# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Tue Jun  9 08:23:36 2020
#   Inital geometry file: a 159 line input string
#   Ligand name: N-{2-(5-carbamimidoyl-2-hydroxyphenoxy)-3,5-difluoro-6-[3-(1-methyl-4,5-dihydro-1H-imidazol-2-yl)phenoxy]pyridin-4-yl}-N-methylglycine
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CN1CCN=C1c2cccc(Oc3nc(Oc4cc(ccc4O)C(N)=N)c(F)c(N(C)CC(O)=O)c3F)c2
#
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
 Z34  Z34  N-{2-(5-carbamimidoyl-2-hydroxyphenoxy)-3,5-difluoro-6-[3-(1-methyl-4,5-dihydro-1H-imidazol-2-yl)phenoxy]pyridin-4-yl}-N-methylglycine  ligand  62  38  .  2022-07-22  2022-11-18
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK (reasonable std)
;

data_comp_Z34
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
 Z34  C1    C  CR6   0   0.348   2.5390   0.4167   2.0501
 Z34  F1    F  F     0  -0.301   2.6178   0.3861   3.3890
 Z34  C2    C  CR6   0   0.182   3.6903   0.2477   1.2658
 Z34  C3    C  CR6   0   0.338   3.4626   0.2728  -0.1180
 Z34  F2    F  F     0  -0.299   4.4895   0.2098  -0.9768
 Z34  C4    C  CR6   0   0.368   2.1814   0.4084  -0.6172
 Z34  N5    N  N     0  -0.444   1.1340   0.5619   0.1568
 Z34  C6    C  CR6   0   0.349   1.3069   0.5924   1.4544
 Z34  O11   O  OH1   0  -0.614  -0.9031   2.9510   0.8461
 Z34  O1    O  O2    0  -0.518   0.2379   0.7954   2.2583
 Z34  C11   C  CR6   0   0.266  -1.0153   0.6952   1.6839
 Z34  C12   C  CR16  0  -0.339  -1.7301  -0.4720   1.8363
 Z34  C13   C  CR6   0   0.026  -3.0132  -0.5925   1.3088
 Z34  C14   C  CR16  0  -0.293  -3.5492   0.4968   0.6249
 Z34  C15   C  CR16  0  -0.333  -2.8309   1.6696   0.4714
 Z34  C16   C  CR6   0   0.349  -1.5521   1.7906   1.0028
 Z34  C17   C  C     0   0.335  -3.7651  -1.8573   1.5154
 Z34  N11   N  N     0  -0.652  -3.4161  -2.6331   2.4691
 Z34  N12   N  NH2   0  -0.829  -4.8263  -2.0571   0.6751
 Z34  O2    O  O2    0  -0.514   2.0246   0.4017  -1.9548
 Z34  C21   C  CR6   0   0.372   0.8107   0.8158  -2.4614
 Z34  C22   C  CR16  0  -0.276   0.4106   2.1376  -2.3425
 Z34  C23   C  CR16  0  -0.237  -0.7969   2.5250  -2.8997
 Z34  C24   C  CR16  0  -0.291  -1.5985   1.6038  -3.5578
 Z34  C25   C  CR6   0   0.034  -1.1837   0.2805  -3.6734
 Z34  C26   C  CR16  0  -0.349   0.0334  -0.1132  -3.1254
 Z34  C27   C  CR5   0   0.429  -1.9992  -0.7163  -4.3925
 Z34  N21   N  NR5   0  -0.472  -3.3610  -0.7940  -4.1982
 Z34  C30   C  CH3   0  -0.537  -3.9847  -0.5222  -2.9252
 Z34  N22   N  N     0  -0.453  -1.4967  -1.5072  -5.2597
 Z34  C28   C  CH2   0  -0.309  -3.7971  -2.0019  -4.8908
 Z34  C29   C  CH2   0  -0.354  -2.6012  -2.2845  -5.8096
 Z34  N31   N  NT    0  -0.486   4.9322   0.0848   1.8049
