# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sun Apr 12 21:10:16 2020
#   Inital geometry file: a 163 line input string
#   Ligand name: 2-{4-[(4'-methoxybiphenyl-3-yl)sulfonyl]piperazin-1-yl}-3-(4-methoxyphenyl)pyrazine
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: COc1ccc(cc1)c2cccc(c2)[S](=O)(=O)N3CCN(CC3)c4nccnc4c5ccc(OC)cc5
#
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
 751  751  2-{4-[(4'-methoxybiphenyl-3-yl)sulfonyl]piperazin-1-yl}-3-(4-methoxyphenyl)pyrazine  ligand  65  37  .  2022-07-23  2022-07-26
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK (reasonable std)
;

data_comp_751
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
 751  C28   C  CH3   0  -0.438   7.2594  -1.2293  -4.0015
 751  O4    O  O2    0  -0.468   7.2608  -1.6907  -2.6642
 751  C25   C  CR6   0   0.377   6.2399  -1.3438  -1.8624
 751  C26   C  CR16  0  -0.327   6.3064  -1.7951  -0.5418
 751  C27   C  CR16  0  -0.290   5.3027  -1.4833   0.3528
 751  C24   C  CR16  0  -0.369   5.1467  -0.5791  -2.2637
 751  C23   C  CR16  0  -0.290   4.1469  -0.2738  -1.3506
 751  C22   C  CR6   0   0.063   4.2012  -0.7127  -0.0310
 751  C18   C  CR6   0   0.112   3.1400  -0.3704   0.9329
 751  C17   C  CR16  0  -0.308   2.5232   0.8794   0.8917
 751  C19   C  CR16  0  -0.293   2.7338  -1.2769   1.9143
 751  C20   C  CR16  0  -0.233   1.7505  -0.9460   2.8335
 751  C21   C  CR16  0  -0.249   1.1377   0.2970   2.7932
 751  C16   C  CR6   0  -0.182   1.5316   1.1950   1.8089
 751  S1    S  S     0   1.379   0.6994   2.7540   1.6736
 751  O1    O  OS    0  -0.648   0.2051   3.1224   2.9890
 751  O2    O  OS    0  -0.648   1.5580   3.6729   0.9457
 751  N1    N  N     0  -0.570  -0.6248   2.4680   0.7178
 751  C4    C  CH2   0  -0.310  -1.6477   1.5912   1.2937
 751  C3    C  CH2   0  -0.316  -2.9008   1.6627   0.4460
 751  C1    C  CH2   0  -0.309  -0.3499   2.1846  -0.6926
 751  C2    C  CH2   0  -0.296  -1.6369   2.2680  -1.4946
 751  N2    N  NT    0  -0.514  -2.5904   1.3355  -0.9348
 751  C5    C  CR6   0   0.437  -3.5840   0.8224  -1.7430
 751  N3    N  N     0  -0.402  -3.8618   1.4475  -2.8740
 751  C6    C  CR16  0  -0.102  -4.8521   0.9803  -3.6262
 751  C7    C  CR16  0  -0.146  -5.6081  -0.1012  -3.2243
 751  N4    N  N     0  -0.365  -5.2926  -0.7795  -2.1247
 751  C8    C  CR6   0   0.156  -4.2672  -0.3749  -1.3963
 751  C9    C  CR6   0  -0.003  -3.8625  -1.2407  -0.2700
 751  C10   C  CR16  0  -0.261  -4.8257  -1.8269   0.5537
 751  C11   C  CR16  0  -0.331  -4.4644  -2.6615   1.5932
 751  C12   C  CR6   0   0.379  -3.1182  -2.9505   1.8298
 751  O3    O  O2    0  -0.467  -2.8537  -3.7635   2.8670
 751  C15   C  CH3   0  -0.437  -1.5044  -4.0541   3.1736
 751  C13   C  CR16  0  -0.364  -2.1478  -2.3944   0.9986
 751  C14   C  CR16  0  -0.259  -2.5261  -1.5498  -0.0346
