# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Mon Apr  6 13:27:36 2020
#   Inital geometry file: a 144 line input string
#   Ligand name: 1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}prop-2-en-1-one
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: Nc1ncnc2n(nc(c3ccc(Oc4ccccc4)cc3)c12)[C@@H]5CCCN(C5)C(=O)C=C
#
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
 1E8  1E8  1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}prop-2-en-1-one  ligand  57  33  .  2021-08-03  2021-08-03  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK
;

data_comp_1E8
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
 1E8  N1    N  N     0  -0.477   0.5466   4.0888  -0.2542
 1E8  C2    C  CR16  0   0.056   1.8438   3.9026  -0.4917
 1E8  N3    N  N     0  -0.464   2.5068   2.7682  -0.5808
 1E8  C4    C  CR56  0   0.586   1.7082   1.7072  -0.4365
 1E8  C5    C  CR56  0  -0.275   0.3266   1.7343  -0.2298
 1E8  C6    C  CR6   0   0.433  -0.2420   3.0228  -0.0949
 1E8  NAB   N  NH2   0  -0.816  -1.5295   3.2357   0.1825
 1E8  OAC   O  O     0  -0.495   5.9832  -0.0643   1.8374
 1E8  CAD   C  C1    0  -0.333   7.4835  -1.5991   0.8578
 1E8  CAE   C  CR16  0  -0.257  -8.6189  -0.5214  -0.7942
 1E8  CAF   C  CR16  0  -0.253  -8.0084   0.0832   0.2979
 1E8  CAG   C  CR16  0  -0.253  -8.0246  -1.6232  -1.3942
 1E8  CAI   C  CR16  0  -0.298  -6.8070  -0.4066   0.7904
 1E8  CAJ   C  CR16  0  -0.307  -6.8193  -2.1193  -0.9135
 1E8  CAK   C  CR16  0  -0.324  -3.7344  -0.3611  -0.4667
 1E8  CAL   C  CR16  0  -0.318  -2.7766  -1.8710   1.1490
 1E8  CAM   C  CR16  0  -0.327  -2.4833   0.2110  -0.6501
 1E8  CAN   C  CR16  0  -0.274  -1.5377  -1.2913   0.9553
 1E8  CAO   C  CH2   0  -0.439   4.8850  -1.5984  -2.0243
 1E8  CAP   C  CH2   0  -0.443   3.5151  -0.9349  -1.9214
 1E8  CAQ   C  CH2   0  -0.328   5.1930  -2.4122  -0.7731
 1E8  CAR   C  CH2   0  -0.319   3.7592  -1.0183   0.5818
 1E8  NAU   N  N     0  -0.273   1.0119  -0.3947  -0.2794
 1E8  CAY   C  CR6   0   0.303  -6.2237  -1.5072   0.1780
 1E8  CAZ   C  CR6   0   0.361  -3.8814  -1.4031   0.4411
 1E8  CBA   C  CR6   0   0.021  -1.3718  -0.2327   0.0606
 1E8  CBB   C  CR5   0   0.273  -0.0501   0.3650  -0.1465
 1E8  CBE   C  CH1   0  -0.097   3.3969  -0.1421  -0.6221
 1E8  NBF   N  NR5   0  -0.383   2.0710   0.4109  -0.4506
 1E8  NBG   N  NT    0  -0.466   5.0893  -1.5670   0.4082
 1E8  H2    H  HCR6  0   0.254   2.4266   4.8092  -0.6180
 1E8  HAA   H  H     0   0.257   8.5356   0.0527   1.6515
 1E8  HAAA  H  H     0   0.258   9.5588  -1.3730   1.0835
 1E8  HNAB  H  HNH2  0   0.406  -1.8416   4.1770   0.3533
