# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sat May  9 05:00:43 2020
#   Inital geometry file: a 132 line input string
#   Ligand name: 1-[(1-{2-[(3-chloro-1,2-dimethyl-1H-indol-5-yl)amino]pyrimidin-4-yl}-3-methyl-1H-pyrazol-4-yl)methyl]azetidin-3-ol
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: Cn1c(C)c(Cl)c2cc(Nc3nccc(n3)n4cc(CN5CC(O)C5)c(C)n4)ccc12
#
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
 X9G  X9G  1-[(1-{2-[(3-chloro-1,2-dimethyl-1H-indol-5-yl)amino]pyrimidin-4-yl}-3-methyl-1H-pyrazol-4-yl)methyl]azetidin-3-ol  ligand  55  31  .  2021-08-24  2021-08-24  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_X9G
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
 X9G  C4   C   CR6   0   0.573  -1.9578   1.7739   0.5546
 X9G  C5   C   CR16  0  -0.423  -1.6766   3.1385   0.5897
 X9G  C6   C   CR16  0  -0.005  -0.3597   3.4608   0.3335
 X9G  N1   N   N     0  -0.464   0.5860   2.5678   0.0710
 X9G  N3   N   N     0  -0.508  -1.0466   0.8631   0.2935
 X9G  CAM  C   C     0  -0.297  -6.9702  -0.8761  -1.0290
 X9G  CBB  C   C     0  -0.006  -7.7131  -2.1335  -1.4926
 X9G  OAD  O   OH1   0  -0.671  -7.1547  -2.6383  -2.6759
 X9G  CAN  C   C     0  -0.296  -7.1876  -2.7739  -0.1949
 X9G  NBC  N   N     0  -0.405  -6.1940  -1.7013  -0.1003
 X9G  CAV  C   CR5   0  -0.191  -4.9786   0.0086   1.1113
 X9G  CAK  C   CR15  0   0.059  -3.6499   0.0004   0.7971
 X9G  CAS  C   CR5   0   0.300  -5.2950   1.3852   1.2863
 X9G  CAA  C   CH3   0  -0.747  -6.6169   1.9729   1.6356
 X9G  NAQ  N   N     0  -0.306  -4.2382   2.1404   1.0991
 X9G  NBE  N   NR5   0  -0.399  -3.2398   1.2959   0.8005
 X9G  C2   C   CR6   0   0.598   0.1969   1.2963   0.0605
 X9G  NAR  N   NH1   0  -0.759   1.0963   0.3159  -0.1975
 X9G  CAT  C   CR6   0   0.349   2.4783   0.4187  -0.4171
 X9G  CAJ  C   CR16  0  -0.444   3.2818  -0.5956   0.0803
 X9G  CAZ  C   CR56  0   0.235   4.6516  -0.5594  -0.1750
 X9G  CAW  C   CR5   0  -0.315   5.7487  -1.3970   0.1602
 X9G  CL1  CL  CL    0  -0.168   5.6386  -2.8505   1.0701
 X9G  CAU  C   CR5   0   0.415   6.8948  -0.8493  -0.3527
 X9G  CAB  C   CH3   0  -0.742   8.2899  -1.3469  -0.2761
 X9G  NBD  N   NR5   0  -0.575   6.5579   0.3146  -0.9973
 X9G  CAC  C   CH3   0  -0.540   7.4550   1.1745  -1.7309
 X9G  CBA  C   CR56  0   0.322   5.2049   0.5056  -0.9100
 X9G  CAI  C   CR16  0  -0.313   4.3998   1.5215  -1.4165
 X9G  CAH  C   CR16  0  -0.307   3.0413   1.4660  -1.1733