 751  H281  H  HCH3  0   0.261   8.1705  -1.6067  -4.4588
 751  H282  H  HCH3  0   0.230   6.4016  -1.6070  -4.5639
 751  H283  H  HCH3  0   0.231   7.2640  -0.1377  -4.0558
 751  H26   H  HCR6  0   0.266   7.1581  -2.3820  -0.2212
 751  H24   H  HCR6  0   0.283   5.0506  -0.2191  -3.2788
 751  H27   H  HCR6  0   0.259   5.3928  -1.8282   1.3753
 751  H23   H  HCR6  0   0.256   3.2978   0.3038  -1.6952
 751  H17   H  HCR6  0   0.285   2.8456   1.6130   0.1642
 751  H19   H  HCR6  0   0.268   3.1832  -2.2608   1.9554
 751  H20   H  HCR6  0   0.273   1.4584  -1.6625   3.5892
 751  H21   H  HCR6  0   0.289   0.3798   0.5521   3.5213
 751  H41C  H  HCH2  0   0.244  -1.3026   0.5506   1.3408
 751  H42C  H  HCH2  0   0.282  -1.8879   1.9211   2.3023
 751  H11C  H  HCH2  0   0.281   0.3573   2.9138  -1.0814
 751  H12C  H  HCH2  0   0.239   0.0772   1.1819  -0.8210
 751  H31C  H  HCH2  0   0.281  -3.6331   0.9718   0.8577
 751  H32C  H  HCH2  0   0.252  -3.3291   2.6718   0.5077
 751  H21C  H  HCH2  0   0.233  -2.0165   3.2978  -1.4932
 751  H22C  H  HCH2  0   0.269  -1.4134   1.9974  -2.5249
 751  H6    H  HCR6  0   0.270  -5.0537   1.4911  -4.5601
 751  H7    H  HCR6  0   0.267  -6.4508  -0.4516  -3.8069
 751  H10   H  HCR6  0   0.254  -5.8742  -1.6141   0.3881
 751  H14   H  HCR6  0   0.264  -1.7538  -1.1299  -0.6648
 751  H11   H  HCR6  0   0.265  -5.2227  -3.0929   2.2347
 751  H13   H  HCR6  0   0.274  -1.0957  -2.6062   1.1346
 751  H151  H  HCH3  0   0.222  -0.9418  -3.1509   3.4260
 751  H152  H  HCH3  0   0.264  -1.5184  -4.7081   4.0415
 751  H153  H  HCH3  0   0.232  -0.9972  -4.5688   2.3536

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
 751  C28  O4    single    1.415  0.020  1.415
 751  O4   C25   single    1.344  0.020  1.344
 751  C25  C26   aromatic  1.397  0.020  1.397
 751  C25  C24   aromatic  1.393  0.020  1.393
 751  C26  C27   aromatic  1.380  0.020  1.380
 751  C27  C22   aromatic  1.398  0.020  1.398
 751  C24  C23   aromatic  1.388  0.020  1.388
 751  C23  C22   aromatic  1.392  0.020  1.392
 751  C22  C18   single    1.474  0.020  1.474
 751  C18  C17   aromatic  1.394  0.020  1.394
 751  C18  C19   aromatic  1.396  0.020  1.396
 751  C17  C16   aromatic  1.387  0.020  1.387
 751  C19  C20   aromatic  1.386  0.020  1.386
 751  C20  C21   aromatic  1.386  0.020  1.386
 751  C21  C16   aromatic  1.389  0.020  1.389
 751  S1   C16   single    1.772  0.020  1.772
 751  S1   O1    double    1.453  0.020  1.453
 751  S1   O2    double    1.453  0.020  1.453
 751  S1   N1    single    1.658  0.020  1.658
 751  N1   C4    single    1.465  0.020  1.465
 751  N1   C1    single    1.465  0.020  1.465
 751  C4   C3    single    1.515  0.020  1.515
 751  C3   N2    single    1.453  0.020  1.453
 751  C1   C2    single    1.519  0.020  1.519
 751  C2   N2    single    1.446  0.020  1.446
