.272  -9.7897   0.6931  -1.9204

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
 I6X  C1   C2    single    1.519  0.020  1.519
 I6X  C2   N3    single    1.464  0.020  1.464
 I6X  N3   C4    single    1.359  0.020  1.359
 I6X  N3   C8    single    1.383  0.020  1.383
 I6X  C4   C5    double    1.354  0.020  1.354
 I6X  C5   C6    single    1.419  0.020  1.419
 I6X  C5   C11   single    1.519  0.020  1.519
 I6X  C6   C7    double    1.359  0.020  1.359
 I6X  C7   C8    single    1.448  0.020  1.448
 I6X  C7   C10   single    1.494  0.020  1.494
 I6X  C8   O9    double    1.230  0.020  1.230
 I6X  C11  C12   single    1.520  0.020  1.520
 I6X  C11  N19   single    1.456  0.020  1.456
 I6X  C11  C22   single    1.526  0.020  1.526
 I6X  C12  C13   aromatic  1.383  0.020  1.383
 I6X  C12  C17   aromatic  1.387  0.020  1.387
 I6X  C13  C14   aromatic  1.391  0.020  1.391
 I6X  C14  C15   aromatic  1.391  0.020  1.391
 I6X  C15  C16   aromatic  1.381  0.020  1.381
 I6X  C16  C17   aromatic  1.381  0.020  1.381
 I6X  C16  F21   single    1.341  0.020  1.341
 I6X  C17  C18   single    1.472  0.020  1.472
 I6X  C18  N19   double    1.288  0.020  1.288
 I6X  C18  N20   single    1.345  0.020  1.345
 I6X  C22  C23   aromatic  1.389  0.020  1.389
 I6X  C22  C27   aromatic  1.392  0.020  1.392
 I6X  C23  C24   aromatic  1.390  0.020  1.390
 I6X  C24  C25   aromatic  1.383  0.020  1.383
 I6X  C25  C26   aromatic  1.397  0.020  1.397
 I6X  C26  C27   aromatic  1.392  0.020  1.392
 I6X  C26  C28   single    1.474  0.020  1.474
 I6X  C28  C29   aromatic  1.390  0.020  1.390
 I6X  C28  C33   aromatic  1.395  0.020  1.395
 I6X  C29  C30   aromatic  1.393  0.020  1.393
 I6X  C30  C31   aromatic  1.397  0.020  1.397
 I6X  C30  C34   single    1.424  0.020  1.424
 I6X  C31  N32   aromatic  1.323  0.020  1.323
 I6X  N32  C33   aromatic  1.326  0.020  1.326
 I6X  C34  C35   triple    1.205  0.020  1.205
 I6X  C35  C36   single    1.452  0.020  1.452
 I6X  C1   H11C  single    0.970  0.020  1.090
 I6X  C1   H12C  single    0.970  0.020  1.090
 I6X  C1   H13C  single    0.970  0.020  1.090
 I6X  C2   H21C  single    0.970  0.020  1.090
 I6X  C2   H22C  single    0.970  0.020  1.090
 I6X  C4   H4    single    0.930  0.020  1.080
 I6X  C6   H6    single    0.930  0.020  1.080
 I6X  C10  H101  single    0.970  0.020  1.090
 I6X  C10  H102  single    0.970  0.020  1.090
 I6X  C10  H103  single    0.970  0.020  1.090
 I6X  C13  H13   single    0.930  0.020  1.080
 I6X  C14  H14   single    0.930  0.020  1.080
 I6X  C15  H15   single    0.930  0.020  1.080
 I6X  N20  H201  single    0.890  0.020  1.040
 I6X  N20  H202  single    0.890  0.020  1.040
 I6X  C23  H23   single    0.930  0.020  1.080
 I6X  C27  H27   single    0.930  0.020  1.080
 I6X  C24  H24   single    0.930  0.020  1.080
 I6X  C25  H25   single    0.930  0.020  1.080