 Z34  C32   C  CH2   0  -0.466   5.3267   0.7801   2.9975
 Z34  C33   C  C     0   0.543   5.2480  -0.0713   4.2492
 Z34  O34   O  O     0  -0.434   5.0192  -1.2514   4.2658
 Z34  O35   O  OH1   0  -0.592   5.4985   0.6555   5.3295
 Z34  C36   C  CH3   0  -0.533   5.9441  -0.7485   1.1817
 Z34  H11   H  HOH1  0   0.477  -0.0738   2.9629   1.3366
 Z34  H12   H  HCR6  0   0.270  -1.2853  -1.3014   2.3710
 Z34  H14   H  HCR6  0   0.259  -4.5558   0.4616   0.2286
 Z34  H15   H  HCR6  0   0.271  -3.2643   2.5093  -0.0561
 Z34  H111  H  H     0   0.324  -3.9852  -3.4751   2.4835
 Z34  H121  H  HNH2  0   0.392  -5.2520  -2.9706   0.6891
 Z34  H122  H  HNH2  0   0.390  -4.7855  -1.6598  -0.2486
 Z34  H22   H  HCR6  0   0.272   1.0283   2.8565  -1.8208
 Z34  H23   H  HCR6  0   0.264  -1.1159   3.5553  -2.8187
 Z34  H24   H  HCR6  0   0.267  -2.5377   1.9209  -3.9925
 Z34  H26   H  HCR6  0   0.266   0.3602  -1.1423  -3.2115
 Z34  H301  H  HCH3  0   0.263  -3.5503   0.3542  -2.4512
 Z34  H302  H  HCH3  0   0.251  -5.0476  -0.3317  -3.0685
 Z34  H303  H  HCH3  0   0.212  -3.8790  -1.3708  -2.2365
 Z34  H281  H  HCH2  0   0.227  -3.9527  -2.8112  -4.1661
 Z34  H282  H  HCH2  0   0.249  -4.7344  -1.8450  -5.4251
 Z34  H291  H  HCH2  0   0.237  -2.3519  -3.3453  -5.8613
 Z34  H292  H  HCH2  0   0.235  -2.7977  -1.9556  -6.8347
 Z34  H321  H  HCH2  0   0.318   6.3658   1.1086   2.8838
 Z34  H322  H  HCH2  0   0.305   4.7564   1.6999   3.1340
 Z34  H35   H  HOH1  0   0.485   5.4762   0.0983   6.1220
 Z34  H361  H  HCH3  0   0.256   6.5173  -1.2464   1.9621
 Z34  H362  H  HCH3  0   0.255   5.4869  -1.5305   0.5808
 Z34  H363  H  HCH3  0   0.241   6.6393  -0.1795   0.5615

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
 Z34  C1   F1    single    1.342  0.020  1.342
 Z34  C1   C2    aromatic  1.403  0.020  1.403
 Z34  C1   C6    aromatic  1.380  0.020  1.380
 Z34  C2   C3    aromatic  1.403  0.020  1.403
 Z34  C2   N31   single    1.364  0.020  1.364
 Z34  C3   F2    single    1.340  0.020  1.340
 Z34  C3   C4    aromatic  1.382  0.020  1.382
 Z34  C4   N5    aromatic  1.311  0.020  1.311
 Z34  C4   O2    single    1.347  0.020  1.347
 Z34  N5   C6    aromatic  1.309  0.020  1.309
 Z34  C6   O1    single    1.353  0.020  1.353
 Z34  O11  C16   single    1.339  0.020  1.339
 Z34  O11  H11   single    0.850  0.020  0.980
 Z34  O1   C11   single    1.382  0.020  1.382
 Z34  C11  C12   aromatic  1.377  0.020  1.377
 Z34  C11  C16   aromatic  1.397  0.020  1.397
 Z34  C12  C13   aromatic  1.393  0.020  1.393
 Z34  C12  H12   single    0.930  0.020  1.080
 Z34  C13  C14   aromatic  1.393  0.020  1.393
 Z34  C13  C17   single    1.486  0.020  1.486
 Z34  C14  C15   aromatic  1.384  0.020  1.384
