# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sat Apr 11 22:53:43 2020
#   Inital geometry file: a 140 line input string
#   Ligand name: 1-[[4-fluoranyl-3-[(3~{R})-3-methyl-4-[2,2,2-tris(fluoranyl)ethyl]piperazin-1-yl]carbonyl-phenyl]methyl]quinazoline-2,4-dione
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: C[C@@H]1CN(CCN1CC(F)(F)F)C(=O)c2cc(CN3C(=O)NC(=O)c4ccccc34)ccc2F
#
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
 6WZ  6WZ  1-[[4-fluoranyl-3-[(3~{R})-3-methyl-4-[2,2,2-tris(fluoranyl)ethyl]piperazin-1-yl]carbonyl-phenyl]methyl]quinazoline-2,4-dione  ligand  56  34  .  2021-08-05  2021-08-05  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_6WZ
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
 6WZ  OAD  O  O     0  -0.464   1.6361   1.2368  -1.5982
 6WZ  CBA  C  CR6   0   0.722   2.7202   1.4228  -1.0866
 6WZ  NAU  N  NR16  0  -0.732   3.0853   2.6702  -0.6375
 6WZ  CAZ  C  CR6   0   0.566   4.2675   3.0375  -0.0501
 6WZ  OAC  O  O     0  -0.439   4.4704   4.1860   0.2898
 6WZ  CBB  C  CR66  0  -0.147   5.2133   1.9372   0.1200
 6WZ  CAM  C  CR16  0  -0.274   6.4441   2.1868   0.7261
 6WZ  CAI  C  CR16  0  -0.261   7.3551   1.1706   0.9139
 6WZ  CAJ  C  CR16  0  -0.234   7.0230  -0.1121   0.4883
 6WZ  CAN  C  CR16  0  -0.336   5.8089  -0.3781  -0.1157
 6WZ  CBC  C  CR66  0   0.446   4.8782   0.6474  -0.3155
 6WZ  NBG  N  NR6   0  -0.608   3.6484   0.4250  -0.9269
 6WZ  CAR  C  CH2   0  -0.443   3.2297  -0.8949  -1.4001
 6WZ  CAW  C  CR6   0   0.147   2.2618  -1.5580  -0.4560
 6WZ  CAO  C  CR16  0  -0.269   0.9464  -1.7674  -0.8446
 6WZ  CAK  C  CR16  0  -0.278   2.6534  -1.9485   0.8224
 6WZ  CAL  C  CR16  0  -0.398   1.7503  -2.5327   1.6961
 6WZ  CAX  C  CR6   0   0.541   0.4508  -2.7292   1.2733
 6WZ  FAE  F  F     0  -0.300  -0.4344  -3.2721   2.1204
 6WZ  CAY  C  CR6   0  -0.288   0.0228  -2.3552   0.0129
 6WZ  CAV  C  C     0   0.527  -1.3754  -2.6560  -0.4335
 6WZ  OAB  O  O     0  -0.480  -1.7305  -3.8195  -0.5536
 6WZ  NBE  N  NT    0  -0.450  -2.1584  -1.6005  -0.7218
 6WZ  CAS  C  CH2   0  -0.290  -1.8746  -0.2217  -0.3813
 6WZ  CBD  C  CH1   0  -0.065  -2.8466   0.3170   0.6683
 6WZ  CAA  C  CH3   0  -0.682  -2.5092   1.7829   0.8975
 6WZ  CAP  C  CH2   0  -0.325  -3.5203  -1.7809  -1.1848
