# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sun May  3 11:33:13 2020
#   Inital geometry file: a 155 line input string
#   Ligand name: N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-Nalpha-[(2E)-3-phenylprop-2-enoyl]-L-phenylalaninamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: OC[C@H](Cc1ccccc1)NC(=O)[C@H](Cc2ccccc2)NC(=O)/C=C/c3ccccc3
#
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
 S89  S89  N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-Nalpha-[(2E)-3-phenylprop-2-enoyl]-L-phenylalaninamide  peptide  60  32  .  2022-03-23  2022-03-23
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as GRAND
;

data_comp_S89
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
 S89  CAZ   C  C     0   0.596  -0.8148   0.3388  -0.4643
 S89  OAB   O  O     0  -0.496  -0.4268   0.7895  -1.5349
 S89  CAE   C  C1    0  -0.416  -1.9561  -0.5981  -0.3521
 S89  CAF   C  C1    0  -0.231  -2.6104  -1.0072  -1.4425
 S89  CBB   C  CR6   0   0.149  -3.7340  -1.9382  -1.4973
 S89  CAP   C  CR16  0  -0.316  -4.2111  -2.6288  -0.3780
 S89  CAJ   C  CR16  0  -0.233  -5.2802  -3.5004  -0.4911
 S89  CAG   C  CR16  0  -0.262  -5.8969  -3.7010  -1.7222
 S89  CAK   C  CR16  0  -0.240  -5.4326  -3.0250  -2.8416
 S89  CAQ   C  CR16  0  -0.307  -4.3588  -2.1543  -2.7282
 S89  NAY   N  NH1   0  -0.648  -0.2474   0.6495   0.7183
 S89  CBF   C  CH1   0  -0.214   0.8990   1.5052   0.8614
 S89  CBA   C  C     0   0.586   2.0890   0.6670   1.3289
 S89  OAC   O  O     0  -0.488   1.9817  -0.0770   2.2907
 S89  CAW   C  CH2   0  -0.530   0.6302   2.6333   1.8690
 S89  CBD   C  CR6   0   0.155  -0.5267   3.4888   1.4413
 S89  CAU   C  CR16  0  -0.311  -1.8076   3.2563   1.9344
 S89  CAT   C  CR16  0  -0.303  -0.3457   4.5089   0.5100
 S89  CAO   C  CR16  0  -0.242  -2.8835   4.0257   1.5109
 S89  CAN   C  CR16  0  -0.241  -1.4174   5.2803   0.0829
 S89  CAI   C  CR16  0  -0.272  -2.6915   5.0399   0.5823
 S89  N     N  NH1   0  -0.630   3.2174   0.8487   0.6300
 S89  CA    C  CH1   0  -0.116   4.4258   0.0729   0.8124
 S89  C     C  CH2   0  -0.156   5.6342   0.9890   0.9006
 S89  O     O  OH1   0  -0.673   5.7538   1.7057  -0.3069
 S89  CB    C  CH2   0  -0.511   4.5600  -0.9759  -0.3052
 S89  CG    C  CR6   0   0.142   3.3824  -1.9074  -0.3399
 S89  CD1   C  CR16  0  -0.304   2.2714  -1.6248  -1.1310
 S89  CD2   C  CR16  0  -0.301   3.3524  -3.0449   0.4635
 S89  CE1   C  CR16  0  -0.229   1.1550  -2.4498  -1.1136
 S89  CE2   C  CR16  0  -0.243   2.2416  -3.8768   0.4799