 X9G  H1   H   HCR6  0   0.285  -2.4222   3.8874   0.7998
 X9G  H2   H   HCR6  0   0.276  -0.0481   4.4993   0.3417
 X9G  H3   H   H     0   0.234  -6.3917  -0.3267  -1.7761
 X9G  H4   H   H     0   0.212  -7.6532  -0.1753  -0.5292
 X9G  H5   H   H     0   0.224  -8.8011  -2.0448  -1.5620
 X9G  H6   H   HOH1  0   0.452  -7.5390  -3.5044  -2.8440
 X9G  H7   H   H     0   0.207  -7.9436  -2.7390   0.6010
 X9G  H8   H   H     0   0.232  -6.7831  -3.7884  -0.2524
 X9G  H10  H   HCH2  0   0.207  -6.8164  -0.8584   1.7400
 X9G  H11  H   HCH2  0   0.252  -5.4419  -1.9534   1.8057
 X9G  H12  H   HCR5  0   0.299  -2.9738  -0.8099   0.5829
 X9G  H13  H   HCH3  0   0.252  -7.0321   1.5038   2.5280
 X9G  H14  H   HCH3  0   0.258  -6.5305   3.0421   1.8194
 X9G  H15  H   HCH3  0   0.253  -7.3387   1.8269   0.8306
 X9G  H16  H   HNH1  0   0.405   0.7388  -0.6163  -0.0556
 X9G  H17  H   HCR6  0   0.257   2.8501  -1.4052   0.6572
 X9G  H18  H   HCH3  0   0.264   8.6935  -1.5693  -1.2653
 X9G  H19  H   HCH3  0   0.263   8.9524  -0.6184   0.1944
 X9G  H20  H   HCH3  0   0.263   8.3292  -2.2605   0.3126
 X9G  H21  H   HCH3  0   0.255   7.3494   1.0345  -2.8072
 X9G  H22  H   HCH3  0   0.259   7.2535   2.2173  -1.4916
 X9G  H23  H   HCH3  0   0.273   8.4834   0.9622  -1.4535
 X9G  H24  H   HCR6  0   0.269   4.8112   2.3365  -1.9981
 X9G  H25  H   HCR6  0   0.264   2.4063   2.2402  -1.5745
 X9G  CAL  C   CH2   0  -0.386  -5.9002  -1.1627   1.2057

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
 X9G  CAH  CAI  aromatic  1.381  0.020  1.381
 X9G  CAH  CAT  aromatic  1.409  0.020  1.409
 X9G  CAI  CBA  aromatic  1.392  0.020  1.392
 X9G  NAR  CAT  single    1.403  0.020  1.403
 X9G  NAR  C2   single    1.355  0.020  1.355
 X9G  CAT  CAJ  aromatic  1.386  0.020  1.386
 X9G  CAC  NBD  single    1.443  0.020  1.443
 X9G  N1   C2   aromatic  1.330  0.020  1.330
 X9G  N1   C6   aromatic  1.327  0.020  1.327
 X9G  CBA  NBD  aromatic  1.369  0.020  1.369
 X9G  CBA  CAZ  aromatic  1.407  0.020  1.407
 X9G  C2   N3   aromatic  1.337  0.020  1.337
 X9G  NBD  CAU  aromatic  1.372  0.020  1.372
 X9G  C6   C5   aromatic  1.380  0.020  1.380
 X9G  CAJ  CAZ  aromatic  1.394  0.020  1.394
 X9G  CAZ  CAW  aromatic  1.420  0.020  1.420
 X9G  N3   C4   aromatic  1.315  0.020  1.315
 X9G  CAU  CAW  aromatic  1.370  0.020  1.370
 X9G  CAU  CAB  single    1.483  0.020  1.483
 X9G  C5   C4   aromatic  1.394  0.020  1.394
 X9G  CAW  CL1  single    1.718  0.020  1.718