 751  N2   C5    single    1.380  0.020  1.380
 751  C5   N3    aromatic  1.322  0.020  1.322
 751  C5   C8    aromatic  1.421  0.020  1.421
 751  N3   C6    aromatic  1.328  0.020  1.328
 751  C6   C7    aromatic  1.379  0.020  1.379
 751  C7   N4    aromatic  1.330  0.020  1.330
 751  N4   C8    aromatic  1.321  0.020  1.321
 751  C8   C9    single    1.477  0.020  1.477
 751  C9   C10   aromatic  1.396  0.020  1.396
 751  C9   C14   aromatic  1.392  0.020  1.392
 751  C10  C11   aromatic  1.381  0.020  1.381
 751  C11  C12   aromatic  1.397  0.020  1.397
 751  C12  O3    single    1.344  0.020  1.344
 751  C12  C13   aromatic  1.394  0.020  1.394
 751  O3   C15   single    1.414  0.020  1.414
 751  C13  C14   aromatic  1.387  0.020  1.387
 751  C28  H281  single    0.970  0.020  1.090
 751  C28  H282  single    0.970  0.020  1.090
 751  C28  H283  single    0.970  0.020  1.090
 751  C26  H26   single    0.930  0.020  1.080
 751  C24  H24   single    0.930  0.020  1.080
 751  C27  H27   single    0.930  0.020  1.080
 751  C23  H23   single    0.930  0.020  1.080
 751  C17  H17   single    0.930  0.020  1.080
 751  C19  H19   single    0.930  0.020  1.080
 751  C20  H20   single    0.930  0.020  1.080
 751  C21  H21   single    0.930  0.020  1.080
 751  C4   H41C  single    0.970  0.020  1.090
 751  C4   H42C  single    0.970  0.020  1.090
 751  C1   H11C  single    0.970  0.020  1.090
 751  C1   H12C  single    0.970  0.020  1.090
 751  C3   H31C  single    0.970  0.020  1.090
 751  C3   H32C  single    0.970  0.020  1.090
 751  C2   H21C  single    0.970  0.020  1.090
 751  C2   H22C  single    0.970  0.020  1.090
 751  C6   H6    single    0.930  0.020  1.080
 751  C7   H7    single    0.930  0.020  1.080
 751  C10  H10   single    0.930  0.020  1.080
 751  C14  H14   single    0.930  0.020  1.080
 751  C11  H11   single    0.930  0.020  1.080
 751  C13  H13   single    0.930  0.020  1.080
 751  C15  H151  single    0.970  0.020  1.090
 751  C15  H152  single    0.970  0.020  1.090
 751  C15  H153  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
 751  H283  C28  H282  108.83  3.000
 751  H283  C28  H281  108.80  3.000
 751  H282  C28  H281  108.75  3.000
 751  H283  C28  O4    111.88  3.000
 751  H282  C28  O4    111.99  3.000
 751  H281  C28  O4    106.48  3.000
 751  C25   O4   C28   118.63  3.000
 751  C24   C25  C26   119.14  3.000
 751  C24   C25  O4    124.48  3.000
 751  C26   C25  O4    116.38  3.000
 751  H26   C26  C27   120.17  3.000
 751  H26   C26  C25   119.50  3.000
 751  C27   C26  C25   120.33  3.000
 751  H27   C27  C22   120.03  3.000
 751  H27   C27  C26   118.65  3.000
 751  C22   C27  C26   121.31  3.000
 751  H24   C24  C23   118.70  3.000
 751  H24   C24  C25   121.53  3.000
 751  C23   C24  C25   119.77  3.000
 751  H23   C23  C22   120.03  3.000
