# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Tue Apr 28 21:27:25 2020
#   Inital geometry file: a 154 line input string
#   Ligand name: (3S)-4-oxo-3-[({6-[({[4-(quinoxalin-2-ylamino)phenyl]carbonyl}amino)methyl]pyridin-3-yl}carbonyl)amino]butanoic acid
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: OC(=O)C[C@H](NC(=O)c1ccc(CNC(=O)c2ccc(Nc3cnc4ccccc4n3)cc2)nc1)C=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
 OQB  OQB  '(3S)-4-oxo-3-[({6-[({[4-(quinoxalin-2-ylamino)phenyl]carbonyl}amino)methyl]pyridin-3-yl}carbonyl)amino]butanoic acid'  ligand  58  37  .  2021-08-17  2021-08-17  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_OQB
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
 OQB  O37   O  OC    -1  -0.767    5.8667  -4.1045   1.7762
 OQB  C9    C  C      0   0.387    6.6768  -3.1597   1.7948
 OQB  O33   O  O      0  -0.458    6.9229  -2.3964   2.7461
 OQB  C10   C  CH2    0  -0.629    7.4988  -2.9447   0.5028
 OQB  C27   C  CH1    0  -0.142    7.8245  -1.4794   0.2367
 OQB  C28   C  C1     0   0.168    8.8632  -1.3827  -0.8505
 OQB  O35   O  O      0  -0.367    8.7060  -0.8439  -1.9151
 OQB  N3    N  NH1    0  -0.661    6.6275  -0.7500  -0.0833
 OQB  C16   C  C      0   0.554    6.5719   0.5909  -0.0563
 OQB  O34   O  O      0  -0.496    7.5167   1.2950   0.2688
 OQB  C21   C  CR6    0  -0.182    5.2616   1.1915  -0.4409
 OQB  C12   C  CR16   0  -0.038    4.0463   0.5670  -0.2005
 OQB  N1    N  N      0  -0.380    2.8762   1.1057  -0.5207
 OQB  C23   C  CR16   0  -0.133    5.2314   2.4569  -1.0245
 OQB  C24   C  CR16   0  -0.368    4.0175   3.0104  -1.3724
 OQB  C14   C  CR6    0   0.272    2.8533   2.2935  -1.1047
 OQB  C19   C  CH2    0  -0.288    1.5130   2.8631  -1.4854
 OQB  N6    N  NH1    0  -0.677    0.4530   2.0100  -1.0238
 OQB  C15   C  C      0   0.531   -0.8386   2.3164  -1.2065
 OQB  O36   O  O      0  -0.440   -1.1814   3.3509  -1.7704
 OQB  C20   C  C      0   0.046   -1.8492   1.3501  -0.6871
 OQB  C22   C  C1     0  -0.270   -3.1934   1.7013  -0.7649
 OQB  C26   C  C1     0  -0.329   -1.5368   0.1090  -0.1286
 OQB  C25   C  C1     0  -0.338   -2.5267  -0.7320   0.3324
 OQB  C11   C  C      0   0.404   -3.8778  -0.3673   0.2569
 OQB  C8    C  C1     0  -0.268   -4.2015   0.8717  -0.3042
 OQB  N2    N  NH1    0  -0.806   -4.7938  -1.2772   0.7555
 OQB  C13   C  CR6    0   0.463   -6.1560  -1.2426   0.7905
 OQB  C29   C  CR16   0  -0.177   -6.8108  -2.3807   1.3807
 OQB  N4    N  N      0  -0.382   -8.0944  -2.4648   1.4668
 OQB  N5    N  N      0  -0.435   -6.8401  -0.2408   0.3182
 OQB  C32   C  CR6    0   0.223   -8.1922  -0.3117   0.4015