 6WZ  CAQ  C  CH2   0  -0.292  -4.4872  -1.2736  -0.1351
 6WZ  NBF  N  NT    0  -0.446  -4.2173   0.1155   0.2039
 6WZ  CAT  C  CH2   0  -0.491  -5.2488   0.6592   1.0596
 6WZ  CBH  C  CT    0   0.991  -6.1480   1.5920   0.2829
 6WZ  FAG  F  F     0  -0.315  -7.1248   2.0865   1.0606
 6WZ  FAH  F  F     0  -0.307  -5.4853   2.6403  -0.2232
 6WZ  FAF  F  F     0  -0.312  -6.7459   0.9841  -0.7530
 6WZ  H1   H  HNR6  0   0.428   2.3934   3.3966  -0.7766
 6WZ  H2   H  HCR6  0   0.273   6.6728   3.1936   1.0483
 6WZ  H3   H  HCR6  0   0.268   8.3075   1.3656   1.3867
 6WZ  H4   H  HCR6  0   0.277   7.7204  -0.9270   0.6297
 6WZ  H5   H  HCR6  0   0.288   5.6093  -1.3938  -0.4204
 6WZ  H6   H  HCH2  0   0.306   2.7810  -0.7819  -2.3849
 6WZ  H7   H  HCH2  0   0.300   4.1113  -1.5098  -1.5494
 6WZ  H8   H  HCR6  0   0.274   0.6256  -1.4554  -1.8308
 6WZ  H9   H  HCR6  0   0.269   3.6722  -1.7988   1.1581
 6WZ  H10  H  HCR6  0   0.287   2.0505  -2.8308   2.6917
 6WZ  H11  H  HCH2  0   0.278  -0.8599  -0.1190  -0.0056
 6WZ  H12  H  HCH2  0   0.248  -1.9489   0.3899  -1.2868
 6WZ  H13  H  HCH1  0   0.211  -2.6631  -0.2362   1.6060
 6WZ  H14  H  HCH3  0   0.234  -2.6710   2.3690  -0.0071
 6WZ  H15  H  HCH3  0   0.244  -3.0862   2.2310   1.7044
 6WZ  H16  H  HCH3  0   0.240  -1.4593   1.8737   1.1773
 6WZ  H17  H  HCH2  0   0.254  -3.6512  -1.2208  -2.1150
 6WZ  H18  H  HCH2  0   0.272  -3.7092  -2.8302  -1.3934
 6WZ  H19  H  HCH2  0   0.255  -5.4998  -1.3577  -0.5311
 6WZ  H20  H  HCH2  0   0.215  -4.4319  -1.9268   0.7508
 6WZ  H22  H  HCH2  0   0.282  -5.8723  -0.1244   1.5047
 6WZ  H23  H  HCH2  0   0.284  -4.8406   1.2185   1.9026

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
 6WZ  FAE  CAX  single    1.340  0.020  1.340
 6WZ  FAH  CBH  single    1.340  0.020  1.340
 6WZ  CAX  CAL  aromatic  1.381  0.020  1.381
 6WZ  CAX  CAY  aromatic  1.383  0.020  1.383
 6WZ  CAL  CAK  aromatic  1.386  0.020  1.386
 6WZ  CAT  CBH  single    1.511  0.020  1.511
 6WZ  CAT  NBF  single    1.446  0.020  1.446
 6WZ  CBH  FAF  single    1.342  0.020  1.342
 6WZ  CBH  FAG  single    1.343  0.020  1.343
 6WZ  CAP  NBE  single    1.450  0.020  1.450
 6WZ  CAP  CAQ  single    1.515  0.020  1.515
 6WZ  CAS  NBE  single    1.448  0.020  1.448
 6WZ  CAS  CBD  single    1.529  0.020  1.529
