# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Thu May  7 06:16:07 2020
#   Inital geometry file: a 143 line input string
#   Ligand name: N-[1-(3-fluorobenzyl)-1H-indazol-5-yl]-5-[(piperidin-1-ylamino)methyl]pyrimidine-4,6-diamine
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: Nc1ncnc(Nc2ccc3n(Cc4cccc(F)c4)ncc3c2)c1CNN5CCCCC5
#
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
 HYZ  HYZ  N-[1-(3-fluorobenzyl)-1H-indazol-5-yl]-5-[(piperidin-1-ylamino)methyl]pyrimidine-4,6-diamine  ligand  60  33  .  2021-08-11  2021-08-11  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK
;

data_comp_HYZ
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
 HYZ  C1    C  CR16  0  -0.419  -5.9266  -2.3031   1.9020
 HYZ  C2    C  CR16  0  -0.225  -6.3272  -1.0417   1.4775
 HYZ  C3    C  CR16  0  -0.297  -5.9075  -0.5400   0.2557
 HYZ  C8    C  CR15  0  -0.118  -3.2455   2.4548  -1.4536
 HYZ  C9    C  CR56  0  -0.085  -2.0591   1.7296  -1.1616
 HYZ  C10   C  CR56  0   0.450  -2.4336   0.3907  -1.3368
 HYZ  C11   C  CR16  0  -0.281  -1.5204  -0.6488  -1.1357
 HYZ  C12   C  CR16  0  -0.375  -0.2482  -0.2965  -0.7631
 HYZ  C13   C  CR6   0   0.375   0.1573   1.0547  -0.5836
 HYZ  C14   C  CR16  0  -0.404  -0.7539   2.0759  -0.7860
 HYZ  C15   C  CR6   0   0.444   4.1420   3.3498   1.0201
 HYZ  C16   C  CR6   0  -0.167   3.5439   2.2439   0.4072
 HYZ  C19   C  CH2   0  -0.337   4.3199   1.0843  -0.1536
 HYZ  C20   C  CH2   0  -0.443   4.2392  -3.5958  -0.9411
 HYZ  C21   C  CH2   0  -0.276   3.6008  -2.4298  -0.2019
 HYZ  C22   C  CH2   0  -0.297   5.7602  -1.5981   0.4779
 HYZ  C24   C  CH2   0  -0.442   5.5818  -3.9663  -0.3237
 HYZ  C4    C  CR6   0   0.134  -5.0745  -1.2974  -0.5648
 HYZ  C5    C  CR16  0  -0.469  -4.6680  -2.5595  -0.1503
 HYZ  C6    C  CR6   0   0.543  -5.1033  -3.0364   1.0729
 HYZ  F1    F  F     0  -0.315  -4.7063  -4.2582   1.4641
 HYZ  N1    N  NR5   0  -0.387  -3.7374   0.3982  -1.7183
 HYZ  N2    N  N     0  -0.241  -4.2228   1.6418  -1.7717
 HYZ  N4    N  N     0  -0.474   3.4227   4.4231   1.3982
 HYZ  C17   C  CR6   0   0.511   2.1449   2.3107   0.2655
 HYZ  N5    N  N     0  -0.486   1.4414   3.3888   0.6246
 HYZ  C18   C  CR16  0   0.066   2.1315   4.3788   1.1589
 HYZ  N7    N  NH1   0  -0.483   3.8461  -0.1810   0.3941
 HYZ  N8    N  NT    0  -0.291   4.4973  -1.2860  -0.1776
 HYZ  C23   C  CH2   0  -0.439   6.4740  -2.7342  -0.2400
 HYZ  H1    H  HCR6  0   0.282  -6.2507  -2.7043   2.8530
 HYZ  H2    H  HCR6  0   0.271  -6.9776  -0.4515   2.1089
 HYZ  H3    H  HCR6  0   0.260  -6.2288   0.4441  -0.0617
 HYZ  HN6   H  HNH2  0   0.397   6.0450   2.6213   1.2635
 HYZ  HN6A  H  HNH2  0   0.391   5.7761   4.1925   1.8365
