# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sun Apr  5 21:49:55 2020
#   Inital geometry file: a 160 line input string
#   Ligand name: N-{(2S)-1-[4-(4-fluorophenyl)-3,6-dihydropyridin-1(2H)-yl]-1-oxopropan-2-yl}-2-[(9aR)-7-oxo-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridin-1-yl]acetamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: C[C@H](NC(=O)CN1CCc2cccc3C(=O)NC[C@H]1c23)C(=O)N4CCC(=CC4)c5ccc(F)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
 15S  15S  N-{(2S)-1-[4-(4-fluorophenyl)-3,6-dihydropyridin-1(2H)-yl]-1-oxopropan-2-yl}-2-[(9aR)-7-oxo-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridin-1-yl]acetamide  ligand  64  35  .  2021-08-03  2021-08-03  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_15S
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
 15S  OAC  O  O     0  -0.478  -8.9165  -1.0449  -0.8945
 15S  CAX  C  C     0   0.513  -7.7849  -0.7623  -0.5243
 15S  NAU  N  NH1   0  -0.637  -6.8599  -1.6920  -0.2308
 15S  CAS  C  CH2   0  -0.252  -5.5623  -1.3883   0.3314
 15S  CBG  C  CH1   0  -0.097  -4.9741  -0.1881  -0.4030
 15S  CBE  C  CR6   0   0.065  -5.9655   0.9439  -0.2462
 15S  CBD  C  CR6   0  -0.052  -7.3287   0.6442  -0.3491
 15S  CAI  C  CR16  0  -0.284  -8.2805   1.6511  -0.2638
 15S  CAG  C  CR16  0  -0.226  -7.8787   2.9608  -0.0541
 15S  CAH  C  CR16  0  -0.282  -6.5311   3.2539   0.0747
 15S  CBC  C  CR6   0   0.066  -5.5639   2.2557  -0.0193
 15S  CAP  C  CH2   0  -0.485  -4.1071   2.5686   0.1486
 15S  CAR  C  CH2   0  -0.299  -3.2441   1.4682  -0.4282
 15S  NBI  N  NT    0  -0.432  -3.6569   0.1721   0.0908
 15S  CAT  C  CH2   0  -0.397  -2.6696  -0.8330  -0.2071
 15S  CAW  C  C     0   0.543  -1.4191  -0.7032   0.6524
 15S  OAB  O  O     0  -0.475  -1.3900  -0.0963   1.7083
 15S  N    N  NH1   0  -0.644  -0.3639  -1.3647   0.1487
 15S  CA   C  CH1   0  -0.196   0.8879  -1.5167   0.8448
 15S  CB   C  CH3   0  -0.631   0.7985  -2.5660   1.9571
 15S  C    C  C     0   0.579   1.9312  -1.9435  -0.1909
 15S  O    O  O     0  -0.503   1.5576  -2.3968  -1.2650
 15S  NBH  N  NT    0  -0.467   3.2314  -1.8548   0.1445
 15S  CAQ  C  CH2   0  -0.300   3.7539  -1.3089   1.3790
 15S  CAO  C  C1    0  -0.278   5.0017  -0.5134   1.1576
 15S  CAN  C  CH2   0  -0.314   4.2596  -2.3511  -0.7538
 15S  CAF  C  CH2   0  -0.484   5.1726  -1.2196  -1.1901
 15S  CAY  C  C     0   0.114   5.6612  -0.4394   0.0008
 15S  CBB  C  CR6   0   0.105   6.8739   0.3869  -0.1539
 15S  CAL  C  CR16  0  -0.282   7.7655   0.5801   0.9029
 15S  CAJ  C  CR16  0  -0.425   8.8942   1.3703   0.7603
 15S  CBA  C  CR6   0   0.538   9.1362   1.9687  -0.4613
