# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sat Apr 25 00:54:15 2020
#   Inital geometry file: a 156 line input string
#   Ligand name: (2S)-N-(benzylsulfonyl)-4-(cyclobutylmethyl)-2-(2,4-dichlorophenyl)-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: Clc1ccc([C@H]2CN(CC3CCC3)c4cc(ccc4O2)C(=O)N[S](=O)(=O)Cc5ccccc5)c(Cl)c1
#
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
 N8J  N8J  (2S)-N-(benzylsulfonyl)-4-(cyclobutylmethyl)-2-(2,4-dichlorophenyl)-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide  ligand  62  36  .  2022-09-22  2023-02-15
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK (reasonable std)
;

data_comp_N8J
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
 N8J  N1    N   NT    0  -0.527    1.6461  -1.2950   0.2498
 N8J  C4    C   CR6   0   0.369    0.7332  -0.3204  -0.0989
 N8J  C5    C   CR16  0  -0.410   -0.6470  -0.4961  -0.0395
 N8J  C6    C   CR6   0  -0.028   -1.5335   0.5120  -0.4204
 N8J  C7    C   C     0   0.579   -2.9795   0.2071  -0.3540
 N8J  C8    C   CR16  0  -0.312   -1.0424   1.7342  -0.8658
 N8J  C10   C   CR6   0   0.340    1.2064   0.9332  -0.5487
 N8J  C15   C   C     0  -0.429    1.7469  -5.0711   1.0813
 N8J  C17   C   C     0  -0.429    2.8066  -4.0900  -0.5110
 N8J  C21   C   CR16  0  -0.180    6.1064   2.4442   0.9518
 N8J  C22   C   CR16  0  -0.333    4.8795   1.9144   0.5894
 N8J  C24   C   CR6   0  -0.119    5.9612   0.0746  -0.4608
 N8J  CL25  CL  CL    0  -0.105    5.9266  -1.4252  -1.3307
 N8J  C2    C   CH2   0  -0.271    1.1754  -2.5394   0.8299
 N8J  O3    O   O2    0  -0.483    2.5213   1.2182  -0.6372
 N8J  C9    C   CR16  0  -0.356    0.3260   1.9325  -0.9278
 N8J  C11   C   CH1   0  -0.007    3.4325   0.1465  -0.4720
 N8J  C12   C   CH2   0  -0.303    2.9456  -0.7922   0.6215
 N8J  O13   O   O     0  -0.438   -3.4237  -0.9217  -0.3210
 N8J  C14   C   C     0  -0.291    2.2282  -3.6254   0.8395
 N8J  C16   C   C     0  -0.452    2.7597  -5.5363   0.0170
 N8J  C18   C   CR16  0  -0.145    7.2042   0.5801  -0.1128
 N8J  C19   C   CR6   0  -0.063    7.2613   1.7698   0.5920
 N8J  C23   C   CR6   0   0.167    4.7766   0.7261  -0.1284
 N8J  O27   O   OS    0  -0.649   -5.9210   2.5901  -0.5197
 N8J  O28   O   OS    0  -0.634   -5.7960   0.3358  -1.6054
 N8J  N29   N   NC1   0  -0.841   -3.8178   1.3012  -0.3189
 N8J  C30   C   CH2   0  -0.710   -6.0528   0.4494   1.0348
 N8J  C31   C   CR6   0   0.104   -7.5466   0.3565   0.9990
 N8J  C32   C   CR16  0  -0.274   -8.1647  -0.7787   0.4829
 N8J  C33   C   CR16  0  -0.242   -9.5487  -0.8632   0.4408
 N8J  C34   C   CR16  0  -0.257  -10.3250   0.1903   0.9064
 N8J  C35   C   CR16  0  -0.242   -9.7126   1.3278   1.4164