 HYZ  H7    H  HCH2  0   0.283  -4.0718  -1.5068  -2.4557
 HYZ  H7A   H  HCH2  0   0.298  -5.4479  -0.4177  -2.4931
 HYZ  H8    H  HCR5  0   0.268  -3.4007   3.5231  -1.4449
 HYZ  H11   H  HCR6  0   0.269  -1.7865  -1.6895  -1.2634
 HYZ  H12   H  HCR6  0   0.269   0.4791  -1.0839  -0.6026
 HYZ  H14   H  HCR6  0   0.274  -0.4747   3.1085  -0.6526
 HYZ  H19   H  HCH2  0   0.260   4.1690   1.0383  -1.2364
 HYZ  H19A  H  HCH2  0   0.225   5.3966   1.2258  -0.0107
 HYZ  H20   H  HCH2  0   0.234   3.5546  -4.4461  -0.9257
 HYZ  H20A  H  HCH2  0   0.219   4.3800  -3.3177  -1.9898
 HYZ  H21   H  HCH2  0   0.240   2.6795  -2.1290  -0.7040
 HYZ  H21A  H  HCH2  0   0.190   3.3244  -2.7467   0.8181
 HYZ  H22   H  HCH2  0   0.239   6.3907  -0.7065   0.4735
 HYZ  H22A  H  HCH2  0   0.195   5.5972  -1.8751   1.5345
 HYZ  H24   H  HCH2  0   0.213   5.4220  -4.3684   0.6827
 HYZ  H24A  H  HCH2  0   0.234   6.0667  -4.7537  -0.9043
 HYZ  H5    H  HCR6  0   0.279  -4.0212  -3.1689  -0.7701
 HYZ  HN3   H  HNH1  0   0.427   2.0662   0.3831  -0.2082
 HYZ  H18   H  HCR6  0   0.248   1.5607   5.2579   1.4438
 HYZ  HN7   H  HNH1  0   0.350   3.9392  -0.1823   1.4104
 HYZ  H23   H  HCH2  0   0.221   6.7472  -2.4049  -1.2468
 HYZ  H23A  H  HCH2  0   0.235   7.4047  -2.9616   0.2840
 HYZ  C7    C  CH2   0  -0.407  -4.6035  -0.7431  -1.8863
 HYZ  N3    N  NH1   0  -0.801   1.4984   1.2302  -0.2482
 HYZ  N6    N  NH2   0  -0.834   5.4770   3.4493   1.2273

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
 HYZ  C1   C2    aromatic  1.390  0.020  1.390
 HYZ  C6   C1    aromatic  1.379  0.020  1.379
 HYZ  C1   H1    single    0.930  0.020  1.080
 HYZ  C2   C3    aromatic  1.386  0.020  1.386
 HYZ  C2   H2    single    0.930  0.020  1.080
 HYZ  C3   C4    aromatic  1.393  0.020  1.393
 HYZ  C3   H3    single    0.930  0.020  1.080
 HYZ  N6   C15   single    1.355  0.020  1.355
 HYZ  N6   HN6   single    0.890  0.020  1.040
 HYZ  N6   HN6A  single    0.890  0.020  1.040
 HYZ  N1   C7    single    1.443  0.020  1.443
 HYZ  C4   C7    single    1.508  0.020  1.508
 HYZ  C7   H7    single    0.970  0.020  1.090
 HYZ  C7   H7A   single    0.970  0.020  1.090
 HYZ  C9   C8    aromatic  1.421  0.020  1.421
 HYZ  C8   N2    aromatic  1.310  0.020  1.310
 HYZ  C8   H8    single    0.930  0.020  1.080
 HYZ  C14  C9    aromatic  1.402  0.020  1.402
 HYZ  C9   C10   aromatic  1.401  0.020  1.401
 HYZ  C11  C10   aromatic  1.398  0.020  1.398
 HYZ  C10  N1    aromatic  1.358  0.020  1.358
 HYZ  C12  C11   aromatic  1.372  0.020  1.372
 HYZ  C11  H11   single    0.930  0.020  1.080
 HYZ  C13  C12   aromatic  1.422  0.020  1.422