 OQB  C31   C  CR6    0   0.112   -8.8335  -1.4296   0.9773
 OQB  C17   C  C1     0  -0.257   -8.9785   0.7462  -0.0942
 OQB  C30   C  C1     0  -0.235  -10.3471   0.6802  -0.0139
 OQB  C18   C  C1     0  -0.283  -10.9837  -0.4364   0.5599
 OQB  C7    C  C1     0  -0.203  -10.2366  -1.4782   1.0493
 OQB  H101  H  HCH2   0   0.307    8.4378  -3.4991   0.6082
 OQB  H102  H  HCH2   0   0.227    6.9871  -3.3791  -0.3604
 OQB  H27   H  HCH1   0   0.258    8.2751  -1.0714   1.1474
 OQB  H28   H  H      0   0.211    9.8180  -1.8748  -0.5892
 OQB  HN3   H  HNH1   0   0.384    5.8801  -1.2616  -0.5249
 OQB  H12   H  HCR6   0   0.297    4.0006  -0.3982   0.2926
 OQB  H23   H  HCR6   0   0.280    6.1516   2.9941  -1.2121
 OQB  H24   H  HCR6   0   0.269    3.9656   3.9844  -1.8412
 OQB  H191  H  HCH2   0   0.229    1.4183   3.8699  -1.0676
 OQB  H192  H  HCH2   0   0.223    1.4781   2.9807  -2.5736
 OQB  HN6   H  HNH1   0   0.380    0.7512   1.1655  -0.5581
 OQB  H22   H  H      0   0.243   -3.4699   2.6542  -1.1954
 OQB  H26   H  H      0   0.242   -0.5160  -0.2400  -0.0440
 OQB  H25   H  H      0   0.261   -2.2507  -1.6895   0.7570
 OQB  H8    H  H      0   0.277   -5.2284   1.1865  -0.3821
 OQB  HN2   H  HNH1   0   0.405   -4.3831  -2.1110   1.1482
 OQB  H29   H  HCR6   0   0.280   -6.2175  -3.2029   1.7705
 OQB  H17   H  H      0   0.285   -8.4833   1.6022  -0.5340
 OQB  H30   H  H      0   0.267  -10.9460   1.4965  -0.3961
 OQB  H18   H  H      0   0.241  -12.0635  -0.4690   0.6143
 OQB  H7    H  H      0   0.282  -10.7050  -2.3463   1.4951

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
 OQB  O37  C9    deloc     1.245  0.020  1.245
 OQB  C9   O33   deloc     1.244  0.020  1.244
 OQB  C9   C10   single    1.546  0.020  1.546
 OQB  C10  C27   single    1.524  0.020  1.524
 OQB  C10  H101  single    0.970  0.020  1.090
 OQB  C10  H102  single    0.970  0.020  1.090
 OQB  C27  C28   single    1.507  0.020  1.507
 OQB  C27  N3    single    1.438  0.020  1.438
 OQB  C27  H27   single    0.970  0.020  1.090
 OQB  C28  O35   double    1.203  0.020  1.203
 OQB  C28  H28   single    0.930  0.020  1.080
 OQB  N3   C16   single    1.342  0.020  1.342
 OQB  N3   HN3   single    0.860  0.020  1.020
 OQB  C16  O34   double    1.222  0.020  1.222
 OQB  C16  C21   single    1.492  0.020  1.492
 OQB  C21  C12   aromatic  1.387  0.020  1.387
 OQB  C21  C23   aromatic  1.394  0.020  1.394
 OQB  C12  N1    aromatic  1.327  0.020  1.327
 OQB  C12  H12   single    0.930  0.020  1.080
 OQB  N1   C14   aromatic  1.324  0.020  1.324
 OQB  C23  C24   aromatic  1.379  0.020  1.379
 OQB  C23  H23   single    0.930  0.020  1.080