 N8J  C36   C   CR16  0  -0.275   -8.3285   1.4124   1.4589
 N8J  H6    H   HCR6  0   0.279   -1.0553  -1.4283   0.3225
 N8J  H7    H   HCR6  0   0.260   -1.6952   2.5288  -1.2018
 N8J  H10   H   H     0   0.233    1.8411  -5.4720   2.0906
 N8J  H11   H   H     0   0.224    0.7175  -5.2134   0.7448
 N8J  H15   H   H     0   0.225    2.0864  -3.9338  -1.3175
 N8J  H14   H   H     0   0.223    3.7703  -3.6860  -0.8222
 N8J  H17   H   HCR6  0   0.288    6.1569   3.3696   1.5084
 N8J  H18   H   HCR6  0   0.277    3.9828   2.4469   0.8756
 N8J  H2    H   HCH2  0   0.230    0.7779  -2.3892   1.8446
 N8J  H4    H   HCH2  0   0.238    0.3468  -2.9000   0.2161
 N8J  H8    H   HCR6  0   0.275    0.7254   2.8734  -1.2837
 N8J  H5    H   HCH1  0   0.269    3.4890  -0.4147  -1.4101
 N8J  H3    H   HCH2  0   0.253    2.9379  -0.2675   1.5874
 N8J  H1    H   HCH2  0   0.271    3.6540  -1.6131   0.7023
 N8J  H9    H   H     0   0.251    3.0318  -3.3994   1.5459
 N8J  H12   H   H     0   0.227    3.7084  -5.8325   0.4663
 N8J  H13   H   H     0   0.230    2.4443  -6.3185  -0.6733
 N8J  H16   H   HCR6  0   0.305    8.1072   0.0529  -0.3867
 N8J  H19   H   HNC1  0   0.448   -3.4578   2.2313  -0.1442
 N8J  H21   H   HCH2  0   0.332   -5.5782  -0.5285   1.1093
 N8J  H20   H   HCH2  0   0.332   -5.6902   1.0827   1.8451
 N8J  H22   H   HCR6  0   0.259   -7.5637  -1.6046   0.1234
 N8J  H23   H   HCR6  0   0.262  -10.0208  -1.7519   0.0434
 N8J  H24   H   HCR6  0   0.262  -11.4047   0.1232   0.8754
 N8J  H25   H   HCR6  0   0.262  -10.3125   2.1509   1.7821
 N8J  H26   H   HCR6  0   0.260   -7.8546   2.2979   1.8631
 N8J  CL20  CL  CL    0  -0.110    8.8037   2.4145   1.0306
 N8J  S26   S   S     0   1.382   -5.4833   1.2060  -0.4906

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
 N8J  O13   C7    double    1.214  0.020  1.214
 N8J  C7    N29   single    1.379  0.020  1.379
 N8J  C7    C6    single    1.479  0.020  1.479
 N8J  N29   S26   single    1.677  0.020  1.677
 N8J  O28   S26   double    1.448  0.020  1.448
 N8J  C6    C8    aromatic  1.390  0.020  1.390
 N8J  C6    C5    aromatic  1.395  0.020  1.395
 N8J  C8    C9    aromatic  1.384  0.020  1.384
 N8J  S26   C30   single    1.795  0.020  1.795
 N8J  S26   O27   double    1.452  0.020  1.452
 N8J  C5    C4    aromatic  1.393  0.020  1.393
 N8J  C30   C31   single    1.497  0.020  1.497
 N8J  C9    C10   aromatic  1.385  0.020  1.385
 N8J  C10   C4    aromatic  1.413  0.020  1.413
 N8J  C10   O3    single    1.348  0.020  1.348
 N8J  C4    N1    single    1.380  0.020  1.380
 N8J  C31   C32   aromatic  1.392  0.020  1.392
 N8J  C31   C36   aromatic  1.392  0.020  1.392
 N8J  C32   C33   aromatic  1.387  0.020  1.387