 1E8  HNAA  H  HNH2  0   0.415  -2.1398   2.4883   0.4650
 1E8  HAD   H  H     0   0.275   7.5825  -2.5867   0.4280
 1E8  HAF   H  HCR6  0   0.265  -8.4702   0.9383   0.7737
 1E8  HAG   H  HCR6  0   0.264  -8.4973  -2.1008  -2.2423
 1E8  HAI   H  HCR6  0   0.276  -6.3320   0.0581   1.6455
 1E8  HAJ   H  HCR6  0   0.273  -6.3495  -2.9777  -1.3766
 1E8  HAK   H  HCR6  0   0.285  -4.5726   0.0068  -1.0432
 1E8  HAL   H  HCR6  0   0.274  -2.8940  -2.6846   1.8534
 1E8  HAM   H  HCR6  0   0.276  -2.3793   1.0013  -1.3834
 1E8  HAN   H  HCR6  0   0.260  -0.6893  -1.6552   1.5198
 1E8  HAO   H  HCH2  0   0.251   4.9169  -2.2518  -2.8979
 1E8  HAOA  H  HCH2  0   0.233   5.6635  -0.8421  -2.1602
 1E8  HAP   H  HCH2  0   0.253   3.3451  -0.2751  -2.7745
 1E8  HAPA  H  HCH2  0   0.238   2.7362  -1.7030  -1.9427
 1E8  HAQ   H  HCH2  0   0.250   4.4701  -3.2269  -0.6719
 1E8  HAQA  H  HCH2  0   0.274   6.1749  -2.8685  -0.8460
 1E8  HAR   H  HCH2  0   0.280   3.7071  -0.4463   1.5044
 1E8  HARA  H  HCH2  0   0.266   3.0501  -1.8476   0.6551
 1E8  HBE   H  HCH1  0   0.279   4.0766   0.7130  -0.6482
 1E8  OAV   O  O2    0  -0.509  -5.0591  -2.0360   0.6810
 1E8  CAW   C  C     0   0.538   6.1340  -1.0046   1.0667
 1E8  HAE   H  HCR6  0   0.263  -9.5574  -0.1380  -1.1719
 1E8  CAA   C  C2    0  -0.464   8.5783  -0.9378   1.2181

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
 1E8  C2   N1    aromatic  1.332  0.020  1.332
 1E8  N1   C6    aromatic  1.336  0.020  1.336
 1E8  N3   C2    aromatic  1.317  0.020  1.317
 1E8  C2   H2    single    0.930  0.020  1.080
 1E8  N3   C4    aromatic  1.336  0.020  1.336
 1E8  NBF  C4    aromatic  1.346  0.020  1.346
 1E8  C4   C5    aromatic  1.397  0.020  1.397
 1E8  C5   C6    aromatic  1.415  0.020  1.415
 1E8  C5   CBB   aromatic  1.423  0.020  1.423
 1E8  C6   NAB   single    1.334  0.020  1.334
 1E8  CAA  CAD   double    1.329  0.020  1.329
 1E8  CAA  HAA   single    0.930  0.020  1.080
 1E8  CAA  HAAA  single    0.930  0.020  1.080
 1E8  NAB  HNAB  single    0.860  0.020  1.020
 1E8  NAB  HNAA  single    0.860  0.020  1.020
 1E8  OAC  CAW   double    1.225  0.020  1.225
 1E8  CAD  CAW   single    1.489  0.020  1.489
 1E8  CAD  HAD   single    0.930  0.020  1.080
 1E8  CAF  CAE   aromatic  1.390  0.020  1.390
 1E8  CAE  CAG   aromatic  1.388  0.020  1.388
 1E8  CAE  HAE   single    0.930  0.020  1.080
 1E8  CAF  CAI   aromatic  1.388  0.020  1.388
 1E8  CAF  HAF   single    0.930  0.020  1.080
 1E8  CAG  CAJ   aromatic  1.389  0.020  1.389
 1E8  CAG  HAG   single    0.930  0.020  1.080
 1E8  CAI  CAY   aromatic  1.388  0.020  1.388
