# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Tue Aug  2 14:07:23 2022
#   Inital geometry file: a 126 line input string
#   Ligand name: 6-(4-{[4-(propan-2-yl)phenyl]acetyl}piperazin-1-yl)pyridine-3-carbonitrile
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CC(C)c1ccc(CC(=O)N2CCN(CC2)c3ccc(cn3)C#N)cc1
#
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
 UOM  UOM  "6-(4-{[4-(propan-2-yl)phenyl]acetyl}piperazin-1-yl)pyridine-3-carbonitrile"
  ligand  50  26  .  2022-08-11  2022-08-11
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_UOM
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
 UOM  C01  C  CH3   0  -0.644  28.2343  -19.1775  -16.7808
 UOM  C02  C  CH1   0  -0.324  28.0164  -20.6837  -16.9153
 UOM  C03  C  CH3   0  -0.642  29.3166  -21.4484  -16.6643
 UOM  C04  C  CR6   0   0.158  27.4239  -21.0515  -18.2557
 UOM  C05  C  CR16  0  -0.300  28.0792  -20.7370  -19.4467
 UOM  C06  C  CR16  0  -0.279  27.5462  -21.0997  -20.6731
 UOM  C07  C  CR6   0   0.156  26.3408  -21.7924  -20.7549
 UOM  C08  C  CH2   0  -0.719  25.7893  -22.2140  -22.0841
 UOM  C09  C  C     0   0.571  26.4264  -23.5110  -22.5691
 UOM  C11  C  CH2   0  -0.306  25.1303  -23.3131  -24.6958
 UOM  C12  C  CH2   0  -0.304  24.0413  -24.3087  -25.0833
 UOM  C14  C  CR6   0   0.582  24.2800  -26.0699  -26.8162
 UOM  C16  C  CR16  0  -0.022  24.6304  -27.7984  -28.2929
 UOM  C17  C  CR6   0  -0.127  23.6832  -27.3251  -29.1965
 UOM  C18  C  CSP   0   0.028  23.4166  -28.0231  -30.3996
 UOM  C20  C  CR16  0  -0.118  23.0087  -26.1441  -28.8534
 UOM  C21  C  CR16  0  -0.405  23.2965  -25.5136  -27.6740
 UOM  C22  C  CH2   0  -0.313  25.5880  -26.1300  -24.7381
 UOM  C23  C  CH2   0  -0.310  26.6767  -25.1363  -24.3711
 UOM  C25  C  CR16  0  -0.293  25.6792  -22.0963  -19.5727
 UOM  C26  C  CR16  0  -0.318  26.2132  -21.7304  -18.3427
 UOM  N10  N  NT    0  -0.466  26.0967  -23.9309  -23.8122
 UOM  N13  N  NT    0  -0.502  24.6249  -25.5143  -25.6352
 UOM  N15  N  N     0  -0.475  24.9152  -27.2012  -27.1580
 UOM  N19  N  NS    0  -0.264  23.2025  -28.5992  -31.3766
 UOM  O24  O  O     0  -0.479  27.2072  -24.1297  -21.8635
 UOM  H1   H  HCH3  0   0.228  28.6074  -18.9330  -15.7849
 UOM  H2   H  HCH3  0   0.220  28.9668  -18.8133  -17.5033
 UOM  H3   H  HCH3  0   0.229  27.3075  -18.6241  -16.9368
 UOM  H4   H  HCH1  0   0.237  27.2985  -20.9861  -16.1466
 UOM  H5   H  HCH3  0   0.227  29.7156  -21.2186  -15.6748
 UOM  H6   H  HCH3  0   0.229  29.1611  -22.5264  -16.7207
 UOM  H7   H  HCH3  0   0.219  30.0801  -21.1820  -17.3980
 UOM  H8   H  HCR6  0   0.244  29.0231  -20.2041  -19.4215
