# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sun Jul 31 02:10:56 2022
#   Inital geometry file: a 138 line input string
#   Ligand name: 3-[2-[butyl(2-cycloheptylethyl)amino]ethyl]-1~{H}-indol-6-ol
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CCCCN(CCC1CCCCCC1)CCc2c[nH]c3cc(O)ccc23
#
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
 A87  A87  "3-[2-[butyl(2-cycloheptylethyl)amino]ethyl]-1~{H}-indol-6-ol"
  ligand  62  26  .  2022-09-16  2022-09-16
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_A87
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
 A87  C01  C  CH3   0  -0.658  18.0187  49.4281  39.8329
 A87  C02  C  CH2   0  -0.421  19.0085  48.3742  40.3092
 A87  C03  C  CH2   0  -0.418  18.4292  46.9651  40.2875
 A87  C04  C  CH2   0  -0.264  19.4301  45.9199  40.7616
 A87  C06  C  CH2   0  -0.319  19.5387  43.6591  41.6500
 A87  C07  C  CH2   0  -0.446  21.0515  43.4735  41.5019
 A87  C08  C  CH1   0  -0.205  21.5690  42.2539  42.2736
 A87  C09  C  CH2   0  -0.446  21.2534  40.9527  41.5237
 A87  C10  C  CH2   0  -0.430  20.9988  39.7541  42.4332
 A87  C11  C  CH2   0  -0.421  22.2125  39.2027  43.1738
 A87  C12  C  CH2   0  -0.433  23.0463  40.2224  43.9485
 A87  C13  C  CH2   0  -0.439  23.8169  41.1830  43.0401
 A87  C14  C  CH2   0  -0.418  23.0579  42.4312  42.5851
 A87  C15  C  CH2   0  -0.301  18.7447  44.0232  39.3813
 A87  C16  C  CH2   0  -0.512  17.3214  43.5252  39.1008
 A87  C17  C  CR5   0   0.033  16.8868  42.4155  39.9975
 A87  C18  C  CR15  0  -0.104  16.0377  42.4942  41.0613
 A87  C20  C  CR56  0   0.372  16.7438  40.3781  41.0415
 A87  C21  C  CR56  0  -0.008  17.3519  41.0569  39.9644
 A87  C22  C  CR16  0  -0.342  18.2233  40.3435  39.1354
 A87  C23  C  CR16  0  -0.347  18.4664  39.0089  39.3849
 A87  C24  C  CR6   0   0.343  17.8497  38.3548  40.4694
 A87  C26  C  CR16  0  -0.453  16.9808  39.0286  41.3100
 A87  N05  N  NT    0  -0.409  18.9009  44.5704  40.7185
 A87  N19  N  NR15  0  -0.693  15.9501  41.2737  41.6884
 A87  O25  O  OH1   0  -0.642  18.1557  37.0471  40.6407
 A87  H1   H  HCH3  0   0.225  18.4571  50.4264  39.8489
 A87  H2   H  HCH3  0   0.215  17.6915  49.2274  38.8112
 A87  H3   H  HCH3  0   0.215  17.1287  49.4481  40.4644
 A87  H4   H  HCH2  0   0.211  19.3405  48.6150  41.3238
 A87  H5   H  HCH2  0   0.211  19.9053  48.4060  39.6829
 A87  H6   H  HCH2  0   0.213  18.0940  46.7326  39.2710
 A87  H7   H  HCH2  0   0.207  17.5387  46.9187  40.9222
 A87  H8   H  HCH2  0   0.183  20.3625  46.0260  40.1819
 A87  H9   H  HCH2  0   0.219  19.6960  46.1421  41.7998
 A87  H10  H  HCH2  0   0.218  19.3326  44.0039  42.6698
 A87  H11  H  HCH2  0   0.242  19.0372  42.6933  41.5569