 1E8  CAI  HAI   single    0.930  0.020  1.080
 1E8  CAY  CAJ   aromatic  1.386  0.020  1.386
 1E8  CAJ  HAJ   single    0.930  0.020  1.080
 1E8  CAM  CAK   aromatic  1.388  0.020  1.388
 1E8  CAK  CAZ   aromatic  1.390  0.020  1.390
 1E8  CAK  HAK   single    0.930  0.020  1.080
 1E8  CAZ  CAL   aromatic  1.393  0.020  1.393
 1E8  CAN  CAL   aromatic  1.381  0.020  1.381
 1E8  CAL  HAL   single    0.930  0.020  1.080
 1E8  CAM  CBA   aromatic  1.392  0.020  1.392
 1E8  CAM  HAM   single    0.930  0.020  1.080
 1E8  CBA  CAN   aromatic  1.396  0.020  1.396
 1E8  CAN  HAN   single    0.930  0.020  1.080
 1E8  CAQ  CAO   single    1.524  0.020  1.524
 1E8  CAO  CAP   single    1.526  0.020  1.526
 1E8  CAO  HAO   single    0.970  0.020  1.090
 1E8  CAO  HAOA  single    0.970  0.020  1.090
 1E8  CBE  CAP   single    1.527  0.020  1.527
 1E8  CAP  HAP   single    0.970  0.020  1.090
 1E8  CAP  HAPA  single    0.970  0.020  1.090
 1E8  NBG  CAQ   single    1.456  0.020  1.456
 1E8  CAQ  HAQ   single    0.970  0.020  1.090
 1E8  CAQ  HAQA  single    0.970  0.020  1.090
 1E8  NBG  CAR   single    1.449  0.020  1.449
 1E8  CAR  CBE   single    1.532  0.020  1.532
 1E8  CAR  HAR   single    0.970  0.020  1.090
 1E8  CAR  HARA  single    0.970  0.020  1.090
 1E8  NBF  NAU   aromatic  1.342  0.020  1.342
 1E8  NAU  CBB   aromatic  1.312  0.020  1.312
 1E8  CAZ  OAV   single    1.358  0.020  1.358
 1E8  CAY  OAV   single    1.374  0.020  1.374
 1E8  CAW  NBG   single    1.357  0.020  1.357
 1E8  CBB  CBA   single    1.465  0.020  1.465
 1E8  CBE  NBF   single    1.447  0.020  1.447
 1E8  CBE  HBE   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
 1E8  C6    N1   C2    119.00  3.000
 1E8  H2    C2   N3    116.19  3.000
 1E8  H2    C2   N1    115.29  3.000
 1E8  N3    C2   N1    128.52  3.000
 1E8  C4    N3   C2    112.08  3.000
 1E8  NBF   C4   C5    106.66  3.000
 1E8  C5    C4   N3    126.28  3.000
 1E8  NBF   C4   N3    127.06  3.000
 1E8  CBB   C5   C6    139.87  3.000
 1E8  CBB   C5   C4    104.59  3.000
 1E8  C6    C5   C4    115.41  3.000
 1E8  NAB   C6   C5    123.57  3.000
 1E8  NAB   C6   N1    117.86  3.000
 1E8  C5    C6   N1    118.57  3.000
 1E8  HNAA  NAB  HNAB  117.34  3.000
 1E8  HNAA  NAB  C6    121.71  3.000
 1E8  HNAB  NAB  C6    118.94  3.000
 1E8  HAD   CAD  CAW   120.21  3.000
 1E8  HAD   CAD  CAA   119.13  3.000
 1E8  CAW   CAD  CAA   120.65  3.000
 1E8  HAE   CAE  CAG   120.12  3.000
 1E8  HAE   CAE  CAF   120.08  3.000
 1E8  CAG   CAE  CAF   119.80  3.000
 1E8  HAF   CAF  CAI   119.49  3.000
 1E8  HAF   CAF  CAE   120.13  3.000