 UOM  H9   H  HCR6  0   0.241  28.0777  -20.8418  -21.5822
 UOM  H10  H  HCH2  0   0.289  25.9525  -21.4272  -22.8257
 UOM  H11  H  HCH2  0   0.294  24.7062  -22.3491  -22.0154
 UOM  H12  H  HCH2  0   0.254  25.6384  -22.9656  -25.6011
 UOM  H13  H  HCH2  0   0.284  24.6604  -22.4500  -24.2327
 UOM  H14  H  HCH2  0   0.277  23.3752  -23.8247  -25.7904
 UOM  H15  H  HCH2  0   0.255  23.4486  -24.5662  -24.1989
 UOM  H16  H  HCR6  0   0.279  25.1793  -28.7088  -28.5104
 UOM  H17  H  HCR6  0   0.284  22.2584  -25.7298  -29.5138
 UOM  H18  H  HCR6  0   0.284  22.7634  -24.6096  -27.4257
 UOM  H19  H  HCH2  0   0.248  25.0696  -26.4571  -23.8302
 UOM  H20  H  HCH2  0   0.284  26.0267  -27.0026  -25.2101
 UOM  H21  H  HCH2  0   0.273  27.3572  -25.5850  -23.6529
 UOM  H22  H  HCH2  0   0.249  27.2526  -24.8756  -25.2651
 UOM  H23  H  HCR6  0   0.242  24.7333  -22.6253  -19.6074
 UOM  H24  H  HCR6  0   0.242  25.6768  -21.9826  -17.4350

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
 UOM  N19  C18  triple    1.154  0.020  1.154
 UOM  C18  C17  single    1.416  0.020  1.416
 UOM  C17  C20  aromatic  1.403  0.020  1.403
 UOM  C17  C16  aromatic  1.392  0.020  1.392
 UOM  C20  C21  aromatic  1.368  0.020  1.368
 UOM  C16  N15  aromatic  1.314  0.020  1.314
 UOM  C21  C14  aromatic  1.419  0.020  1.419
 UOM  N15  C14  aromatic  1.342  0.020  1.342
 UOM  C14  N13  single    1.350  0.020  1.350
 UOM  N13  C12  single    1.449  0.020  1.449
 UOM  N13  C22  single    1.453  0.020  1.453
 UOM  C12  C11  single    1.526  0.020  1.526
 UOM  C22  C23  single    1.519  0.020  1.519
 UOM  C11  N10  single    1.448  0.020  1.448
 UOM  C23  N10  single    1.450  0.020  1.450
 UOM  N10  C09  single    1.353  0.020  1.353
 UOM  C09  C08  single    1.524  0.020  1.524
 UOM  C09  O24  double    1.221  0.020  1.221
 UOM  C08  C07  single    1.500  0.020  1.500
 UOM  C06  C07  aromatic  1.393  0.020  1.393
 UOM  C06  C05  aromatic  1.386  0.020  1.386
 UOM  C07  C25  aromatic  1.388  0.020  1.388
 UOM  C05  C04  aromatic  1.395  0.020  1.395
 UOM  C25  C26  aromatic  1.390  0.020  1.390
 UOM  C04  C26  aromatic  1.391  0.020  1.391
 UOM  C04  C02  single    1.511  0.020  1.511
 UOM  C01  C02  single    1.528  0.020  1.528
 UOM  C02  C03  single    1.529  0.020  1.529
 UOM  C01  H1   single    0.970  0.020  1.090
 UOM  C01  H2   single    0.970  0.020  1.090
 UOM  C01  H3   single    0.970  0.020  1.090
 UOM  C02  H4   single    0.970  0.020  1.090
 UOM  C03  H5   single    0.970  0.020  1.090
 UOM  C03  H6   single    0.970  0.020  1.090
 UOM  C03  H7   single    0.970  0.020  1.090
 UOM  C05  H8   single    0.930  0.020  1.080