 S89  CZ    C  CR16  0  -0.276   1.1358  -3.5787  -0.3067
 S89  HAE   H  H     0   0.267  -2.2344  -0.9397   0.6387
 S89  HAF   H  H     0   0.260  -2.2837  -0.6168  -2.4017
 S89  HAP   H  HCR6  0   0.256  -3.7434  -2.4947   0.5889
 S89  HAJ   H  HCR6  0   0.262  -5.6331  -4.0318   0.3832
 S89  HAG   H  HCR6  0   0.262  -6.7329  -4.3829  -1.8050
 S89  HAK   H  HCR6  0   0.261  -5.9045  -3.1757  -3.8036
 S89  HAQ   H  HCR6  0   0.259  -3.9990  -1.6292  -3.6052
 S89  HNAY  H  HNH1  0   0.398  -0.5966   0.2071   1.5541
 S89  HBF   H  HCH1  0   0.281   1.1004   1.9469  -0.1150
 S89  HAW   H  HCH2  0   0.269   1.5375   3.2359   1.9558
 S89  HAWA  H  HCH2  0   0.263   0.4390   2.1999   2.8537
 S89  HAU   H  HCR6  0   0.245  -1.9651   2.4714   2.6650
 S89  HAT   H  HCR6  0   0.246   0.6464   4.7056   0.1191
 S89  HAO   H  HCR6  0   0.253  -3.8721   3.8340   1.9084
 S89  HAN   H  HCR6  0   0.253  -1.2587   6.0728  -0.6372
 S89  HAI   H  HCR6  0   0.253  -3.5277   5.6439   0.2540
 S89  HN    H  HNH1  0   0.395   3.1961   1.4683  -0.1648
 S89  HA    H  HCH1  0   0.270   4.3431  -0.4435   1.7698
 S89  H     H  HCH2  0   0.206   6.5223   0.3763   1.1011
 S89  H1    H  HCH2  0   0.219   5.5012   1.6605   1.7573
 S89  HO    H  HOH1  0   0.461   6.4338   2.3762  -0.1975
 S89  HB    H  HCH2  0   0.252   4.6670  -0.4699  -1.2672
 S89  HBA   H  HCH2  0   0.249   5.4825  -1.5373  -0.1376
 S89  HD1   H  HCR6  0   0.240   2.2754  -0.7481  -1.7674
 S89  HD2   H  HCR6  0   0.241   4.2084  -3.2838   1.0848
 S89  HE1   H  HCR6  0   0.248   0.2993  -2.2081  -1.7306
 S89  HE2   H  HCR6  0   0.249   2.2386  -4.7587   1.1081
 S89  HZ    H  HCR6  0   0.248   0.2675  -4.2249  -0.2932

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
 S89  C    CA    single    1.525  0.021  1.525
 S89  C    O     single    1.231  0.020  1.231
 S89  C    H     single    0.970  0.020  1.090
 S89  CBA  N     single    1.340  0.020  1.340
 S89  N    CA    single    1.458  0.019  1.458
 S89  N    HN    single    0.860  0.020  1.020
 S89  CA   CB    single    1.521  0.033  1.521
 S89  CA   HA    single    0.970  0.020  0.970
 S89  CB   CG    single    1.502  0.020  1.502
 S89  CB   HB    single    0.970  0.020  1.090
 S89  CB   HBA   single    0.970  0.020  1.090
 S89  CG   CD1   aromatic  1.393  0.020  1.393
 S89  CG   CD2   aromatic  1.393  0.020  1.393
 S89  CE1  CZ    aromatic  1.388  0.020  1.388
 S89  CZ   CE2   aromatic  1.389  0.020  1.389
 S89  CZ   HZ    single    0.930  0.020  1.080
 S89  OAB  CAZ   double    1.225  0.020  1.225