 A87  H12  H  HCH2  0   0.214  21.3257  43.3647  40.4457
 A87  H13  H  HCH2  0   0.220  21.5595  44.3776  41.8530
 A87  H14  H  HCH1  0   0.207  21.0285  42.2185  43.2296
 A87  H15  H  HCH2  0   0.211  22.0550  40.7317  40.8092
 A87  H16  H  HCH2  0   0.239  20.3550  41.0961  40.9160
 A87  H17  H  HCH2  0   0.203  20.2282  40.0341  43.1605
 A87  H18  H  HCH2  0   0.222  20.5636  38.9436  41.8406
 A87  H19  H  HCH2  0   0.217  21.8702  38.4215  43.8589
 A87  H20  H  HCH2  0   0.204  22.8738  38.7031  42.4572
 A87  H21  H  HCH2  0   0.212  22.4173  40.7750  44.6548
 A87  H22  H  HCH2  0   0.223  23.7642  39.6706  44.5612
 A87  H23  H  HCH2  0   0.211  24.1549  40.6198  42.1645
 A87  H24  H  HCH2  0   0.224  24.7302  41.5098  43.5440
 A87  H25  H  HCH2  0   0.210  23.5594  42.8310  41.6969
 A87  H26  H  HCH2  0   0.213  23.1491  43.2091  43.3497
 A87  H27  H  HCH2  0   0.218  19.4573  43.2076  39.1998
 A87  H28  H  HCH2  0   0.228  18.9856  44.7866  38.6362
 A87  H29  H  HCH2  0   0.231  16.6338  44.3692  39.1970
 A87  H30  H  HCH2  0   0.218  17.2739  43.2023  38.0555
 A87  H31  H  HCR5  0   0.270  15.4824  43.3411  41.4331
 A87  H32  H  HCR6  0   0.241  18.7113  40.8295  38.2990
 A87  H33  H  HCR6  0   0.249  19.1410  38.4482  38.7498
 A87  H34  H  HCR6  0   0.267  16.5041  38.5285  42.1462
 A87  H36  H  HNR5  0   0.401  15.3801  41.0760  42.4933
 A87  H37  H  HOH1  0   0.468  17.6868  36.6924  41.4039

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
 A87  C16  C15  single    1.534  0.020  1.534
 A87  C16  C17  single    1.491  0.020  1.491
 A87  C15  N05  single    1.453  0.020  1.453
 A87  C17  C18  aromatic  1.363  0.020  1.363
 A87  C17  C21  aromatic  1.436  0.020  1.436
 A87  C18  N19  aromatic  1.375  0.020  1.375
 A87  C21  C22  aromatic  1.398  0.020  1.398
 A87  C21  C20  aromatic  1.411  0.020  1.411
 A87  C22  C23  aromatic  1.379  0.020  1.379
 A87  N19  C20  aromatic  1.360  0.020  1.360
 A87  C03  C04  single    1.523  0.020  1.523
 A87  C03  C02  single    1.524  0.020  1.524
 A87  C20  C26  aromatic  1.396  0.020  1.396
 A87  C04  N05  single    1.450  0.020  1.450
 A87  N05  C06  single    1.451  0.020  1.451
 A87  C01  C02  single    1.522  0.020  1.522
 A87  C23  C24  aromatic  1.409  0.020  1.409
 A87  C09  C10  single    1.526  0.020  1.526
 A87  C09  C08  single    1.535  0.020  1.535
 A87  C26  C24  aromatic  1.384  0.020  1.384
 A87  C07  C06  single    1.531  0.020  1.531
 A87  C07  C08  single    1.533  0.020  1.533
 A87  C24  O25  single    1.354  0.020  1.354
 A87  C10  C11  single    1.525  0.020  1.525
 A87  C08  C14  single    1.531  0.020  1.531
 A87  C14  C13  single    1.530  0.020  1.530
 A87  C11  C12  single    1.528  0.020  1.528
 A87  C13  C12  single    1.530  0.020  1.530