 UOM  C06  H9   single    0.930  0.020  1.080
 UOM  C08  H10  single    0.970  0.020  1.090
 UOM  C08  H11  single    0.970  0.020  1.090
 UOM  C11  H12  single    0.970  0.020  1.090
 UOM  C11  H13  single    0.970  0.020  1.090
 UOM  C12  H14  single    0.970  0.020  1.090
 UOM  C12  H15  single    0.970  0.020  1.090
 UOM  C16  H16  single    0.930  0.020  1.080
 UOM  C20  H17  single    0.930  0.020  1.080
 UOM  C21  H18  single    0.930  0.020  1.080
 UOM  C22  H19  single    0.970  0.020  1.090
 UOM  C22  H20  single    0.970  0.020  1.090
 UOM  C23  H21  single    0.970  0.020  1.090
 UOM  C23  H22  single    0.970  0.020  1.090
 UOM  C25  H23  single    0.930  0.020  1.080
 UOM  C26  H24  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
 UOM  H3   C01  H2   107.84  3.000
 UOM  H3   C01  H1   107.90  3.000
 UOM  H2   C01  H1   107.45  3.000
 UOM  H3   C01  C02  111.50  3.000
 UOM  H2   C01  C02  111.49  3.000
 UOM  H1   C01  C02  110.49  3.000
 UOM  H4   C02  C04  107.37  3.000
 UOM  H4   C02  C03  107.72  3.000
 UOM  C04  C02  C03  110.94  3.000
 UOM  H4   C02  C01  107.71  3.000
 UOM  C03  C02  C01  110.94  3.000
 UOM  C04  C02  C01  111.96  3.000
 UOM  H7   C03  H6   107.82  3.000
 UOM  H7   C03  H5   107.59  3.000
 UOM  H6   C03  H5   107.89  3.000
 UOM  H7   C03  C02  111.24  3.000
 UOM  H6   C03  C02  111.38  3.000
 UOM  H5   C03  C02  110.75  3.000
 UOM  C26  C04  C05  117.74  3.000
 UOM  C26  C04  C02  121.05  3.000
 UOM  C05  C04  C02  121.21  3.000
 UOM  H8   C05  C06  118.95  3.000
 UOM  H8   C05  C04  119.99  3.000
 UOM  C06  C05  C04  121.05  3.000
 UOM  H9   C06  C07  119.57  3.000
 UOM  H9   C06  C05  119.43  3.000
 UOM  C07  C06  C05  121.01  3.000
 UOM  C25  C07  C08  121.20  3.000
 UOM  C25  C07  C06  118.12  3.000
 UOM  C08  C07  C06  120.68  3.000
 UOM  H11  C08  H10  106.22  3.000
 UOM  H11  C08  C09  109.20  3.000
 UOM  H10  C08  C09  109.52  3.000
 UOM  H11  C08  C07  110.08  3.000
 UOM  H10  C08  C07  110.12  3.000
 UOM  C09  C08  C07  111.56  3.000
 UOM  O24  C09  N10  121.98  3.000
 UOM  O24  C09  C08  120.98  3.000
 UOM  N10  C09  C08  117.04  3.000
 UOM  H13  C11  H12  107.53  3.000
 UOM  H13  C11  N10  111.56  3.000
 UOM  H12  C11  N10  109.29  3.000
 UOM  H13  C11  C12  108.54  3.000
 UOM  H12  C11  C12  109.17  3.000
 UOM  N10  C11  C12  110.67  3.000
 UOM  H15  C12  H14  107.38  3.000
 UOM  H15  C12  N13  109.26  3.000
 UOM  H14  C12  N13  111.72  3.000
 UOM  H15  C12  C11  109.55  3.000
 UOM  H14  C12  C11  108.21  3.000
 UOM  N13  C12  C11  110.63  3.000
 UOM  N15  C14  N13  116.68  3.000
 UOM  N13  C14  C21  123.01  3.000