 HYZ  C12  H12   single    0.930  0.020  1.080
 HYZ  N3   C13   single    1.393  0.020  1.393
 HYZ  C13  C14   aromatic  1.383  0.020  1.383
 HYZ  C14  H14   single    0.930  0.020  1.080
 HYZ  C15  C16   aromatic  1.399  0.020  1.399
 HYZ  C15  N4    aromatic  1.346  0.020  1.346
 HYZ  C19  C16   single    1.504  0.020  1.504
 HYZ  C16  C17   aromatic  1.408  0.020  1.408
 HYZ  N7   C19   single    1.458  0.020  1.458
 HYZ  C19  H19   single    0.970  0.020  1.090
 HYZ  C19  H19A  single    0.970  0.020  1.090
 HYZ  C20  C21   single    1.521  0.020  1.521
 HYZ  C20  C24   single    1.523  0.020  1.523
 HYZ  C20  H20   single    0.970  0.020  1.090
 HYZ  C20  H20A  single    0.970  0.020  1.090
 HYZ  C21  N8    single    1.453  0.020  1.453
 HYZ  C21  H21   single    0.970  0.020  1.090
 HYZ  C21  H21A  single    0.970  0.020  1.090
 HYZ  N8   C22   single    1.457  0.020  1.457
 HYZ  C23  C22   single    1.522  0.020  1.522
 HYZ  C22  H22   single    0.970  0.020  1.090
 HYZ  C22  H22A  single    0.970  0.020  1.090
 HYZ  C24  C23   single    1.524  0.020  1.524
 HYZ  C24  H24   single    0.970  0.020  1.090
 HYZ  C24  H24A  single    0.970  0.020  1.090
 HYZ  C4   C5    aromatic  1.389  0.020  1.389
 HYZ  C5   C6    aromatic  1.383  0.020  1.383
 HYZ  C5   H5    single    0.930  0.020  1.080
 HYZ  F1   C6    single    1.343  0.020  1.343
 HYZ  N1   N2    aromatic  1.336  0.020  1.336
 HYZ  C17  N3    single    1.360  0.020  1.360
 HYZ  N3   HN3   single    0.860  0.020  1.020
 HYZ  N4   C18   aromatic  1.314  0.020  1.314
 HYZ  C17  N5    aromatic  1.337  0.020  1.337
 HYZ  C18  N5    aromatic  1.320  0.020  1.320
 HYZ  C18  H18   single    0.930  0.020  1.080
 HYZ  N8   N7    single    1.404  0.020  1.404
 HYZ  N7   HN7   single    0.890  0.020  1.040
 HYZ  C23  H23   single    0.970  0.020  1.090
 HYZ  C23  H23A  single    0.970  0.020  1.090

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
 HYZ  H1    C1   C6   120.67  3.000
 HYZ  H1    C1   C2   121.24  3.000
 HYZ  C6    C1   C2   118.09  3.000
 HYZ  H2    C2   C3   119.94  3.000
 HYZ  H2    C2   C1   119.36  3.000
 HYZ  C3    C2   C1   120.70  3.000
 HYZ  H3    C3   C4   119.93  3.000
 HYZ  H3    C3   C2   119.84  3.000
 HYZ  C4    C3   C2   120.23  3.000
 HYZ  H8    C8   N2   120.58  3.000
 HYZ  H8    C8   C9   128.57  3.000
 HYZ  N2    C8   C9   110.85  3.000
 HYZ  C14   C9   C10  121.22  3.000
 HYZ  C10   C9   C8   103.82  3.000
 HYZ  C14   C9   C8   134.95  3.000
 HYZ  N1    C10  C11  132.17  3.000
 HYZ  N1    C10  C9   106.63  3.000
 HYZ  C11   C10  C9   121.19  3.000
 HYZ  H11   C11  C12  120.48  3.000
 HYZ  H11   C11  C10  122.52  3.000
 HYZ  C12   C11  C10  117.00  3.000