 X9G  C4   NBE  single    1.390  0.020  1.390
 X9G  NBE  CAK  aromatic  1.359  0.020  1.359
 X9G  NBE  NAQ  aromatic  1.341  0.020  1.341
 X9G  CAK  CAV  aromatic  1.365  0.020  1.365
 X9G  NAQ  CAS  aromatic  1.312  0.020  1.312
 X9G  CAV  CAS  aromatic  1.423  0.020  1.423
 X9G  CAV  CAL  single    1.493  0.020  1.493
 X9G  CAS  CAA  single    1.488  0.020  1.488
 X9G  CAL  NBC  single    1.443  0.020  1.443
 X9G  CAN  NBC  single    1.465  0.020  1.465
 X9G  CAN  CBB  single    1.540  0.020  1.540
 X9G  NBC  CAM  single    1.465  0.020  1.465
 X9G  OAD  CBB  single    1.402  0.020  1.402
 X9G  CBB  CAM  single    1.532  0.020  1.532
 X9G  C5   H1   single    0.930  0.020  1.080
 X9G  C6   H2   single    0.930  0.020  1.080
 X9G  CAM  H3   single    0.970  0.020  1.090
 X9G  CAM  H4   single    0.970  0.020  1.090
 X9G  CBB  H5   single    0.970  0.020  1.090
 X9G  OAD  H6   single    0.850  0.020  0.980
 X9G  CAN  H7   single    0.970  0.020  1.090
 X9G  CAN  H8   single    0.970  0.020  1.090
 X9G  CAL  H10  single    0.970  0.020  1.090
 X9G  CAL  H11  single    0.970  0.020  1.090
 X9G  CAK  H12  single    0.930  0.020  1.080
 X9G  CAA  H13  single    0.970  0.020  1.090
 X9G  CAA  H14  single    0.970  0.020  1.090
 X9G  CAA  H15  single    0.970  0.020  1.090
 X9G  NAR  H16  single    0.860  0.020  1.020
 X9G  CAJ  H17  single    0.930  0.020  1.080
 X9G  CAB  H18  single    0.970  0.020  1.090
 X9G  CAB  H19  single    0.970  0.020  1.090
 X9G  CAB  H20  single    0.970  0.020  1.090
 X9G  CAC  H21  single    0.970  0.020  1.090
 X9G  CAC  H22  single    0.970  0.020  1.090
 X9G  CAC  H23  single    0.970  0.020  1.090
 X9G  CAI  H24  single    0.930  0.020  1.080
 X9G  CAH  H25  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
 X9G  NBE  C4   N3   115.86  3.000
 X9G  NBE  C4   C5   121.22  3.000
 X9G  N3   C4   C5   122.93  3.000
 X9G  H1   C5   C6   122.29  3.000
 X9G  H1   C5   C4   123.09  3.000
 X9G  C6   C5   C4   114.62  3.000
 X9G  H2   C6   N1   116.18  3.000
 X9G  H2   C6   C5   119.77  3.000
 X9G  N1   C6   C5   124.04  3.000
 X9G  C2   N1   C6   115.88  3.000
 X9G  C2   N3   C4   117.05  3.000
 X9G  H4   CAM  H3   108.62  3.000
 X9G  H4   CAM  NBC  113.59  3.000
 X9G  H3   CAM  NBC  115.85  3.000
 X9G  H4   CAM  CBB  111.08  3.000
 X9G  H3   CAM  CBB  117.53  3.000
 X9G  NBC  CAM  CBB   89.23  3.000
 X9G  H5   CBB  CAN  115.26  3.000
 X9G  H5   CBB  OAD  111.82  3.000
 X9G  CAN  CBB  OAD  115.19  3.000