 UOM  N15  C14  C21  120.32  3.000
 UOM  H16  C16  N15  116.42  3.000
 UOM  H16  C16  C17  119.96  3.000
 UOM  N15  C16  C17  123.62  3.000
 UOM  C20  C17  C18  122.16  3.000
 UOM  C20  C17  C16  117.05  3.000
 UOM  C18  C17  C16  120.79  3.000
 UOM  N19  C18  C17  180.00  3.000
 UOM  H17  C20  C21  119.71  3.000
 UOM  H17  C20  C17  120.43  3.000
 UOM  C21  C20  C17  119.86  3.000
 UOM  H18  C21  C20  118.74  3.000
 UOM  H18  C21  C14  122.15  3.000
 UOM  C20  C21  C14  119.11  3.000
 UOM  H20  C22  H19  108.17  3.000
 UOM  H20  C22  N13  109.90  3.000
 UOM  H19  C22  N13  108.93  3.000
 UOM  H20  C22  C23  109.97  3.000
 UOM  H19  C22  C23  109.53  3.000
 UOM  N13  C22  C23  110.31  3.000
 UOM  H22  C23  H21  107.98  3.000
 UOM  H22  C23  N10  109.10  3.000
 UOM  H21  C23  N10  109.83  3.000
 UOM  H22  C23  C22  109.60  3.000
 UOM  H21  C23  C22  109.79  3.000
 UOM  N10  C23  C22  110.51  3.000
 UOM  H23  C25  C26  119.47  3.000
 UOM  H23  C25  C07  119.68  3.000
 UOM  C26  C25  C07  120.85  3.000
 UOM  H24  C26  C25  119.31  3.000
 UOM  H24  C26  C04  119.47  3.000
 UOM  C25  C26  C04  121.22  3.000
 UOM  C23  N10  C11  112.74  3.000
 UOM  C23  N10  C09  120.98  3.000
 UOM  C11  N10  C09  126.23  3.000
 UOM  C22  N13  C14  122.35  3.000
 UOM  C22  N13  C12  112.61  3.000
 UOM  C14  N13  C12  124.95  3.000
 UOM  C16  N15  C14  120.05  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
 UOM  CONST_01  C07  C06  C05  C04     0.00   0.0  0
 UOM  CONST_02  C07  C25  C26  C04     0.00   0.0  0
 UOM  CONST_03  C25  C07  C06  C05     0.00   0.0  0
 UOM  CONST_04  C25  C26  C04  C05     0.00   0.0  0
 UOM  CONST_05  C26  C25  C07  C06     0.00   0.0  0
 UOM  CONST_06  C26  C04  C05  C06     0.00   0.0  0
 UOM  CONST_07  C17  C20  C21  C14     0.00   0.0  0
 UOM  CONST_08  C17  C16  N15  C14     0.00   0.0  0
 UOM  CONST_09  C21  C20  C17  C16     0.00   0.0  0
 UOM  CONST_10  C21  C14  N15  C16     0.00   0.0  0
 UOM  CONST_11  N15  C16  C17  C20     0.00   0.0  0
 UOM  CONST_12  N15  C14  C21  C20     0.00   0.0  0
 UOM  CONST_13  N13  C14  N15  C16   180.00   0.0  0
 UOM  CONST_14  N13  C14  C21  C20   180.00   0.0  0
 UOM  CONST_15  C06  C05  C04  C02   180.00   0.0  0
 UOM  CONST_16  C25  C26  C04  C02   180.00   0.0  0
 UOM  CONST_17  C08  C07  C06  C05   180.00   0.0  0
 UOM  CONST_18  C26  C25  C07  C08   180.00   0.0  0
 UOM  CONST_19  C21  C20  C17  C18   180.00   0.0  0
 UOM  CONST_20  N15  C16  C17  C18   180.00   0.0  0
 UOM  CONST_21  H9   C06  C05  C04   180.00   0.0  0
 UOM  CONST_22  H23  C25  C26  C04   180.00   0.0  0
 UOM  CONST_23  H24  C26  C04  C05   180.00   0.0  0