 N8J  O3    C11   single    1.416  0.020  1.416
 N8J  N1    C2    single    1.451  0.020  1.451
 N8J  N1    C12   single    1.442  0.020  1.442
 N8J  C36   C35   aromatic  1.387  0.020  1.387
 N8J  C33   C34   aromatic  1.389  0.020  1.389
 N8J  C2    C14   single    1.513  0.020  1.513
 N8J  C11   C12   single    1.521  0.020  1.521
 N8J  C11   C23   single    1.504  0.020  1.504
 N8J  C14   C15   single    1.543  0.020  1.543
 N8J  C14   C17   single    1.541  0.020  1.541
 N8J  C15   C16   single    1.541  0.020  1.541
 N8J  C35   C34   aromatic  1.389  0.020  1.389
 N8J  C23   C22   aromatic  1.392  0.020  1.392
 N8J  C23   C24   aromatic  1.392  0.020  1.392
 N8J  C22   C21   aromatic  1.385  0.020  1.385
 N8J  C17   C16   single    1.540  0.020  1.540
 N8J  CL25  C24   single    1.734  0.020  1.734
 N8J  C24   C18   aromatic  1.386  0.020  1.386
 N8J  C21   C19   aromatic  1.385  0.020  1.385
 N8J  C18   C19   aromatic  1.384  0.020  1.384
 N8J  C19   CL20  single    1.728  0.020  1.728
 N8J  C5    H6    single    0.930  0.020  1.080
 N8J  C8    H7    single    0.930  0.020  1.080
 N8J  C15   H10   single    0.970  0.020  1.090
 N8J  C15   H11   single    0.970  0.020  1.090
 N8J  C17   H15   single    0.970  0.020  1.090
 N8J  C17   H14   single    0.970  0.020  1.090
 N8J  C21   H17   single    0.930  0.020  1.080
 N8J  C22   H18   single    0.930  0.020  1.080
 N8J  C2    H2    single    0.970  0.020  1.090
 N8J  C2    H4    single    0.970  0.020  1.090
 N8J  C9    H8    single    0.930  0.020  1.080
 N8J  C11   H5    single    0.970  0.020  1.090
 N8J  C12   H3    single    0.970  0.020  1.090
 N8J  C12   H1    single    0.970  0.020  1.090
 N8J  C14   H9    single    0.970  0.020  1.090
 N8J  C16   H12   single    0.970  0.020  1.090
 N8J  C16   H13   single    0.970  0.020  1.090
 N8J  C18   H16   single    0.930  0.020  1.080
 N8J  N29   H19   single    0.860  0.020  1.020
 N8J  C30   H21   single    0.970  0.020  1.090
 N8J  C30   H20   single    0.970  0.020  1.090
 N8J  C32   H22   single    0.930  0.020  1.080
 N8J  C33   H23   single    0.930  0.020  1.080
 N8J  C34   H24   single    0.930  0.020  1.080
 N8J  C35   H25   single    0.930  0.020  1.080
 N8J  C36   H26   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
 N8J  C12   N1   C2    119.22  3.000
 N8J  C12   N1   C4    114.52  3.000
 N8J  C2    N1   C4    119.46  3.000
 N8J  C10   C4   C5    117.21  3.000
 N8J  C10   C4   N1    119.03  3.000
 N8J  C5    C4   N1    123.76  3.000
 N8J  H6    C5   C6    118.35  3.000
 N8J  H6    C5   C4    119.86  3.000
 N8J  C6    C5   C4    121.79  3.000
 N8J  C8    C6   C7    122.74  3.000
 N8J  C8    C6   C5    119.87  3.000