 A87  C01  H1   single    0.970  0.020  1.090
 A87  C01  H2   single    0.970  0.020  1.090
 A87  C01  H3   single    0.970  0.020  1.090
 A87  C02  H4   single    0.970  0.020  1.090
 A87  C02  H5   single    0.970  0.020  1.090
 A87  C03  H6   single    0.970  0.020  1.090
 A87  C03  H7   single    0.970  0.020  1.090
 A87  C04  H8   single    0.970  0.020  1.090
 A87  C04  H9   single    0.970  0.020  1.090
 A87  C06  H10  single    0.970  0.020  1.090
 A87  C06  H11  single    0.970  0.020  1.090
 A87  C07  H12  single    0.970  0.020  1.090
 A87  C07  H13  single    0.970  0.020  1.090
 A87  C08  H14  single    0.970  0.020  1.090
 A87  C09  H15  single    0.970  0.020  1.090
 A87  C09  H16  single    0.970  0.020  1.090
 A87  C10  H17  single    0.970  0.020  1.090
 A87  C10  H18  single    0.970  0.020  1.090
 A87  C11  H19  single    0.970  0.020  1.090
 A87  C11  H20  single    0.970  0.020  1.090
 A87  C12  H21  single    0.970  0.020  1.090
 A87  C12  H22  single    0.970  0.020  1.090
 A87  C13  H23  single    0.970  0.020  1.090
 A87  C13  H24  single    0.970  0.020  1.090
 A87  C14  H25  single    0.970  0.020  1.090
 A87  C14  H26  single    0.970  0.020  1.090
 A87  C15  H27  single    0.970  0.020  1.090
 A87  C15  H28  single    0.970  0.020  1.090
 A87  C16  H29  single    0.970  0.020  1.090
 A87  C16  H30  single    0.970  0.020  1.090
 A87  C18  H31  single    0.930  0.020  1.080
 A87  C22  H32  single    0.930  0.020  1.080
 A87  C23  H33  single    0.930  0.020  1.080
 A87  C26  H34  single    0.930  0.020  1.080
 A87  N19  H36  single    0.860  0.020  1.020
 A87  O25  H37  single    0.850  0.020  0.980

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
 A87  H3   C01  H2   107.49  3.000
 A87  H3   C01  H1   107.61  3.000
 A87  H2   C01  H1   107.61  3.000
 A87  H3   C01  C02  111.22  3.000
 A87  H2   C01  C02  111.13  3.000
 A87  H1   C01  C02  111.58  3.000
 A87  H5   C02  H4   105.99  3.000
 A87  H5   C02  C03  109.29  3.000
 A87  H4   C02  C03  109.40  3.000
 A87  H5   C02  C01  109.49  3.000
 A87  H4   C02  C01  109.57  3.000
 A87  C03  C02  C01  112.87  3.000
 A87  H7   C03  H6   106.28  3.000
 A87  H7   C03  C04  108.97  3.000
 A87  H6   C03  C04  110.14  3.000
 A87  H7   C03  C02  109.89  3.000
 A87  H6   C03  C02  109.02  3.000
 A87  C04  C03  C02  112.36  3.000
 A87  H9   C04  H8   105.88  3.000
 A87  H9   C04  N05  107.80  3.000
 A87  H8   C04  N05  112.48  3.000
 A87  H9   C04  C03  108.40  3.000
 A87  H8   C04  C03  109.02  3.000
 A87  N05  C04  C03  112.93  3.000
 A87  H11  C06  H10  105.73  3.000
 A87  H11  C06  N05  107.39  3.000
 A87  H10  C06  N05  108.49  3.000
 A87  H11  C06  C07  109.76  3.000