 Z34  C14  H14   single    0.930  0.020  1.080
 Z34  C15  C16   aromatic  1.390  0.020  1.390
 Z34  C15  H15   single    0.930  0.020  1.080
 Z34  C17  N11   double    1.278  0.020  1.278
 Z34  C17  N12   single    1.368  0.020  1.368
 Z34  N11  H111  single    0.890  0.020  1.040
 Z34  N12  H121  single    0.890  0.020  1.040
 Z34  N12  H122  single    0.890  0.020  1.040
 Z34  O2   C21   single    1.379  0.020  1.379
 Z34  C21  C22   aromatic  1.386  0.020  1.386
 Z34  C21  C26   aromatic  1.381  0.020  1.381
 Z34  C22  C23   aromatic  1.385  0.020  1.385
 Z34  C22  H22   single    0.930  0.020  1.080
 Z34  C23  C24   aromatic  1.387  0.020  1.387
 Z34  C23  H23   single    0.930  0.020  1.080
 Z34  C24  C25   aromatic  1.392  0.020  1.392
 Z34  C24  H24   single    0.930  0.020  1.080
 Z34  C25  C26   aromatic  1.392  0.020  1.392
 Z34  C25  C27   single    1.475  0.020  1.475
 Z34  C26  H26   single    0.930  0.020  1.080
 Z34  C27  N21   single    1.378  0.020  1.378
 Z34  C27  N22   double    1.277  0.020  1.277
 Z34  N21  C30   single    1.443  0.020  1.443
 Z34  N21  C28   single    1.459  0.020  1.459
 Z34  C30  H301  single    0.970  0.020  1.090
 Z34  C30  H302  single    0.970  0.020  1.090
 Z34  C30  H303  single    0.970  0.020  1.090
 Z34  N22  C29   single    1.458  0.020  1.458
 Z34  C28  C29   single    1.534  0.020  1.534
 Z34  C28  H281  single    0.970  0.020  1.090
 Z34  C28  H282  single    0.970  0.020  1.090
 Z34  C29  H291  single    0.970  0.020  1.090
 Z34  C29  H292  single    0.970  0.020  1.090
 Z34  N31  C32   single    1.436  0.020  1.436
 Z34  N31  C36   single    1.451  0.020  1.451
 Z34  C32  C33   single    1.516  0.020  1.516
 Z34  C32  H321  single    0.970  0.020  1.090
 Z34  C32  H322  single    0.970  0.020  1.090
 Z34  C33  O34   double    1.202  0.020  1.202
 Z34  C33  O35   single    1.326  0.020  1.326
 Z34  O35  H35   single    0.850  0.020  0.980
 Z34  C36  H361  single    0.970  0.020  1.090
 Z34  C36  H362  single    0.970  0.020  1.090
 Z34  C36  H363  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
 Z34  C6    C1   C2    120.44  3.000
 Z34  C6    C1   F1    119.09  3.000
 Z34  C2    C1   F1    120.46  3.000
 Z34  N31   C2   C3    122.69  3.000
 Z34  N31   C2   C1    122.72  3.000
 Z34  C3    C2   C1    114.59  3.000
 Z34  C4    C3   F2    118.92  3.000
 Z34  C4    C3   C2    120.58  3.000
 Z34  F2    C3   C2    120.46  3.000
 Z34  O2    C4   N5    119.59  3.000
 Z34  O2    C4   C3    117.79  3.000
 Z34  N5    C4   C3    122.60  3.000
 Z34  C6    N5   C4    118.83  3.000
 Z34  O1    C6   N5    119.21  3.000
 Z34  O1    C6   C1    117.91  3.000
 Z34  N5    C6   C1    122.87  3.000