 15S  FAE  F  F     0  -0.306  10.2302   2.7311  -0.6079
 15S  CAK  C  CR16  0  -0.374   8.2883   1.7943  -1.5364
 15S  CAM  C  CR16  0  -0.271   7.1658   0.9980  -1.3744
 15S  H3   H  HNH1  0   0.380  -7.1450  -2.6572  -0.2802
 15S  H5   H  HCH2  0   0.243  -5.6237  -1.1697   1.4025
 15S  H6   H  HCH2  0   0.244  -4.9513  -2.2804   0.2123
 15S  H7   H  HCH1  0   0.223  -4.9341  -0.4470  -1.4787
 15S  H8   H  HCR6  0   0.245  -9.3310   1.4085  -0.3510
 15S  H9   H  HCR6  0   0.240  -8.6151   3.7500   0.0147
 15S  H10  H  HCR6  0   0.233  -6.2191   4.2765   0.2511
 15S  H11  H  HCH2  0   0.240  -3.8614   3.5182  -0.3307
 15S  H12  H  HCH2  0   0.250  -3.8813   2.6867   1.2122
 15S  H13  H  HCH2  0   0.202  -3.2935   1.4905  -1.5296
 15S  H14  H  HCH2  0   0.252  -2.2054   1.6491  -0.1552
 15S  H16  H  HCH2  0   0.271  -3.0639  -1.8283   0.0070
 15S  H17  H  HCH2  0   0.218  -2.3883  -0.8479  -1.2738
 15S  H18  H  HNH1  0   0.381  -0.4438  -1.8529  -0.7305
 15S  H19  H  HCH1  0   0.263   1.1518  -0.5490   1.2767
 15S  H20  H  HCH3  0   0.238   1.7344  -2.6632   2.5047
 15S  H21  H  HCH3  0   0.251   0.0283  -2.2872   2.6731
 15S  H22  H  HCH3  0   0.228   0.5470  -3.5422   1.5433
 15S  H23  H  HCH2  0   0.257   3.0233  -0.6588   1.8582
 15S  H24  H  HCH2  0   0.251   3.9606  -2.1118   2.0987
 15S  H25  H  H     0   0.239   5.3393   0.0389   2.0265
 15S  H27  H  HCH2  0   0.251   4.8442  -3.1114  -0.2272
 15S  H28  H  HCH2  0   0.265   3.7954  -2.8288  -1.6102
 15S  H29  H  HCH2  0   0.250   6.0202  -1.6420  -1.7344
 15S  H30  H  HCH2  0   0.237   4.6475  -0.5676  -1.8953
 15S  H32  H  HCR6  0   0.244   7.5939   0.0894   1.8521
 15S  H33  H  HCR6  0   0.271   9.5803   1.5083   1.5847
 15S  H34  H  HCR6  0   0.248   8.4954   2.2740  -2.4830
 15S  H35  H  HCR6  0   0.233   6.5012   0.8699  -2.2185

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
 15S  CAK  CAM  aromatic  1.386  0.020  1.386
 15S  CAK  CBA  aromatic  1.380  0.020  1.380
 15S  FAE  CBA  single    1.341  0.020  1.341
 15S  CAM  CBB  aromatic  1.396  0.020  1.396
 15S  CBA  CAJ  aromatic  1.382  0.020  1.382
 15S  CBB  CAY  single    1.476  0.020  1.476
 15S  CBB  CAL  aromatic  1.396  0.020  1.396
 15S  CAJ  CAL  aromatic  1.385  0.020  1.385
 15S  CAY  CAO  double    1.334  0.020  1.334
 15S  CAY  CAF  single    1.505  0.020  1.505
 15S  CAO  CAQ  single    1.496  0.020  1.496
 15S  CAF  CAN  single    1.518  0.020  1.518
 15S  CAQ  NBH  single    1.447  0.020  1.447
 15S  OAB  CAW  double    1.218  0.020  1.218
 15S  CAN  NBH  single    1.453  0.020  1.453
 15S  NBH  C    single    1.346  0.020  1.346
