# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Thu May  7 08:00:10 2020
#   Inital geometry file: a 147 line input string
#   Ligand name: N-[(3,4-dichlorophenyl)methyl]-3-(6-fluoro-2-methylpyridin-3-yl)-5-{[(2E)-2-imino-3-methyl-2,3-dihydro-1H-imidazol-1-yl]methyl}benzamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CN1C=CN(Cc2cc(cc(c2)c3ccc(F)nc3C)C(=O)NCc4ccc(Cl)c(Cl)c4)C1=N
#
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
 HLJ  HLJ  N-[(3,4-dichlorophenyl)methyl]-3-(6-fluoro-2-methylpyridin-3-yl)-5-{[(2E)-2-imino-3-methyl-2,3-dihydro-1H-imidazol-1-yl]methyl}benzamide  ligand  56  34  .  2021-08-11  2021-08-11  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_HLJ
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
 HLJ  N1   N   NH1   0  -0.634  -1.5296  -1.5458  -1.4612
 HLJ  N3   N   NR5   0  -0.499   5.4897  -1.1553  -0.4033
 HLJ  C4   C   CR16  0  -0.276  -4.9561  -1.4370  -0.6205
 HLJ  C5   C   CR6   0   0.023  -5.8071  -1.1476   0.4378
 HLJ  C6   C   CR6   0  -0.019  -5.3956  -1.3771   1.7434
 HLJ  C7   C   CR16  0  -0.199  -4.1320  -1.9017   1.9824
 HLJ  C8   C   CR16  0  -0.293  -3.2901  -2.1912   0.9246
 HLJ  C10  C   CR16  0  -0.361   0.6478   0.1616  -0.6154
 HLJ  C13  C   CR6   0   0.235   0.7507   3.3155  -0.6617
 HLJ  C15  C   CR6   0   0.570   1.3343   4.9374   0.8173
 HLJ  C17  C   CR16  0  -0.153   2.3453   2.8433   1.0591
 HLJ  C21  C   CR5   0   0.639   5.4138  -1.8354   0.7905
 HLJ  C24  C   CR15  0  -0.119   6.5196  -0.2233  -0.3526
 HLJ  C1   C   C     0   0.535  -0.3556  -2.1009  -1.1125
 HLJ  C11  C   CR6   0   0.080   1.7534   1.0031  -0.4990
 HLJ  C12  C   CR6   0  -0.025   1.6035   2.3990  -0.0359
 HLJ  C16  C   CR16  0  -0.461   2.2222   4.1412   1.5146
 HLJ  C18  C   CR16  0  -0.336   3.0153   0.4970  -0.7882
 HLJ  C19  C   CR6   0   0.165   3.1860  -0.8268  -1.1818
 HLJ  C2   C   CH2   0  -0.387  -2.7749  -2.2730  -1.5434
 HLJ  C23  C   CR15  0  -0.117   7.0901  -0.3253   0.8568
 HLJ  C25  C   CR16  0  -0.353   2.0771  -1.6499  -1.2858
 HLJ  C3   C   CR6   0   0.136  -3.6938  -1.9615  -0.3886
 HLJ  C9   C   CR6   0   0.012   0.8018  -1.1575  -1.0192
 HLJ  F1   F   F     0  -0.301   1.1605   6.2038   1.2074
 HLJ  N2   N   N     0  -0.447   0.6361   4.5685  -0.2151
 HLJ  N4   N   NR5   0  -0.490   6.4159  -1.3094   1.5597
 HLJ  N5   N   N     0  -0.746   4.6226  -2.7725   1.1829
 HLJ  O1   O   O     0  -0.485  -0.2140  -3.2941  -0.8866
 HLJ  CL2  CL  CL    0  -0.097  -6.4327  -1.0198   3.0710
 HLJ  H1   H   HNH1  0   0.408  -1.5577  -0.5713  -1.7126