 X9G  H5   CBB  CAM  115.78  3.000
 X9G  OAD  CBB  CAM  110.96  3.000
 X9G  CAN  CBB  CAM   85.46  3.000
 X9G  H6   OAD  CBB  108.20  3.000
 X9G  H8   CAN  H7   108.79  3.000
 X9G  H8   CAN  NBC  115.57  3.000
 X9G  H7   CAN  NBC  113.38  3.000
 X9G  H8   CAN  CBB  117.89  3.000
 X9G  H7   CAN  CBB  111.27  3.000
 X9G  NBC  CAN  CBB   88.93  3.000
 X9G  CAL  NBC  CAN  118.02  3.000
 X9G  CAN  NBC  CAM   90.69  3.000
 X9G  CAL  NBC  CAM  118.13  3.000
 X9G  CAS  CAV  CAK  104.50  3.000
 X9G  CAS  CAV  CAL  127.85  3.000
 X9G  CAK  CAV  CAL  127.62  3.000
 X9G  H12  CAK  NBE  121.89  3.000
 X9G  H12  CAK  CAV  131.40  3.000
 X9G  NBE  CAK  CAV  106.70  3.000
 X9G  NAQ  CAS  CAA  121.44  3.000
 X9G  CAA  CAS  CAV  127.46  3.000
 X9G  NAQ  CAS  CAV  111.10  3.000
 X9G  H15  CAA  H14  107.97  3.000
 X9G  H15  CAA  H13  107.12  3.000
 X9G  H14  CAA  H13  108.34  3.000
 X9G  H15  CAA  CAS  111.20  3.000
 X9G  H14  CAA  CAS  110.92  3.000
 X9G  H13  CAA  CAS  111.13  3.000
 X9G  NBE  NAQ  CAS  105.60  3.000
 X9G  NAQ  NBE  CAK  112.10  3.000
 X9G  NAQ  NBE  C4   120.62  3.000
 X9G  CAK  NBE  C4   127.28  3.000
 X9G  NAR  C2   N3   114.58  3.000
 X9G  N3   C2   N1   125.48  3.000
 X9G  NAR  C2   N1   119.93  3.000
 X9G  H16  NAR  CAT  116.04  3.000
 X9G  H16  NAR  C2   113.99  3.000
 X9G  CAT  NAR  C2   129.08  3.000
 X9G  CAH  CAT  CAJ  120.32  3.000
 X9G  CAJ  CAT  NAR  117.46  3.000
 X9G  CAH  CAT  NAR  122.14  3.000
 X9G  H17  CAJ  CAZ  120.55  3.000
 X9G  H17  CAJ  CAT  120.44  3.000
 X9G  CAZ  CAJ  CAT  119.00  3.000
 X9G  CBA  CAZ  CAW  105.42  3.000
 X9G  CAW  CAZ  CAJ  134.47  3.000
 X9G  CBA  CAZ  CAJ  120.11  3.000
 X9G  CAU  CAW  CL1  126.16  3.000
 X9G  CL1  CAW  CAZ  125.05  3.000
 X9G  CAU  CAW  CAZ  108.79  3.000
 X9G  NBD  CAU  CAB  122.66  3.000
 X9G  CAB  CAU  CAW  129.31  3.000
 X9G  NBD  CAU  CAW  108.03  3.000
 X9G  H20  CAB  H19  107.78  3.000
 X9G  H20  CAB  H18  107.82  3.000
 X9G  H19  CAB  H18  107.60  3.000
 X9G  H20  CAB  CAU  110.11  3.000
 X9G  H19  CAB  CAU  111.68  3.000
 X9G  H18  CAB  CAU  111.68  3.000
 X9G  CBA  NBD  CAC  124.30  3.000
 X9G  CBA  NBD  CAU  109.33  3.000
 X9G  CAC  NBD  CAU  126.26  3.000
 X9G  H23  CAC  H22  107.84  3.000
 X9G  H23  CAC  H21  108.58  3.000
 X9G  H22  CAC  H21  108.78  3.000
 X9G  H23  CAC  NBD  110.02  3.000
 X9G  H22  CAC  NBD  110.12  3.000
 X9G  H21  CAC  NBD  111.41  3.000
 X9G  CAI  CBA  NBD  130.57  3.000
 X9G  NBD  CBA  CAZ  108.43  3.000
 X9G  CAI  CBA  CAZ  121.00  3.000
