# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version 1.18.1-3865-
#   - file written: Sat May 23 00:48:40 2020
#   Inital geometry file: a 173 line input string
#   Ligand name: N-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoyl)-L-gamma-glutamyl-L-glutamic acid
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: NC1=Nc2ncc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)nc2C(=O)N1
#
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
 28Z  28Z  'N-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoyl)-L-gamma-glutamyl-L-glutamic acid'  ligand  64  41  .  2022-07-22  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_28Z
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
 28Z  O4   O  O      0  -0.434    9.4170  -1.1983  -1.4906
 28Z  C4   C  CR6    0   0.538    9.4013  -0.0834  -1.0150
 28Z  C4A  C  CR66   0  -0.043    8.3526   0.4610  -0.1519
 28Z  N3   N  NR16   0  -0.715   10.4162   0.8193  -1.2496
 28Z  C8A  C  CR66   0   0.399    8.4790   1.7777   0.3262
 28Z  N5   N  N      0  -0.352    7.3201  -0.3155   0.1516
 28Z  C2   C  CR6    0   0.703   10.4551   2.0889  -0.7410
 28Z  N8   N  N      0  -0.384    7.5243   2.2798   1.1268
 28Z  N1   N  N      0  -0.505    9.5211   2.5805   0.0290
 28Z  C6   C  CR6    0   0.128    6.3914   0.1840   0.9374
 28Z  N2   N  NH2    0  -0.820   11.5079   2.8318  -1.0689
 28Z  C7   C  CR16   0  -0.081    6.5129   1.4992   1.4202
 28Z  C9   C  CH2    0  -0.331    5.2050  -0.6607   1.2923
 28Z  N10  N  NH1    0  -0.697    4.0870  -0.3387   0.4370
 28Z  CBH  C  C      0   0.398    2.8447  -0.8584   0.6119
 28Z  CAL  C  C1     0  -0.350    2.5846  -1.8648   1.5560
 28Z  CAK  C  C1     0  -0.333    1.7689  -0.3953  -0.1675
 28Z  CAN  C  C1     0  -0.260    1.3070  -2.3705   1.7061
 28Z  CAM  C  C1     0  -0.284    0.5043  -0.9184  -0.0086
 28Z  CBI  C  C      0  -0.086    0.2409  -1.9226   0.9291
 28Z  CBF  C  C      0   0.546   -1.1067  -2.5050   1.1657
 28Z  OAF  O  O      0  -0.510   -1.3510  -3.1316   2.1932
 28Z  NBA  N  NH1    0  -0.645   -2.0397  -2.2803   0.2225
 28Z  CBO  C  CH1    0  -0.198   -3.3375  -2.9117   0.2700
 28Z  CBD  C  C      0   0.412   -3.2943  -4.4120  -0.1280
 28Z  OAI  O  O      0  -0.595   -2.2387  -4.8532  -0.6113
 28Z  CAS  C  CH2    0  -0.450   -4.3186  -2.1489  -0.6180
 28Z  CAQ  C  CH2    0  -0.579   -4.5417  -0.7144  -0.1620
 28Z  CBE  C  C      0   0.570   -5.5675   0.0212  -0.9987
 28Z  OAE  O  O      0  -0.519   -5.7618  -0.2499  -2.1783
 28Z  OAD  O  OC    -1  -0.618   -4.3566  -5.0364   0.0670
 28Z  N    N  NH1    0  -0.629   -6.2516   0.9770  -0.3531