 Z34  H11   O11  C16   111.61  3.000
 Z34  C11   O1   C6    117.30  3.000
 Z34  C16   C11  C12   121.27  3.000
 Z34  C16   C11  O1    119.61  3.000
 Z34  C12   C11  O1    119.09  3.000
 Z34  H12   C12  C13   119.96  3.000
 Z34  H12   C12  C11   119.39  3.000
 Z34  C13   C12  C11   120.65  3.000
 Z34  C17   C13  C14   122.62  3.000
 Z34  C17   C13  C12   119.16  3.000
 Z34  C14   C13  C12   118.21  3.000
 Z34  H14   C14  C15   118.01  3.000
 Z34  H14   C14  C13   120.80  3.000
 Z34  C15   C14  C13   121.15  3.000
 Z34  H15   C15  C16   119.16  3.000
 Z34  H15   C15  C14   120.25  3.000
 Z34  C16   C15  C14   120.59  3.000
 Z34  C15   C16  C11   118.14  3.000
 Z34  C15   C16  O11   118.47  3.000
 Z34  C11   C16  O11   123.39  3.000
 Z34  N12   C17  N11   125.55  3.000
 Z34  N12   C17  C13   115.55  3.000
 Z34  N11   C17  C13   118.84  3.000
 Z34  H111  N11  C17   111.14  3.000
 Z34  H122  N12  H121  112.81  3.000
 Z34  H122  N12  C17   118.33  3.000
 Z34  H121  N12  C17   116.83  3.000
 Z34  C21   O2   C4    117.76  3.000
 Z34  C26   C21  C22   121.34  3.000
 Z34  C26   C21  O2    118.03  3.000
 Z34  C22   C21  O2    120.59  3.000
 Z34  H22   C22  C23   120.39  3.000
 Z34  H22   C22  C21   120.68  3.000
 Z34  C23   C22  C21   118.93  3.000
 Z34  H23   C23  C24   119.85  3.000
 Z34  H23   C23  C22   119.56  3.000
 Z34  C24   C23  C22   120.59  3.000
 Z34  H24   C24  C25   120.25  3.000
 Z34  H24   C24  C23   119.83  3.000
 Z34  C25   C24  C23   119.91  3.000
 Z34  C27   C25  C26   118.97  3.000
 Z34  C27   C25  C24   121.22  3.000
 Z34  C26   C25  C24   119.80  3.000
 Z34  H26   C26  C25   120.09  3.000
 Z34  H26   C26  C21   120.49  3.000
 Z34  C25   C26  C21   119.42  3.000
 Z34  N22   C27  N21   116.74  3.000
 Z34  N22   C27  C25   122.15  3.000
 Z34  N21   C27  C25   121.05  3.000
 Z34  C28   N21  C30   116.45  3.000
 Z34  C28   N21  C27   105.97  3.000
 Z34  C30   N21  C27   122.75  3.000
 Z34  H303  C30  H302  108.15  3.000
 Z34  H303  C30  H301  108.13  3.000
 Z34  H302  C30  H301  107.84  3.000
 Z34  H303  C30  N21   111.47  3.000
 Z34  H302  C30  N21   109.79  3.000
 Z34  H301  C30  N21   111.33  3.000
 Z34  C29   N22  C27   106.74  3.000
 Z34  H282  C28  H281  107.93  3.000
 Z34  H282  C28  C29   113.77  3.000
 Z34  H281  C28  C29   111.72  3.000
 Z34  H282  C28  N21   111.74  3.000
 Z34  H281  C28  N21   109.84  3.000
 Z34  C29   C28  N21   101.76  3.000
 Z34  H292  C29  H291  106.79  3.000
 Z34  H292  C29  C28   111.45  3.000
 Z34  H291  C29  C28   112.68  3.000
 Z34  H292  C29  N22   109.21  3.000
 Z34  H291  C29  N22   111.29  3.000
 Z34  C28   C29  N22   105.45  3.000
 Z34  C36   N31  C32   116.30  3.000
 Z34  C36   N31  C2    122.26  3.000
 Z34  C32   N31  C2    121.39  3.000