 UOM  CONST_24  H23  C25  C07  C06   180.00   0.0  0
 UOM  CONST_25  H8   C05  C06  C07   180.00   0.0  0
 UOM  CONST_26  H24  C26  C25  C07   180.00   0.0  0
 UOM  CONST_27  H17  C20  C21  C14   180.00   0.0  0
 UOM  CONST_28  H16  C16  N15  C14   180.00   0.0  0
 UOM  CONST_29  H17  C20  C17  C16   180.00   0.0  0
 UOM  CONST_30  H18  C21  C20  C17   180.00   0.0  0
 UOM  CONST_31  H16  C16  C17  C20   180.00   0.0  0
 UOM  CONST_32  H9   C06  C07  C25   180.00   0.0  0
 UOM  CONST_33  H8   C05  C04  C26   180.00   0.0  0
 UOM  CONST_34  H18  C21  C14  N13     0.00   0.0  0
 UOM  CONST_35  H18  C21  C14  N15   180.00   0.0  0
 UOM  CONST_36  C11  N10  C09  C08     0.00   0.0  0
 UOM  CONST_37  C23  N10  C09  C08   180.00   0.0  0
 UOM  CONST_38  O24  C09  N10  C11   180.00   0.0  0
 UOM  CONST_39  O24  C09  N10  C23     0.00   0.0  0
 UOM  Var_01    C14  N13  C12  C11  -127.91  30.0  1
 UOM  Var_02    C22  N13  C12  C11    55.54  30.0  1
 UOM  Var_03    C22  C23  N10  C11   -56.07  30.0  1
 UOM  Var_04    C21  C14  N13  C12     0.76  30.0  2
 UOM  Var_05    N15  C14  N13  C12  -179.03  30.0  2
 UOM  Var_06    C23  C22  N13  C12   -56.24  30.0  1
 UOM  Var_07    C23  N10  C11  C12    55.29  30.0  1
 UOM  Var_08    C23  C22  N13  C14   127.11  30.0  1
 UOM  Var_09    C22  N13  C14  C21   176.99  30.0  2
 UOM  Var_10    N15  C14  N13  C22    -2.80  30.0  2
 UOM  Var_11    N13  C12  C11  N10   -53.91  30.0  1
 UOM  Var_12    N13  C22  C23  N10    55.22  30.0  1
 UOM  Var_13    C12  C11  N10  C09  -122.12  30.0  1
 UOM  Var_14    C22  C23  N10  C09   121.49  30.0  1
 UOM  Var_15    H21  C23  N10  C11  -177.34  30.0  1
 UOM  Var_16    H22  C23  N10  C11    64.49  30.0  1
 UOM  Var_17    H19  C22  N13  C12    64.01  30.0  1
 UOM  Var_18    H20  C22  N13  C12  -177.65  30.0  1
 UOM  Var_19    H14  C12  N13  C14    -7.28  30.0  1
 UOM  Var_20    H15  C12  N13  C14   111.40  30.0  1
 UOM  Var_21    H19  C22  N13  C14  -112.64  30.0  1
 UOM  Var_22    H20  C22  N13  C14     5.70  30.0  1
 UOM  Var_23    H14  C12  N13  C22   176.17  30.0  1
 UOM  Var_24    H15  C12  N13  C22   -65.15  30.0  1
 UOM  Var_25    H12  C11  N10  C23   -64.97  30.0  1
 UOM  Var_26    H13  C11  N10  C23   176.25  30.0  1
 UOM  Var_27    H14  C12  C11  N10  -176.60  30.0  1
 UOM  Var_28    H15  C12  C11  N10    66.61  30.0  1
 UOM  Var_29    H19  C22  C23  N10   -64.67  30.0  1
 UOM  Var_30    H20  C22  C23  N10   176.59  30.0  1
 UOM  Var_31    H12  C11  C12  N13    66.42  30.0  1
 UOM  Var_32    H13  C11  C12  N13  -176.65  30.0  1
 UOM  Var_33    H21  C23  C22  N13   176.51  30.0  1
 UOM  Var_34    H22  C23  C22  N13   -65.05  30.0  1