 28Z  CA   C  CH1    0  -0.183   -7.0781   1.9357  -1.0495
 28Z  C    C  C      0   0.408   -6.2506   2.9076  -1.9307
 28Z  O    O  O     -1  -0.600   -5.0209   2.9499  -1.7546
 28Z  CB   C  CH2    0  -0.448   -7.9299   2.7171  -0.0487
 28Z  CG   C  CH2    0  -0.578   -8.8696   1.8443   0.7693
 28Z  CD   C  C      0   0.411   -9.8382   2.6000   1.6976
 28Z  OE1  O  O      0  -0.609   -9.8440   3.8457   1.6490
 28Z  OE2  O  OC    -1  -0.634  -10.5564   1.8876   2.4315
 28Z  OXT  O  OC     0  -0.621   -6.9202   3.5892  -2.7339
 28Z  H4   H  HNR6   0   0.433   11.1780   0.5003  -1.8358
 28Z  H2   H  HNH2   0   0.424   12.2605   2.4904  -1.6412
 28Z  H3   H  HNH2   0   0.421   11.5773   3.7665  -0.7050
 28Z  H1   H  HCR6   0   0.283    5.7481   1.9076   2.0731
 28Z  H5   H  HCH2   0   0.258    5.4836  -1.7140   1.1923
 28Z  H6   H  HCH2   0   0.252    4.9456  -0.4958   2.3452
 28Z  H7   H  HNH1   0   0.395    4.1865   0.4261  -0.2093
 28Z  H10  H  H      0   0.270    3.3784  -2.2572   2.1771
 28Z  H8   H  H      0   0.262    1.9351   0.3914  -0.8938
 28Z  H11  H  H      0   0.251    1.1400  -3.1402   2.4484
 28Z  H9   H  H      0   0.248   -0.2898  -0.5063  -0.6192
 28Z  H12  H  HNH1   0   0.387   -1.7264  -1.9825  -0.6876
 28Z  H13  H  HCH1   0   0.234   -3.6972  -2.8550   1.3007
 28Z  H15  H  HCH2   0   0.227   -3.9672  -2.1632  -1.6539
 28Z  H16  H  HCH2   0   0.242   -5.2638  -2.6921  -0.6053
 28Z  H17  H  HCH2   0   0.246   -4.8335  -0.6993   0.8920
 28Z  H18  H  HCH2   0   0.263   -3.6085  -0.1446  -0.2202
 28Z  H19  H  HNH1   0   0.384   -5.9497   1.2139   0.5789
 28Z  H20  H  HCH1   0   0.223   -7.7564   1.3830  -1.7072
 28Z  H22  H  HCH2   0   0.210   -7.2742   3.2915   0.6152
 28Z  H23  H  HCH2   0   0.226   -8.5097   3.4495  -0.6103
 28Z  H24  H  HCH2   0   0.220   -9.4663   1.2220   0.0908
 28Z  H25  H  HCH2   0   0.219   -8.3042   1.1319   1.3788

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
 28Z  O    C    deloc     1.243  0.020  1.243
 28Z  OE1  CD   deloc     1.247  0.020  1.247
 28Z  C    OXT  deloc     1.248  0.020  1.248
 28Z  C    CA   single    1.551  0.020  1.551
 28Z  CD   OE2  deloc     1.250  0.020  1.250
 28Z  CD   CG   single    1.540  0.020  1.540
 28Z  CG   CB   single    1.521  0.020  1.521
 28Z  CB   CA   single    1.529  0.020  1.529
 28Z  CA   N    single    1.445  0.020  1.445
 28Z  CAL  CBH  aromatic  1.404  0.020  1.404
 28Z  CAL  CAN  aromatic  1.382  0.020  1.382
 28Z  N10  CBH  single    1.358  0.020  1.358
 28Z  N10  C9   single    1.444  0.020  1.444
 28Z  CBH  CAK  aromatic  1.407  0.020  1.407