 I6X  C29  H29   single    0.930  0.020  1.080
 I6X  C33  H33   single    0.930  0.020  1.080
 I6X  C31  H31   single    0.930  0.020  1.080
 I6X  C36  H361  single    0.970  0.020  1.090
 I6X  C36  H362  single    0.970  0.020  1.090
 I6X  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
 I6X  H13C  C1   H12C  108.45  3.000
 I6X  H13C  C1   H11C  108.07  3.000
 I6X  H12C  C1   H11C  107.94  3.000
 I6X  H13C  C1   C2    111.37  3.000
 I6X  H12C  C1   C2    111.06  3.000
 I6X  H11C  C1   C2    109.84  3.000
 I6X  H22C  C2   H21C  107.26  3.000
 I6X  H22C  C2   N3    108.49  3.000
 I6X  H21C  C2   N3    107.46  3.000
 I6X  H22C  C2   C1    110.87  3.000
 I6X  H21C  C2   C1    110.61  3.000
 I6X  N3    C2   C1    111.98  3.000
 I6X  C8    N3   C4    123.15  3.000
 I6X  C8    N3   C2    118.58  3.000
 I6X  C4    N3   C2    118.17  3.000
 I6X  H4    C4   C5    122.04  3.000
 I6X  H4    C4   N3    115.82  3.000
 I6X  C5    C4   N3    122.15  3.000
 I6X  C11   C5   C6    121.21  3.000
 I6X  C11   C5   C4    121.69  3.000
 I6X  C6    C5   C4    117.09  3.000
 I6X  H6    C6   C7    118.56  3.000
 I6X  H6    C6   C5    119.47  3.000
 I6X  C7    C6   C5    121.96  3.000
 I6X  C10   C7   C8    117.03  3.000
 I6X  C10   C7   C6    122.86  3.000
 I6X  C8    C7   C6    120.11  3.000
 I6X  O9    C8   C7    123.61  3.000
 I6X  O9    C8   N3    120.90  3.000
 I6X  C7    C8   N3    115.48  3.000
 I6X  H103  C10  H102  108.02  3.000
 I6X  H103  C10  H101  108.00  3.000
 I6X  H102  C10  H101  106.82  3.000
 I6X  H103  C10  C7    110.89  3.000
 I6X  H102  C10  C7    111.50  3.000
 I6X  H101  C10  C7    111.42  3.000
 I6X  C22   C11  N19   107.76  3.000
 I6X  C22   C11  C12   113.71  3.000
 I6X  N19   C11  C12   104.78  3.000
 I6X  C22   C11  C5    110.57  3.000
 I6X  N19   C11  C5    110.94  3.000
 I6X  C12   C11  C5    108.95  3.000
 I6X  C17   C12  C13   121.17  3.000
 I6X  C17   C12  C11   107.02  3.000
 I6X  C13   C12  C11   131.79  3.000
 I6X  H13   C13  C14   119.93  3.000
 I6X  H13   C13  C12   121.87  3.000
 I6X  C14   C13  C12   118.20  3.000
 I6X  H14   C14  C15   118.90  3.000
 I6X  H14   C14  C13   119.67  3.000
 I6X  C15   C14  C13   121.43  3.000
 I6X  H15   C15  C16   120.24  3.000
 I6X  H15   C15  C14   120.78  3.000
 I6X  C16   C15  C14   118.98  3.000
 I6X  F21   C16  C17   119.99  3.000
 I6X  F21   C16  C15   119.42  3.000
 I6X  C17   C16  C15   120.59  3.000
 I6X  C18   C17  C16   134.24  3.000
 I6X  C18   C17  C12   106.12  3.000
 I6X  C16   C17  C12   119.63  3.000
 I6X  N20   C18  N19   124.12  3.000
 I6X  N20   C18  C17   123.16  3.000
 I6X  N19   C18  C17   112.67  3.000
 I6X  C18   N19  C11   109.41  3.000
 I6X  H202  N20  H201  115.67  3.000
 I6X  H202  N20  C18   117.91  3.000
 I6X  H201  N20  C18   120.18  3.000
 I6X  C27   C22  C23   118.83  3.000
 I6X  C27   C22  C11   118.32  3.000
 I6X  C23   C22  C11   122.79  3.000