 6WZ  NBE  CAV  single    1.345  0.020  1.345
 6WZ  CAV  CAY  single    1.498  0.020  1.498
 6WZ  CAV  OAB  double    1.222  0.020  1.222
 6WZ  CAY  CAO  aromatic  1.391  0.020  1.391
 6WZ  CAK  CAW  aromatic  1.393  0.020  1.393
 6WZ  CAQ  NBF  single    1.455  0.020  1.455
 6WZ  NBF  CBD  single    1.461  0.020  1.461
 6WZ  CBD  CAA  single    1.522  0.020  1.522
 6WZ  CAO  CAW  aromatic  1.387  0.020  1.387
 6WZ  CAW  CAR  single    1.506  0.020  1.506
 6WZ  CAJ  CAN  aromatic  1.382  0.020  1.382
 6WZ  CAJ  CAI  aromatic  1.392  0.020  1.392
 6WZ  CAN  CBC  aromatic  1.399  0.020  1.399
 6WZ  CAI  CAM  aromatic  1.378  0.020  1.378
 6WZ  CAR  NBG  single    1.463  0.020  1.463
 6WZ  CBC  NBG  single    1.391  0.020  1.391
 6WZ  CBC  CBB  aromatic  1.402  0.020  1.402
 6WZ  NBG  CBA  single    1.372  0.020  1.372
 6WZ  CAM  CBB  aromatic  1.395  0.020  1.395
 6WZ  CBB  CAZ  single    1.461  0.020  1.461
 6WZ  CBA  OAD  double    1.213  0.020  1.213
 6WZ  CBA  NAU  single    1.375  0.020  1.375
 6WZ  CAZ  NAU  single    1.370  0.020  1.370
 6WZ  CAZ  OAC  double    1.215  0.020  1.215
 6WZ  NAU  H1   single    0.860  0.020  1.020
 6WZ  CAM  H2   single    0.930  0.020  1.080
 6WZ  CAI  H3   single    0.930  0.020  1.080
 6WZ  CAJ  H4   single    0.930  0.020  1.080
 6WZ  CAN  H5   single    0.930  0.020  1.080
 6WZ  CAR  H6   single    0.970  0.020  1.090
 6WZ  CAR  H7   single    0.970  0.020  1.090
 6WZ  CAO  H8   single    0.930  0.020  1.080
 6WZ  CAK  H9   single    0.930  0.020  1.080
 6WZ  CAL  H10  single    0.930  0.020  1.080
 6WZ  CAS  H11  single    0.970  0.020  1.090
 6WZ  CAS  H12  single    0.970  0.020  1.090
 6WZ  CBD  H13  single    0.970  0.020  1.090
 6WZ  CAA  H14  single    0.970  0.020  1.090
 6WZ  CAA  H15  single    0.970  0.020  1.090
 6WZ  CAA  H16  single    0.970  0.020  1.090
 6WZ  CAP  H17  single    0.970  0.020  1.090
 6WZ  CAP  H18  single    0.970  0.020  1.090
 6WZ  CAQ  H19  single    0.970  0.020  1.090
 6WZ  CAQ  H20  single    0.970  0.020  1.090
 6WZ  CAT  H22  single    0.970  0.020  1.090
 6WZ  CAT  H23  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
 6WZ  NBG  CBA  NAU  116.24  3.000
 6WZ  NAU  CBA  OAD  120.93  3.000
 6WZ  NBG  CBA  OAD  122.83  3.000
 6WZ  H1   NAU  CAZ  117.13  3.000
 6WZ  H1   NAU  CBA  115.11  3.000