 A87  H10  C06  C07  108.29  3.000
 A87  N05  C06  C07  116.63  3.000
 A87  H13  C07  H12  105.95  3.000
 A87  H13  C07  C08  109.81  3.000
 A87  H12  C07  C08  108.76  3.000
 A87  H13  C07  C06  109.10  3.000
 A87  H12  C07  C06  110.62  3.000
 A87  C08  C07  C06  112.41  3.000
 A87  H14  C08  C14  107.75  3.000
 A87  H14  C08  C09  107.25  3.000
 A87  C14  C08  C09  113.42  3.000
 A87  H14  C08  C07  107.31  3.000
 A87  C14  C08  C07  109.78  3.000
 A87  C09  C08  C07  111.05  3.000
 A87  H16  C09  H15  105.36  3.000
 A87  H16  C09  C10  107.28  3.000
 A87  H15  C09  C10  110.62  3.000
 A87  H16  C09  C08  109.22  3.000
 A87  H15  C09  C08  109.81  3.000
 A87  C10  C09  C08  114.15  3.000
 A87  H18  C10  H17  105.60  3.000
 A87  H18  C10  C11  108.16  3.000
 A87  H17  C10  C11  109.25  3.000
 A87  H18  C10  C09  108.98  3.000
 A87  H17  C10  C09  108.19  3.000
 A87  C11  C10  C09  116.15  3.000
 A87  H20  C11  H19  105.83  3.000
 A87  H20  C11  C12  107.85  3.000
 A87  H19  C11  C12  109.25  3.000
 A87  H20  C11  C10  109.12  3.000
 A87  H19  C11  C10  108.26  3.000
 A87  C12  C11  C10  116.05  3.000
 A87  H22  C12  H21  105.68  3.000
 A87  H22  C12  C13  108.59  3.000
 A87  H21  C12  C13  110.81  3.000
 A87  H22  C12  C11  107.79  3.000
 A87  H21  C12  C11  110.50  3.000
 A87  C13  C12  C11  113.12  3.000
 A87  H24  C13  H23  105.35  3.000
 A87  H24  C13  C14  107.91  3.000
 A87  H23  C13  C14  109.58  3.000
 A87  H24  C13  C12  109.56  3.000
 A87  H23  C13  C12  107.90  3.000
 A87  C14  C13  C12  116.02  3.000
 A87  H26  C14  H25  105.60  3.000
 A87  H26  C14  C13  109.32  3.000
 A87  H25  C14  C13  108.16  3.000
 A87  H26  C14  C08  107.78  3.000
 A87  H25  C14  C08  108.80  3.000
 A87  C13  C14  C08  116.64  3.000
 A87  H28  C15  H27  105.25  3.000
 A87  H28  C15  N05  109.90  3.000
 A87  H27  C15  N05  111.23  3.000
 A87  H28  C15  C16  107.84  3.000
 A87  H27  C15  C16  109.31  3.000
 A87  N05  C15  C16  112.97  3.000
 A87  H30  C16  H29  106.53  3.000
 A87  H30  C16  C17  109.99  3.000
 A87  H29  C16  C17  109.78  3.000
 A87  H30  C16  C15  108.09  3.000
 A87  H29  C16  C15  108.49  3.000
 A87  C17  C16  C15  113.71  3.000
 A87  C21  C17  C18  105.91  3.000
 A87  C21  C17  C16  126.55  3.000
 A87  C18  C17  C16  127.42  3.000
 A87  H31  C18  N19  120.46  3.000
 A87  H31  C18  C17  129.40  3.000
 A87  N19  C18  C17  110.14  3.000
 A87  N19  C20  C26  130.08  3.000
 A87  C26  C20  C21  122.60  3.000
 A87  N19  C20  C21  107.32  3.000
 A87  C22  C21  C20  118.40  3.000
 A87  C20  C21  C17  107.33  3.000
 A87  C22  C21  C17  134.26  3.000
 A87  H32  C22  C23  119.62  3.000
 A87  H32  C22  C21  120.63  3.000
 A87  C23  C22  C21  119.75  3.000
 A87  H33  C23  C24  118.93  3.000