 S89  CBA  OAC   double    1.221  0.020  1.221
 S89  CAZ  CAE   single    1.481  0.020  1.481
 S89  CAF  CAE   double    1.336  0.020  1.336
 S89  CAE  HAE   single    0.930  0.020  1.080
 S89  C    H1    single    0.970  0.020  1.090
 S89  CAF  CBB   single    1.460  0.020  1.460
 S89  CAF  HAF   single    0.930  0.020  1.080
 S89  O    HO    single    0.850  0.020  0.980
 S89  CAK  CAG   aromatic  1.388  0.020  1.388
 S89  CAG  CAJ   aromatic  1.392  0.020  1.392
 S89  CAG  HAG   single    0.930  0.020  1.080
 S89  CAO  CAI   aromatic  1.388  0.020  1.388
 S89  CAI  CAN   aromatic  1.389  0.020  1.389
 S89  CAI  HAI   single    0.930  0.020  1.080
 S89  CAP  CAJ   aromatic  1.384  0.020  1.384
 S89  CAJ  HAJ   single    0.930  0.020  1.080
 S89  CAQ  CAK   aromatic  1.387  0.020  1.387
 S89  CAK  HAK   single    0.930  0.020  1.080
 S89  CAN  CAT   aromatic  1.388  0.020  1.388
 S89  CAN  HAN   single    0.930  0.020  1.080
 S89  CAO  CAU   aromatic  1.389  0.020  1.389
 S89  CAO  HAO   single    0.930  0.020  1.080
 S89  CBB  CAP   aromatic  1.399  0.020  1.399
 S89  CAP  HAP   single    0.930  0.020  1.080
 S89  CAQ  CBB   aromatic  1.397  0.020  1.397
 S89  CAQ  HAQ   single    0.930  0.020  1.080
 S89  CBD  CAT   aromatic  1.393  0.020  1.393
 S89  CAT  HAT   single    0.930  0.020  1.080
 S89  CAU  CBD   aromatic  1.392  0.020  1.392
 S89  CAU  HAU   single    0.930  0.020  1.080
 S89  CBD  CAW   single    1.501  0.020  1.501
 S89  CAW  CBF   single    1.536  0.020  1.536
 S89  CAW  HAW   single    0.970  0.020  1.090
 S89  CAW  HAWA  single    0.970  0.020  1.090
 S89  CBF  NAY   single    1.438  0.020  1.438
 S89  NAY  CAZ   single    1.348  0.020  1.348
 S89  NAY  HNAY  single    0.860  0.020  1.020
 S89  CBF  CBA   single    1.529  0.020  1.529
 S89  CBF  HBF   single    0.970  0.020  1.090
 S89  CD1  CE1   aromatic  1.388  0.020  1.388
 S89  CD1  HD1   single    0.930  0.020  1.080
 S89  CD2  CE2   aromatic  1.388  0.020  1.388
 S89  CD2  HD2   single    0.930  0.020  1.080
 S89  CE1  HE1   single    0.930  0.020  1.080
 S89  CE2  HE2   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
 S89  NAY   CAZ  CAE  113.81  3.000
 S89  NAY   CAZ  OAB  123.28  3.000
 S89  CAE   CAZ  OAB  122.90  3.000
 S89  HAE   CAE  CAF  121.58  3.000
 S89  HAE   CAE  CAZ  117.80  3.000
 S89  CAF   CAE  CAZ  120.63  3.000
 S89  HAF   CAF  CBB  115.31  3.000
 S89  HAF   CAF  CAE  117.61  3.000
 S89  CBB   CAF  CAE  127.07  3.000
 S89  CAQ   CBB  CAP  118.43  3.000
 S89  CAQ   CBB  CAF  118.41  3.000