 X9G  H24  CAI  CAH  119.91  3.000
 X9G  H24  CAI  CBA  121.69  3.000
 X9G  CAH  CAI  CBA  118.40  3.000
 X9G  H25  CAH  CAI  118.99  3.000
 X9G  H25  CAH  CAT  119.86  3.000
 X9G  CAI  CAH  CAT  121.15  3.000
 X9G  H11  CAL  H10  106.37  3.000
 X9G  H11  CAL  CAV  110.08  3.000
 X9G  H10  CAL  CAV  109.07  3.000
 X9G  H11  CAL  NBC  108.19  3.000
 X9G  H10  CAL  NBC  111.85  3.000
 X9G  CAV  CAL  NBC  111.17  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
 X9G  CONST_01  N1   C2   N3   C4     0.00   0.0  0
 X9G  CONST_02  N1   C6   C5   C4     0.00   0.0  0
 X9G  CONST_03  CAV  CAK  NBE  C4   180.00   0.0  0
 X9G  CONST_04  CAS  NAQ  NBE  C4   180.00   0.0  0
 X9G  CONST_05  C2   N1   C6   C5     0.00   0.0  0
 X9G  CONST_06  C2   N3   C4   C5     0.00   0.0  0
 X9G  CONST_07  CAK  NBE  C4   C5   180.00   0.0  0
 X9G  CONST_08  NAQ  NBE  C4   C5     0.00   0.0  0
 X9G  CONST_09  N3   C2   N1   C6     0.00   0.0  0
 X9G  CONST_10  N3   C4   C5   C6     0.00   0.0  0
 X9G  CONST_11  NBE  C4   C5   C6   180.00   0.0  0
 X9G  CONST_12  CAK  NBE  C4   N3     0.00   0.0  0
 X9G  CONST_13  NAQ  NBE  C4   N3   180.00   0.0  0
 X9G  CONST_14  NAQ  NBE  CAK  CAV    0.00   0.0  0
 X9G  CONST_15  NBE  NAQ  CAS  CAV    0.00   0.0  0
 X9G  CONST_16  CAS  NAQ  NBE  CAK    0.00   0.0  0
 X9G  CONST_17  NAQ  CAS  CAV  CAK    0.00   0.0  0
 X9G  CONST_18  NBE  CAK  CAV  CAS    0.00   0.0  0
 X9G  CONST_19  C2   N3   C4   NBE  180.00   0.0  0
 X9G  CONST_20  CBA  CAI  CAH  CAT    0.00   0.0  0
 X9G  CONST_21  CBA  CAZ  CAJ  CAT    0.00   0.0  0
 X9G  CONST_22  CAW  CAZ  CAJ  CAT  180.00   0.0  0
 X9G  CONST_23  CAI  CAH  CAT  CAJ    0.00   0.0  0
 X9G  CONST_24  CAI  CBA  CAZ  CAJ    0.00   0.0  0
 X9G  CONST_25  NBD  CBA  CAZ  CAJ  180.00   0.0  0
 X9G  CONST_26  CAU  CAW  CAZ  CAJ  180.00   0.0  0
 X9G  CONST_27  CAH  CAI  CBA  CAZ    0.00   0.0  0
 X9G  CONST_28  CAU  NBD  CBA  CAZ    0.00   0.0  0
 X9G  CONST_29  CAH  CAT  CAJ  CAZ    0.00   0.0  0
 X9G  CONST_30  NBD  CAU  CAW  CAZ    0.00   0.0  0
 X9G  CONST_31  CAI  CBA  CAZ  CAW  180.00   0.0  0
 X9G  CONST_32  NBD  CBA  CAZ  CAW    0.00   0.0  0
 X9G  CONST_33  CBA  NBD  CAU  CAW    0.00   0.0  0
 X9G  CONST_34  CAI  CBA  NBD  CAU  180.00   0.0  0
 X9G  CONST_35  CBA  CAZ  CAW  CAU    0.00   0.0  0
 X9G  CONST_36  CAH  CAI  CBA  NBD  180.00   0.0  0
 X9G  CONST_37  NAR  C2   N3   C4   180.00   0.0  0
 X9G  CONST_38  NAR  C2   N1   C6   180.00   0.0  0
