# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Wed Mar  9 04:35:46 2022
#   Inital geometry file: a 158 line input string
#   Ligand name: 4-[8-(beta-alanyl)-8,9-dihydro-1H-dibenzo[b,f][1,2,3]triazolo[4,5-d]azocin-1-yl]-L-phenylalanine
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: NCCC(=O)N1Cc2ccccc2c3n(nnc3c4ccccc14)c5ccc(C[C@H](N)C(O)=O)cc5
#
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
 66C  66C  4-[8-(beta-alanyl)-8,9-dihydro-1H-dibenzo[b,f][1,2,3]triazolo[4,5-d]azocin-1-yl]-L-phenylalanine  L-peptide  61  36  .  2019-03-22  2022-09-22
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as GRAND (side chain)
;

data_comp_66C
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
 66C  OBE  O  O      0  -0.471  17.3129  123.7359  -1.2718
 66C  CBD  C  C      0   0.549  18.4531  123.8052  -1.6984
 66C  CF   C  CH2    0  -0.594  19.5994  124.2968  -0.8454
 66C  CH   C  CH2    0  -0.268  19.2343  124.4119   0.6270
 66C  NBH  N  NH2    0  -0.798  20.3611  124.9676   1.3617
 66C  CAT  C  CH2    0  -0.384  17.7421  122.8262  -3.8112
 66C  NAU  N  NT     0  -0.568  18.7571  123.4170  -2.9728
 66C  CAP  C  CR6    0   0.218  20.0149  123.6887  -3.5730
 66C  CAO  C  CR16   0  -0.249  20.9434  122.6738  -3.7519
 66C  CAN  C  CR16   0  -0.263  22.1720  122.9561  -4.3306
 66C  CAS  C  CR16   0  -0.236  22.4753  124.2552  -4.7186
 66C  CAR  C  CR16   0  -0.314  21.5459  125.2692  -4.5458
 66C  CAQ  C  CR6    0   0.103  20.3003  124.9906  -3.9917
 66C  CAY  C  CR5    0   0.030  19.2934  126.0223  -3.7690
 66C  N03  N  N      0  -0.292  19.5460  127.1787  -3.1195
 66C  N02  N  N      0  -0.099  18.4513  127.8344  -2.9762
 66C  CAV  C  CR6    0   0.061  17.0887  123.7092  -4.8529
 66C  CAZ  C  CR16   0  -0.277  16.3124  123.0194  -5.7871
 66C  CBA  C  CR16   0  -0.242  15.6040  123.6693  -6.7788
 66C  CBB  C  CR16   0  -0.252  15.6719  125.0537  -6.8699
 66C  CBC  C  CR16   0  -0.274  16.4463  125.7518  -5.9663
 66C  CAW  C  CR6    0   0.015  17.1511  125.1030  -4.9409
 66C  CAX  C  CR5    0   0.318  17.9482  125.9716  -4.0635
 66C  N01  N  NR5    0  -0.433  17.4772  127.1271  -3.5348
 66C  CZ   C  C      0   0.271  16.1310  127.5622  -3.4530
 66C  CE2  C  C1     0  -0.247  15.1799  126.7098  -2.9123
 66C  CD2  C  C1     0  -0.291  13.8547  127.1086  -2.8849
 66C  CE1  C  C1     0  -0.244  15.7772  128.8140  -3.9307
 66C  CD1  C  C1     0  -0.316  14.4470  129.2006  -3.8852
 66C  CG   C  C      0   0.135  13.4644  128.3504  -3.3821
 66C  CB   C  CH2    0  -0.514  12.0170  128.7365  -3.4311
 66C  CA   C  CH1    0  -0.155  11.3586  128.3618  -4.7689
 66C  N    N  NH2    0  -0.806   9.9754  128.8215  -4.7333