 S89  CAP   CBB  CAF  123.17  3.000
 S89  HAP   CAP  CAJ  119.00  3.000
 S89  HAP   CAP  CBB  120.41  3.000
 S89  CAJ   CAP  CBB  120.59  3.000
 S89  HAJ   CAJ  CAG  119.96  3.000
 S89  HAJ   CAJ  CAP  119.68  3.000
 S89  CAG   CAJ  CAP  120.36  3.000
 S89  HAG   CAG  CAK  120.25  3.000
 S89  HAG   CAG  CAJ  120.06  3.000
 S89  CAK   CAG  CAJ  119.69  3.000
 S89  HAK   CAK  CAQ  119.85  3.000
 S89  HAK   CAK  CAG  120.23  3.000
 S89  CAQ   CAK  CAG  119.93  3.000
 S89  HAQ   CAQ  CAK  119.67  3.000
 S89  HAQ   CAQ  CBB  119.32  3.000
 S89  CAK   CAQ  CBB  121.01  3.000
 S89  HNAY  NAY  CBF  117.06  3.000
 S89  HNAY  NAY  CAZ  118.71  3.000
 S89  CBF   NAY  CAZ  124.07  3.000
 S89  HBF   CBF  CAW  108.79  3.000
 S89  HBF   CBF  CBA  110.62  3.000
 S89  CAW   CBF  CBA  109.77  3.000
 S89  HBF   CBF  NAY  107.41  3.000
 S89  CBA   CBF  NAY  108.96  3.000
 S89  CAW   CBF  NAY  111.27  3.000
 S89  N     CBA  OAC  124.59  3.000
 S89  OAC   CBA  CBF  120.44  3.000
 S89  N     CBA  CBF  114.95  3.000
 S89  HAWA  CAW  HAW  107.01  3.000
 S89  HAWA  CAW  CBD  110.36  3.000
 S89  HAW   CAW  CBD  110.38  3.000
 S89  HAWA  CAW  CBF  109.30  3.000
 S89  HAW   CAW  CBF  108.17  3.000
 S89  CBD   CAW  CBF  111.50  3.000
 S89  CAT   CBD  CAU  118.60  3.000
 S89  CAU   CBD  CAW  120.87  3.000
 S89  CAT   CBD  CAW  120.51  3.000
 S89  HAU   CAU  CAO  119.61  3.000
 S89  HAU   CAU  CBD  119.57  3.000
 S89  CAO   CAU  CBD  120.82  3.000
 S89  HAT   CAT  CAN  119.66  3.000
 S89  HAT   CAT  CBD  119.52  3.000
 S89  CAN   CAT  CBD  120.82  3.000
 S89  HAO   CAO  CAI  120.08  3.000
 S89  HAO   CAO  CAU  119.82  3.000
 S89  CAI   CAO  CAU  120.10  3.000
 S89  HAN   CAN  CAI  120.02  3.000
 S89  HAN   CAN  CAT  119.89  3.000
 S89  CAI   CAN  CAT  120.09  3.000
 S89  HAI   CAI  CAN  120.18  3.000
 S89  HAI   CAI  CAO  120.24  3.000
 S89  CAN   CAI  CAO  119.58  3.000
 S89  HN    N    CA   116.51  3.000
 S89  HN    N    CBA  118.48  3.000
 S89  CA    N    CBA  124.39  3.000
 S89  HA    CA   CB   109.00  3.000
 S89  HA    CA   C    110.00  3.000
 S89  CB    CA   C    110.50  1.500
 S89  HA    CA   N    110.00  3.000
 S89  CB    CA   N    110.40  1.500
 S89  C     CA   N    111.00  2.800
 S89  H1    C    H    107.30  3.000
 S89  H1    C    O    111.61  3.000
 S89  H     C    O    111.82  3.000
 S89  H1    C    CA   108.56  3.000
 S89  H     C    CA   108.52  3.000
 S89  O     C    CA   120.80  1.700
 S89  HO    O    C    108.50  3.000
 S89  HBA   CB   HB   106.87  3.000
 S89  HBA   CB   CG   110.29  3.000