 OQB  C24  C14   aromatic  1.393  0.020  1.393
 OQB  C24  H24   single    0.930  0.020  1.080
 OQB  C14  C19   single    1.505  0.020  1.505
 OQB  C19  N6    single    1.437  0.020  1.437
 OQB  C19  H191  single    0.970  0.020  1.090
 OQB  C19  H192  single    0.970  0.020  1.090
 OQB  N6   C15   single    1.340  0.020  1.340
 OQB  N6   HN6   single    0.860  0.020  1.020
 OQB  C15  O36   double    1.227  0.020  1.227
 OQB  C15  C20   single    1.492  0.020  1.492
 OQB  C20  C22   aromatic  1.392  0.020  1.392
 OQB  C20  C26   aromatic  1.396  0.020  1.396
 OQB  C22  C8    aromatic  1.384  0.020  1.384
 OQB  C22  H22   single    0.930  0.020  1.080
 OQB  C26  C25   aromatic  1.378  0.020  1.378
 OQB  C26  H26   single    0.930  0.020  1.080
 OQB  C25  C11   aromatic  1.401  0.020  1.401
 OQB  C25  H25   single    0.930  0.020  1.080
 OQB  C11  C8    aromatic  1.398  0.020  1.398
 OQB  C11  N2    single    1.384  0.020  1.384
 OQB  C8   H8    single    0.930  0.020  1.080
 OQB  N2   C13   single    1.363  0.020  1.363
 OQB  N2   HN2   single    0.860  0.020  1.020
 OQB  C13  C29   aromatic  1.440  0.020  1.440
 OQB  C13  N5    aromatic  1.302  0.020  1.302
 OQB  C29  N4    aromatic  1.289  0.020  1.289
 OQB  C29  H29   single    0.930  0.020  1.080
 OQB  N4   C31   aromatic  1.363  0.020  1.363
 OQB  N5   C32   aromatic  1.357  0.020  1.357
 OQB  C32  C31   aromatic  1.412  0.020  1.412
 OQB  C32  C17   aromatic  1.408  0.020  1.408
 OQB  C31  C7    aromatic  1.406  0.020  1.406
 OQB  C17  C30   aromatic  1.373  0.020  1.373
 OQB  C17  H17   single    0.930  0.020  1.080
 OQB  C30  C18   aromatic  1.408  0.020  1.408
 OQB  C30  H30   single    0.930  0.020  1.080
 OQB  C18  C7    aromatic  1.372  0.020  1.372
 OQB  C18  H18   single    0.930  0.020  1.080
 OQB  C7   H7    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
 OQB  C10   C9   O33   116.64  3.000
 OQB  C10   C9   O37   116.04  3.000
 OQB  O33   C9   O37   127.29  3.000
 OQB  H102  C10  H101  106.03  3.000
 OQB  H102  C10  C27   110.12  3.000
 OQB  H101  C10  C27   108.67  3.000
 OQB  H102  C10  C9    110.83  3.000
 OQB  H101  C10  C9    107.75  3.000
 OQB  C27   C10  C9    113.14  3.000
 OQB  H27   C27  N3    109.80  3.000
 OQB  H27   C27  C28   107.01  3.000
 OQB  N3    C27  C28   112.38  3.000
 OQB  H27   C27  C10   107.51  3.000
 OQB  N3    C27  C10   110.40  3.000
 OQB  C28   C27  C10   109.57  3.000
 OQB  H28   C28  O35   121.41  3.000
 OQB  H28   C28  C27   113.35  3.000
 OQB  O35   C28  C27   125.24  3.000
 OQB  HN3   N3   C16   119.03  3.000
 OQB  HN3   N3   C27   117.22  3.000
 OQB  C16   N3   C27   122.46  3.000
 OQB  C21   C16  O34   121.04  3.000