 N8J  C7    C6   C5    117.38  3.000
 N8J  N29   C7   O13   121.00  3.000
 N8J  N29   C7   C6    115.59  3.000
 N8J  O13   C7   C6    123.41  3.000
 N8J  H7    C8   C9    118.52  3.000
 N8J  H7    C8   C6    122.14  3.000
 N8J  C9    C8   C6    119.31  3.000
 N8J  C9    C10  O3    116.71  3.000
 N8J  O3    C10  C4    122.34  3.000
 N8J  C9    C10  C4    120.95  3.000
 N8J  H11   C15  H10   108.59  3.000
 N8J  H11   C15  C16   111.55  3.000
 N8J  H10   C15  C16   118.13  3.000
 N8J  H11   C15  C14   111.58  3.000
 N8J  H10   C15  C14   117.57  3.000
 N8J  C16   C15  C14    88.26  3.000
 N8J  H14   C17  H15   108.60  3.000
 N8J  H14   C17  C16   118.20  3.000
 N8J  H15   C17  C16   111.55  3.000
 N8J  H14   C17  C14   118.05  3.000
 N8J  H15   C17  C14   110.89  3.000
 N8J  C16   C17  C14    88.36  3.000
 N8J  H17   C21  C19   120.77  3.000
 N8J  H17   C21  C22   120.25  3.000
 N8J  C19   C21  C22   118.98  3.000
 N8J  H18   C22  C23   119.71  3.000
 N8J  H18   C22  C21   118.49  3.000
 N8J  C23   C22  C21   121.80  3.000
 N8J  C23   C24  C18   122.16  3.000
 N8J  C18   C24  CL25  117.34  3.000
 N8J  C23   C24  CL25  120.50  3.000
 N8J  H4    C2   H2    106.81  3.000
 N8J  H4    C2   C14   107.13  3.000
 N8J  H2    C2   C14   110.10  3.000
 N8J  H4    C2   N1    107.72  3.000
 N8J  H2    C2   N1    111.64  3.000
 N8J  C14   C2   N1    113.10  3.000
 N8J  C11   O3   C10   117.37  3.000
 N8J  H8    C9   C10   118.86  3.000
 N8J  H8    C9   C8    120.28  3.000
 N8J  C10   C9   C8    120.86  3.000
 N8J  H5    C11  C23   110.33  3.000
 N8J  H5    C11  C12   108.44  3.000
 N8J  C23   C11  C12   111.09  3.000
 N8J  H5    C11  O3    108.73  3.000
 N8J  C23   C11  O3    108.06  3.000
 N8J  C12   C11  O3    110.17  3.000
 N8J  H1    C12  H3    107.44  3.000
 N8J  H1    C12  C11   108.10  3.000
 N8J  H3    C12  C11   109.84  3.000
 N8J  H1    C12  N1    110.06  3.000
 N8J  H3    C12  N1    112.75  3.000
 N8J  C11   C12  N1    108.56  3.000
 N8J  H9    C14  C2    111.54  3.000
 N8J  H9    C14  C17   110.65  3.000
 N8J  C2    C14  C17   118.18  3.000
 N8J  H9    C14  C15   108.76  3.000
 N8J  C17   C14  C15    88.39  3.000
 N8J  C2    C14  C15   117.17  3.000
 N8J  H13   C16  H12   108.53  3.000
 N8J  H13   C16  C17   117.75  3.000
 N8J  H12   C16  C17   111.70  3.000
 N8J  H13   C16  C15   117.64  3.000
 N8J  H12   C16  C15   111.67  3.000
 N8J  C17   C16  C15    88.47  3.000
 N8J  H16   C18  C19   120.92  3.000
 N8J  H16   C18  C24   120.51  3.000
 N8J  C19   C18  C24   118.58  3.000
 N8J  C18   C19  CL20  119.13  3.000
 N8J  CL20  C19  C21   119.78  3.000
 N8J  C18   C19  C21   121.10  3.000
 N8J  C11   C23  C24   121.71  3.000
 N8J  C24   C23  C22   117.37  3.000