 1E8  CAI   CAF  CAE   120.38  3.000
 1E8  HAG   CAG  CAJ   119.52  3.000
 1E8  HAG   CAG  CAE   120.14  3.000
 1E8  CAJ   CAG  CAE   120.35  3.000
 1E8  HAI   CAI  CAY   120.28  3.000
 1E8  HAI   CAI  CAF   120.56  3.000
 1E8  CAY   CAI  CAF   119.15  3.000
 1E8  HAJ   CAJ  CAY   120.04  3.000
 1E8  HAJ   CAJ  CAG   120.77  3.000
 1E8  CAY   CAJ  CAG   119.19  3.000
 1E8  HAK   CAK  CAZ   121.41  3.000
 1E8  HAK   CAK  CAM   119.20  3.000
 1E8  CAZ   CAK  CAM   119.38  3.000
 1E8  HAL   CAL  CAZ   119.81  3.000
 1E8  HAL   CAL  CAN   120.26  3.000
 1E8  CAZ   CAL  CAN   119.93  3.000
 1E8  HAM   CAM  CBA   120.11  3.000
 1E8  HAM   CAM  CAK   118.47  3.000
 1E8  CBA   CAM  CAK   121.40  3.000
 1E8  HAN   CAN  CBA   119.75  3.000
 1E8  HAN   CAN  CAL   119.27  3.000
 1E8  CBA   CAN  CAL   120.98  3.000
 1E8  HAOA  CAO  HAO   107.08  3.000
 1E8  HAOA  CAO  CAQ   109.11  3.000
 1E8  HAO   CAO  CAQ   109.36  3.000
 1E8  HAOA  CAO  CAP   110.29  3.000
 1E8  HAO   CAO  CAP   109.91  3.000
 1E8  CAQ   CAO  CAP   111.00  3.000
 1E8  HAPA  CAP  HAP   107.35  3.000
 1E8  HAPA  CAP  CBE   109.02  3.000
 1E8  HAP   CAP  CBE   109.82  3.000
 1E8  HAPA  CAP  CAO   109.43  3.000
 1E8  HAP   CAP  CAO   110.49  3.000
 1E8  CBE   CAP  CAO   110.65  3.000
 1E8  HAQA  CAQ  HAQ   106.91  3.000
 1E8  HAQA  CAQ  NBG   111.28  3.000
 1E8  HAQ   CAQ  NBG   108.07  3.000
 1E8  HAQA  CAQ  CAO   110.63  3.000
 1E8  HAQ   CAQ  CAO   109.89  3.000
 1E8  NBG   CAQ  CAO   109.98  3.000
 1E8  HARA  CAR  HAR   108.13  3.000
 1E8  HARA  CAR  NBG   108.42  3.000
 1E8  HAR   CAR  NBG   110.18  3.000
 1E8  HARA  CAR  CBE   109.45  3.000
 1E8  HAR   CAR  CBE   110.77  3.000
 1E8  NBG   CAR  CBE   109.83  3.000
 1E8  NBF   NAU  CBB   107.71  3.000
 1E8  OAV   CAY  CAJ   118.85  3.000
 1E8  OAV   CAY  CAI   119.98  3.000
 1E8  CAJ   CAY  CAI   121.14  3.000
 1E8  OAV   CAZ  CAL   116.19  3.000
 1E8  OAV   CAZ  CAK   123.80  3.000
 1E8  CAL   CAZ  CAK   120.00  3.000
 1E8  CBB   CBA  CAN   120.47  3.000
 1E8  CBB   CBA  CAM   121.20  3.000
 1E8  CAN   CBA  CAM   118.30  3.000
 1E8  CBA   CBB  NAU   120.54  3.000
 1E8  CBA   CBB  C5    129.77  3.000
 1E8  NAU   CBB  C5    109.69  3.000
 1E8  HBE   CBE  NBF   105.89  3.000
 1E8  HBE   CBE  CAR   108.61  3.000
 1E8  NBF   CBE  CAR   110.00  3.000
 1E8  HBE   CBE  CAP   109.75  3.000
 1E8  NBF   CBE  CAP   111.74  3.000
 1E8  CAR   CBE  CAP   110.70  3.000
 1E8  CBE   NBF  NAU   120.60  3.000
 1E8  CBE   NBF  C4    128.04  3.000
 1E8  NAU   NBF  C4    111.36  3.000
 1E8  CAW   NBG  CAR   119.44  3.000
 1E8  CAW   NBG  CAQ   125.41  3.000
 1E8  CAR   NBG  CAQ   112.48  3.000