 OQB  C21   C16  N3    115.68  3.000
 OQB  O34   C16  N3    123.28  3.000
 OQB  C23   C21  C12   117.53  3.000
 OQB  C23   C21  C16   119.50  3.000
 OQB  C12   C21  C16   122.93  3.000
 OQB  H12   C12  N1    115.69  3.000
 OQB  H12   C12  C21   121.08  3.000
 OQB  N1    C12  C21   123.21  3.000
 OQB  C14   N1   C12   119.07  3.000
 OQB  H23   C23  C24   120.38  3.000
 OQB  H23   C23  C21   120.33  3.000
 OQB  C24   C23  C21   119.29  3.000
 OQB  H24   C24  C14   120.41  3.000
 OQB  H24   C24  C23   120.86  3.000
 OQB  C14   C24  C23   118.73  3.000
 OQB  C19   C14  C24   120.05  3.000
 OQB  C19   C14  N1    117.81  3.000
 OQB  C24   C14  N1    122.14  3.000
 OQB  H192  C19  H191  106.13  3.000
 OQB  H192  C19  N6    111.07  3.000
 OQB  H191  C19  N6    111.09  3.000
 OQB  H192  C19  C14   108.68  3.000
 OQB  H191  C19  C14   109.19  3.000
 OQB  N6    C19  C14   110.55  3.000
 OQB  HN6   N6   C15   122.61  3.000
 OQB  HN6   N6   C19   115.28  3.000
 OQB  C15   N6   C19   122.11  3.000
 OQB  C20   C15  O36   121.13  3.000
 OQB  C20   C15  N6    117.22  3.000
 OQB  O36   C15  N6    121.65  3.000
 OQB  C26   C20  C22   117.57  3.000
 OQB  C26   C20  C15   124.30  3.000
 OQB  C22   C20  C15   118.13  3.000
 OQB  H22   C22  C8    118.31  3.000
 OQB  H22   C22  C20   119.45  3.000
 OQB  C8    C22  C20   122.24  3.000
 OQB  H26   C26  C25   117.04  3.000
 OQB  H26   C26  C20   121.94  3.000
 OQB  C25   C26  C20   121.02  3.000
 OQB  H25   C25  C11   119.79  3.000
 OQB  H25   C25  C26   119.17  3.000
 OQB  C11   C25  C26   121.04  3.000
 OQB  N2    C11  C8    125.03  3.000
 OQB  N2    C11  C25   116.59  3.000
 OQB  C8    C11  C25   118.38  3.000
 OQB  H8    C8   C11   120.59  3.000
 OQB  H8    C8   C22   119.67  3.000
 OQB  C11   C8   C22   119.74  3.000
 OQB  HN2   N2   C13   114.69  3.000
 OQB  HN2   N2   C11   114.46  3.000
 OQB  C13   N2   C11   130.84  3.000
 OQB  N5    C13  C29   121.20  3.000
 OQB  N5    C13  N2    122.37  3.000
 OQB  C29   C13  N2    116.43  3.000
 OQB  H29   C29  N4    118.06  3.000
 OQB  H29   C29  C13   119.81  3.000
 OQB  N4    C29  C13   122.13  3.000
 OQB  C31   N4   C29   117.80  3.000
 OQB  C32   N5   C13   117.47  3.000
 OQB  C17   C32  C31   119.00  3.000
 OQB  C17   C32  N5    119.72  3.000
 OQB  C31   C32  N5    121.29  3.000
 OQB  C7    C31  C32   120.12  3.000
 OQB  C7    C31  N4    119.78  3.000
 OQB  C32   C31  N4    120.11  3.000
 OQB  H17   C17  C30   121.20  3.000
 OQB  H17   C17  C32   118.79  3.000
 OQB  C30   C17  C32   120.01  3.000
 OQB  H30   C30  C18   119.48  3.000
 OQB  H30   C30  C17   119.66  3.000
 OQB  C18   C30  C17   120.86  3.000
 OQB  H18   C18  C7    120.18  3.000