 I6X  H23   C23  C24   119.07  3.000
 I6X  H23   C23  C22   120.66  3.000
 I6X  C24   C23  C22   120.26  3.000
 I6X  H24   C24  C25   119.86  3.000
 I6X  H24   C24  C23   119.62  3.000
 I6X  C25   C24  C23   120.52  3.000
 I6X  H25   C25  C26   120.25  3.000
 I6X  H25   C25  C24   119.69  3.000
 I6X  C26   C25  C24   120.06  3.000
 I6X  C28   C26  C27   120.51  3.000
 I6X  C28   C26  C25   120.64  3.000
 I6X  C27   C26  C25   118.85  3.000
 I6X  H27   C27  C26   119.42  3.000
 I6X  H27   C27  C22   119.09  3.000
 I6X  C26   C27  C22   121.48  3.000
 I6X  C33   C28  C29   117.14  3.000
 I6X  C33   C28  C26   121.28  3.000
 I6X  C29   C28  C26   121.58  3.000
 I6X  H29   C29  C30   119.56  3.000
 I6X  H29   C29  C28   120.64  3.000
 I6X  C30   C29  C28   119.79  3.000
 I6X  C34   C30  C31   120.79  3.000
 I6X  C34   C30  C29   121.51  3.000
 I6X  C31   C30  C29   117.70  3.000
 I6X  H31   C31  N32   117.11  3.000
 I6X  H31   C31  C30   119.85  3.000
 I6X  N32   C31  C30   123.04  3.000
 I6X  C33   N32  C31   118.58  3.000
 I6X  H33   C33  N32   116.21  3.000
 I6X  H33   C33  C28   120.05  3.000
 I6X  N32   C33  C28   123.74  3.000
 I6X  C35   C34  C30   180.00  3.000
 I6X  C36   C35  C34   180.00  3.000
 I6X  H363  C36  H362  107.87  3.000
 I6X  H363  C36  H361  107.90  3.000
 I6X  H362  C36  H361  108.04  3.000
 I6X  H363  C36  C35   110.96  3.000
 I6X  H362  C36  C35   110.93  3.000
 I6X  H361  C36  C35   111.01  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
 I6X  CONST_01  C15   C14  C13  C12     0.00   0.0  0
 I6X  CONST_02  C15   C16  C17  C12     0.00   0.0  0
 I6X  CONST_03  C16   C17  C12  C13     0.00   0.0  0
 I6X  CONST_04  C16   C15  C14  C13     0.00   0.0  0
 I6X  CONST_05  C17   C12  C13  C14     0.00   0.0  0
 I6X  CONST_06  C17   C16  C15  C14     0.00   0.0  0
 I6X  CONST_07  C25   C24  C23  C22     0.00   0.0  0
 I6X  CONST_08  C25   C26  C27  C22     0.00   0.0  0
 I6X  CONST_09  C28   C26  C27  C22   180.00   0.0  0
 I6X  CONST_10  C26   C27  C22  C23     0.00   0.0  0
 I6X  CONST_11  C26   C25  C24  C23     0.00   0.0  0
 I6X  CONST_12  C27   C22  C23  C24     0.00   0.0  0
 I6X  CONST_13  C27   C26  C25  C24     0.00   0.0  0
 I6X  CONST_14  C28   C26  C25  C24   180.00   0.0  0
 I6X  CONST_17  C30   C29  C28  C26   180.00   0.0  0
 I6X  CONST_18  N32   C33  C28  C26   180.00   0.0  0
 I6X  CONST_21  C31   C30  C29  C28     0.00   0.0  0
 I6X  CONST_22  C31   N32  C33  C28     0.00   0.0  0
 I6X  CONST_23  N32   C33  C28  C29     0.00   0.0  0
 I6X  CONST_24  N32   C31  C30  C29     0.00   0.0  0
 I6X  CONST_25  C33   C28  C29  C30     0.00   0.0  0
 I6X  CONST_26  C33   N32  C31  C30     0.00   0.0  0
 I6X  CONST_27  C24   C23  C22  C11   180.00   0.0  0
 I6X  CONST_28  C26   C27  C22  C11   180.00   0.0  0
 I6X  CONST_29  C7    C8   N3   C4      0.00   0.0  0
 I6X  CONST_30  C17   C18  N19  C11     0.00   0.0  0