 A87  H33  C23  C22  120.31  3.000
 A87  C24  C23  C22  120.76  3.000
 A87  O25  C24  C26  122.36  3.000
 A87  O25  C24  C23  116.55  3.000
 A87  C26  C24  C23  121.09  3.000
 A87  H34  C26  C24  121.31  3.000
 A87  H34  C26  C20  121.29  3.000
 A87  C24  C26  C20  117.40  3.000
 A87  C15  N05  C06  113.67  3.000
 A87  C06  N05  C04  113.89  3.000
 A87  C15  N05  C04  114.64  3.000
 A87  H36  N19  C20  125.57  3.000
 A87  H36  N19  C18  125.14  3.000
 A87  C20  N19  C18  109.29  3.000
 A87  H37  O25  C24  110.24  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
 A87  CONST_01  C20  N19  C18  C17     0.00   0.0  0
 A87  CONST_02  C23  C22  C21  C17   180.00   0.0  0
 A87  CONST_03  N19  C20  C21  C17     0.00   0.0  0
 A87  CONST_04  C26  C20  C21  C17   180.00   0.0  0
 A87  CONST_05  C22  C21  C17  C18   180.00   0.0  0
 A87  CONST_06  C20  C21  C17  C18     0.00   0.0  0
 A87  CONST_07  C21  C20  N19  C18     0.00   0.0  0
 A87  CONST_08  C26  C20  N19  C18   180.00   0.0  0
 A87  CONST_09  C23  C22  C21  C20     0.00   0.0  0
 A87  CONST_10  C23  C24  C26  C20     0.00   0.0  0
 A87  CONST_11  N19  C18  C17  C21     0.00   0.0  0
 A87  CONST_12  C24  C23  C22  C21     0.00   0.0  0
 A87  CONST_13  C24  C26  C20  C21     0.00   0.0  0
 A87  CONST_14  N19  C20  C21  C22   180.00   0.0  0
 A87  CONST_15  C26  C20  C21  C22     0.00   0.0  0
 A87  CONST_16  C26  C24  C23  C22     0.00   0.0  0
 A87  CONST_17  N19  C20  C26  C24   180.00   0.0  0
 A87  CONST_18  N19  C18  C17  C16   180.00   0.0  0
 A87  CONST_19  C22  C21  C17  C16     0.00   0.0  0
 A87  CONST_20  C20  C21  C17  C16   180.00   0.0  0
 A87  CONST_21  O25  C24  C26  C20   180.00   0.0  0
 A87  CONST_22  O25  C24  C23  C22   180.00   0.0  0
 A87  CONST_23  H36  N19  C18  C17   180.00   0.0  0
 A87  CONST_24  H32  C22  C21  C17     0.00   0.0  0
 A87  CONST_25  H32  C22  C21  C20   180.00   0.0  0
 A87  CONST_26  H31  C18  N19  C20   180.00   0.0  0
 A87  CONST_27  H31  C18  C17  C21   180.00   0.0  0
 A87  CONST_28  H33  C23  C22  C21   180.00   0.0  0
 A87  CONST_29  H36  N19  C20  C21   180.00   0.0  0
 A87  CONST_30  H34  C26  C20  C21   180.00   0.0  0
 A87  CONST_31  H34  C26  C24  C23   180.00   0.0  0
 A87  CONST_32  H32  C22  C23  C24   180.00   0.0  0
 A87  CONST_33  H36  N19  C20  C26     0.00   0.0  0
 A87  CONST_34  H33  C23  C24  C26   180.00   0.0  0
 A87  CONST_35  H34  C26  C20  N19     0.00   0.0  0
 A87  Var_01    C18  C17  C16  C15   103.70  30.0  2
 A87  Var_02    C21  C17  C16  C15   -71.89  30.0  2
 A87  Var_03    H29  C16  C17  C18   -18.03  30.0  3
 A87  Var_04    H30  C16  C17  C18  -134.93  30.0  3
 A87  Var_05    H29  C16  C17  C21   166.38  30.0  3
 A87  Var_06    H30  C16  C17  C21    49.48  30.0  3