 15S  O    C    double    1.224  0.020  1.224
 15S  C    CA   single    1.531  0.020  1.531
 15S  CAW  CAT  single    1.523  0.020  1.523
 15S  CAW  N    single    1.343  0.020  1.343
 15S  CA   N    single    1.440  0.020  1.440
 15S  CA   CB   single    1.532  0.020  1.532
 15S  CAT  NBI  single    1.440  0.020  1.440
 15S  CAS  NAU  single    1.446  0.020  1.446
 15S  CAS  CBG  single    1.525  0.020  1.525
 15S  NAU  CAX  single    1.344  0.020  1.344
 15S  NBI  CBG  single    1.452  0.020  1.452
 15S  NBI  CAR  single    1.456  0.020  1.456
 15S  CBG  CBE  single    1.513  0.020  1.513
 15S  CAX  OAC  double    1.224  0.020  1.224
 15S  CAX  CBD  single    1.489  0.020  1.489
 15S  CAR  CAP  single    1.513  0.020  1.513
 15S  CBE  CBD  aromatic  1.400  0.020  1.400
 15S  CBE  CBC  aromatic  1.391  0.020  1.391
 15S  CBD  CAI  aromatic  1.388  0.020  1.388
 15S  CAP  CBC  single    1.499  0.020  1.499
 15S  CBC  CAH  aromatic  1.393  0.020  1.393
 15S  CAI  CAG  aromatic  1.386  0.020  1.386
 15S  CAH  CAG  aromatic  1.385  0.020  1.385
 15S  NAU  H3   single    0.860  0.020  1.020
 15S  CAS  H5   single    0.970  0.020  1.090
 15S  CAS  H6   single    0.970  0.020  1.090
 15S  CBG  H7   single    0.970  0.020  1.090
 15S  CAI  H8   single    0.930  0.020  1.080
 15S  CAG  H9   single    0.930  0.020  1.080
 15S  CAH  H10  single    0.930  0.020  1.080
 15S  CAP  H11  single    0.970  0.020  1.090
 15S  CAP  H12  single    0.970  0.020  1.090
 15S  CAR  H13  single    0.970  0.020  1.090
 15S  CAR  H14  single    0.970  0.020  1.090
 15S  CAT  H16  single    0.970  0.020  1.090
 15S  CAT  H17  single    0.970  0.020  1.090
 15S  N    H18  single    0.860  0.020  1.020
 15S  CA   H19  single    0.970  0.020  1.090
 15S  CB   H20  single    0.970  0.020  1.090
 15S  CB   H21  single    0.970  0.020  1.090
 15S  CB   H22  single    0.970  0.020  1.090
 15S  CAQ  H23  single    0.970  0.020  1.090
 15S  CAQ  H24  single    0.970  0.020  1.090
 15S  CAO  H25  single    0.930  0.020  1.080
 15S  CAN  H27  single    0.970  0.020  1.090
 15S  CAN  H28  single    0.970  0.020  1.090
 15S  CAF  H29  single    0.970  0.020  1.090
 15S  CAF  H30  single    0.970  0.020  1.090
 15S  CAL  H32  single    0.930  0.020  1.080
 15S  CAJ  H33  single    0.930  0.020  1.080
 15S  CAK  H34  single    0.930  0.020  1.080
 15S  CAM  H35  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
 15S  CBD  CAX  NAU  114.64  3.000
 15S  CBD  CAX  OAC  122.48  3.000
 15S  NAU  CAX  OAC  122.88  3.000
 15S  H3   NAU  CAS  118.30  3.000
 15S  H3   NAU  CAX  117.21  3.000
 15S  CAS  NAU  CAX  123.86  3.000