 X9G  CONST_39  NBE  CAK  CAV  CAL  180.00   0.0  0
 X9G  CONST_40  NAQ  CAS  CAV  CAL  180.00   0.0  0
 X9G  CONST_41  CAA  CAS  CAV  CAK  180.00   0.0  0
 X9G  CONST_42  NBE  NAQ  CAS  CAA  180.00   0.0  0
 X9G  CONST_43  CAI  CAH  CAT  NAR  180.00   0.0  0
 X9G  CONST_44  CAZ  CAJ  CAT  NAR  180.00   0.0  0
 X9G  CONST_45  CL1  CAW  CAZ  CAJ    0.00   0.0  0
 X9G  CONST_46  CAC  NBD  CBA  CAZ  180.00   0.0  0
 X9G  CONST_47  CAB  CAU  CAW  CAZ  180.00   0.0  0
 X9G  CONST_48  CAC  NBD  CAU  CAW  180.00   0.0  0
 X9G  CONST_49  CBA  CAZ  CAW  CL1  180.00   0.0  0
 X9G  CONST_50  NBD  CAU  CAW  CL1  180.00   0.0  0
 X9G  CONST_51  CBA  NBD  CAU  CAB  180.00   0.0  0
 X9G  CONST_52  CAI  CBA  NBD  CAC    0.00   0.0  0
 X9G  CONST_53  H2   C6   C5   C4   180.00   0.0  0
 X9G  CONST_54  H12  CAK  NBE  C4     0.00   0.0  0
 X9G  CONST_55  H1   C5   C6   N1   180.00   0.0  0
 X9G  CONST_56  H24  CAI  CAH  CAT  180.00   0.0  0
 X9G  CONST_57  H25  CAH  CAT  CAJ  180.00   0.0  0
 X9G  CONST_58  H17  CAJ  CAZ  CAW    0.00   0.0  0
 X9G  Var_01    CBB  CAN  NBC  CAM   18.28  30.0  1
 X9G  Var_02    CAT  NAR  C2   N1     3.13  30.0  1
 X9G  Var_03    CAV  CAL  NBC  CAM  -66.71  30.0  2
 X9G  Var_04    CAK  CAV  CAL  NBC  -71.63  30.0  2
 X9G  Var_05    CAH  CAT  NAR  C2   -39.69  30.0  2
 X9G  Var_06    H13  CAA  CAS  CAV   52.56  30.0  2
 X9G  Var_07    H18  CAB  CAU  CAW  117.62  30.0  2
 X9G  Var_08    H21  CAC  NBD  CAU  102.51  30.0  2

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
 X9G  chir_01  CBB  CAN  OAD  CAM  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
 X9G  plan-1  C4   0.020
 X9G  plan-1  CAV  0.020
 X9G  plan-1  CAK  0.020
 X9G  plan-1  CAS  0.020
 X9G  plan-1  CAA  0.020
 X9G  plan-1  NAQ  0.020
 X9G  plan-1  NBE  0.020
 X9G  plan-1  H12  0.020
 X9G  plan-1  CAL  0.020
 X9G  plan-2  C4   0.020
 X9G  plan-2  C5   0.020
 X9G  plan-2  C6   0.020
 X9G  plan-2  N1   0.020
 X9G  plan-2  N3   0.020
 X9G  plan-2  NBE  0.020
 X9G  plan-2  C2   0.020
 X9G  plan-2  NAR  0.020
 X9G  plan-2  H1   0.020
 X9G  plan-2  H2   0.020
 X9G  plan-3  NAR  0.020
 X9G  plan-3  CAT  0.020
 X9G  plan-3  CAJ  0.020
 X9G  plan-3  CAZ  0.020
 X9G  plan-3  CAW  0.020
 X9G  plan-3  CL1  0.020
 X9G  plan-3  CAU  0.020
 X9G  plan-3  CAB  0.020
 X9G  plan-3  NBD  0.020
 X9G  plan-3  CAC  0.020
 X9G  plan-3  CBA  0.020
 X9G  plan-3  CAI  0.020
 X9G  plan-3  CAH  0.020
 X9G  plan-3  H17  0.020
 X9G  plan-3  H24  0.020
 X9G  plan-3  H25  0.020