 OQB  H18   C18  C30   119.73  3.000
 OQB  C7    C18  C30   120.10  3.000
 OQB  H7    C7   C18   121.34  3.000
 OQB  H7    C7   C31   118.73  3.000
 OQB  C18   C7   C31   119.92  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
 OQB  CONST_01  C14  N1   C12  C21     0.00   0.0  0
 OQB  CONST_02  C14  C24  C23  C21     0.00   0.0  0
 OQB  CONST_03  C24  C23  C21  C12     0.00   0.0  0
 OQB  CONST_04  C24  C14  N1   C12     0.00   0.0  0
 OQB  CONST_05  C23  C21  C12  N1      0.00   0.0  0
 OQB  CONST_06  C23  C24  C14  N1      0.00   0.0  0
 OQB  CONST_07  C11  C8   C22  C20     0.00   0.0  0
 OQB  CONST_08  C11  C25  C26  C20     0.00   0.0  0
 OQB  CONST_09  C25  C26  C20  C22     0.00   0.0  0
 OQB  CONST_10  C25  C11  C8   C22     0.00   0.0  0
 OQB  CONST_11  C8   C22  C20  C26     0.00   0.0  0
 OQB  CONST_12  C8   C11  C25  C26     0.00   0.0  0
 OQB  CONST_13  C31  N4   C29  C13     0.00   0.0  0
 OQB  CONST_14  C31  C32  N5   C13     0.00   0.0  0
 OQB  CONST_15  C17  C32  N5   C13   180.00   0.0  0
 OQB  CONST_16  C32  N5   C13  C29     0.00   0.0  0
 OQB  CONST_17  C32  C31  N4   C29     0.00   0.0  0
 OQB  CONST_18  C7   C31  N4   C29   180.00   0.0  0
 OQB  CONST_19  N5   C13  C29  N4      0.00   0.0  0
 OQB  CONST_20  N5   C32  C31  N4      0.00   0.0  0
 OQB  CONST_21  C17  C32  C31  N4    180.00   0.0  0
 OQB  CONST_22  C18  C7   C31  N4    180.00   0.0  0
 OQB  CONST_23  C7   C31  C32  N5    180.00   0.0  0
 OQB  CONST_24  C30  C17  C32  N5    180.00   0.0  0
 OQB  CONST_25  C18  C7   C31  C32     0.00   0.0  0
 OQB  CONST_26  C18  C30  C17  C32     0.00   0.0  0
 OQB  CONST_27  C30  C17  C32  C31     0.00   0.0  0
 OQB  CONST_28  C30  C18  C7   C31     0.00   0.0  0
 OQB  CONST_29  C7   C31  C32  C17     0.00   0.0  0
 OQB  CONST_30  C7   C18  C30  C17     0.00   0.0  0
 OQB  CONST_31  N1   C12  C21  C16   180.00   0.0  0
 OQB  CONST_32  C24  C23  C21  C16   180.00   0.0  0
 OQB  CONST_33  C19  C14  N1   C12   180.00   0.0  0
 OQB  CONST_34  C19  C14  C24  C23   180.00   0.0  0
 OQB  CONST_35  C8   C22  C20  C15   180.00   0.0  0
 OQB  CONST_36  C25  C26  C20  C15   180.00   0.0  0
 OQB  CONST_37  N2   C11  C8   C22   180.00   0.0  0
 OQB  CONST_38  N2   C11  C25  C26   180.00   0.0  0
 OQB  CONST_39  N4   C29  C13  N2    180.00   0.0  0
 OQB  CONST_40  C32  N5   C13  N2    180.00   0.0  0
 OQB  CONST_41  H24  C24  C23  C21   180.00   0.0  0
 OQB  CONST_42  H23  C23  C21  C12   180.00   0.0  0
 OQB  CONST_43  H12  C12  C21  C23   180.00   0.0  0
 OQB  CONST_44  H8   C8   C22  C20   180.00   0.0  0
 OQB  CONST_45  H25  C25  C26  C20   180.00   0.0  0