 6WZ  CAZ  NAU  CBA  127.75  3.000
 6WZ  CBB  CAZ  OAC  124.85  3.000
 6WZ  OAC  CAZ  NAU  121.16  3.000
 6WZ  CBB  CAZ  NAU  113.99  3.000
 6WZ  CBC  CBB  CAM  120.70  3.000
 6WZ  CAM  CBB  CAZ  119.16  3.000
 6WZ  CBC  CBB  CAZ  120.14  3.000
 6WZ  H2   CAM  CAI  120.41  3.000
 6WZ  H2   CAM  CBB  118.86  3.000
 6WZ  CAI  CAM  CBB  120.72  3.000
 6WZ  H3   CAI  CAJ  120.68  3.000
 6WZ  H3   CAI  CAM  120.60  3.000
 6WZ  CAJ  CAI  CAM  118.71  3.000
 6WZ  H4   CAJ  CAN  118.59  3.000
 6WZ  H4   CAJ  CAI  120.03  3.000
 6WZ  CAN  CAJ  CAI  121.38  3.000
 6WZ  H5   CAN  CBC  121.77  3.000
 6WZ  H5   CAN  CAJ  117.85  3.000
 6WZ  CBC  CAN  CAJ  120.38  3.000
 6WZ  NBG  CBC  CAN  122.25  3.000
 6WZ  NBG  CBC  CBB  119.66  3.000
 6WZ  CAN  CBC  CBB  118.10  3.000
 6WZ  CAR  NBG  CBC  122.63  3.000
 6WZ  CBC  NBG  CBA  122.20  3.000
 6WZ  CAR  NBG  CBA  115.14  3.000
 6WZ  H7   CAR  H6   105.63  3.000
 6WZ  H7   CAR  CAW  111.03  3.000
 6WZ  H6   CAR  CAW  110.37  3.000
 6WZ  H7   CAR  NBG  108.86  3.000
 6WZ  H6   CAR  NBG  108.48  3.000
 6WZ  CAW  CAR  NBG  112.23  3.000
 6WZ  CAK  CAW  CAO  118.77  3.000
 6WZ  CAO  CAW  CAR  120.01  3.000
 6WZ  CAK  CAW  CAR  121.21  3.000
 6WZ  H8   CAO  CAY  119.11  3.000
 6WZ  H8   CAO  CAW  119.50  3.000
 6WZ  CAY  CAO  CAW  121.38  3.000
 6WZ  H9   CAK  CAL  118.42  3.000
 6WZ  H9   CAK  CAW  120.67  3.000
 6WZ  CAL  CAK  CAW  120.90  3.000
 6WZ  H10  CAL  CAX  120.26  3.000
 6WZ  H10  CAL  CAK  121.03  3.000
 6WZ  CAX  CAL  CAK  118.71  3.000
 6WZ  CAY  CAX  FAE  118.78  3.000
 6WZ  CAY  CAX  CAL  122.14  3.000
 6WZ  FAE  CAX  CAL  119.07  3.000
 6WZ  CAV  CAY  CAX  120.40  3.000
 6WZ  CAV  CAY  CAO  121.40  3.000
 6WZ  CAX  CAY  CAO  118.09  3.000
 6WZ  NBE  CAV  OAB  123.82  3.000
 6WZ  OAB  CAV  CAY  119.44  3.000
 6WZ  NBE  CAV  CAY  116.70  3.000
 6WZ  CAP  NBE  CAS  112.19  3.000
 6WZ  CAS  NBE  CAV  125.62  3.000
 6WZ  CAP  NBE  CAV  121.16  3.000
 6WZ  H12  CAS  H11  107.24  3.000
 6WZ  H12  CAS  CBD  109.13  3.000
 6WZ  H11  CAS  CBD  108.84  3.000
 6WZ  H12  CAS  NBE  108.91  3.000
 6WZ  H11  CAS  NBE  110.75  3.000
 6WZ  CBD  CAS  NBE  111.86  3.000
 6WZ  H13  CBD  NBF  110.90  3.000
 6WZ  H13  CBD  CAA  108.54  3.000
 6WZ  NBF  CBD  CAA  112.88  3.000
 6WZ  H13  CBD  CAS  107.51  3.000
 6WZ  CAA  CBD  CAS  107.57  3.000