 751  H23   C23  C24   118.21  3.000
 751  C22   C23  C24   121.75  3.000
 751  C18   C22  C23   121.25  3.000
 751  C18   C22  C27   121.05  3.000
 751  C23   C22  C27   117.70  3.000
 751  C19   C18  C17   118.29  3.000
 751  C19   C18  C22   121.22  3.000
 751  C17   C18  C22   120.49  3.000
 751  H17   C17  C16   120.21  3.000
 751  H17   C17  C18   119.71  3.000
 751  C16   C17  C18   120.04  3.000
 751  H19   C19  C20   119.10  3.000
 751  H19   C19  C18   119.74  3.000
 751  C20   C19  C18   121.16  3.000
 751  H20   C20  C21   119.66  3.000
 751  H20   C20  C19   119.79  3.000
 751  C21   C20  C19   120.55  3.000
 751  H21   C21  C16   121.55  3.000
 751  H21   C21  C20   120.11  3.000
 751  C16   C21  C20   118.34  3.000
 751  S1    C16  C21   119.31  3.000
 751  S1    C16  C17   119.03  3.000
 751  C21   C16  C17   121.61  3.000
 751  N1    S1   O2    106.99  3.000
 751  N1    S1   O1    107.10  3.000
 751  O2    S1   O1    119.62  3.000
 751  N1    S1   C16   105.50  3.000
 751  O2    S1   C16   108.49  3.000
 751  O1    S1   C16   108.28  3.000
 751  C1    N1   C4    113.19  3.000
 751  C1    N1   S1    116.02  3.000
 751  C4    N1   S1    115.74  3.000
 751  H42C  C4   H41C  108.50  3.000
 751  H42C  C4   C3    108.78  3.000
 751  H41C  C4   C3    109.21  3.000
 751  H42C  C4   N1    109.70  3.000
 751  H41C  C4   N1    111.39  3.000
 751  C3    C4   N1    109.23  3.000
 751  H32C  C3   H31C  107.45  3.000
 751  H32C  C3   N2    110.11  3.000
 751  H31C  C3   N2    111.14  3.000
 751  H32C  C3   C4    109.56  3.000
 751  H31C  C3   C4    108.37  3.000
 751  N2    C3   C4    110.16  3.000
 751  H12C  C1   H11C  108.53  3.000
 751  H12C  C1   C2    108.55  3.000
 751  H11C  C1   C2    108.99  3.000
 751  H12C  C1   N1    111.25  3.000
 751  H11C  C1   N1    109.67  3.000
 751  C2    C1   N1    109.81  3.000
 751  H22C  C2   H21C  107.79  3.000
 751  H22C  C2   N2    109.96  3.000
 751  H21C  C2   N2    112.12  3.000
 751  H22C  C2   C1    108.19  3.000
 751  H21C  C2   C1    110.12  3.000
 751  N2    C2   C1    108.60  3.000
 751  C5    N2   C2    119.20  3.000
 751  C5    N2   C3    119.12  3.000
 751  C2    N2   C3    111.31  3.000
 751  C8    C5   N3    120.40  3.000
 751  C8    C5   N2    121.10  3.000
 751  N3    C5   N2    118.47  3.000
 751  C6    N3   C5    118.35  3.000
 751  H6    C6   C7    121.25  3.000
 751  H6    C6   N3    117.45  3.000
 751  C7    C6   N3    121.29  3.000
 751  H7    C7   N4    117.68  3.000
 751  H7    C7   C6    121.57  3.000
 751  N4    C7   C6    120.71  3.000
 751  C8    N4   C7    118.93  3.000
 751  C9    C8   N4    116.97  3.000
 751  C9    C8   C5    123.23  3.000
 751  N4    C8   C5    119.77  3.000
 751  C14   C9   C10   117.99  3.000
 751  C14   C9   C8    121.48  3.000
 751  C10   C9   C8    120.45  3.000
 751  H10   C10  C11   119.16  3.000