 HYZ  H12   C12  C13  118.70  3.000
 HYZ  H12   C12  C11  118.43  3.000
 HYZ  C13   C12  C11  122.87  3.000
 HYZ  N3    C13  C14  125.18  3.000
 HYZ  C14   C13  C12  119.67  3.000
 HYZ  N3    C13  C12  115.12  3.000
 HYZ  H14   C14  C13  121.22  3.000
 HYZ  H14   C14  C9   120.73  3.000
 HYZ  C13   C14  C9   118.04  3.000
 HYZ  N4    C15  C16  121.67  3.000
 HYZ  N4    C15  N6   115.15  3.000
 HYZ  C16   C15  N6   123.13  3.000
 HYZ  C17   C16  C19  120.79  3.000
 HYZ  C17   C16  C15  115.57  3.000
 HYZ  C19   C16  C15  123.54  3.000
 HYZ  H19A  C19  H19  105.67  3.000
 HYZ  H19A  C19  N7   112.49  3.000
 HYZ  H19   C19  N7   106.89  3.000
 HYZ  H19A  C19  C16  111.04  3.000
 HYZ  H19   C19  C16  109.29  3.000
 HYZ  N7    C19  C16  111.19  3.000
 HYZ  H20A  C20  H20  106.99  3.000
 HYZ  H20A  C20  C24  109.69  3.000
 HYZ  H20   C20  C24  110.94  3.000
 HYZ  H20A  C20  C21  108.97  3.000
 HYZ  H20   C20  C21  109.09  3.000
 HYZ  C24   C20  C21  111.06  3.000
 HYZ  H21A  C21  H21  107.03  3.000
 HYZ  H21A  C21  N8   111.41  3.000
 HYZ  H21   C21  N8   108.14  3.000
 HYZ  H21A  C21  C20  109.53  3.000
 HYZ  H21   C21  C20  110.00  3.000
 HYZ  N8    C21  C20  110.65  3.000
 HYZ  H22A  C22  H22  107.09  3.000
 HYZ  H22A  C22  C23  109.47  3.000
 HYZ  H22   C22  C23  109.68  3.000
 HYZ  H22A  C22  N8   110.87  3.000
 HYZ  H22   C22  N8   108.89  3.000
 HYZ  C23   C22  N8   110.75  3.000
 HYZ  H24A  C24  H24  106.77  3.000
 HYZ  H24A  C24  C23  110.63  3.000
 HYZ  H24   C24  C23  109.38  3.000
 HYZ  H24A  C24  C20  110.57  3.000
 HYZ  H24   C24  C20  109.46  3.000
 HYZ  C23   C24  C20  109.98  3.000
 HYZ  C5    C4   C7   120.25  3.000
 HYZ  C5    C4   C3   119.55  3.000
 HYZ  C7    C4   C3   120.19  3.000
 HYZ  H5    C5   C6   119.99  3.000
 HYZ  H5    C5   C4   121.00  3.000
 HYZ  C6    C5   C4   119.01  3.000
 HYZ  F1    C6   C5   118.57  3.000
 HYZ  F1    C6   C1   119.01  3.000
 HYZ  C5    C6   C1   122.42  3.000
 HYZ  N2    N1   C10  111.41  3.000
 HYZ  N2    N1   C7   120.91  3.000
 HYZ  C10   N1   C7   127.19  3.000
 HYZ  N1    N2   C8   107.27  3.000
 HYZ  C18   N4   C15  116.55  3.000
 HYZ  N5    C17  N3   119.48  3.000
 HYZ  N5    C17  C16  122.30  3.000
 HYZ  N3    C17  C16  118.22  3.000
 HYZ  C18   N5   C17  116.02  3.000
 HYZ  H18   C18  N5   116.01  3.000
 HYZ  H18   C18  N4   116.19  3.000
 HYZ  N5    C18  N4   127.80  3.000
 HYZ  HN7   N7   N8   111.23  3.000
 HYZ  HN7   N7   C19  110.21  3.000
 HYZ  N8    N7   C19  112.28  3.000
 HYZ  N7    N8   C22  112.80  3.000
 HYZ  N7    N8   C21  109.88  3.000
 HYZ  C22   N8   C21  111.94  3.000
 HYZ  H23A  C23  H23  106.95  3.000
 HYZ  H23A  C23  C24  110.92  3.000