 28Z  CAN  CBI  aromatic  1.393  0.020  1.393
 28Z  C9   C6   single    1.499  0.020  1.499
 28Z  OAE  CBE  double    1.226  0.020  1.226
 28Z  N    CBE  single    1.341  0.020  1.341
 28Z  CBE  CAQ  single    1.514  0.020  1.514
 28Z  CAK  CAM  aromatic  1.378  0.020  1.378
 28Z  CBI  CAM  aromatic  1.399  0.020  1.399
 28Z  CBI  CBF  single    1.487  0.020  1.487
 28Z  CAS  CBO  single    1.527  0.020  1.527
 28Z  CAS  CAQ  single    1.522  0.020  1.522
 28Z  NBA  CBF  single    1.346  0.020  1.346
 28Z  NBA  CBO  single    1.444  0.020  1.444
 28Z  C6   N5   aromatic  1.315  0.020  1.315
 28Z  C6   C7   aromatic  1.406  0.020  1.406
 28Z  CBF  OAF  double    1.228  0.020  1.228
 28Z  N5   C4A  aromatic  1.327  0.020  1.327
 28Z  CBO  CBD  single    1.553  0.020  1.553
 28Z  C7   N8   aromatic  1.311  0.020  1.311
 28Z  O4   C4   double    1.212  0.020  1.212
 28Z  C4A  C4   single    1.463  0.020  1.463
 28Z  C4A  C8A  aromatic  1.406  0.020  1.406
 28Z  N8   C8A  aromatic  1.343  0.020  1.343
 28Z  CBD  OAI  deloc     1.242  0.020  1.242
 28Z  CBD  OAD  deloc     1.248  0.020  1.248
 28Z  C4   N3   single    1.378  0.020  1.378
 28Z  C8A  N1   single    1.349  0.020  1.349
 28Z  N3   C2   single    1.368  0.020  1.368
 28Z  N1   C2   double    1.306  0.020  1.306
 28Z  C2   N2   single    1.330  0.020  1.330
 28Z  C7   H1   single    0.930  0.020  1.080
 28Z  N2   H2   single    0.860  0.020  1.020
 28Z  N2   H3   single    0.860  0.020  1.020
 28Z  N3   H4   single    0.860  0.020  1.020
 28Z  C9   H5   single    0.970  0.020  1.090
 28Z  C9   H6   single    0.970  0.020  1.090
 28Z  N10  H7   single    0.860  0.020  1.020
 28Z  CAK  H8   single    0.930  0.020  1.080
 28Z  CAM  H9   single    0.930  0.020  1.080
 28Z  CAL  H10  single    0.930  0.020  1.080
 28Z  CAN  H11  single    0.930  0.020  1.080
 28Z  NBA  H12  single    0.890  0.020  1.040
 28Z  CBO  H13  single    0.970  0.020  1.090
 28Z  CAS  H15  single    0.970  0.020  1.090
 28Z  CAS  H16  single    0.970  0.020  1.090
 28Z  CAQ  H17  single    0.970  0.020  1.090
 28Z  CAQ  H18  single    0.970  0.020  1.090
 28Z  N    H19  single    0.890  0.020  1.040
 28Z  CA   H20  single    0.970  0.020  1.090
 28Z  CB   H22  single    0.970  0.020  1.090
 28Z  CB   H23  single    0.970  0.020  1.090
 28Z  CG   H24  single    0.970  0.020  1.090
 28Z  CG   H25  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
 28Z  N3   C4   C4A  112.61  3.000
 28Z  N3   C4   O4   121.74  3.000
 28Z  C4A  C4   O4   125.65  3.000
 28Z  N5   C4A  C8A  122.68  3.000
 28Z  C8A  C4A  C4   118.97  3.000
 28Z  N5   C4A  C4   118.34  3.000
