# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Thu May 21 20:33:52 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  59  37  .  2021-08-19  2021-08-19  
;
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  OH1   0  -0.590    6.8879  -2.4974   3.4978
 OQB  C9    C  C     0   0.570    7.4006  -1.7137   2.5596
 OQB  O33   O  O     0  -0.430    7.7027  -0.5625   2.7408
 OQB  C10   C  CH2   0  -0.604    7.5863  -2.4557   1.2612
 OQB  C27   C  CH1   0  -0.210    7.7772  -1.5089   0.0836
 OQB  C28   C  C1    0   0.196    8.2602  -2.2764  -1.1271
 OQB  O35   O  O     0  -0.357    7.7592  -2.2056  -2.2165
 OQB  N3    N  NH1   0  -0.647    6.5853  -0.7583  -0.1889
 OQB  C16   C  C     0   0.557    6.6083   0.5499  -0.5095
 OQB  O34   O  O     0  -0.474    7.6368   1.2035  -0.5795
 OQB  C21   C  CR6   0  -0.152    5.2848   1.1841  -0.7739
 OQB  C12   C  CR16  0  -0.067    4.0849   0.6953  -0.2766
 OQB  N1    N  N     0  -0.453    2.9127   1.2748  -0.5035
 OQB  C23   C  CR16  0  -0.139    5.2384   2.3564  -1.5268
 OQB  C24   C  CR16  0  -0.316    4.0213   2.9561  -1.7685
 OQB  C14   C  CR6   0   0.238    2.8717   2.3765  -1.2374
 OQB  C19   C  CH2   0  -0.285    1.5302   3.0180  -1.4672
 OQB  N6    N  NH1   0  -0.677    0.4697   2.1321  -1.0731
 OQB  C15   C  C     0   0.549   -0.8215   2.4252  -1.2894
 OQB  O36   O  O     0  -0.498   -1.1710   3.4800  -1.8077
 OQB  C20   C  CR6   0  -0.053   -1.8167   1.3994  -0.8697
 OQB  C22   C  CR16  0  -0.258   -3.1446   1.7841  -0.7159
 OQB  C26   C  CR16  0  -0.281   -1.4970   0.0578  -0.6545
 OQB  C25   C  CR16  0  -0.344   -2.4673  -0.8522  -0.2914
 OQB  C11   C  CR6   0   0.367   -3.8013  -0.4557  -0.1254
 OQB  C8    C  CR16  0  -0.304   -4.1301   0.8865  -0.3428
 OQB  N2    N  NH1   0  -0.791   -4.7025  -1.4415   0.2385
 OQB  C13   C  CR6   0   0.485   -6.0447  -1.3813   0.4683
 OQB  C29   C  CR16  0  -0.171   -6.6918  -2.6196   0.8152
 OQB  N4    N  N     0  -0.374   -7.9569  -2.6886   1.0547
 OQB  N5    N  N     0  -0.471   -6.7176  -0.2702   0.3821
 OQB  C32   C  CR66  0   0.274   -8.0501  -0.3242   0.6304
 OQB  C31   C  CR66  0   0.193   -8.6837  -1.5388   0.9702
 OQB  C17   C  CR16  0  -0.320   -8.8229   0.8502   0.5493
 OQB  C30   C  CR16  0  -0.249  -10.1717   0.8024   0.7987
 OQB  C18   C  CR16  0  -0.267  -10.8009  -0.4108   1.1370
 OQB  C7    C  CR16  0  -0.298  -10.0666  -1.5667   1.2220
 OQB  H37   H  HOH1  0   0.483    6.8188  -2.0136   4.3349
 OQB  H101  H  HCH2  0   0.313    8.4691  -3.0944   1.3725
 OQB  H102  H  HCH2  0   0.299    6.7459  -3.1331   1.0920
 OQB  H27   H  HCH1  0   0.309    8.5824  -0.8085   0.3268
 OQB  H28   H  H     0   0.207    9.1426  -2.9108  -0.9332
 OQB  HN3   H  HNH1  0   0.411    5.7374  -1.2846  -0.3335
 OQB  H12   H  HCR6  0   0.270    4.0540  -0.1889   0.3510
 OQB  H23   H  HCR6  0   0.279    6.1472   2.7847  -1.9275
 OQB  H24   H  HCR6  0   0.278    3.9554   3.8581  -2.3625
 OQB  H191  H  HCH2  0   0.271    1.4942   3.9584  -0.9050
 OQB  H192  H  HCH2  0   0.269    1.4348   3.2878  -2.5217
 OQB  HN6   H  HNH1  0   0.408    0.7473   1.3271  -0.5313
 OQB  H22   H  HCR6  0   0.258   -3.4242   2.8152  -0.8872