 I6X  CONST_31  F21   C16  C17  C12   180.00   0.0  0
 I6X  CONST_32  F21   C16  C15  C14   180.00   0.0  0
 I6X  CONST_33  F21   C16  C17  C18     0.00   0.0  0
 I6X  CONST_34  C34   C30  C29  C28   180.00   0.0  0
 I6X  CONST_35  C34   C30  C31  N32   180.00   0.0  0
 I6X  CONST_36  C7    C8   N3   C2    180.00   0.0  0
 I6X  CONST_37  O9    C8   N3   C4    180.00   0.0  0
 I6X  CONST_38  N20   C18  N19  C11   180.00   0.0  0
 I6X  CONST_39  H13   C13  C12  C11     0.00   0.0  0
 I6X  CONST_40  H23   C23  C22  C11     0.00   0.0  0
 I6X  CONST_41  H27   C27  C22  C11     0.00   0.0  0
 I6X  CONST_42  H14   C14  C13  C12   180.00   0.0  0
 I6X  CONST_43  H15   C15  C14  C13   180.00   0.0  0
 I6X  CONST_44  H24   C24  C23  C22   180.00   0.0  0
 I6X  CONST_45  H25   C25  C24  C23   180.00   0.0  0
 I6X  CONST_46  H29   C29  C28  C26     0.00   0.0  0
 I6X  CONST_47  H33   C33  C28  C26     0.00   0.0  0
 I6X  CONST_48  H31   C31  C30  C29   180.00   0.0  0
 I6X  CONST_49  O9    C8   N3   C2      0.00   0.0  0
 I6X  CONST_51  H202  N20  C18  C17   180.00   0.0  0
 I6X  Var_01    C4    N3   C2   C1     89.48  30.0  3
 I6X  Var_02    H101  C10  C7   C6    121.80  30.0  3
 I6X  Var_03    H11C  C1   C2   N3   -179.15  30.0  3
 I6X  Var_04    H361  C36  C35  C34  -169.17  30.0  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
 I6X  chir_01  C11  C12  N19  C22  positiv

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
 I6X  plan-1  C2    0.020
 I6X  plan-1  N3    0.020
 I6X  plan-1  C4    0.020
 I6X  plan-1  C5    0.020
 I6X  plan-1  C6    0.020
 I6X  plan-1  C7    0.020
 I6X  plan-1  C8    0.020
 I6X  plan-1  O9    0.020
 I6X  plan-1  C10   0.020
 I6X  plan-1  C11   0.020
 I6X  plan-1  H4    0.020
 I6X  plan-1  H6    0.020
 I6X  plan-2  C11   0.020
 I6X  plan-2  C22   0.020
 I6X  plan-2  C23   0.020
 I6X  plan-2  C24   0.020
 I6X  plan-2  C25   0.020
 I6X  plan-2  C26   0.020
 I6X  plan-2  C27   0.020
 I6X  plan-2  C28   0.020
 I6X  plan-2  H23   0.020
 I6X  plan-2  H27   0.020
 I6X  plan-2  H24   0.020
 I6X  plan-2  H25   0.020
 I6X  plan-3  C26   0.020
 I6X  plan-3  C28   0.020
 I6X  plan-3  C29   0.020
 I6X  plan-3  C30   0.020
 I6X  plan-3  C31   0.020
 I6X  plan-3  N32   0.020
 I6X  plan-3  C33   0.020
 I6X  plan-3  C34   0.020
 I6X  plan-3  C35   0.020
 I6X  plan-3  H29   0.020
 I6X  plan-3  H33   0.020
 I6X  plan-3  H31   0.020
 I6X  plan-4  C5    0.020
 I6X  plan-4  C11   0.020
 I6X  plan-4  C12   0.020
 I6X  plan-4  C13   0.020
 I6X  plan-4  C14   0.020
 I6X  plan-4  C15   0.020
 I6X  plan-4  C16   0.020
 I6X  plan-4  C17   0.020
 I6X  plan-4  C18   0.020
 I6X  plan-4  N19   0.020
 I6X  plan-4  N20   0.020
 I6X  plan-4  F21   0.020
 I6X  plan-4  C22   0.020
 I6X  plan-4  H13   0.020
 I6X  plan-4  H14   0.020
 I6X  plan-4  H15   0.020
 I6X  plan-4  H201  0.020
 I6X  plan-4  H202  0.020