 OQB  CONST_46  H26  C26  C20  C22   180.00   0.0  0
 OQB  CONST_47  H22  C22  C20  C26   180.00   0.0  0
 OQB  CONST_48  H7   C7   C31  N4      0.00   0.0  0
 OQB  CONST_49  H29  C29  C13  N5    180.00   0.0  0
 OQB  CONST_50  H17  C17  C32  N5      0.00   0.0  0
 OQB  CONST_51  H30  C30  C17  C32   180.00   0.0  0
 OQB  CONST_52  H18  C18  C7   C31   180.00   0.0  0
 OQB  CONST_53  C21  C16  N3   C27   180.00   0.0  0
 OQB  CONST_54  C20  C15  N6   C19   180.00   0.0  0
 OQB  CONST_55  HN3  N3   C16  C21     0.00   0.0  0
 OQB  CONST_56  HN6  N6   C15  C20     0.00   0.0  0
 OQB  CONST_57  O34  C16  N3   C27     0.00   0.0  0
 OQB  CONST_58  O36  C15  N6   C19     0.00   0.0  0
 OQB  Var_01    C13  N2   C11  C25  -177.64  30.0  2
 OQB  Var_02    C29  C13  N2   C11   179.43  30.0  2
 OQB  Var_03    C12  C21  C16  N3     31.44  30.0  2
 OQB  Var_04    N6   C19  C14  N1      4.73  30.0  2
 OQB  Var_05    C22  C20  C15  N6    174.67  30.0  2
 OQB  Var_06    C15  N6   C19  C14   178.16  30.0  3
 OQB  Var_07    C27  C10  C9   O37   147.08  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
 OQB  chir_01  C27  C10  C28  N3  negativ

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
 OQB  plan-1  C16  0.020
 OQB  plan-1  C21  0.020
 OQB  plan-1  C12  0.020
 OQB  plan-1  N1   0.020
 OQB  plan-1  C23  0.020
 OQB  plan-1  C24  0.020
 OQB  plan-1  C14  0.020
 OQB  plan-1  C19  0.020
 OQB  plan-1  H12  0.020
 OQB  plan-1  H23  0.020
 OQB  plan-1  H24  0.020
 OQB  plan-2  C27  0.020
 OQB  plan-2  C28  0.020
 OQB  plan-2  O35  0.020
 OQB  plan-2  H28  0.020
 OQB  plan-3  C15  0.020
 OQB  plan-3  C20  0.020
 OQB  plan-3  C22  0.020
 OQB  plan-3  C26  0.020
 OQB  plan-3  C25  0.020
 OQB  plan-3  C11  0.020
 OQB  plan-3  C8   0.020
 OQB  plan-3  N2   0.020
 OQB  plan-3  H22  0.020
 OQB  plan-3  H26  0.020
 OQB  plan-3  H25  0.020
 OQB  plan-3  H8   0.020
 OQB  plan-4  N2   0.020
 OQB  plan-4  C13  0.020
 OQB  plan-4  C29  0.020
 OQB  plan-4  N4   0.020
 OQB  plan-4  N5   0.020
 OQB  plan-4  C32  0.020
 OQB  plan-4  C31  0.020
 OQB  plan-4  C17  0.020
 OQB  plan-4  C30  0.020
 OQB  plan-4  C18  0.020
 OQB  plan-4  C7   0.020
 OQB  plan-4  H29  0.020
 OQB  plan-4  H17  0.020
 OQB  plan-4  H30  0.020
 OQB  plan-4  H18  0.020
 OQB  plan-4  H7   0.020
 OQB  plan-5  C27  0.020
 OQB  plan-5  N3   0.020
 OQB  plan-5  C16  0.020
 OQB  plan-5  O34  0.020
 OQB  plan-5  C21  0.020
 OQB  plan-5  HN3  0.020
 OQB  plan-6  C19  0.020
 OQB  plan-6  N6   0.020
 OQB  plan-6  C15  0.020
 OQB  plan-6  O36  0.020
 OQB  plan-6  C20  0.020
 OQB  plan-6  HN6  0.020
 OQB  plan-7  O37  0.020
 OQB  plan-7  C9   0.020
 OQB  plan-7  O33  0.020
 OQB  plan-7  C10  0.020