 66C  C    C  C      0   0.396  11.4316  126.8284  -4.9857
 66C  O    O  O      0  -0.604  10.7033  126.1257  -4.2574
 66C  H1   H  HCH2   0   0.266  20.4616  123.6343  -0.9667
 66C  H2   H  HCH2   0   0.276  19.9257  125.2779  -1.2026
 66C  H3   H  HCH2   0   0.224  18.3880  125.0909   0.7398
 66C  H4   H  HCH2   0   0.201  18.9035  123.4345   1.0011
 66C  H5   H  HNH2   0   0.348  20.0911  125.1095   2.3265
 66C  H6   H  HNH2   0   0.339  21.1146  124.2912   1.3889
 66C  H10  H  HCR6   0   0.268  20.7059  121.6695  -3.4240
 66C  H11  H  HCR6   0   0.265  22.8964  122.1646  -4.4691
 66C  H12  H  HCR6   0   0.264  23.4371  124.4776  -5.1613
 66C  H13  H  HCR6   0   0.260  21.7788  126.2795  -4.8570
 66C  H14  H  HCR6   0   0.258  16.2656  121.9381  -5.7241
 66C  H15  H  HCR6   0   0.262  15.0093  123.0999  -7.4809
 66C  H16  H  HCR6   0   0.261  15.1401  125.5837  -7.6487
 66C  H17  H  HCR6   0   0.266  16.5207  126.8271  -6.0638
 66C  H18  H  H      0   0.274  15.4727  125.7443  -2.5185
 66C  H19  H  H      0   0.252  13.1068  126.4368  -2.4832
 66C  H20  H  H      0   0.271  16.5285  129.4711  -4.3491
 66C  H21  H  H      0   0.255  14.1654  130.1752  -4.2655
 66C  H22  H  HCH2   0   0.239  11.9203  129.8163  -3.2825
 66C  H23  H  HCH2   0   0.236  11.4647  128.2508  -2.6239
 66C  H24  H  HCH1   0   0.181  11.9415  128.8421  -5.5688
 66C  H25  H  HNH2   0   0.334   9.9654  129.8348  -4.7211
 66C  H26  H  HNH2   0   0.337   9.5074  128.5585  -5.5919
 66C  O1   O  OC    -1  -0.606  12.2318  126.4288  -5.8545
 66C  H8   H  HCH2   0   0.285  16.9635  122.4184  -3.1669
 66C  H9   H  HCH2   0   0.278  18.1867  121.9724  -4.3281

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
 66C  CBB  CBA  aromatic  1.389  0.020  1.389
 66C  CBB  CBC  aromatic  1.380  0.020  1.380
 66C  CBA  CAZ  aromatic  1.381  0.020  1.381
 66C  CBC  CAW  aromatic  1.403  0.020  1.403
 66C  CAZ  CAV  aromatic  1.397  0.020  1.397
 66C  N    CA   single    1.458  0.019  1.458
 66C  CA   C    single    1.525  0.021  1.525
 66C  CA   CB   single    1.521  0.033  1.521
 66C  CAW  CAV  aromatic  1.398  0.020  1.398
 66C  CAW  CAX  aromatic  1.470  0.020  1.470
 66C  CAS  CAN  aromatic  1.389  0.020  1.389
 66C  CAS  CAR  aromatic  1.386  0.020  1.386
 66C  CAV  CAT  single    1.514  0.020  1.514
 66C  C    O    deloc     1.231  0.020  1.231
 66C  CAN  CAO  aromatic  1.387  0.020  1.387
 66C  CAR  CAQ  aromatic  1.391  0.020  1.391
 66C  CAX  CAY  aromatic  1.378  0.020  1.378
 66C  CAX  N01  aromatic  1.355  0.020  1.355
 66C  CAQ  CAP  aromatic  1.397  0.020  1.397
 66C  CAQ  CAY  aromatic  1.459  0.020  1.459
 66C  CAO  CAP  aromatic  1.387  0.020  1.387