 Z34  H322  C32  H321  104.83  3.000
 Z34  H322  C32  C33   110.06  3.000
 Z34  H321  C32  C33   107.66  3.000
 Z34  H322  C32  N31   111.63  3.000
 Z34  H321  C32  N31   108.64  3.000
 Z34  C33   C32  N31   113.56  3.000
 Z34  O35   C33  O34   124.25  3.000
 Z34  O35   C33  C32   110.80  3.000
 Z34  O34   C33  C32   124.93  3.000
 Z34  H35   O35  C33   110.29  3.000
 Z34  H363  C36  H362  109.19  3.000
 Z34  H363  C36  H361  108.07  3.000
 Z34  H362  C36  H361  106.78  3.000
 Z34  H363  C36  N31   112.87  3.000
 Z34  H362  C36  N31   110.93  3.000
 Z34  H361  C36  N31   108.78  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
 Z34  CONST_01  C4    C3   C2   C1      0.00   0.0  0
 Z34  CONST_02  C4    N5   C6   C1      0.00   0.0  0
 Z34  CONST_03  N5    C6   C1   C2      0.00   0.0  0
 Z34  CONST_04  N5    C4   C3   C2      0.00   0.0  0
 Z34  CONST_05  C6    C1   C2   C3      0.00   0.0  0
 Z34  CONST_06  C6    N5   C4   C3      0.00   0.0  0
 Z34  CONST_07  C14   C13  C12  C11     0.00   0.0  0
 Z34  CONST_08  C14   C15  C16  C11     0.00   0.0  0
 Z34  CONST_09  C15   C16  C11  C12     0.00   0.0  0
 Z34  CONST_10  C15   C14  C13  C12     0.00   0.0  0
 Z34  CONST_11  C16   C11  C12  C13     0.00   0.0  0
 Z34  CONST_12  C16   C15  C14  C13     0.00   0.0  0
 Z34  CONST_13  C24   C23  C22  C21     0.00   0.0  0
 Z34  CONST_14  C24   C25  C26  C21     0.00   0.0  0
 Z34  CONST_15  C25   C26  C21  C22     0.00   0.0  0
 Z34  CONST_16  C25   C24  C23  C22     0.00   0.0  0
 Z34  CONST_17  C26   C21  C22  C23     0.00   0.0  0
 Z34  CONST_18  C26   C25  C24  C23     0.00   0.0  0
 Z34  CONST_19  C27   C25  C26  C21   180.00   0.0  0
 Z34  CONST_20  C27   C25  C24  C23   180.00   0.0  0
 Z34  CONST_21  C28   N21  C27  C25   180.00   0.0  0
 Z34  CONST_22  C29   N22  C27  C25   180.00   0.0  0
 Z34  CONST_24  C28   C29  N22  C27     0.00   0.0  0
 Z34  CONST_25  C29   N22  C27  N21     0.00   0.0  0
 Z34  CONST_27  C28   N21  C27  N22     0.00   0.0  0
 Z34  CONST_28  F2    C3   C2   C1    180.00   0.0  0
 Z34  CONST_29  C3    C2   C1   F1    180.00   0.0  0
 Z34  CONST_30  N5    C6   C1   F1    180.00   0.0  0
 Z34  CONST_31  O1    C6   C1   C2    180.00   0.0  0
 Z34  CONST_32  O2    C4   C3   C2    180.00   0.0  0
 Z34  CONST_33  N5    C4   C3   F2    180.00   0.0  0
 Z34  CONST_34  N31   C2   C3   C4    180.00   0.0  0
 Z34  CONST_35  O1    C6   N5   C4    180.00   0.0  0
 Z34  CONST_36  N31   C2   C1   C6    180.00   0.0  0
 Z34  CONST_37  O2    C4   N5   C6    180.00   0.0  0
 Z34  CONST_38  C12   C11  C16  O11   180.00   0.0  0
 Z34  CONST_39  C14   C15  C16  O11   180.00   0.0  0
 Z34  CONST_40  C13   C12  C11  O1    180.00   0.0  0