 HYZ  H23   C23  C24  109.83  3.000
 HYZ  H23A  C23  C22  109.20  3.000
 HYZ  H23   C23  C22  109.06  3.000
 HYZ  C24   C23  C22  110.79  3.000
 HYZ  H7A   C7   H7   107.22  3.000
 HYZ  H7A   C7   N1   107.09  3.000
 HYZ  H7    C7   N1   108.79  3.000
 HYZ  H7A   C7   C4   110.83  3.000
 HYZ  H7    C7   C4   110.62  3.000
 HYZ  N1    C7   C4   112.10  3.000
 HYZ  HN3   N3   C17  112.34  3.000
 HYZ  HN3   N3   C13  116.13  3.000
 HYZ  C17   N3   C13  130.43  3.000
 HYZ  HN6A  N6   HN6  114.75  3.000
 HYZ  HN6A  N6   C15  116.09  3.000
 HYZ  HN6   N6   C15  120.14  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
 HYZ  CONST_01  C4    C3   C2   C1      0.00   0.0  0
 HYZ  CONST_02  C4    C5   C6   C1      0.00   0.0  0
 HYZ  CONST_03  C5    C6   C1   C2      0.00   0.0  0
 HYZ  CONST_04  C5    C4   C3   C2      0.00   0.0  0
 HYZ  CONST_05  C6    C1   C2   C3      0.00   0.0  0
 HYZ  CONST_06  C6    C5   C4   C3      0.00   0.0  0
 HYZ  CONST_07  C13   C14  C9   C8    180.00   0.0  0
 HYZ  CONST_08  C11   C10  C9   C8    180.00   0.0  0
 HYZ  CONST_09  N1    C10  C9   C8      0.00   0.0  0
 HYZ  CONST_10  C10   N1   N2   C8      0.00   0.0  0
 HYZ  CONST_11  N1    N2   C8   C9      0.00   0.0  0
 HYZ  CONST_12  C12   C13  C14  C9      0.00   0.0  0
 HYZ  CONST_13  C12   C11  C10  C9      0.00   0.0  0
 HYZ  CONST_14  N2    N1   C10  C9      0.00   0.0  0
 HYZ  CONST_15  N2    C8   C9   C10     0.00   0.0  0
 HYZ  CONST_16  C13   C14  C9   C10     0.00   0.0  0
 HYZ  CONST_17  C13   C12  C11  C10     0.00   0.0  0
 HYZ  CONST_18  C14   C9   C10  C11     0.00   0.0  0
 HYZ  CONST_19  N2    N1   C10  C11   180.00   0.0  0
 HYZ  CONST_20  C14   C13  C12  C11     0.00   0.0  0
 HYZ  CONST_21  N1    C10  C11  C12   180.00   0.0  0
 HYZ  CONST_22  N2    C8   C9   C14   180.00   0.0  0
 HYZ  CONST_23  N1    C10  C9   C14   180.00   0.0  0
 HYZ  CONST_24  N5    C17  C16  C15     0.00   0.0  0
 HYZ  CONST_25  N5    C18  N4   C15     0.00   0.0  0
 HYZ  CONST_26  C18   N4   C15  C16     0.00   0.0  0
 HYZ  CONST_27  C18   N5   C17  C16     0.00   0.0  0
 HYZ  CONST_28  C17   C16  C15  N4      0.00   0.0  0
 HYZ  CONST_29  C17   N5   C18  N4      0.00   0.0  0
 HYZ  CONST_30  F1    C6   C1   C2    180.00   0.0  0
 HYZ  CONST_31  C7    C4   C3   C2    180.00   0.0  0
 HYZ  CONST_32  C17   C16  C15  N6    180.00   0.0  0
 HYZ  CONST_33  C18   N4   C15  N6    180.00   0.0  0
 HYZ  CONST_34  C9    C10  N1   C7    180.00   0.0  0
 HYZ  CONST_35  C11   C10  N1   C7      0.00   0.0  0
 HYZ  CONST_36  C8    N2   N1   C7    180.00   0.0  0
 HYZ  CONST_37  C6    C5   C4   C7    180.00   0.0  0
 HYZ  CONST_38  N3    C13  C14  C9    180.00   0.0  0