 66C  CB   CG   single    1.499  0.020  1.499
 66C  CD1  CG   aromatic  1.393  0.020  1.393
 66C  CD1  CE1  aromatic  1.386  0.020  1.386
 66C  CAT  NAU  single    1.443  0.020  1.443
 66C  CG   CD2  aromatic  1.393  0.020  1.393
 66C  CAP  NAU  single    1.420  0.020  1.420
 66C  CE1  CZ   aromatic  1.386  0.020  1.386
 66C  CAY  N03  aromatic  1.350  0.020  1.350
 66C  CD2  CE2  aromatic  1.384  0.020  1.384
 66C  CZ   CE2  aromatic  1.387  0.020  1.387
 66C  CZ   N01  single    1.417  0.020  1.417
 66C  N01  N02  aromatic  1.327  0.020  1.327
 66C  NAU  CBD  single    1.367  0.020  1.367
 66C  N03  N02  aromatic  1.284  0.020  1.284
 66C  CBD  OBE  double    1.219  0.020  1.219
 66C  CBD  CF   single    1.511  0.020  1.511
 66C  CF   CH   single    1.521  0.020  1.521
 66C  CH   NBH  single    1.455  0.020  1.455
 66C  CF   H1   single    0.970  0.020  1.090
 66C  CF   H2   single    0.970  0.020  1.090
 66C  CH   H3   single    0.970  0.020  1.090
 66C  CH   H4   single    0.970  0.020  1.090
 66C  NBH  H5   single    0.890  0.020  1.040
 66C  NBH  H6   single    0.890  0.020  1.040
 66C  CAT  H8   single    0.970  0.020  1.090
 66C  CAT  H9   single    0.970  0.020  1.090
 66C  CAO  H10  single    0.930  0.020  1.080
 66C  CAN  H11  single    0.930  0.020  1.080
 66C  CAS  H12  single    0.930  0.020  1.080
 66C  CAR  H13  single    0.930  0.020  1.080
 66C  CAZ  H14  single    0.930  0.020  1.080
 66C  CBA  H15  single    0.930  0.020  1.080
 66C  CBB  H16  single    0.930  0.020  1.080
 66C  CBC  H17  single    0.930  0.020  1.080
 66C  CE2  H18  single    0.930  0.020  1.080
 66C  CD2  H19  single    0.930  0.020  1.080
 66C  CE1  H20  single    0.930  0.020  1.080
 66C  CD1  H21  single    0.930  0.020  1.080
 66C  CB   H22  single    0.970  0.020  1.090
 66C  CB   H23  single    0.970  0.020  1.090
 66C  CA   H24  single    0.970  0.020  1.090
 66C  N    H25  single    0.890  0.020  1.040
 66C  N    H26  single    0.890  0.020  1.040
 66C  C    O1   deloc     1.247  0.020  1.247

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
 66C  NAU  CBD  CF   116.75  3.000
 66C  CF   CBD  OBE  122.03  3.000
 66C  NAU  CBD  OBE  121.20  3.000
 66C  H2   CF   H1   105.77  3.000
 66C  H2   CF   CH   108.65  3.000
 66C  H1   CF   CH   110.01  3.000
 66C  H2   CF   CBD  109.50  3.000
 66C  H1   CF   CBD  109.77  3.000
 66C  CH   CF   CBD  112.89  3.000
 66C  H4   CH   H3   106.57  3.000
 66C  H4   CH   NBH  113.66  3.000
 66C  H3   CH   NBH  108.11  3.000
 66C  H4   CH   CF   109.56  3.000
 66C  H3   CH   CF   109.47  3.000
 66C  NBH  CH   CF   109.37  3.000
 66C  H6   NBH  H5   105.46  3.000