 OQB  H26   H  HCR6  0   0.253   -0.4879  -0.3102  -0.7930
 OQB  H25   H  HCR6  0   0.276   -2.1908  -1.8890  -0.1404
 OQB  H8    H  HCR6  0   0.295   -5.1453   1.2269  -0.2257
 OQB  HN2   H  HNH1  0   0.422   -4.2989  -2.3603   0.3445
 OQB  H29   H  HCR6  0   0.288   -6.1078  -3.5337   0.8801
 OQB  H17   H  HCR6  0   0.264   -8.3337   1.7797   0.2874
 OQB  H30   H  HCR6  0   0.266  -10.7621   1.7071   0.7354
 OQB  H18   H  HCR6  0   0.264  -11.8655  -0.4270   1.3278
 OQB  H7    H  HCR6  0   0.266  -10.5295  -2.5105   1.4812

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    single    1.326  0.020  1.326
 OQB  O37  H37   single    0.850  0.020  0.980
 OQB  C9   O33   double    1.204  0.020  1.204
 OQB  C9   C10   single    1.507  0.020  1.507
 OQB  C10  C27   single    1.523  0.020  1.523
 OQB  C10  H101  single    0.970  0.020  1.090
 OQB  C10  H102  single    0.970  0.020  1.090
 OQB  C27  C28   single    1.513  0.020  1.513
 OQB  C27  N3    single    1.435  0.020  1.435
 OQB  C27  H27   single    0.970  0.020  1.090
 OQB  C28  O35   double    1.201  0.020  1.201
 OQB  C28  H28   single    0.930  0.020  1.080
 OQB  N3   C16   single    1.347  0.020  1.347
 OQB  N3   HN3   single    0.860  0.020  1.020
 OQB  C16  O34   double    1.221  0.020  1.221
 OQB  C16  C21   single    1.491  0.020  1.491
 OQB  C21  C12   aromatic  1.388  0.020  1.388
 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  1.378  0.020  1.378
 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    1.342  0.020  1.342
 OQB  N6   HN6   single    0.860  0.020  1.020
 OQB  C15  O36   double    1.226  0.020  1.226
 OQB  C15  C20   single    1.490  0.020  1.490
 OQB  C20  C22   aromatic  1.391  0.020  1.391
 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  1.379  0.020  1.379
 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  1.399  0.020  1.399
 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  1.356  0.020  1.356
 OQB  C32  C31   aromatic  1.411  0.020  1.411
 OQB  C32  C17   aromatic  1.408  0.020  1.408
 OQB  C31  C7    aromatic  1.406  0.020  1.406
 OQB  C17  C30   aromatic  1.372  0.020  1.372
 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  H37   O37  C9    110.10  3.000
 OQB  C10   C9   O33   124.72  3.000
 OQB  C10   C9   O37   111.49  3.000
 OQB  O33   C9   O37   123.77  3.000
 OQB  H102  C10  H101  105.90  3.000
 OQB  H102  C10  C27   111.22  3.000
 OQB  H101  C10  C27   109.89  3.000
 OQB  H102  C10  C9    110.12  3.000
 OQB  H101  C10  C9    107.40  3.000
 OQB  C27   C10  C9    112.06  3.000
 OQB  H27   C27  N3    108.58  3.000
 OQB  H27   C27  C28   105.52  3.000
 OQB  N3    C27  C28   112.25  3.000
 OQB  H27   C27  C10   108.55  3.000
 OQB  N3    C27  C10   111.59  3.000
 OQB  C28   C27  C10   110.09  3.000
 OQB  H28   C28  O35   121.77  3.000
 OQB  H28   C28  C27   113.97  3.000
 OQB  O35   C28  C27   124.25  3.000
 OQB  HN3   N3   C16   119.15  3.000
 OQB  HN3   N3   C27   116.92  3.000
 OQB  C16   N3   C27   122.62  3.000
 OQB  C21   C16  O34   120.66  3.000
 OQB  C21   C16  N3    116.10  3.000
 OQB  O34   C16  N3    123.23  3.000
 OQB  C23   C21  C12   117.45  3.000
 OQB  C23   C21  C16   118.88  3.000