 S89  HB    CB   CG   110.11  3.000
 S89  HBA   CB   CA   108.21  3.000
 S89  HB    CB   CA   109.42  3.000
 S89  CG    CB   CA   111.79  3.000
 S89  CD2   CG   CD1  118.43  3.000
 S89  CD2   CG   CB   120.67  3.000
 S89  CD1   CG   CB   120.84  3.000
 S89  HD1   CD1  CE1  119.42  3.000
 S89  HD1   CD1  CG   119.67  3.000
 S89  CE1   CD1  CG   120.91  3.000
 S89  HD2   CD2  CE2  119.54  3.000
 S89  HD2   CD2  CG   119.56  3.000
 S89  CE2   CD2  CG   120.90  3.000
 S89  HE1   CE1  CZ   120.15  3.000
 S89  HE1   CE1  CD1  119.73  3.000
 S89  CZ    CE1  CD1  120.12  3.000
 S89  HE2   CE2  CZ   120.07  3.000
 S89  HE2   CE2  CD2  119.82  3.000
 S89  CZ    CE2  CD2  120.11  3.000
 S89  HZ    CZ   CE2  120.22  3.000
 S89  HZ    CZ   CE1  120.26  3.000
 S89  CE2   CZ   CE1  119.52  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
 S89  CONST_01  CAG   CAJ  CAP  CBB    0.00   0.0  0
 S89  CONST_02  CAG   CAK  CAQ  CBB    0.00   0.0  0
 S89  CONST_03  CAK   CAG  CAJ  CAP    0.00   0.0  0
 S89  CONST_04  CAK   CAQ  CBB  CAP    0.00   0.0  0
 S89  CONST_05  CAQ   CAK  CAG  CAJ    0.00   0.0  0
 S89  CONST_06  CAQ   CBB  CAP  CAJ    0.00   0.0  0
 S89  CONST_07  CAI   CAN  CAT  CBD    0.00   0.0  0
 S89  CONST_08  CAI   CAO  CAU  CBD    0.00   0.0  0
 S89  CONST_09  CAN   CAI  CAO  CAU    0.00   0.0  0
 S89  CONST_10  CAN   CAT  CBD  CAU    0.00   0.0  0
 S89  CONST_11  CAO   CAI  CAN  CAT    0.00   0.0  0
 S89  CONST_12  CAO   CAU  CBD  CAT    0.00   0.0  0
 S89  CONST_13  CZ    CE1  CD1  CG     0.00   0.0  0
 S89  CONST_14  CZ    CE2  CD2  CG     0.00   0.0  0
 S89  CONST_15  CE2   CD2  CG   CD1    0.00   0.0  0
 S89  CONST_16  CE2   CZ   CE1  CD1    0.00   0.0  0
 S89  CONST_17  CE1   CD1  CG   CD2    0.00   0.0  0
 S89  CONST_18  CE1   CZ   CE2  CD2    0.00   0.0  0
 S89  CONST_19  CAJ   CAP  CBB  CAF  180.00   0.0  0
 S89  CONST_20  CAK   CAQ  CBB  CAF  180.00   0.0  0
 S89  CONST_21  CAN   CAT  CBD  CAW  180.00   0.0  0
 S89  CONST_22  CAO   CAU  CBD  CAW  180.00   0.0  0
 S89  CONST_23  CE1   CD1  CG   CB   180.00   0.0  0
 S89  CONST_24  CE2   CD2  CG   CB   180.00   0.0  0
 S89  CONST_25  HAJ   CAJ  CAP  CBB  180.00   0.0  0
 S89  CONST_26  HAK   CAK  CAQ  CBB  180.00   0.0  0
 S89  CONST_27  HAG   CAG  CAJ  CAP  180.00   0.0  0
 S89  CONST_28  HAQ   CAQ  CBB  CAP  180.00   0.0  0
 S89  CONST_29  HAP   CAP  CAJ  CAG  180.00   0.0  0
 S89  CONST_30  HAN   CAN  CAT  CBD  180.00   0.0  0
 S89  CONST_31  HAO   CAO  CAU  CBD  180.00   0.0  0
 S89  CONST_32  HAI   CAI  CAO  CAU  180.00   0.0  0