 15S  H6   CAS  H5   107.60  3.000
 15S  H6   CAS  CBG  112.09  3.000
 15S  H5   CAS  CBG  109.61  3.000
 15S  H6   CAS  NAU  106.80  3.000
 15S  H5   CAS  NAU  111.83  3.000
 15S  CBG  CAS  NAU  108.91  3.000
 15S  H7   CBG  NBI  110.84  3.000
 15S  H7   CBG  CBE  107.41  3.000
 15S  NBI  CBG  CBE  111.94  3.000
 15S  H7   CBG  CAS  107.33  3.000
 15S  CBE  CBG  CAS  106.63  3.000
 15S  NBI  CBG  CAS  112.42  3.000
 15S  CBC  CBE  CBD  119.69  3.000
 15S  CBC  CBE  CBG  122.24  3.000
 15S  CBD  CBE  CBG  118.06  3.000
 15S  CAI  CBD  CBE  120.53  3.000
 15S  CAI  CBD  CAX  118.83  3.000
 15S  CBE  CBD  CAX  120.62  3.000
 15S  H8   CAI  CAG  120.38  3.000
 15S  H8   CAI  CBD  119.89  3.000
 15S  CAG  CAI  CBD  119.73  3.000
 15S  H9   CAG  CAH  120.14  3.000
 15S  H9   CAG  CAI  120.12  3.000
 15S  CAH  CAG  CAI  119.74  3.000
 15S  H10  CAH  CBC  119.17  3.000
 15S  H10  CAH  CAG  119.66  3.000
 15S  CBC  CAH  CAG  121.17  3.000
 15S  CAP  CBC  CAH  121.16  3.000
 15S  CAH  CBC  CBE  119.11  3.000
 15S  CAP  CBC  CBE  119.72  3.000
 15S  H12  CAP  H11  106.65  3.000
 15S  H12  CAP  CAR  109.36  3.000
 15S  H11  CAP  CAR  109.69  3.000
 15S  H12  CAP  CBC  109.40  3.000
 15S  H11  CAP  CBC  110.55  3.000
 15S  CAR  CAP  CBC  111.09  3.000
 15S  H14  CAR  H13  106.84  3.000
 15S  H14  CAR  NBI  109.21  3.000
 15S  H13  CAR  NBI  111.18  3.000
 15S  H14  CAR  CAP  109.13  3.000
 15S  H13  CAR  CAP  109.91  3.000
 15S  NBI  CAR  CAP  110.48  3.000
 15S  CAT  NBI  CAR  110.68  3.000
 15S  CAR  NBI  CBG  110.91  3.000
 15S  CAT  NBI  CBG  112.24  3.000
 15S  H17  CAT  H16  105.63  3.000
 15S  H17  CAT  CAW  109.72  3.000
 15S  H16  CAT  CAW  105.28  3.000
 15S  H17  CAT  NBI  112.60  3.000
 15S  H16  CAT  NBI  110.38  3.000
 15S  CAW  CAT  NBI  112.75  3.000
 15S  N    CAW  OAB  123.47  3.000
 15S  N    CAW  CAT  113.04  3.000
 15S  OAB  CAW  CAT  123.45  3.000
 15S  H18  N    CA   116.04  3.000
 15S  H18  N    CAW  120.19  3.000
 15S  CA   N    CAW  123.60  3.000
 15S  H19  CA   C    110.49  3.000
 15S  H19  CA   CB   109.51  3.000
 15S  C    CA   CB   109.88  3.000
 15S  H19  CA   N    107.92  3.000
 15S  CB   CA   N    111.87  3.000
 15S  C    CA   N    107.14  3.000
 15S  H22  CB   H21  108.42  3.000
 15S  H22  CB   H20  108.03  3.000
 15S  H21  CB   H20  107.48  3.000
 15S  H22  CB   CA   110.58  3.000
 15S  H21  CB   CA   110.10  3.000
 15S  H20  CB   CA   112.10  3.000
 15S  NBH  C    O    122.54  3.000
 15S  O    C    CA   119.27  3.000
 15S  NBH  C    CA   118.13  3.000
 15S  CAN  NBH  CAQ  113.62  3.000
 15S  CAN  NBH  C    120.48  3.000
 15S  CAQ  NBH  C    125.89  3.000