 66C  H6   NBH  CH   109.54  3.000
 66C  H5   NBH  CH   109.16  3.000
 66C  H9   CAT  H8   106.13  3.000
 66C  H9   CAT  CAV  107.81  3.000
 66C  H8   CAT  CAV  108.46  3.000
 66C  H9   CAT  NAU  107.98  3.000
 66C  H8   CAT  NAU  108.19  3.000
 66C  CAV  CAT  NAU  117.69  3.000
 66C  CAP  NAU  CAT  117.12  3.000
 66C  CAP  NAU  CBD  122.47  3.000
 66C  CAT  NAU  CBD  120.12  3.000
 66C  CAQ  CAP  CAO  120.42  3.000
 66C  CAO  CAP  NAU  120.50  3.000
 66C  CAQ  CAP  NAU  119.07  3.000
 66C  H10  CAO  CAN  120.63  3.000
 66C  H10  CAO  CAP  119.51  3.000
 66C  CAN  CAO  CAP  119.85  3.000
 66C  H11  CAN  CAS  120.15  3.000
 66C  H11  CAN  CAO  119.84  3.000
 66C  CAS  CAN  CAO  120.01  3.000
 66C  H12  CAS  CAR  119.77  3.000
 66C  H12  CAS  CAN  120.04  3.000
 66C  CAR  CAS  CAN  120.19  3.000
 66C  H13  CAR  CAQ  119.60  3.000
 66C  H13  CAR  CAS  120.18  3.000
 66C  CAQ  CAR  CAS  120.21  3.000
 66C  CAY  CAQ  CAR  122.48  3.000
 66C  CAY  CAQ  CAP  118.19  3.000
 66C  CAR  CAQ  CAP  119.27  3.000
 66C  CAX  CAY  N03  108.48  3.000
 66C  N03  CAY  CAQ  123.37  3.000
 66C  CAX  CAY  CAQ  127.97  3.000
 66C  N02  N03  CAY  109.36  3.000
 66C  N01  N02  N03  107.85  3.000
 66C  CAW  CAV  CAZ  118.36  3.000
 66C  CAW  CAV  CAT  127.27  3.000
 66C  CAZ  CAV  CAT  114.33  3.000
 66C  H14  CAZ  CBA  119.27  3.000
 66C  H14  CAZ  CAV  118.53  3.000
 66C  CBA  CAZ  CAV  122.20  3.000
 66C  H15  CBA  CBB  120.58  3.000
 66C  H15  CBA  CAZ  120.01  3.000
 66C  CBB  CBA  CAZ  119.41  3.000
 66C  H16  CBB  CBC  119.97  3.000
 66C  H16  CBB  CBA  120.77  3.000
 66C  CBC  CBB  CBA  119.26  3.000
 66C  H17  CBC  CAW  119.38  3.000
 66C  H17  CBC  CBB  118.84  3.000
 66C  CAW  CBC  CBB  121.77  3.000
 66C  CAX  CAW  CBC  115.81  3.000
 66C  CAX  CAW  CAV  125.16  3.000
 66C  CBC  CAW  CAV  118.98  3.000
 66C  N01  CAX  CAW  123.25  3.000
 66C  N01  CAX  CAY  102.97  3.000
 66C  CAW  CAX  CAY  132.76  3.000
 66C  CZ   N01  CAX  127.91  3.000
 66C  CZ   N01  N02  120.62  3.000
 66C  CAX  N01  N02  111.32  3.000
 66C  CE1  CZ   CE2  120.97  3.000
 66C  CE2  CZ   N01  119.03  3.000
 66C  CE1  CZ   N01  120.00  3.000
 66C  H18  CE2  CD2  120.56  3.000
 66C  H18  CE2  CZ   120.28  3.000
 66C  CD2  CE2  CZ   119.16  3.000
 66C  H19  CD2  CG   119.47  3.000
 66C  H19  CD2  CE2  119.34  3.000
 66C  CG   CD2  CE2  121.19  3.000
 66C  H20  CE1  CD1  120.64  3.000
 66C  H20  CE1  CZ   120.30  3.000
 66C  CD1  CE1  CZ   119.05  3.000
 66C  H21  CD1  CG   119.50  3.000
 66C  H21  CD1  CE1  119.26  3.000
 66C  CG   CD1  CE1  121.23  3.000
 66C  CB   CG   CD1  120.80  3.000
 66C  CD1  CG   CD2  118.37  3.000
 66C  CB   CG   CD2  120.78  3.000