 UOM  Var_35    C05  C04  C02  C01    59.06  30.0  3
 UOM  Var_36    C26  C04  C02  C01  -121.74  30.0  3
 UOM  Var_37    C05  C04  C02  C03   -65.47  30.0  3
 UOM  Var_38    C26  C04  C02  C03   113.73  30.0  3
 UOM  Var_39    C09  C08  C07  C06    82.29  30.0  2
 UOM  Var_40    N10  C09  C08  C07  -174.31  30.0  1
 UOM  Var_41    C25  C07  C08  C09   -96.75  30.0  2
 UOM  Var_42    H4   C02  C04  C05   177.08  30.0  2
 UOM  Var_43    H10  C08  C07  C06   -39.54  30.0  2
 UOM  Var_44    H11  C08  C07  C06  -156.32  30.0  2
 UOM  Var_45    H12  C11  N10  C09   117.62  30.0  1
 UOM  Var_46    H13  C11  N10  C09    -1.15  30.0  1
 UOM  Var_47    H21  C23  N10  C09     0.22  30.0  1
 UOM  Var_48    H22  C23  N10  C09  -117.95  30.0  1
 UOM  Var_49    H10  C08  C07  C25   141.42  30.0  2
 UOM  Var_50    H11  C08  C07  C25    24.64  30.0  2
 UOM  Var_51    H4   C02  C04  C26    -3.72  30.0  2
 UOM  Var_52    O24  C09  C08  C07     5.08  30.0  1
 UOM  Var_53    H1   C01  C02  C04   176.69  30.0  3
 UOM  Var_54    H2   C01  C02  C04   -63.89  30.0  3
 UOM  Var_55    H3   C01  C02  C04    56.71  30.0  3
 UOM  Var_56    H5   C03  C02  C04  -177.15  30.0  3
 UOM  Var_57    H6   C03  C02  C04   -57.08  30.0  3
 UOM  Var_58    H7   C03  C02  C04    63.24  30.0  3
 UOM  Var_59    H10  C08  C09  N10   -52.13  30.0  3
 UOM  Var_60    H11  C08  C09  N10    63.79  30.0  3
 UOM  Var_61    H5   C03  C02  C01    57.75  30.0  3
 UOM  Var_62    H6   C03  C02  C01   177.82  30.0  3
 UOM  Var_63    H7   C03  C02  C01   -61.86  30.0  3
 UOM  Var_64    H1   C01  C02  C03   -58.78  30.0  3
 UOM  Var_65    H2   C01  C02  C03    60.64  30.0  3
 UOM  Var_66    H3   C01  C02  C03  -178.77  30.0  3
 UOM  Var_67    H10  C08  C09  O24   127.26  30.0  3
 UOM  Var_68    H11  C08  C09  O24  -116.82  30.0  3

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
 UOM  plan-1  C02  0.020
 UOM  plan-1  C04  0.020
 UOM  plan-1  C05  0.020
 UOM  plan-1  C06  0.020
 UOM  plan-1  C07  0.020
 UOM  plan-1  C08  0.020
 UOM  plan-1  C25  0.020
 UOM  plan-1  C26  0.020
 UOM  plan-1  H8   0.020
 UOM  plan-1  H9   0.020
 UOM  plan-1  H23  0.020
 UOM  plan-1  H24  0.020
 UOM  plan-2  C14  0.020
 UOM  plan-2  C16  0.020
 UOM  plan-2  C17  0.020
 UOM  plan-2  C18  0.020
 UOM  plan-2  C20  0.020
 UOM  plan-2  C21  0.020
 UOM  plan-2  N13  0.020
 UOM  plan-2  N15  0.020
 UOM  plan-2  N19  0.020
 UOM  plan-2  H16  0.020
 UOM  plan-2  H17  0.020
 UOM  plan-2  H18  0.020
 UOM  plan-3  C08  0.020
 UOM  plan-3  C09  0.020
 UOM  plan-3  C11  0.020
 UOM  plan-3  C23  0.020
 UOM  plan-3  N10  0.020
 UOM  plan-3  O24  0.020