 HLJ  H2   H   HCR6  0   0.286  -5.2872  -1.2462  -1.6332
 HLJ  H3   H   HCR6  0   0.290  -3.8126  -2.0841   2.9991
 HLJ  H4   H   HCR6  0   0.268  -2.3125  -2.6068   1.1339
 HLJ  H5   H   HCR6  0   0.264  -0.3284   0.5362  -0.3333
 HLJ  H6   H   HCR6  0   0.279   3.0149   2.1620   1.5681
 HLJ  H7   H   HCH2  0   0.295   4.9740  -0.8535  -2.3666
 HLJ  H8   H   HCH2  0   0.280   4.5117  -2.4190  -1.7366
 HLJ  H9   H   HCH3  0   0.253   7.5114  -1.1742   3.3049
 HLJ  H10  H   HCH3  0   0.244   5.8214  -1.6385   3.5384
 HLJ  H11  H   HCH3  0   0.243   6.9797  -2.8129   2.9050
 HLJ  H12  H   HCR5  0   0.294   6.7518   0.4184  -1.1849
 HLJ  H13  H   HCH3  0   0.259  -1.0262   2.5294  -1.5764
 HLJ  H14  H   HCH3  0   0.266  -0.2925   3.8745  -2.4338
 HLJ  H15  H   HCH3  0   0.255   0.4337   2.2622  -2.5195
 HLJ  H16  H   HCR6  0   0.291   2.7782   4.5103   2.3646
 HLJ  H17  H   HCR6  0   0.261   3.8779   1.1496  -0.7128
 HLJ  H18  H   HCH2  0   0.280  -3.2642  -2.0267  -2.4860
 HLJ  H19  H   HCH2  0   0.279  -2.5505  -3.3387  -1.5666
 HLJ  H20  H   HCR5  0   0.292   7.9200   0.2125   1.2819
 HLJ  H21  H   HCR6  0   0.266   2.2013  -2.6846  -1.5819
 HLJ  H22  H   H     0   0.322   3.9464  -3.0084   0.4685
 HLJ  CL1  CL  CL    0  -0.097  -7.3678  -0.4962   0.1096
 HLJ  C20  C   CH2   0  -0.423   4.5668  -1.3557  -1.4885
 HLJ  C14  C   CH3   0  -0.745  -0.0711   2.9725  -1.8665
 HLJ  C22  C   CH3   0  -0.508   6.6933  -1.7610   2.8961

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
 HLJ  C22  N4   single    1.438  0.020  1.438
 HLJ  C23  N4   single    1.385  0.020  1.385
 HLJ  C23  C24  double    1.341  0.020  1.341
 HLJ  N4   C21  single    1.368  0.020  1.368
 HLJ  C24  N3   single    1.390  0.020  1.390
 HLJ  C21  N3   single    1.376  0.020  1.376
 HLJ  C21  N5   double    1.288  0.020  1.288
 HLJ  N3   C20  single    1.439  0.020  1.439
 HLJ  C20  C19  single    1.510  0.020  1.510
 HLJ  C18  C19  aromatic  1.392  0.020  1.392
 HLJ  C18  C11  aromatic  1.390  0.020  1.390
 HLJ  F1   C15  single    1.336  0.020  1.336
 HLJ  C19  C25  aromatic  1.385  0.020  1.385
 HLJ  C15  C16  aromatic  1.382  0.020  1.382
 HLJ  C15  N2   aromatic  1.300  0.020  1.300
 HLJ  C16  C17  aromatic  1.381  0.020  1.381
 HLJ  N2   C13  aromatic  1.335  0.020  1.335
 HLJ  C13  C14  single    1.498  0.020  1.498
 HLJ  C13  C12  aromatic  1.400  0.020  1.400
 HLJ  C17  C12  aromatic  1.395  0.020  1.395
 HLJ  C12  C11  single    1.478  0.020  1.478
 HLJ  C11  C10  aromatic  1.394  0.020  1.394
 HLJ  C25  C9   aromatic  1.393  0.020  1.393