 15S  H24  CAQ  H23  105.93  3.000
 15S  H24  CAQ  CAO  109.19  3.000
 15S  H23  CAQ  CAO  107.89  3.000
 15S  H24  CAQ  NBH  110.56  3.000
 15S  H23  CAQ  NBH  110.99  3.000
 15S  CAO  CAQ  NBH  112.04  3.000
 15S  H25  CAO  CAY  120.88  3.000
 15S  H25  CAO  CAQ  114.34  3.000
 15S  CAY  CAO  CAQ  124.77  3.000
 15S  H28  CAN  H27  107.61  3.000
 15S  H28  CAN  CAF  111.01  3.000
 15S  H27  CAN  CAF  109.57  3.000
 15S  H28  CAN  NBH  109.62  3.000
 15S  H27  CAN  NBH  108.55  3.000
 15S  CAF  CAN  NBH  110.41  3.000
 15S  H30  CAF  H29  106.36  3.000
 15S  H30  CAF  CAY  110.90  3.000
 15S  H29  CAF  CAY  110.04  3.000
 15S  H30  CAF  CAN  109.92  3.000
 15S  H29  CAF  CAN  108.77  3.000
 15S  CAY  CAF  CAN  110.74  3.000
 15S  CBB  CAY  CAF  118.30  3.000
 15S  CAF  CAY  CAO  119.80  3.000
 15S  CBB  CAY  CAO  121.90  3.000
 15S  CAM  CBB  CAL  117.89  3.000
 15S  CAL  CBB  CAY  121.53  3.000
 15S  CAM  CBB  CAY  120.58  3.000
 15S  H32  CAL  CAJ  118.56  3.000
 15S  H32  CAL  CBB  120.00  3.000
 15S  CAJ  CAL  CBB  121.42  3.000
 15S  H33  CAJ  CBA  120.51  3.000
 15S  H33  CAJ  CAL  120.75  3.000
 15S  CBA  CAJ  CAL  118.74  3.000
 15S  CAK  CBA  FAE  119.19  3.000
 15S  FAE  CBA  CAJ  119.06  3.000
 15S  CAK  CBA  CAJ  121.75  3.000
 15S  H34  CAK  CAM  120.83  3.000
 15S  H34  CAK  CBA  120.54  3.000
 15S  CAM  CAK  CBA  118.63  3.000
 15S  H35  CAM  CAK  118.32  3.000
 15S  H35  CAM  CBB  120.12  3.000
 15S  CAK  CAM  CBB  121.55  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
 15S  CONST_01  CAG  CAI  CBD  CBE     0.00   0.0  0
 15S  CONST_02  CAG  CAH  CBC  CBE     0.00   0.0  0
 15S  CONST_03  CAH  CBC  CBE  CBD     0.00   0.0  0
 15S  CONST_04  CAH  CAG  CAI  CBD     0.00   0.0  0
 15S  CONST_05  CBC  CBE  CBD  CAI     0.00   0.0  0
 15S  CONST_06  CBC  CAH  CAG  CAI     0.00   0.0  0
 15S  CONST_07  CBA  CAK  CAM  CBB     0.00   0.0  0
 15S  CONST_08  CBA  CAJ  CAL  CBB     0.00   0.0  0
 15S  CONST_09  CAK  CAM  CBB  CAL     0.00   0.0  0
 15S  CONST_10  CAK  CBA  CAJ  CAL     0.00   0.0  0
 15S  CONST_11  CAM  CAK  CBA  CAJ     0.00   0.0  0
 15S  CONST_12  CAM  CBB  CAL  CAJ     0.00   0.0  0
 15S  CONST_13  CAK  CAM  CBB  CAY   180.00   0.0  0
 15S  CONST_14  CAJ  CAL  CBB  CAY   180.00   0.0  0
 15S  CONST_15  CBD  CAX  NAU  CAS     0.00   0.0  0
 15S  CONST_16  FAE  CBA  CAJ  CAL   180.00   0.0  0
 15S  CONST_17  CAM  CAK  CBA  FAE   180.00   0.0  0
 15S  CONST_18  CAS  NAU  CAX  OAC   180.00   0.0  0
 15S  CONST_19  H8   CAI  CBD  CAX     0.00   0.0  0
 15S  CONST_20  H10  CAH  CBC  CBE   180.00   0.0  0
 15S  CONST_21  H9   CAG  CAI  CBD   180.00   0.0  0