 6WZ  NBF  CBD  CAS  109.25  3.000
 6WZ  H16  CAA  H15  106.62  3.000
 6WZ  H16  CAA  H14  108.13  3.000
 6WZ  H15  CAA  H14  108.37  3.000
 6WZ  H16  CAA  CBD  109.42  3.000
 6WZ  H15  CAA  CBD  112.99  3.000
 6WZ  H14  CAA  CBD  111.11  3.000
 6WZ  H18  CAP  H17  108.08  3.000
 6WZ  H18  CAP  CAQ  110.21  3.000
 6WZ  H17  CAP  CAQ  109.97  3.000
 6WZ  H18  CAP  NBE  110.17  3.000
 6WZ  H17  CAP  NBE  108.69  3.000
 6WZ  CAQ  CAP  NBE  109.68  3.000
 6WZ  H20  CAQ  H19  107.02  3.000
 6WZ  H20  CAQ  NBF  111.67  3.000
 6WZ  H19  CAQ  NBF  109.30  3.000
 6WZ  H20  CAQ  CAP  109.06  3.000
 6WZ  H19  CAQ  CAP  108.38  3.000
 6WZ  NBF  CAQ  CAP  111.27  3.000
 6WZ  CAT  NBF  CAQ  111.37  3.000
 6WZ  CAQ  NBF  CBD  112.32  3.000
 6WZ  CAT  NBF  CBD  115.41  3.000
 6WZ  H23  CAT  H22  105.40  3.000
 6WZ  H23  CAT  CBH  107.67  3.000
 6WZ  H22  CAT  CBH  108.16  3.000
 6WZ  H23  CAT  NBF  112.52  3.000
 6WZ  H22  CAT  NBF  112.17  3.000
 6WZ  CBH  CAT  NBF  110.64  3.000
 6WZ  FAF  CBH  FAH  106.46  3.000
 6WZ  FAF  CBH  FAG  106.85  3.000
 6WZ  FAH  CBH  FAG  106.88  3.000
 6WZ  FAG  CBH  CAT  111.26  3.000
 6WZ  FAF  CBH  CAT  112.49  3.000
 6WZ  FAH  CBH  CAT  112.52  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
 6WZ  CONST_01  CAJ  CAN  CBC  CBB    0.00   0.0  0
 6WZ  CONST_02  CAJ  CAI  CAM  CBB    0.00   0.0  0
 6WZ  CONST_03  CAN  CAJ  CAI  CAM    0.00   0.0  0
 6WZ  CONST_04  CAN  CBC  CBB  CAM    0.00   0.0  0
 6WZ  CONST_05  CBC  CAN  CAJ  CAI    0.00   0.0  0
 6WZ  CONST_06  CBC  CBB  CAM  CAI    0.00   0.0  0
 6WZ  CONST_07  CAX  CAL  CAK  CAW    0.00   0.0  0
 6WZ  CONST_08  CAX  CAY  CAO  CAW    0.00   0.0  0
 6WZ  CONST_09  CAL  CAX  CAY  CAO    0.00   0.0  0
 6WZ  CONST_10  CAL  CAK  CAW  CAO    0.00   0.0  0
 6WZ  CONST_11  CAY  CAX  CAL  CAK    0.00   0.0  0
 6WZ  CONST_12  CAY  CAO  CAW  CAK    0.00   0.0  0
 6WZ  CONST_13  CBC  NBG  CBA  NAU    0.00   0.0  0
 6WZ  CONST_14  NBG  CBA  NAU  CAZ    0.00   0.0  0
 6WZ  CONST_15  CAL  CAK  CAW  CAR  180.00   0.0  0
 6WZ  CONST_16  CAY  CAO  CAW  CAR  180.00   0.0  0
 6WZ  CONST_17  CAV  CAY  CAO  CAW  180.00   0.0  0
 6WZ  CONST_18  FAE  CAX  CAY  CAO  180.00   0.0  0
 6WZ  CONST_19  FAE  CAX  CAL  CAK  180.00   0.0  0
 6WZ  CONST_20  CAV  CAY  CAX  CAL  180.00   0.0  0
 6WZ  CONST_21  CAP  NBE  CAV  CAY  180.00   0.0  0