 28Z  H4   N3   C2   119.08  3.000
 28Z  H4   N3   C4   116.50  3.000
 28Z  C2   N3   C4   124.42  3.000
 28Z  N1   C8A  N8   117.26  3.000
 28Z  N1   C8A  C4A  123.49  3.000
 28Z  N8   C8A  C4A  119.25  3.000
 28Z  C6   N5   C4A  117.63  3.000
 28Z  N2   C2   N1   120.08  3.000
 28Z  N2   C2   N3   116.70  3.000
 28Z  N1   C2   N3   123.22  3.000
 28Z  C7   N8   C8A  117.33  3.000
 28Z  C2   N1   C8A  117.28  3.000
 28Z  C9   C6   C7   120.94  3.000
 28Z  C7   C6   N5   119.96  3.000
 28Z  C9   C6   N5   119.10  3.000
 28Z  H3   N2   H2   118.05  3.000
 28Z  H3   N2   C2   119.00  3.000
 28Z  H2   N2   C2   122.92  3.000
 28Z  H1   C7   C6   119.84  3.000
 28Z  H1   C7   N8   117.01  3.000
 28Z  C6   C7   N8   123.15  3.000
 28Z  H6   C9   H5   107.02  3.000
 28Z  H6   C9   N10  110.61  3.000
 28Z  H5   C9   N10  110.96  3.000
 28Z  H6   C9   C6   109.25  3.000
 28Z  H5   C9   C6   108.62  3.000
 28Z  N10  C9   C6   110.30  3.000
 28Z  H7   N10  CBH  117.66  3.000
 28Z  H7   N10  C9   118.25  3.000
 28Z  CBH  N10  C9   123.14  3.000
 28Z  CAK  CBH  CAL  117.82  3.000
 28Z  CAK  CBH  N10  120.14  3.000
 28Z  CAL  CBH  N10  122.03  3.000
 28Z  H10  CAL  CAN  118.90  3.000
 28Z  H10  CAL  CBH  120.67  3.000
 28Z  CAN  CAL  CBH  120.43  3.000
 28Z  H8   CAK  CAM  119.59  3.000
 28Z  H8   CAK  CBH  119.55  3.000
 28Z  CAM  CAK  CBH  120.86  3.000
 28Z  H11  CAN  CBI  119.54  3.000
 28Z  H11  CAN  CAL  118.52  3.000
 28Z  CBI  CAN  CAL  121.94  3.000
 28Z  H9   CAM  CBI  120.86  3.000
 28Z  H9   CAM  CAK  117.61  3.000
 28Z  CBI  CAM  CAK  121.51  3.000
 28Z  CBF  CBI  CAM  123.94  3.000
 28Z  CBF  CBI  CAN  118.61  3.000
 28Z  CAM  CBI  CAN  117.43  3.000
 28Z  NBA  CBF  OAF  122.26  3.000
 28Z  OAF  CBF  CBI  120.88  3.000
 28Z  NBA  CBF  CBI  116.84  3.000
 28Z  H12  NBA  CBO  116.00  3.000
 28Z  H12  NBA  CBF  117.83  3.000
 28Z  CBO  NBA  CBF  121.81  3.000
 28Z  H13  CBO  CAS  108.11  3.000
 28Z  H13  CBO  CBD  107.52  3.000
 28Z  CAS  CBO  CBD  110.57  3.000
 28Z  H13  CBO  NBA  107.70  3.000
 28Z  CBD  CBO  NBA  112.89  3.000
 28Z  CAS  CBO  NBA  109.87  3.000
 28Z  OAD  CBD  OAI  127.36  3.000
 28Z  OAD  CBD  CBO  114.82  3.000
 28Z  OAI  CBD  CBO  117.82  3.000
 28Z  H16  CAS  H15  106.44  3.000
 28Z  H16  CAS  CAQ  109.81  3.000
 28Z  H15  CAS  CAQ  110.07  3.000
 28Z  H16  CAS  CBO  107.54  3.000
 28Z  H15  CAS  CBO  109.74  3.000
 28Z  CAQ  CAS  CBO  113.00  3.000
 28Z  H18  CAQ  H17  105.75  3.000
 28Z  H18  CAQ  CBE  107.17  3.000
 28Z  H17  CAQ  CBE  110.19  3.000
 28Z  H18  CAQ  CAS  110.46  3.000
 28Z  H17  CAQ  CAS  109.93  3.000