 N8J  C11   C23  C22   120.86  3.000
 N8J  H19   N29  S26   115.02  3.000
 N8J  H19   N29  C7    121.14  3.000
 N8J  S26   N29  C7    123.79  3.000
 N8J  H20   C30  H21   109.00  3.000
 N8J  H20   C30  C31   112.68  3.000
 N8J  H21   C30  C31   112.37  3.000
 N8J  H20   C30  S26   106.32  3.000
 N8J  H21   C30  S26   107.35  3.000
 N8J  C31   C30  S26   108.81  3.000
 N8J  C36   C31  C32   119.46  3.000
 N8J  C36   C31  C30   120.36  3.000
 N8J  C32   C31  C30   120.17  3.000
 N8J  H22   C32  C33   119.82  3.000
 N8J  H22   C32  C31   119.92  3.000
 N8J  C33   C32  C31   120.26  3.000
 N8J  H23   C33  C34   120.15  3.000
 N8J  H23   C33  C32   119.77  3.000
 N8J  C34   C33  C32   120.08  3.000
 N8J  H24   C34  C35   120.08  3.000
 N8J  H24   C34  C33   120.06  3.000
 N8J  C35   C34  C33   119.86  3.000
 N8J  H25   C35  C36   119.76  3.000
 N8J  H25   C35  C34   120.17  3.000
 N8J  C36   C35  C34   120.07  3.000
 N8J  H26   C36  C35   119.86  3.000
 N8J  H26   C36  C31   119.86  3.000
 N8J  C35   C36  C31   120.27  3.000
 N8J  C30   S26  N29   104.60  3.000
 N8J  C30   S26  O28   109.41  3.000
 N8J  N29   S26  O28   109.10  3.000
 N8J  C30   S26  O27   108.85  3.000
 N8J  O28   S26  O27   119.49  3.000
 N8J  N29   S26  O27   104.32  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
 N8J  CONST_01  C8    C6   C5   C4       0.00   0.0  0
 N8J  CONST_02  C8    C9   C10  C4       0.00   0.0  0
 N8J  CONST_03  C9    C8   C6   C5       0.00   0.0  0
 N8J  CONST_04  C9    C10  C4   C5       0.00   0.0  0
 N8J  CONST_05  C10   C9   C8   C6       0.00   0.0  0
 N8J  CONST_06  C10   C4   C5   C6       0.00   0.0  0
 N8J  CONST_07  C24   C23  C22  C21      0.00   0.0  0
 N8J  CONST_08  C24   C18  C19  C21      0.00   0.0  0
 N8J  CONST_09  C18   C24  C23  C22      0.00   0.0  0
 N8J  CONST_10  C18   C19  C21  C22      0.00   0.0  0
 N8J  CONST_11  C23   C22  C21  C19      0.00   0.0  0
 N8J  CONST_12  C23   C24  C18  C19      0.00   0.0  0
 N8J  CONST_13  C34   C33  C32  C31      0.00   0.0  0
 N8J  CONST_14  C34   C35  C36  C31      0.00   0.0  0
 N8J  CONST_15  C35   C36  C31  C32      0.00   0.0  0
 N8J  CONST_16  C35   C34  C33  C32      0.00   0.0  0
 N8J  CONST_17  C36   C31  C32  C33      0.00   0.0  0
 N8J  CONST_18  C36   C35  C34  C33      0.00   0.0  0
 N8J  CONST_19  C11   C23  C22  C21    180.00   0.0  0
 N8J  CONST_20  C18   C24  C23  C11    180.00   0.0  0
 N8J  CONST_21  C7    C6   C5   C4     180.00   0.0  0
 N8J  CONST_22  C9    C8   C6   C7     180.00   0.0  0
 N8J  CONST_23  CL25  C24  C23  C22    180.00   0.0  0
 N8J  CONST_24  CL20  C19  C21  C22    180.00   0.0  0
 N8J  CONST_25  CL20  C19  C18  C24    180.00   0.0  0