 6WZ  CONST_22  CAS  NBE  CAV  CAY    0.00   0.0  0
 6WZ  CONST_23  CBC  NBG  CBA  OAD  180.00   0.0  0
 6WZ  CONST_24  CAZ  NAU  CBA  OAD  180.00   0.0  0
 6WZ  CONST_25  CAR  NBG  CBA  NAU  180.00   0.0  0
 6WZ  CONST_26  H2   CAM  CBB  CAZ    0.00   0.0  0
 6WZ  CONST_27  H5   CAN  CBC  CBB  180.00   0.0  0
 6WZ  CONST_28  H3   CAI  CAM  CBB  180.00   0.0  0
 6WZ  CONST_29  H4   CAJ  CAI  CAM  180.00   0.0  0
 6WZ  CONST_30  H10  CAL  CAK  CAW  180.00   0.0  0
 6WZ  CONST_31  H9   CAK  CAW  CAO  180.00   0.0  0
 6WZ  CONST_32  H8   CAO  CAW  CAK  180.00   0.0  0
 6WZ  CONST_33  H1   NAU  CBA  NBG  180.00   0.0  0
 6WZ  CONST_34  CAP  NBE  CAV  OAB    0.00   0.0  0
 6WZ  CONST_35  CAS  NBE  CAV  OAB  180.00   0.0  0
 6WZ  CONST_36  CAR  NBG  CBA  OAD    0.00   0.0  0
 6WZ  Var_01    NBF  CAQ  CAP  NBE   56.08  30.0  1
 6WZ  Var_02    CAQ  CAP  NBE  CAS  -56.29  30.0  1
 6WZ  Var_03    CAP  NBE  CAS  CBD   56.46  30.0  1
 6WZ  Var_04    CAP  CAQ  NBF  CBD  -56.95  30.0  1
 6WZ  Var_05    CAW  CAR  NBG  CBA  -76.03  30.0  2
 6WZ  Var_06    CAK  CAW  CAR  NBG  -66.13  30.0  1
 6WZ  Var_07    NBE  CAV  CAY  CAO  -65.90  30.0  2
 6WZ  Var_08    CBH  CAT  NBF  CBD  125.05  30.0  1
 6WZ  Var_09    FAH  CBH  CAT  NBF  -61.15  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
 6WZ  chir_01  CBD  CAS  NBF  CAA  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
 6WZ  plan-1  CAR  0.020
 6WZ  plan-1  CAW  0.020
 6WZ  plan-1  CAO  0.020
 6WZ  plan-1  CAK  0.020
 6WZ  plan-1  CAL  0.020
 6WZ  plan-1  CAX  0.020
 6WZ  plan-1  FAE  0.020
 6WZ  plan-1  CAY  0.020
 6WZ  plan-1  CAV  0.020
 6WZ  plan-1  H8   0.020
 6WZ  plan-1  H9   0.020
 6WZ  plan-1  H10  0.020
 6WZ  plan-2  OAD  0.020
 6WZ  plan-2  CBA  0.020
 6WZ  plan-2  NAU  0.020
 6WZ  plan-2  CAZ  0.020
 6WZ  plan-2  OAC  0.020
 6WZ  plan-2  CBB  0.020
 6WZ  plan-2  CAM  0.020
 6WZ  plan-2  CAI  0.020
 6WZ  plan-2  CAJ  0.020
 6WZ  plan-2  CAN  0.020
 6WZ  plan-2  CBC  0.020
 6WZ  plan-2  NBG  0.020
 6WZ  plan-2  CAR  0.020
 6WZ  plan-2  H1   0.020
 6WZ  plan-2  H2   0.020
 6WZ  plan-2  H3   0.020
 6WZ  plan-2  H4   0.020
 6WZ  plan-2  H5   0.020
 6WZ  plan-3  CAY  0.020
 6WZ  plan-3  CAV  0.020
 6WZ  plan-3  OAB  0.020
 6WZ  plan-3  NBE  0.020
 6WZ  plan-3  CAS  0.020
 6WZ  plan-3  CAP  0.020