 28Z  CBE  CAQ  CAS  113.06  3.000
 28Z  N    CBE  OAE  122.69  3.000
 28Z  N    CBE  CAQ  115.20  3.000
 28Z  OAE  CBE  CAQ  122.11  3.000
 28Z  H19  N    CA   117.46  3.000
 28Z  H19  N    CBE  117.38  3.000
 28Z  CA   N    CBE  122.19  3.000
 28Z  H20  CA   CB   107.82  3.000
 28Z  H20  CA   C    107.79  3.000
 28Z  CB   CA   C    110.42  3.000
 28Z  H20  CA   N    108.00  3.000
 28Z  CB   CA   N    110.02  3.000
 28Z  C    CA   N    112.61  3.000
 28Z  OXT  C    O    127.11  3.000
 28Z  OXT  C    CA   114.93  3.000
 28Z  O    C    CA   117.94  3.000
 28Z  H23  CB   H22  106.15  3.000
 28Z  H23  CB   CG   109.51  3.000
 28Z  H22  CB   CG   110.16  3.000
 28Z  H23  CB   CA   107.61  3.000
 28Z  H22  CB   CA   109.33  3.000
 28Z  CG   CB   CA   113.76  3.000
 28Z  H25  CG   H24  104.84  3.000
 28Z  H25  CG   CD   107.97  3.000
 28Z  H24  CG   CD   108.00  3.000
 28Z  H25  CG   CB   110.71  3.000
 28Z  H24  CG   CB   109.20  3.000
 28Z  CD   CG   CB   115.54  3.000
 28Z  OE2  CD   OE1  126.14  3.000
 28Z  OE2  CD   CG   115.84  3.000
 28Z  OE1  CD   CG   118.02  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
 28Z  CONST_01  C7   C6   N5   C4A     0.00   0.0  0
 28Z  CONST_02  C7   N8   C8A  C4A     0.00   0.0  0
 28Z  CONST_03  C6   N5   C4A  C8A     0.00   0.0  0
 28Z  CONST_04  C6   C7   N8   C8A     0.00   0.0  0
 28Z  CONST_05  N8   C7   C6   N5      0.00   0.0  0
 28Z  CONST_06  N8   C8A  C4A  N5      0.00   0.0  0
 28Z  CONST_07  CBI  CAN  CAL  CBH     0.00   0.0  0
 28Z  CONST_08  CBI  CAM  CAK  CBH     0.00   0.0  0
 28Z  CONST_09  CAM  CAK  CBH  CAL     0.00   0.0  0
 28Z  CONST_10  CAM  CBI  CAN  CAL     0.00   0.0  0
 28Z  CONST_11  CAN  CAL  CBH  CAK     0.00   0.0  0
 28Z  CONST_12  CAN  CBI  CAM  CAK     0.00   0.0  0
 28Z  CONST_13  N1   C2   N3   C4      0.00   0.0  0
 28Z  CONST_14  C2   N3   C4   C4A     0.00   0.0  0
 28Z  CONST_15  C8A  N1   C2   N3      0.00   0.0  0
 28Z  CONST_16  C9   C6   N5   C4A   180.00   0.0  0
 28Z  CONST_17  C9   C6   C7   N8    180.00   0.0  0
 28Z  CONST_18  CAN  CAL  CBH  N10   180.00   0.0  0
 28Z  CONST_19  CAM  CAK  CBH  N10   180.00   0.0  0
 28Z  CONST_20  CBF  CBI  CAN  CAL   180.00   0.0  0
 28Z  CONST_21  CBF  CBI  CAM  CAK   180.00   0.0  0
 28Z  CONST_22  C2   N3   C4   O4    180.00   0.0  0
 28Z  CONST_23  N2   C2   N3   C4    180.00   0.0  0
 28Z  CONST_24  N2   C2   N1   C8A   180.00   0.0  0
 28Z  CONST_25  H1   C7   N8   C8A   180.00   0.0  0
 28Z  CONST_26  H11  CAN  CAL  CBH   180.00   0.0  0
 28Z  CONST_27  H9   CAM  CAK  CBH   180.00   0.0  0
 28Z  CONST_28  H8   CAK  CBH  CAL   180.00   0.0  0