 OQB  C12   C21  C16   123.65  3.000
 OQB  H12   C12  N1    115.45  3.000
 OQB  H12   C12  C21   121.27  3.000
 OQB  N1    C12  C21   123.27  3.000
 OQB  C14   N1   C12   119.03  3.000
 OQB  H23   C23  C24   120.31  3.000
 OQB  H23   C23  C21   120.34  3.000
 OQB  C24   C23  C21   119.35  3.000
 OQB  H24   C24  C14   120.40  3.000
 OQB  H24   C24  C23   120.85  3.000
 OQB  C14   C24  C23   118.75  3.000
 OQB  C19   C14  C24   120.02  3.000
 OQB  C19   C14  N1    117.83  3.000
 OQB  C24   C14  N1    122.14  3.000
 OQB  H192  C19  H191  106.27  3.000
 OQB  H192  C19  N6    110.65  3.000
 OQB  H191  C19  N6    111.34  3.000
 OQB  H192  C19  C14   109.30  3.000
 OQB  H191  C19  C14   108.46  3.000
 OQB  N6    C19  C14   110.69  3.000
 OQB  HN6   N6   C15   121.70  3.000
 OQB  HN6   N6   C19   115.85  3.000
 OQB  C15   N6   C19   122.10  3.000
 OQB  C20   C15  O36   121.41  3.000
 OQB  C20   C15  N6    116.56  3.000
 OQB  O36   C15  N6    122.03  3.000
 OQB  C26   C20  C22   117.87  3.000
 OQB  C26   C20  C15   123.52  3.000
 OQB  C22   C20  C15   118.59  3.000
 OQB  H22   C22  C8    118.46  3.000
 OQB  H22   C22  C20   119.52  3.000
 OQB  C8    C22  C20   122.01  3.000
 OQB  H26   C26  C25   117.71  3.000
 OQB  H26   C26  C20   121.35  3.000
 OQB  C25   C26  C20   120.91  3.000
 OQB  H25   C25  C11   119.81  3.000
 OQB  H25   C25  C26   119.25  3.000
 OQB  C11   C25  C26   120.94  3.000
 OQB  N2    C11  C8    124.83  3.000
 OQB  N2    C11  C25   116.69  3.000
 OQB  C8    C11  C25   118.48  3.000
 OQB  H8    C8   C11   120.52  3.000
 OQB  H8    C8   C22   119.70  3.000
 OQB  C11   C8   C22   119.78  3.000
 OQB  HN2   N2   C13   114.60  3.000
 OQB  HN2   N2   C11   114.56  3.000
 OQB  C13   N2   C11   130.84  3.000
 OQB  N5    C13  C29   121.18  3.000
 OQB  N5    C13  N2    122.38  3.000
 OQB  C29   C13  N2    116.44  3.000
 OQB  H29   C29  N4    118.12  3.000
 OQB  H29   C29  C13   119.76  3.000
 OQB  N4    C29  C13   122.13  3.000
 OQB  C31   N4   C29   117.81  3.000
 OQB  C32   N5   C13   117.49  3.000
 OQB  C17   C32  C31   119.02  3.000
 OQB  C17   C32  N5    119.69  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    120.10  3.000
 OQB  H17   C17  C30   121.20  3.000
 OQB  H17   C17  C32   118.82  3.000
 OQB  C30   C17  C32   119.99  3.000
 OQB  H30   C30  C18   119.38  3.000
 OQB  H30   C30  C17   119.76  3.000
 OQB  C18   C30  C17   120.86  3.000
 OQB  H18   C18  C7    120.21  3.000
 OQB  H18   C18  C30   119.68  3.000
 OQB  C7    C18  C30   120.11  3.000
 OQB  H7    C7   C18   121.35  3.000
 OQB  H7    C7   C31   118.74  3.000
 OQB  C18   C7   C31   119.91  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  CONST_59  H37  O37  C9   O33     0.00   0.0  0
 OQB  Var_01    C13  N2   C11  C25  -179.72  30.0  2
 OQB  Var_02    C29  C13  N2   C11   179.02  30.0  2
 OQB  Var_03    C12  C21  C16  N3     23.43  30.0  2
 OQB  Var_04    N6   C19  C14  N1    -12.74  30.0  2
 OQB  Var_05    C22  C20  C15  N6    162.10  30.0  2
 OQB  Var_06    C15  N6   C19  C14  -173.97  30.0  3
 OQB  Var_07    C27  C10  C9   O37   163.22  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
 OQB  plan-7  H37  0.020