 S89  CONST_33  HAT   CAT  CBD  CAU  180.00   0.0  0
 S89  CONST_34  HAU   CAU  CBD  CAT  180.00   0.0  0
 S89  CONST_35  HE1   CE1  CD1  CG   180.00   0.0  0
 S89  CONST_36  HE2   CE2  CD2  CG   180.00   0.0  0
 S89  CONST_37  HD2   CD2  CG   CD1  180.00   0.0  0
 S89  CONST_38  HZ    CZ   CE1  CD1  180.00   0.0  0
 S89  CONST_39  HD1   CD1  CG   CD2  180.00   0.0  0
 S89  CONST_40  CBF   NAY  CAZ  OAB    0.00   0.0  0
 S89  CONST_41  CBF   NAY  CAZ  CAE  180.00   0.0  0
 S89  CONST_42  CA    N    CBA  CBF  180.00   0.0  0
 S89  CONST_43  CA    N    CBA  OAC    0.00   0.0  0
 S89  CONST_44  HNAY  NAY  CAZ  OAB  180.00   0.0  0
 S89  CONST_45  HN    N    CBA  CBF    0.00   0.0  0
 S89  Var_01    CAP   CBB  CAF  CAE   -5.69  30.0  2
 S89  Var_02    CAT   CBD  CAW  CBF  -82.14  30.0  3
 S89  Var_03    CD1   CG   CB   CA    91.03  30.0  2
 S89  Var_04    CBB   CAF  CAE  CAZ  178.97   0.0  2
 S89  Var_05    CAF   CAE  CAZ  OAB    0.77  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
 S89  chir_01  CBF  CAW  NAY  CBA  positiv
 S89  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
 S89  plan-1  CAF   0.020
 S89  plan-1  CBB   0.020
 S89  plan-1  CAP   0.020
 S89  plan-1  CAJ   0.020
 S89  plan-1  CAG   0.020
 S89  plan-1  CAK   0.020
 S89  plan-1  CAQ   0.020
 S89  plan-1  HAP   0.020
 S89  plan-1  HAJ   0.020
 S89  plan-1  HAG   0.020
 S89  plan-1  HAK   0.020
 S89  plan-1  HAQ   0.020
 S89  plan-2  CAZ   0.020
 S89  plan-2  CAE   0.020
 S89  plan-2  CAF   0.020
 S89  plan-2  CBB   0.020
 S89  plan-2  HAE   0.020
 S89  plan-2  HAF   0.020
 S89  plan-3  CAW   0.020
 S89  plan-3  CBD   0.020
 S89  plan-3  CAU   0.020
 S89  plan-3  CAT   0.020
 S89  plan-3  CAO   0.020
 S89  plan-3  CAN   0.020
 S89  plan-3  CAI   0.020
 S89  plan-3  HAU   0.020
 S89  plan-3  HAT   0.020
 S89  plan-3  HAO   0.020
 S89  plan-3  HAN   0.020
 S89  plan-3  HAI   0.020
 S89  plan-4  CB    0.020
 S89  plan-4  CG    0.020
 S89  plan-4  CD1   0.020
 S89  plan-4  CD2   0.020
 S89  plan-4  CE1   0.020
 S89  plan-4  CE2   0.020
 S89  plan-4  CZ    0.020
 S89  plan-4  HD1   0.020
 S89  plan-4  HD2   0.020
 S89  plan-4  HE1   0.020
 S89  plan-4  HE2   0.020
 S89  plan-4  HZ    0.020
 S89  plan-5  CAZ   0.020
 S89  plan-5  OAB   0.020
 S89  plan-5  CAE   0.020
 S89  plan-5  NAY   0.020
 S89  plan-5  CBF   0.020
 S89  plan-5  HNAY  0.020
 S89  plan-6  CBF   0.020
 S89  plan-6  CBA   0.020
 S89  plan-6  OAC   0.020
 S89  plan-6  N     0.020
 S89  plan-6  CA    0.020
 S89  plan-6  HN    0.020