 66C  H23  CB   H22  107.09  3.000
 66C  H23  CB   CA   108.55  3.000
 66C  H22  CB   CA   108.71  3.000
 66C  H23  CB   CG   110.47  3.000
 66C  H22  CB   CG   109.58  3.000
 66C  CA   CB   CG   112.29  3.000
 66C  H24  CA   C    107.77  3.000
 66C  H24  CA   N    112.51  3.000
 66C  C    CA   N    111.00  2.800
 66C  H24  CA   CB   107.42  3.000
 66C  C    CA   CB   110.50  1.500
 66C  N    CA   CB   110.40  1.500
 66C  H26  N    H25  105.38  3.000
 66C  H26  N    CA   109.63  3.000
 66C  H25  N    CA   108.96  3.000
 66C  O1   C    O    126.96  3.000
 66C  O1   C    CA   116.40  3.000
 66C  O    C    CA   120.80  1.700

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
 66C  CONST_01  CAS  CAR  CAQ  CAP     0.00   0.0  0
 66C  CONST_04  CAS  CAN  CAO  CAP     0.00   0.0  0
 66C  CONST_05  CAR  CAS  CAN  CAO     0.00   0.0  0
 66C  CONST_06  CAR  CAQ  CAP  CAO     0.00   0.0  0
 66C  CONST_07  CAY  CAQ  CAP  CAO   180.00   0.0  0
 66C  CONST_08  CAQ  CAR  CAS  CAN     0.00   0.0  0
 66C  CONST_09  CAQ  CAP  CAO  CAN     0.00   0.0  0
 66C  CONST_10  CAY  CAQ  CAR  CAS   180.00   0.0  0
 66C  CONST_14  N01  CAX  CAY  CAQ   180.00   0.0  0
 66C  CONST_15  N02  N03  CAY  CAQ   180.00   0.0  0
 66C  CONST_18  CZ   N01  CAX  CAY   180.00   0.0  0
 66C  CONST_19  N02  N01  CAX  CAY     0.00   0.0  0
 66C  CONST_20  N01  N02  N03  CAY     0.00   0.0  0
 66C  CONST_21  CAW  CAX  CAY  N03   180.00   0.0  0
 66C  CONST_22  N01  CAX  CAY  N03     0.00   0.0  0
 66C  CONST_23  CAX  N01  N02  N03     0.00   0.0  0
 66C  CONST_24  CZ   N01  N02  N03   180.00   0.0  0
 66C  CONST_25  CAW  CAX  N01  N02   180.00   0.0  0
 66C  CONST_28  CAX  CAY  N03  N02     0.00   0.0  0
 66C  CONST_29  CBB  CBA  CAZ  CAV     0.00   0.0  0
 66C  CONST_30  CBB  CBC  CAW  CAV     0.00   0.0  0
 66C  CONST_32  CBC  CBB  CBA  CAZ     0.00   0.0  0
 66C  CONST_33  CBC  CAW  CAV  CAZ     0.00   0.0  0
 66C  CONST_34  CAX  CAW  CAV  CAZ   180.00   0.0  0
 66C  CONST_35  CAW  CBC  CBB  CBA     0.00   0.0  0
 66C  CONST_36  CAW  CAV  CAZ  CBA     0.00   0.0  0
 66C  CONST_37  CAX  CAW  CBC  CBB   180.00   0.0  0
 66C  CONST_42  CD1  CE1  CZ   N01   180.00   0.0  0
 66C  CONST_43  CD2  CE2  CZ   N01   180.00   0.0  0
 66C  CONST_44  CG   CD1  CE1  CZ      0.00   0.0  0
 66C  CONST_45  CG   CD2  CE2  CZ      0.00   0.0  0
 66C  CONST_46  CD1  CG   CD2  CE2     0.00   0.0  0
 66C  CONST_47  CD1  CE1  CZ   CE2     0.00   0.0  0
 66C  CONST_48  CE1  CD1  CG   CD2     0.00   0.0  0
 66C  CONST_49  CE1  CZ   CE2  CD2     0.00   0.0  0
 66C  CONST_50  CB   CG   CD2  CE2   180.00   0.0  0
 66C  CONST_51  CB   CG   CD1  CE1   180.00   0.0  0