 HLJ  C10  C9   aromatic  1.388  0.020  1.388
 HLJ  C9   C1   single    1.496  0.020  1.496
 HLJ  C1   O1   double    1.223  0.020  1.223
 HLJ  C1   N1   single    1.345  0.020  1.345
 HLJ  CL1  C5   single    1.723  0.020  1.723
 HLJ  N1   C2   single    1.444  0.020  1.444
 HLJ  C5   C4   aromatic  1.389  0.020  1.389
 HLJ  C5   C6   aromatic  1.388  0.020  1.388
 HLJ  C4   C3   aromatic  1.386  0.020  1.386
 HLJ  CL2  C6   single    1.722  0.020  1.722
 HLJ  C6   C7   aromatic  1.389  0.020  1.389
 HLJ  C3   C2   single    1.508  0.020  1.508
 HLJ  C3   C8   aromatic  1.393  0.020  1.393
 HLJ  C7   C8   aromatic  1.383  0.020  1.383
 HLJ  N1   H1   single    0.860  0.020  1.020
 HLJ  C4   H2   single    0.930  0.020  1.080
 HLJ  C7   H3   single    0.930  0.020  1.080
 HLJ  C8   H4   single    0.930  0.020  1.080
 HLJ  C10  H5   single    0.930  0.020  1.080
 HLJ  C17  H6   single    0.930  0.020  1.080
 HLJ  C20  H7   single    0.970  0.020  1.090
 HLJ  C20  H8   single    0.970  0.020  1.090
 HLJ  C22  H9   single    0.970  0.020  1.090
 HLJ  C22  H10  single    0.970  0.020  1.090
 HLJ  C22  H11  single    0.970  0.020  1.090
 HLJ  C24  H12  single    0.930  0.020  1.080
 HLJ  C14  H13  single    0.970  0.020  1.090
 HLJ  C14  H14  single    0.970  0.020  1.090
 HLJ  C14  H15  single    0.970  0.020  1.090
 HLJ  C16  H16  single    0.930  0.020  1.080
 HLJ  C18  H17  single    0.930  0.020  1.080
 HLJ  C2   H18  single    0.970  0.020  1.090
 HLJ  C2   H19  single    0.970  0.020  1.090
 HLJ  C23  H20  single    0.930  0.020  1.080
 HLJ  C25  H21  single    0.930  0.020  1.080
 HLJ  N5   H22  single    0.890  0.020  1.040

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
 HLJ  H1   N1   C2   116.68  3.000
 HLJ  H1   N1   C1   119.26  3.000
 HLJ  C2   N1   C1   124.03  3.000
 HLJ  C24  N3   C21  109.91  3.000
 HLJ  C21  N3   C20  123.39  3.000
 HLJ  C24  N3   C20  126.60  3.000
 HLJ  H2   C4   C3   120.11  3.000
 HLJ  H2   C4   C5   119.26  3.000
 HLJ  C3   C4   C5   120.62  3.000
 HLJ  CL1  C5   C6   120.69  3.000
 HLJ  C6   C5   C4   120.05  3.000
 HLJ  CL1  C5   C4   119.26  3.000
 HLJ  CL2  C6   C7   119.58  3.000
 HLJ  C7   C6   C5   119.61  3.000
 HLJ  CL2  C6   C5   120.82  3.000
 HLJ  H3   C7   C8   120.28  3.000
 HLJ  H3   C7   C6   119.63  3.000
 HLJ  C8   C7   C6   120.10  3.000
 HLJ  H4   C8   C3   120.48  3.000
 HLJ  H4   C8   C7   118.84  3.000
 HLJ  C3   C8   C7   120.68  3.000
 HLJ  H5   C10  C9   120.30  3.000
 HLJ  H5   C10  C11  118.96  3.000
 HLJ  C9   C10  C11  120.65  3.000