 1E8  CAZ   OAV  CAY   119.39  3.000
 1E8  NBG   CAW  CAD   117.65  3.000
 1E8  NBG   CAW  OAC   121.91  3.000
 1E8  CAD   CAW  OAC   120.41  3.000
 1E8  HAAA  CAA  HAA   117.01  3.000
 1E8  HAAA  CAA  CAD   120.87  3.000
 1E8  HAA   CAA  CAD   122.12  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
 1E8  CONST_01  C4    N3   C2   N1     0.00   0.0  0
 1E8  CONST_02  C4    C5   C6   N1     0.00   0.0  0
 1E8  CONST_03  CBB   C5   C6   N1   180.00   0.0  0
 1E8  CONST_04  C5    C6   N1   C2     0.00   0.0  0
 1E8  CONST_05  NBF   C4   N3   C2   180.00   0.0  0
 1E8  CONST_06  C5    C4   N3   C2     0.00   0.0  0
 1E8  CONST_07  C6    N1   C2   N3     0.00   0.0  0
 1E8  CONST_08  NAU   NBF  C4   N3   180.00   0.0  0
 1E8  CONST_09  C6    C5   C4   N3     0.00   0.0  0
 1E8  CONST_10  CBB   C5   C4   N3   180.00   0.0  0
 1E8  CONST_11  CBB   NAU  NBF  C4     0.00   0.0  0
 1E8  CONST_12  NAU   CBB  C5   C4     0.00   0.0  0
 1E8  CONST_13  CBA   CBB  C5   C4   180.00   0.0  0
 1E8  CONST_14  NAU   NBF  C4   C5     0.00   0.0  0
 1E8  CONST_15  NBF   NAU  CBB  C5     0.00   0.0  0
 1E8  CONST_18  NBF   C4   C5   C6   180.00   0.0  0
 1E8  CONST_19  NAU   CBB  C5   C6   180.00   0.0  0
 1E8  CONST_20  CBA   CBB  C5   C6     0.00   0.0  0
 1E8  CONST_21  CAY   CAI  CAF  CAE    0.00   0.0  0
 1E8  CONST_22  CAY   CAJ  CAG  CAE    0.00   0.0  0
 1E8  CONST_23  CAJ   CAG  CAE  CAF    0.00   0.0  0
 1E8  CONST_24  CAJ   CAY  CAI  CAF    0.00   0.0  0
 1E8  CONST_25  CAI   CAF  CAE  CAG    0.00   0.0  0
 1E8  CONST_26  CAI   CAY  CAJ  CAG    0.00   0.0  0
 1E8  CONST_27  CAN   CBA  CAM  CAK    0.00   0.0  0
 1E8  CONST_28  CBB   CBA  CAM  CAK  180.00   0.0  0
 1E8  CONST_29  CAN   CAL  CAZ  CAK    0.00   0.0  0
 1E8  CONST_30  CAM   CAK  CAZ  CAL    0.00   0.0  0
 1E8  CONST_31  CAM   CBA  CAN  CAL    0.00   0.0  0
 1E8  CONST_32  CBB   CBA  CAN  CAL  180.00   0.0  0
 1E8  CONST_35  CBA   CAM  CAK  CAZ    0.00   0.0  0
 1E8  CONST_36  CBA   CAN  CAL  CAZ    0.00   0.0  0
 1E8  CONST_37  NBF   NAU  CBB  CBA  180.00   0.0  0
 1E8  CONST_38  NBF   C4   C5   CBB    0.00   0.0  0
 1E8  CONST_39  CBE   NBF  C4   N3     0.00   0.0  0
 1E8  CONST_40  CBE   NBF  C4   C5   180.00   0.0  0
 1E8  CONST_41  CBE   NBF  NAU  CBB  180.00   0.0  0
 1E8  CONST_42  NAB   C6   N1   C2   180.00   0.0  0
 1E8  CONST_43  NAB   C6   C5   C4   180.00   0.0  0
 1E8  CONST_44  CBB   C5   C6   NAB    0.00   0.0  0
 1E8  CONST_45  OAV   CAY  CAI  CAF  180.00   0.0  0
 1E8  CONST_46  OAV   CAY  CAJ  CAG  180.00   0.0  0
 1E8  CONST_47  OAV   CAZ  CAK  CAM  180.00   0.0  0