 66C  CONST_52  H14  CAZ  CAV  CAT     0.00   0.0  0
 66C  CONST_53  H10  CAO  CAP  NAU     0.00   0.0  0
 66C  CONST_54  H13  CAR  CAQ  CAP   180.00   0.0  0
 66C  CONST_55  H11  CAN  CAO  CAP   180.00   0.0  0
 66C  CONST_56  H12  CAS  CAN  CAO   180.00   0.0  0
 66C  CONST_57  H15  CBA  CAZ  CAV   180.00   0.0  0
 66C  CONST_58  H17  CBC  CAW  CAV   180.00   0.0  0
 66C  CONST_59  H16  CBB  CBA  CAZ   180.00   0.0  0
 66C  CONST_60  H20  CE1  CZ   N01     0.00   0.0  0
 66C  CONST_61  H18  CE2  CZ   N01     0.00   0.0  0
 66C  CONST_62  H21  CD1  CE1  CZ    180.00   0.0  0
 66C  CONST_63  H19  CD2  CE2  CZ    180.00   0.0  0
 66C  CONST_64  CAT  NAU  CBD  OBE     0.00   0.0  0
 66C  CONST_65  CAP  NAU  CBD  OBE   180.00   0.0  0
 66C  CONST_66  CAT  NAU  CBD  CF    180.00   0.0  0
 66C  CONST_67  CAP  NAU  CBD  CF      0.00   0.0  0
 66C  Var_01    CAQ  CAP  NAU  CAT    99.59  30.0  1
 66C  Var_02    CAZ  CAV  CAT  NAU   168.36  30.0  1
 66C  Var_03    CAV  CAT  NAU  CAP   -72.89  30.0  1
 66C  Var_04    CA   CB   CG   CD2   -91.38  30.0  2
 66C  Var_05    NAU  CBD  CF   CH   -167.27  30.0  1
 66C  Var_06    NBH  CH   CF   CBD  -176.50  30.0  3
 66C  Var_07    H5   NBH  CH   CF    175.67  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
 66C  chir_01  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
 66C  plan-1  N01  0.020
 66C  plan-1  CZ   0.020
 66C  plan-1  CE2  0.020
 66C  plan-1  CD2  0.020
 66C  plan-1  CE1  0.020
 66C  plan-1  CD1  0.020
 66C  plan-1  CG   0.020
 66C  plan-1  CB   0.020
 66C  plan-1  H18  0.020
 66C  plan-1  H19  0.020
 66C  plan-1  H20  0.020
 66C  plan-1  H21  0.020
 66C  plan-2  CAQ  0.020
 66C  plan-2  CAY  0.020
 66C  plan-2  N03  0.020
 66C  plan-2  N02  0.020
 66C  plan-2  CAW  0.020
 66C  plan-2  CAX  0.020
 66C  plan-2  N01  0.020
 66C  plan-2  CZ   0.020
 66C  plan-3  NAU  0.020
 66C  plan-3  CAP  0.020
 66C  plan-3  CAO  0.020
 66C  plan-3  CAN  0.020
 66C  plan-3  CAS  0.020
 66C  plan-3  CAR  0.020
 66C  plan-3  CAQ  0.020
 66C  plan-3  CAY  0.020
 66C  plan-3  H10  0.020
 66C  plan-3  H11  0.020
 66C  plan-3  H12  0.020
 66C  plan-3  H13  0.020
 66C  plan-4  CAT  0.020
 66C  plan-4  CAV  0.020
 66C  plan-4  CAZ  0.020
 66C  plan-4  CBA  0.020
 66C  plan-4  CBB  0.020
 66C  plan-4  CBC  0.020
 66C  plan-4  CAW  0.020
 66C  plan-4  CAX  0.020
 66C  plan-4  H14  0.020
 66C  plan-4  H15  0.020
 66C  plan-4  H16  0.020
 66C  plan-4  H17  0.020
 66C  plan-5  OBE  0.020
 66C  plan-5  CBD  0.020
 66C  plan-5  CF   0.020
 66C  plan-5  CAT  0.020
 66C  plan-5  NAU  0.020
 66C  plan-5  CAP  0.020
 66C  plan-6  CA   0.020
 66C  plan-6  C    0.020
 66C  plan-6  O    0.020
 66C  plan-6  O1   0.020