 751  H10   C10  C9    119.69  3.000
 751  C11   C10  C9    121.14  3.000
 751  H11   C11  C12   119.47  3.000
 751  H11   C11  C10   120.23  3.000
 751  C12   C11  C10   120.30  3.000
 751  C13   C12  O3    124.38  3.000
 751  C13   C12  C11   119.17  3.000
 751  O3    C12  C11   116.45  3.000
 751  C15   O3   C12   118.65  3.000
 751  H153  C15  H152  108.77  3.000
 751  H153  C15  H151  108.87  3.000
 751  H152  C15  H151  108.62  3.000
 751  H153  C15  O3    112.15  3.000
 751  H152  C15  O3    106.53  3.000
 751  H151  C15  O3    111.79  3.000
 751  H13   C13  C14   118.57  3.000
 751  H13   C13  C12   121.61  3.000
 751  C14   C13  C12   119.82  3.000
 751  H14   C14  C13   118.40  3.000
 751  H14   C14  C9    120.06  3.000
 751  C13   C14  C9    121.55  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
 751  CONST_01  C22   C27  C26  C25     0.00   0.0  0
 751  CONST_02  C22   C23  C24  C25     0.00   0.0  0
 751  CONST_03  C23   C24  C25  C26     0.00   0.0  0
 751  CONST_04  C23   C22  C27  C26     0.00   0.0  0
 751  CONST_05  C18   C22  C27  C26   180.00   0.0  0
 751  CONST_06  C24   C25  C26  C27     0.00   0.0  0
 751  CONST_07  C24   C23  C22  C27     0.00   0.0  0
 751  CONST_10  C18   C22  C23  C24   180.00   0.0  0
 751  CONST_13  C16   C17  C18  C22   180.00   0.0  0
 751  CONST_14  C20   C19  C18  C22   180.00   0.0  0
 751  CONST_15  C21   C16  C17  C18     0.00   0.0  0
 751  CONST_16  C21   C20  C19  C18     0.00   0.0  0
 751  CONST_17  C20   C19  C18  C17     0.00   0.0  0
 751  CONST_18  C20   C21  C16  C17     0.00   0.0  0
 751  CONST_19  C16   C17  C18  C19     0.00   0.0  0
 751  CONST_20  C16   C21  C20  C19     0.00   0.0  0
 751  CONST_21  C7    C6   N3   C5      0.00   0.0  0
 751  CONST_22  C7    N4   C8   C5      0.00   0.0  0
 751  CONST_25  N4    C8   C5   N3      0.00   0.0  0
 751  CONST_26  C9    C8   C5   N3    180.00   0.0  0
 751  CONST_27  N4    C7   C6   N3      0.00   0.0  0
 751  CONST_28  C8    C5   N3   C6      0.00   0.0  0
 751  CONST_29  C8    N4   C7   C6      0.00   0.0  0
 751  CONST_30  C9    C8   N4   C7    180.00   0.0  0
 751  CONST_33  C11   C10  C9   C8    180.00   0.0  0
 751  CONST_34  C13   C14  C9   C8    180.00   0.0  0
 751  CONST_35  C12   C11  C10  C9      0.00   0.0  0
 751  CONST_36  C12   C13  C14  C9      0.00   0.0  0
 751  CONST_37  C13   C14  C9   C10     0.00   0.0  0
 751  CONST_38  C13   C12  C11  C10     0.00   0.0  0
 751  CONST_39  C14   C9   C10  C11     0.00   0.0  0
 751  CONST_40  C14   C13  C12  C11     0.00   0.0  0
 751  CONST_41  C6    N3   C5   N2    180.00   0.0  0
 751  CONST_42  N4    C8   C5   N2    180.00   0.0  0
 751  CONST_43  C9    C8   C5   N2      0.00   0.0  0
 751  CONST_44  C27   C26  C25  O4    180.00   0.0  0
 751  CONST_45  C23   C24  C25  O4    180.00   0.0  0
 751  CONST_46  S1    C16  C17  C18   180.00   0.0  0