 HLJ  N2   C13  C14  115.90  3.000
 HLJ  C14  C13  C12  122.95  3.000
 HLJ  N2   C13  C12  121.15  3.000
 HLJ  N2   C15  F1   115.53  3.000
 HLJ  N2   C15  C16  125.63  3.000
 HLJ  F1   C15  C16  118.84  3.000
 HLJ  H6   C17  C16  119.44  3.000
 HLJ  H6   C17  C12  119.83  3.000
 HLJ  C16  C17  C12  120.72  3.000
 HLJ  N5   C21  N4   123.95  3.000
 HLJ  N5   C21  N3   131.14  3.000
 HLJ  N4   C21  N3   104.91  3.000
 HLJ  H12  C24  C23  130.61  3.000
 HLJ  H12  C24  N3   122.10  3.000
 HLJ  C23  C24  N3   107.28  3.000
 HLJ  O1   C1   C9   120.95  3.000
 HLJ  O1   C1   N1   123.50  3.000
 HLJ  C9   C1   N1   115.55  3.000
 HLJ  C18  C11  C12  120.07  3.000
 HLJ  C12  C11  C10  121.04  3.000
 HLJ  C18  C11  C10  118.86  3.000
 HLJ  C11  C12  C17  119.51  3.000
 HLJ  C11  C12  C13  122.68  3.000
 HLJ  C17  C12  C13  117.80  3.000
 HLJ  H16  C16  C17  122.32  3.000
 HLJ  H16  C16  C15  122.06  3.000
 HLJ  C17  C16  C15  115.62  3.000
 HLJ  H17  C18  C19  119.65  3.000
 HLJ  H17  C18  C11  119.25  3.000
 HLJ  C19  C18  C11  121.10  3.000
 HLJ  C25  C19  C18  119.23  3.000
 HLJ  C25  C19  C20  120.58  3.000
 HLJ  C18  C19  C20  120.18  3.000
 HLJ  H19  C2   H18  107.16  3.000
 HLJ  H19  C2   C3   110.11  3.000
 HLJ  H18  C2   C3   109.99  3.000
 HLJ  H19  C2   N1   108.43  3.000
 HLJ  H18  C2   N1   108.81  3.000
 HLJ  C3   C2   N1   112.19  3.000
 HLJ  H20  C23  N4   122.01  3.000
 HLJ  H20  C23  C24  130.25  3.000
 HLJ  N4   C23  C24  107.74  3.000
 HLJ  H21  C25  C9   119.67  3.000
 HLJ  H21  C25  C19  119.76  3.000
 HLJ  C9   C25  C19  120.58  3.000
 HLJ  C2   C3   C8   120.75  3.000
 HLJ  C8   C3   C4   118.94  3.000
 HLJ  C2   C3   C4   120.31  3.000
 HLJ  C25  C9   C1   118.26  3.000
 HLJ  C1   C9   C10  122.11  3.000
 HLJ  C25  C9   C10  119.55  3.000
 HLJ  C15  N2   C13  119.07  3.000
 HLJ  C23  N4   C22  126.95  3.000
 HLJ  C23  N4   C21  110.15  3.000
 HLJ  C22  N4   C21  122.89  3.000
 HLJ  H22  N5   C21  111.42  3.000
 HLJ  H8   C20  H7   106.50  3.000
 HLJ  H8   C20  C19  109.92  3.000
 HLJ  H7   C20  C19  110.10  3.000
 HLJ  H8   C20  N3   109.81  3.000
 HLJ  H7   C20  N3   107.69  3.000
 HLJ  C19  C20  N3   112.62  3.000
 HLJ  H15  C14  H14  108.81  3.000
 HLJ  H15  C14  H13  107.46  3.000
 HLJ  H14  C14  H13  107.26  3.000
 HLJ  H15  C14  C13  112.17  3.000
 HLJ  H14  C14  C13  109.94  3.000
 HLJ  H13  C14  C13  111.04  3.000
 HLJ  H11  C22  H10  108.28  3.000
 HLJ  H11  C22  H9   108.67  3.000
 HLJ  H10  C22  H9   108.66  3.000
 HLJ  H11  C22  N4   111.18  3.000
 HLJ  H10  C22  N4   110.99  3.000