 15S  CONST_22  H35  CAM  CBB  CAY     0.00   0.0  0
 15S  CONST_23  H32  CAL  CBB  CAY     0.00   0.0  0
 15S  CONST_24  H34  CAK  CAM  CBB   180.00   0.0  0
 15S  CONST_25  H33  CAJ  CAL  CBB   180.00   0.0  0
 15S  CONST_26  H3   NAU  CAX  CBD   180.00   0.0  0
 15S  CONST_27  CAQ  NBH  C    CA      0.00   0.0  0
 15S  CONST_28  CAN  NBH  C    CA    180.00   0.0  0
 15S  CONST_29  CAQ  NBH  C    O     180.00   0.0  0
 15S  CONST_30  CAN  NBH  C    O       0.00   0.0  0
 15S  CONST_31  CA   N    CAW  CAT   180.00   0.0  0
 15S  CONST_32  CA   N    CAW  OAB     0.00   0.0  0
 15S  CONST_33  H18  N    CAW  CAT     0.00   0.0  0
 15S  Var_01    CBG  CAS  NAU  CAX   -44.05  30.0  1
 15S  Var_02    CBE  CBD  CAX  NAU    16.32  30.0  1
 15S  Var_03    CAP  CAR  NBI  CBG    67.68  30.0  1
 15S  Var_04    CAR  CAP  CBC  CBE    19.88  30.0  1
 15S  Var_05    NBI  CAR  CAP  CBC   -51.24  30.0  1
 15S  Var_06    CAY  CAO  CAQ  NBH    -7.78  30.0  1
 15S  Var_07    CAY  CAF  CAN  NBH    50.28  30.0  1
 15S  Var_08    CBB  CAY  CAO  CAQ   178.80  30.0  1
 15S  Var_09    CAF  CAN  NBH  CAQ   -62.77  30.0  1
 15S  Var_10    CAM  CBB  CAY  CAO  -147.63  30.0  3
 15S  Var_11    CAN  CAF  CAY  CAO   -19.68  30.0  1
 15S  Var_12    CAN  NBH  CAQ  CAO    40.00  30.0  1
 15S  Var_13    CAW  CAT  NBI  CBG  -161.94  30.0  2
 15S  Var_14    OAB  CAW  CAT  NBI    19.84  30.0  1

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
 15S  chir_01  CBG  CAS  NBI  CBE  positiv
 15S  chir_02  CA   N    CB   C    negativ

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
 15S  plan-1  CAY  0.020
 15S  plan-1  CBB  0.020
 15S  plan-1  CAL  0.020
 15S  plan-1  CAJ  0.020
 15S  plan-1  CBA  0.020
 15S  plan-1  FAE  0.020
 15S  plan-1  CAK  0.020
 15S  plan-1  CAM  0.020
 15S  plan-1  H32  0.020
 15S  plan-1  H33  0.020
 15S  plan-1  H34  0.020
 15S  plan-1  H35  0.020
 15S  plan-2  CAX  0.020
 15S  plan-2  CBG  0.020
 15S  plan-2  CBE  0.020
 15S  plan-2  CBD  0.020
 15S  plan-2  CAI  0.020
 15S  plan-2  CAG  0.020
 15S  plan-2  CAH  0.020
 15S  plan-2  CBC  0.020
 15S  plan-2  CAP  0.020
 15S  plan-2  H8   0.020
 15S  plan-2  H9   0.020
 15S  plan-2  H10  0.020
 15S  plan-3  CAT  0.020
 15S  plan-3  CAW  0.020
 15S  plan-3  OAB  0.020
 15S  plan-3  N    0.020
 15S  plan-3  CA   0.020
 15S  plan-3  H18  0.020
 15S  plan-4  CA   0.020
 15S  plan-4  C    0.020
 15S  plan-4  O    0.020
 15S  plan-4  NBH  0.020
 15S  plan-4  CAQ  0.020
 15S  plan-4  CAN  0.020
 15S  plan-5  OAC  0.020
 15S  plan-5  CAX  0.020
 15S  plan-5  NAU  0.020
 15S  plan-5  CAS  0.020
 15S  plan-5  CBD  0.020
 15S  plan-5  H3   0.020