 N8J  CONST_26  C11   C23  C24  CL25     0.00   0.0  0
 N8J  CONST_27  C19   C18  C24  CL25   180.00   0.0  0
 N8J  CONST_28  C33   C32  C31  C30    180.00   0.0  0
 N8J  CONST_29  C35   C36  C31  C30    180.00   0.0  0
 N8J  CONST_30  H6    C5   C4   N1       0.00   0.0  0
 N8J  CONST_31  H8    C9   C10  C4     180.00   0.0  0
 N8J  CONST_32  H7    C8   C6   C5     180.00   0.0  0
 N8J  CONST_33  H16   C18  C19  C21    180.00   0.0  0
 N8J  CONST_34  H18   C22  C23  C24    180.00   0.0  0
 N8J  CONST_35  H17   C21  C19  C18    180.00   0.0  0
 N8J  CONST_36  H23   C33  C32  C31    180.00   0.0  0
 N8J  CONST_37  H25   C35  C36  C31    180.00   0.0  0
 N8J  CONST_38  H26   C36  C31  C32    180.00   0.0  0
 N8J  CONST_39  H24   C34  C33  C32    180.00   0.0  0
 N8J  CONST_40  H22   C32  C33  C34    180.00   0.0  0
 N8J  CONST_41  S26   N29  C7   C6     180.00   0.0  0
 N8J  CONST_42  H19   N29  C7   C6       0.00   0.0  0
 N8J  CONST_43  S26   N29  C7   O13      0.00   0.0  0
 N8J  Var_01    C11   C12  N1   C4     -51.44  30.0  1
 N8J  Var_02    C12   N1   C4   C5    -156.84  30.0  1
 N8J  Var_03    C14   C17  C16  C15     19.18  30.0  1
 N8J  Var_04    C14   C2   N1   C4     165.70  30.0  3
 N8J  Var_05    O13   C7   C6   C5     -19.16  30.0  2
 N8J  Var_06    C32   C31  C30  S26     90.53  30.0  2
 N8J  Var_07    C31   C30  S26  O27     67.26  30.0  3
 N8J  Var_08    O28   S26  N29  C7     -45.83  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
 N8J  chir_01  C11  O3  C12  C23  positiv
 N8J  chir_02  C14  C2  C15  C17  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
 N8J  plan-1  C21   0.020
 N8J  plan-1  C22   0.020
 N8J  plan-1  C24   0.020
 N8J  plan-1  CL25  0.020
 N8J  plan-1  C11   0.020
 N8J  plan-1  C18   0.020
 N8J  plan-1  C19   0.020
 N8J  plan-1  C23   0.020
 N8J  plan-1  H17   0.020
 N8J  plan-1  H18   0.020
 N8J  plan-1  H16   0.020
 N8J  plan-1  CL20  0.020
 N8J  plan-2  N1    0.020
 N8J  plan-2  C4    0.020
 N8J  plan-2  C5    0.020
 N8J  plan-2  C6    0.020
 N8J  plan-2  C7    0.020
 N8J  plan-2  C8    0.020
 N8J  plan-2  C10   0.020
 N8J  plan-2  O3    0.020
 N8J  plan-2  C9    0.020
 N8J  plan-2  H6    0.020
 N8J  plan-2  H7    0.020
 N8J  plan-2  H8    0.020
 N8J  plan-3  C30   0.020
 N8J  plan-3  C31   0.020
 N8J  plan-3  C32   0.020
 N8J  plan-3  C33   0.020
 N8J  plan-3  C34   0.020
 N8J  plan-3  C35   0.020
 N8J  plan-3  C36   0.020
 N8J  plan-3  H22   0.020
 N8J  plan-3  H23   0.020
 N8J  plan-3  H24   0.020
 N8J  plan-3  H25   0.020
 N8J  plan-3  H26   0.020
 N8J  plan-4  C6    0.020
 N8J  plan-4  C7    0.020
 N8J  plan-4  O13   0.020
 N8J  plan-4  N29   0.020
 N8J  plan-4  H19   0.020
 N8J  plan-4  S26   0.020