 HLJ  H9   C22  N4   108.99  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
 HLJ  CONST_01  C7   C6   C5   C4      0.00   0.0  0
 HLJ  CONST_02  C7   C8   C3   C4      0.00   0.0  0
 HLJ  CONST_03  C8   C3   C4   C5      0.00   0.0  0
 HLJ  CONST_04  C8   C7   C6   C5      0.00   0.0  0
 HLJ  CONST_05  C3   C4   C5   C6      0.00   0.0  0
 HLJ  CONST_06  C3   C8   C7   C6      0.00   0.0  0
 HLJ  CONST_07  C19  C18  C11  C10     0.00   0.0  0
 HLJ  CONST_10  C19  C25  C9   C10     0.00   0.0  0
 HLJ  CONST_11  C16  C15  N2   C13     0.00   0.0  0
 HLJ  CONST_12  C16  C17  C12  C13     0.00   0.0  0
 HLJ  CONST_14  C12  C17  C16  C15     0.00   0.0  0
 HLJ  CONST_15  C12  C13  N2   C15     0.00   0.0  0
 HLJ  CONST_16  N2   C15  C16  C17     0.00   0.0  0
 HLJ  CONST_17  N2   C13  C12  C17     0.00   0.0  0
 HLJ  CONST_19  C25  C19  C18  C11     0.00   0.0  0
 HLJ  CONST_20  N2   C13  C12  C11   180.00   0.0  0
 HLJ  CONST_21  C16  C17  C12  C11   180.00   0.0  0
 HLJ  CONST_22  C25  C9   C10  C11     0.00   0.0  0
 HLJ  CONST_23  C19  C18  C11  C12   180.00   0.0  0
 HLJ  CONST_24  C9   C10  C11  C12   180.00   0.0  0
 HLJ  CONST_25  C9   C25  C19  C18     0.00   0.0  0
 HLJ  CONST_26  C9   C10  C11  C18     0.00   0.0  0
 HLJ  CONST_27  N4   C23  C24  N3      0.00   0.0  0
 HLJ  CONST_28  C23  N4   C21  N3      0.00   0.0  0
 HLJ  CONST_29  C24  C23  N4   C21     0.00   0.0  0
 HLJ  CONST_30  C23  C24  N3   C21     0.00   0.0  0
 HLJ  CONST_31  N4   C21  N3   C24     0.00   0.0  0
 HLJ  CONST_32  CL2  C6   C5   C4    180.00   0.0  0
 HLJ  CONST_33  C2   C3   C4   C5    180.00   0.0  0
 HLJ  CONST_34  CL1  C5   C6   C7    180.00   0.0  0
 HLJ  CONST_35  C2   C3   C8   C7    180.00   0.0  0
 HLJ  CONST_36  CL2  C6   C7   C8    180.00   0.0  0
 HLJ  CONST_37  F1   C15  N2   C13   180.00   0.0  0
 HLJ  CONST_38  C14  C13  N2   C15   180.00   0.0  0
 HLJ  CONST_39  F1   C15  C16  C17   180.00   0.0  0
 HLJ  CONST_40  C14  C13  C12  C17   180.00   0.0  0
 HLJ  CONST_41  C11  C18  C19  C20   180.00   0.0  0
 HLJ  CONST_42  C9   C25  C19  C20   180.00   0.0  0
 HLJ  CONST_43  C19  C25  C9   C1    180.00   0.0  0
 HLJ  CONST_44  C11  C10  C9   C1    180.00   0.0  0
 HLJ  CONST_45  C14  C13  C12  C11     0.00   0.0  0
 HLJ  CONST_46  CL1  C5   C4   C3    180.00   0.0  0
 HLJ  CONST_47  C22  N4   C21  N3    180.00   0.0  0
 HLJ  CONST_48  C23  C24  N3   C20   180.00   0.0  0
 HLJ  CONST_49  N4   C21  N3   C20   180.00   0.0  0
 HLJ  CONST_50  C24  C23  N4   C22   180.00   0.0  0