 28Z  CONST_29  H10  CAL  CBH  CAK   180.00   0.0  0
 28Z  CONST_30  H4   N3   C4   C4A   180.00   0.0  0
 28Z  CONST_31  CAL  CBH  N10  C9      0.00   0.0  0
 28Z  CONST_32  CAK  CBH  N10  C9    180.00   0.0  0
 28Z  CONST_33  H7   N10  CBH  CAL   180.00   0.0  0
 28Z  CONST_34  H2   N2   C2   N3      0.00   0.0  0
 28Z  CONST_35  H3   N2   C2   N3    180.00   0.0  0
 28Z  CONST_36  CBO  NBA  CBF  CBI   180.00   0.0  0
 28Z  CONST_38  CBO  NBA  CBF  OAF     0.00   0.0  0
 28Z  CONST_39  CA   N    CBE  CAQ   180.00   0.0  0
 28Z  CONST_40  CA   N    CBE  OAE     0.00   0.0  0
 28Z  CONST_41  H19  N    CBE  CAQ     0.00   0.0  0
 28Z  Var_01    N10  C9   C6   N5    -97.63  30.0  2
 28Z  Var_02    CBH  N10  C9   C6   -173.68  30.0  1
 28Z  Var_03    NBA  CBF  CBI  CAN  -165.69  30.0  2
 28Z  Var_04    CBE  CAQ  CAS  CBO  -177.05  30.0  3
 28Z  Var_05    OAE  CBE  CAQ  CAS   -28.97  30.0  1
 28Z  Var_06    CD   CG   CB   CA   -174.62  30.0  2
 28Z  Var_07    OE1  CD   CG   CB      4.53  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
 28Z  chir_01  CBO  CAS  NBA  CBD  positiv
 28Z  chir_02  CA   N    C    CB   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
 28Z  plan-1  N10  0.020
 28Z  plan-1  CBH  0.020
 28Z  plan-1  CAL  0.020
 28Z  plan-1  CAK  0.020
 28Z  plan-1  CAN  0.020
 28Z  plan-1  CAM  0.020
 28Z  plan-1  CBI  0.020
 28Z  plan-1  CBF  0.020
 28Z  plan-1  H10  0.020
 28Z  plan-1  H8   0.020
 28Z  plan-1  H11  0.020
 28Z  plan-1  H9   0.020
 28Z  plan-2  CBO  0.020
 28Z  plan-2  CBD  0.020
 28Z  plan-2  OAI  0.020
 28Z  plan-2  OAD  0.020
 28Z  plan-3  CA   0.020
 28Z  plan-3  C    0.020
 28Z  plan-3  O    0.020
 28Z  plan-3  OXT  0.020
 28Z  plan-4  CG   0.020
 28Z  plan-4  CD   0.020
 28Z  plan-4  OE1  0.020
 28Z  plan-4  OE2  0.020
 28Z  plan-5  O4   0.020
 28Z  plan-5  C4   0.020
 28Z  plan-5  C4A  0.020
 28Z  plan-5  N3   0.020
 28Z  plan-5  C8A  0.020
 28Z  plan-5  N5   0.020
 28Z  plan-5  C2   0.020
 28Z  plan-5  N8   0.020
 28Z  plan-5  N1   0.020
 28Z  plan-5  C6   0.020
 28Z  plan-5  N2   0.020
 28Z  plan-5  C7   0.020
 28Z  plan-5  C9   0.020
 28Z  plan-5  H4   0.020
 28Z  plan-5  H2   0.020
 28Z  plan-5  H3   0.020
 28Z  plan-5  H1   0.020
 28Z  plan-6  CBI  0.020
 28Z  plan-6  CBF  0.020
 28Z  plan-6  OAF  0.020
 28Z  plan-6  NBA  0.020
 28Z  plan-6  CBO  0.020
 28Z  plan-6  H12  0.020
 28Z  plan-7  CAQ  0.020
 28Z  plan-7  CBE  0.020
 28Z  plan-7  OAE  0.020
 28Z  plan-7  N    0.020
 28Z  plan-7  CA   0.020
 28Z  plan-7  H19  0.020
 28Z  plan-8  C9   0.020
 28Z  plan-8  N10  0.020
 28Z  plan-8  CBH  0.020
 28Z  plan-8  H7   0.020