 A87  Var_07    N05  C06  C07  C08  -165.56  30.0  3
 A87  Var_08    N05  C15  C16  C17   -61.78  30.0  3
 A87  Var_09    H10  C06  C07  C08    71.79  30.0  3
 A87  Var_10    H11  C06  C07  C08   -43.18  30.0  3
 A87  Var_11    H27  C15  C16  C17    62.64  30.0  3
 A87  Var_12    H28  C15  C16  C17   176.56  30.0  3
 A87  Var_13    C04  C03  C02  C01   179.81  30.0  1
 A87  Var_14    N05  C04  C03  C02  -178.75  30.0  3
 A87  Var_15    C15  N05  C04  C03    71.83  30.0  3
 A87  Var_16    C06  N05  C04  C03  -154.83  30.0  3
 A87  Var_17    C16  C15  N05  C04  -125.29  30.0  1
 A87  Var_18    C07  C06  N05  C04   -58.55  30.0  3
 A87  Var_19    C16  C15  N05  C06   101.26  30.0  1
 A87  Var_20    C15  N05  C06  C07    75.25  30.0  1
 A87  Var_21    H6   C03  C02  C01    57.42  30.0  1
 A87  Var_22    H7   C03  C02  C01   -58.68  30.0  1
 A87  Var_23    H8   C04  C03  C02   -52.94  30.0  3
 A87  Var_24    H9   C04  C03  C02    61.88  30.0  3
 A87  Var_25    H1   C01  C02  C03  -179.52  30.0  3
 A87  Var_26    H2   C01  C02  C03   -59.40  30.0  3
 A87  Var_27    H3   C01  C02  C03    60.31  30.0  3
 A87  Var_28    H4   C02  C03  C04   -57.92  30.0  3
 A87  Var_29    H5   C02  C03  C04    57.72  30.0  3
 A87  Var_30    H27  C15  N05  C04   111.34  30.0  1
 A87  Var_31    H28  C15  N05  C04    -4.80  30.0  1
 A87  Var_32    H10  C06  N05  C04    63.99  30.0  3
 A87  Var_33    H11  C06  N05  C04   177.84  30.0  3
 A87  Var_34    H27  C15  N05  C06   -22.11  30.0  1
 A87  Var_35    H28  C15  N05  C06  -138.25  30.0  1
 A87  Var_36    H8   C04  N05  C06    81.25  30.0  2
 A87  Var_37    H9   C04  N05  C06   -35.11  30.0  2
 A87  Var_38    H8   C04  N05  C15   -52.10  30.0  2
 A87  Var_39    H9   C04  N05  C15  -168.45  30.0  2
 A87  Var_40    H10  C06  N05  C15  -162.21  30.0  3
 A87  Var_41    H11  C06  N05  C15   -48.36  30.0  3
 A87  Var_42    H29  C16  C15  N05    60.66  30.0  1
 A87  Var_43    H30  C16  C15  N05   175.79  30.0  1
 A87  Var_44    H6   C03  C04  N05   -57.00  30.0  1
 A87  Var_45    H7   C03  C04  N05    59.21  30.0  1
 A87  Var_46    H12  C07  C06  N05   -43.77  30.0  1
 A87  Var_47    H13  C07  C06  N05    72.39  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
 A87  chir_01  C08  C09  C07  C14  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
 A87  plan-1  C16  0.020
 A87  plan-1  C17  0.020
 A87  plan-1  C18  0.020
 A87  plan-1  C20  0.020
 A87  plan-1  C21  0.020
 A87  plan-1  C22  0.020
 A87  plan-1  C23  0.020
 A87  plan-1  C24  0.020
 A87  plan-1  C26  0.020
 A87  plan-1  N19  0.020
 A87  plan-1  O25  0.020
 A87  plan-1  H31  0.020
 A87  plan-1  H32  0.020
 A87  plan-1  H33  0.020
 A87  plan-1  H34  0.020
 A87  plan-1  H36  0.020