 HLJ  CONST_51  N5   C21  N3   C24   180.00   0.0  0
 HLJ  CONST_52  N5   C21  N4   C23   180.00   0.0  0
 HLJ  CONST_53  H4   C8   C3   C4    180.00   0.0  0
 HLJ  CONST_54  H3   C7   C6   C5    180.00   0.0  0
 HLJ  CONST_55  H2   C4   C5   C6    180.00   0.0  0
 HLJ  CONST_56  H17  C18  C11  C10   180.00   0.0  0
 HLJ  CONST_57  H21  C25  C9   C10   180.00   0.0  0
 HLJ  CONST_58  H6   C17  C12  C13   180.00   0.0  0
 HLJ  CONST_59  H16  C16  C17  C12   180.00   0.0  0
 HLJ  CONST_60  H5   C10  C11  C12     0.00   0.0  0
 HLJ  CONST_61  N5   C21  N3   C20     0.00   0.0  0
 HLJ  CONST_62  N5   C21  N4   C22     0.00   0.0  0
 HLJ  CONST_63  H22  N5   C21  N3      0.00   0.0  0
 HLJ  CONST_64  C9   C1   N1   C2    180.00   0.0  0
 HLJ  CONST_65  H1   N1   C1   C9      0.00   0.0  0
 HLJ  CONST_66  O1   C1   N1   C2      0.00   0.0  0
 HLJ  Var_01    C18  C19  C20  N3     54.75  30.0  2
 HLJ  Var_02    C19  C20  N3   C21    69.88  30.0  3
 HLJ  Var_03    C25  C9   C1   N1   -150.48  30.0  3
 HLJ  Var_04    C4   C3   C2   N1    121.14  30.0  2
 HLJ  Var_05    H9   C22  N4   C21  -178.44  30.0  3
 HLJ  Var_06    H13  C14  C13  C12    86.57  30.0  2
 HLJ  Var_07    C3   C2   N1   C1    105.67  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
 HLJ  plan-1  N3   0.020
 HLJ  plan-1  C21  0.020
 HLJ  plan-1  C24  0.020
 HLJ  plan-1  C23  0.020
 HLJ  plan-1  N4   0.020
 HLJ  plan-1  N5   0.020
 HLJ  plan-1  H12  0.020
 HLJ  plan-1  H20  0.020
 HLJ  plan-1  H22  0.020
 HLJ  plan-1  C20  0.020
 HLJ  plan-1  C22  0.020
 HLJ  plan-2  C4   0.020
 HLJ  plan-2  C5   0.020
 HLJ  plan-2  C6   0.020
 HLJ  plan-2  C7   0.020
 HLJ  plan-2  C8   0.020
 HLJ  plan-2  C2   0.020
 HLJ  plan-2  C3   0.020
 HLJ  plan-2  CL2  0.020
 HLJ  plan-2  H2   0.020
 HLJ  plan-2  H3   0.020
 HLJ  plan-2  H4   0.020
 HLJ  plan-2  CL1  0.020
 HLJ  plan-3  C13  0.020
 HLJ  plan-3  C15  0.020
 HLJ  plan-3  C17  0.020
 HLJ  plan-3  C11  0.020
 HLJ  plan-3  C12  0.020
 HLJ  plan-3  C16  0.020
 HLJ  plan-3  F1   0.020
 HLJ  plan-3  N2   0.020
 HLJ  plan-3  H6   0.020
 HLJ  plan-3  H16  0.020
 HLJ  plan-3  C14  0.020
 HLJ  plan-4  C10  0.020
 HLJ  plan-4  C1   0.020
 HLJ  plan-4  C11  0.020
 HLJ  plan-4  C12  0.020
 HLJ  plan-4  C18  0.020
 HLJ  plan-4  C19  0.020
 HLJ  plan-4  C25  0.020
 HLJ  plan-4  C9   0.020
 HLJ  plan-4  H5   0.020
 HLJ  plan-4  H17  0.020
 HLJ  plan-4  H21  0.020
 HLJ  plan-4  C20  0.020
 HLJ  plan-5  N1   0.020
 HLJ  plan-5  C1   0.020
 HLJ  plan-5  C2   0.020
 HLJ  plan-5  C9   0.020
 HLJ  plan-5  O1   0.020
 HLJ  plan-5  H1   0.020