 1E8  CONST_48  OAV   CAZ  CAL  CAN  180.00   0.0  0
 1E8  CONST_49  H2    C2   N3   C4   180.00   0.0  0
 1E8  CONST_50  HAI   CAI  CAF  CAE  180.00   0.0  0
 1E8  CONST_51  HAJ   CAJ  CAG  CAE  180.00   0.0  0
 1E8  CONST_52  HAG   CAG  CAE  CAF  180.00   0.0  0
 1E8  CONST_53  HAF   CAF  CAE  CAG  180.00   0.0  0
 1E8  CONST_54  HAE   CAE  CAF  CAI  180.00   0.0  0
 1E8  CONST_55  HAL   CAL  CAZ  CAK  180.00   0.0  0
 1E8  CONST_56  HAK   CAK  CAZ  CAL  180.00   0.0  0
 1E8  CONST_57  HAN   CAN  CBA  CAM  180.00   0.0  0
 1E8  CONST_58  HAM   CAM  CBA  CAN  180.00   0.0  0
 1E8  CONST_60  CAR   NBG  CAW  OAC    0.00   0.0  0
 1E8  CONST_62  CAR   NBG  CAW  CAD  180.00   0.0  0
 1E8  CONST_63  HNAB  NAB  C6   N1     0.00   0.0  0
 1E8  CONST_64  HNAA  NAB  C6   N1   180.00   0.0  0
 1E8  Var_01    CAR   NBG  CAQ  CAO   61.09  30.0  1
 1E8  Var_02    NBG   CAQ  CAO  CAP  -55.77  30.0  1
 1E8  Var_03    CBE   CAP  CAO  CAQ   52.46  30.0  1
 1E8  Var_04    CBE   CAR  NBG  CAQ  -61.23  30.0  1
 1E8  Var_05    NBG   CAW  CAD  CAA  164.85  30.0  2
 1E8  Var_06    HAA   CAA  CAD  CAW   -1.33   0.0  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
 1E8  chir_01  CBE  CAP  CAR  NBF  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
 1E8  plan-1  CAE   0.020
 1E8  plan-1  CAF   0.020
 1E8  plan-1  CAG   0.020
 1E8  plan-1  CAI   0.020
 1E8  plan-1  CAJ   0.020
 1E8  plan-1  CAY   0.020
 1E8  plan-1  HAF   0.020
 1E8  plan-1  HAG   0.020
 1E8  plan-1  HAI   0.020
 1E8  plan-1  HAJ   0.020
 1E8  plan-1  OAV   0.020
 1E8  plan-1  HAE   0.020
 1E8  plan-2  CAK   0.020
 1E8  plan-2  CAL   0.020
 1E8  plan-2  CAM   0.020
 1E8  plan-2  CAN   0.020
 1E8  plan-2  CAZ   0.020
 1E8  plan-2  CBA   0.020
 1E8  plan-2  CBB   0.020
 1E8  plan-2  HAK   0.020
 1E8  plan-2  HAL   0.020
 1E8  plan-2  HAM   0.020
 1E8  plan-2  HAN   0.020
 1E8  plan-2  OAV   0.020
 1E8  plan-3  N1    0.020
 1E8  plan-3  C2    0.020
 1E8  plan-3  N3    0.020
 1E8  plan-3  C4    0.020
 1E8  plan-3  C5    0.020
 1E8  plan-3  C6    0.020
 1E8  plan-3  NAB   0.020
 1E8  plan-3  NAU   0.020
 1E8  plan-3  CBA   0.020
 1E8  plan-3  CBB   0.020
 1E8  plan-3  CBE   0.020
 1E8  plan-3  NBF   0.020
 1E8  plan-3  H2    0.020
 1E8  plan-4  C6    0.020
 1E8  plan-4  NAB   0.020
 1E8  plan-4  HNAB  0.020
 1E8  plan-4  HNAA  0.020
 1E8  plan-5  OAC   0.020
 1E8  plan-5  CAD   0.020
 1E8  plan-5  CAQ   0.020
 1E8  plan-5  CAR   0.020
 1E8  plan-5  NBG   0.020
 1E8  plan-5  CAW   0.020
 1E8  plan-6  CAD   0.020
 1E8  plan-6  HAA   0.020
 1E8  plan-6  HAAA  0.020
 1E8  plan-6  HAD   0.020
 1E8  plan-6  CAW   0.020
 1E8  plan-6  CAA   0.020