 751  CONST_47  S1    C16  C21  C20   180.00   0.0  0
 751  CONST_48  O3    C12  C11  C10   180.00   0.0  0
 751  CONST_49  C14   C13  C12  O3    180.00   0.0  0
 751  CONST_50  H27   C27  C26  C25   180.00   0.0  0
 751  CONST_51  H23   C23  C24  C25   180.00   0.0  0
 751  CONST_52  H24   C24  C25  C26   180.00   0.0  0
 751  CONST_53  H26   C26  C25  C24   180.00   0.0  0
 751  CONST_54  H17   C17  C18  C22     0.00   0.0  0
 751  CONST_55  H19   C19  C18  C22     0.00   0.0  0
 751  CONST_56  H20   C20  C19  C18   180.00   0.0  0
 751  CONST_57  H21   C21  C16  C17   180.00   0.0  0
 751  CONST_58  H6    C6   N3   C5    180.00   0.0  0
 751  CONST_59  H7    C7   C6   N3    180.00   0.0  0
 751  CONST_60  H10   C10  C9   C8      0.00   0.0  0
 751  CONST_61  H14   C14  C9   C8      0.00   0.0  0
 751  CONST_62  H11   C11  C10  C9    180.00   0.0  0
 751  CONST_63  H13   C13  C14  C9    180.00   0.0  0
 751  Var_01    N2    C3   C4   N1     55.54  30.0  1
 751  Var_02    N2    C2   C1   N1    -57.46  30.0  1
 751  Var_03    C2    C1   N1   C4     55.91  30.0  1
 751  Var_04    C2    N2   C3   C4    -61.03  30.0  1
 751  Var_05    C1    N1   C4   C3    -54.47  30.0  1
 751  Var_06    C1    C2   N2   C3     61.27  30.0  1
 751  Var_07    N3    C5   N2   C3    124.04  30.0  2
 751  Var_08    N1    S1   C16  C17    91.42  30.0  3
 751  Var_09    C4    N1   S1   C16    66.61  30.0  3
 751  Var_10    C26   C25  O4   C28  -178.35  30.0  2
 751  Var_11    C13   C12  O3   C15     1.91  30.0  2
 751  Var_12    H281  C28  O4   C25   179.04  30.0  3
 751  Var_13    H151  C15  O3   C12    60.75  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
 751  plan-1  O4   0.020
 751  plan-1  C25  0.020
 751  plan-1  C26  0.020
 751  plan-1  C27  0.020
 751  plan-1  C24  0.020
 751  plan-1  C23  0.020
 751  plan-1  C22  0.020
 751  plan-1  C18  0.020
 751  plan-1  H26  0.020
 751  plan-1  H24  0.020
 751  plan-1  H27  0.020
 751  plan-1  H23  0.020
 751  plan-2  C22  0.020
 751  plan-2  C18  0.020
 751  plan-2  C17  0.020
 751  plan-2  C19  0.020
 751  plan-2  C20  0.020
 751  plan-2  C21  0.020
 751  plan-2  C16  0.020
 751  plan-2  S1   0.020
 751  plan-2  H17  0.020
 751  plan-2  H19  0.020
 751  plan-2  H20  0.020
 751  plan-2  H21  0.020
 751  plan-3  N2   0.020
 751  plan-3  C5   0.020
 751  plan-3  N3   0.020
 751  plan-3  C6   0.020
 751  plan-3  C7   0.020
 751  plan-3  N4   0.020
 751  plan-3  C8   0.020
 751  plan-3  C9   0.020
 751  plan-3  H6   0.020
 751  plan-3  H7   0.020
 751  plan-4  C8   0.020
 751  plan-4  C9   0.020
 751  plan-4  C10  0.020
 751  plan-4  C11  0.020
 751  plan-4  C12  0.020
 751  plan-4  O3   0.020
 751  plan-4  C13  0.020
 751  plan-4  C14  0.020
 751  plan-4  H10  0.020
 751  plan-4  H14  0.020
 751  plan-4  H11  0.020
 751  plan-4  H13  0.020