 HYZ  CONST_39  N3    C13  C12  C11   180.00   0.0  0
 HYZ  CONST_40  N3    C17  C16  C15   180.00   0.0  0
 HYZ  CONST_41  N4    C15  C16  C19   180.00   0.0  0
 HYZ  CONST_42  N5    C17  C16  C19   180.00   0.0  0
 HYZ  CONST_43  F1    C6   C5   C4    180.00   0.0  0
 HYZ  CONST_44  C18   N5   C17  N3    180.00   0.0  0
 HYZ  CONST_45  H3    C3   C2   C1    180.00   0.0  0
 HYZ  CONST_46  H5    C5   C6   C1    180.00   0.0  0
 HYZ  CONST_47  H1    C1   C2   C3    180.00   0.0  0
 HYZ  CONST_48  H14   C14  C9   C8      0.00   0.0  0
 HYZ  CONST_49  H11   C11  C10  C9    180.00   0.0  0
 HYZ  CONST_50  H8    C8   C9   C10   180.00   0.0  0
 HYZ  CONST_51  H12   C12  C11  C10   180.00   0.0  0
 HYZ  CONST_52  H18   C18  N4   C15   180.00   0.0  0
 HYZ  CONST_53  H2    C2   C3   C4    180.00   0.0  0
 HYZ  CONST_55  HN6A  N6   C15  C16   180.00   0.0  0
 HYZ  Var_01    C22   N8   C21  C20   -59.45  30.0  1
 HYZ  Var_02    C22   C23  C24  C20    53.30  30.0  1
 HYZ  Var_03    C23   C24  C20  C21   -53.35  30.0  1
 HYZ  Var_04    C23   C22  N8   C21    59.63  30.0  1
 HYZ  Var_05    N8    C21  C20  C24    56.22  30.0  1
 HYZ  Var_06    N8    C22  C23  C24   -56.31  30.0  1
 HYZ  Var_07    N1    C7   C4   C3     65.75  30.0  2
 HYZ  Var_08    C4    C7   N1   C10    76.23  30.0  2
 HYZ  Var_09    C17   N3   C13  C12  -164.11  30.0  2
 HYZ  Var_10    C16   C17  N3   C13  -174.87  30.0  1
 HYZ  Var_11    N7    C19  C16  C15   126.37  30.0  1
 HYZ  Var_12    N8    N7   C19  C16   176.20  30.0  1
 HYZ  Var_13    C21   N8   N7   C19  -149.30  30.0  1

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
 HYZ  plan-1  C1    0.020
 HYZ  plan-1  C2    0.020
 HYZ  plan-1  C3    0.020
 HYZ  plan-1  C4    0.020
 HYZ  plan-1  C5    0.020
 HYZ  plan-1  C6    0.020
 HYZ  plan-1  F1    0.020
 HYZ  plan-1  H1    0.020
 HYZ  plan-1  H2    0.020
 HYZ  plan-1  H3    0.020
 HYZ  plan-1  H5    0.020
 HYZ  plan-1  C7    0.020
 HYZ  plan-2  C15   0.020
 HYZ  plan-2  C16   0.020
 HYZ  plan-2  C19   0.020
 HYZ  plan-2  N4    0.020
 HYZ  plan-2  C17   0.020
 HYZ  plan-2  N5    0.020
 HYZ  plan-2  C18   0.020
 HYZ  plan-2  H18   0.020
 HYZ  plan-2  N3    0.020
 HYZ  plan-2  N6    0.020
 HYZ  plan-3  C8    0.020
 HYZ  plan-3  C9    0.020
 HYZ  plan-3  C10   0.020
 HYZ  plan-3  C11   0.020
 HYZ  plan-3  C12   0.020
 HYZ  plan-3  C13   0.020
 HYZ  plan-3  C14   0.020
 HYZ  plan-3  N1    0.020
 HYZ  plan-3  N2    0.020
 HYZ  plan-3  H8    0.020
 HYZ  plan-3  H11   0.020
 HYZ  plan-3  H12   0.020
 HYZ  plan-3  H14   0.020
 HYZ  plan-3  C7    0.020
 HYZ  plan-3  N3    0.020
 HYZ  plan-4  C15   0.020
 HYZ  plan-4  HN6   0.020
 HYZ  plan-4  HN6A  0.020
 HYZ  plan-4  N6    0.020