 Z34  CONST_41  C15   C16  C11  O1    180.00   0.0  0
 Z34  CONST_42  C17   C13  C12  C11   180.00   0.0  0
 Z34  CONST_43  C17   C13  C14  C15   180.00   0.0  0
 Z34  CONST_44  C23   C22  C21  O2    180.00   0.0  0
 Z34  CONST_45  C25   C26  C21  O2    180.00   0.0  0
 Z34  CONST_49  H15   C15  C16  C11   180.00   0.0  0
 Z34  CONST_50  H14   C14  C13  C12   180.00   0.0  0
 Z34  CONST_51  H12   C12  C13  C14   180.00   0.0  0
 Z34  CONST_52  H23   C23  C22  C21   180.00   0.0  0
 Z34  CONST_53  H26   C26  C21  C22   180.00   0.0  0
 Z34  CONST_54  H24   C24  C23  C22   180.00   0.0  0
 Z34  CONST_55  H22   C22  C23  C24   180.00   0.0  0
 Z34  CONST_60  H111  N11  C17  C13   180.00   0.0  0
 Z34  CONST_61  H121  N12  C17  C13   180.00   0.0  0
 Z34  CONST_63  H35   O35  C33  C32   180.00   0.0  0
 Z34  Var_01    N21   C27  C25  C24   -44.78  30.0  2
 Z34  Var_02    C22   C21  O2   C4     67.34  30.0  2
 Z34  Var_03    C12   C11  O1   C6     99.32  30.0  2
 Z34  Var_04    H281  C28  N21  C27   101.58  30.0  1
 Z34  Var_05    H291  C29  N22  C27  -134.01  30.0  1
 Z34  Var_06    N11   C17  C13  C12    20.44  30.0  2
 Z34  Var_07    H301  C30  N21  C27    42.71  30.0  3
 Z34  Var_08    C33   C32  N31  C2    100.16  30.0  3
 Z34  Var_09    H361  C36  N31  C2   -143.74  30.0  3
 Z34  Var_10    O34   C33  C32  N31     7.53  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
 Z34  plan-1  C1    0.020
 Z34  plan-1  F1    0.020
 Z34  plan-1  C2    0.020
 Z34  plan-1  C3    0.020
 Z34  plan-1  F2    0.020
 Z34  plan-1  C4    0.020
 Z34  plan-1  N5    0.020
 Z34  plan-1  C6    0.020
 Z34  plan-1  O1    0.020
 Z34  plan-1  O2    0.020
 Z34  plan-1  N31   0.020
 Z34  plan-2  O11   0.020
 Z34  plan-2  O1    0.020
 Z34  plan-2  C11   0.020
 Z34  plan-2  C12   0.020
 Z34  plan-2  C13   0.020
 Z34  plan-2  C14   0.020
 Z34  plan-2  C15   0.020
 Z34  plan-2  C16   0.020
 Z34  plan-2  C17   0.020
 Z34  plan-2  H12   0.020
 Z34  plan-2  H14   0.020
 Z34  plan-2  H15   0.020
 Z34  plan-3  O2    0.020
 Z34  plan-3  C21   0.020
 Z34  plan-3  C22   0.020
 Z34  plan-3  C23   0.020
 Z34  plan-3  C24   0.020
 Z34  plan-3  C25   0.020
 Z34  plan-3  C26   0.020
 Z34  plan-3  C27   0.020
 Z34  plan-3  H22   0.020
 Z34  plan-3  H23   0.020
 Z34  plan-3  H24   0.020
 Z34  plan-3  H26   0.020
 Z34  plan-4  C2    0.020
 Z34  plan-4  N31   0.020
 Z34  plan-4  C32   0.020
 Z34  plan-4  C36   0.020
 Z34  plan-5  C13   0.020
 Z34  plan-5  C17   0.020
 Z34  plan-5  N11   0.020
 Z34  plan-5  N12   0.020
 Z34  plan-5  H111  0.020
 Z34  plan-5  H121  0.020
 Z34  plan-5  H122  0.020
 Z34  plan-6  C25   0.020
 Z34  plan-6  C27   0.020
 Z34  plan-6  N21   0.020
 Z34  plan-6  C30   0.020
 Z34  plan-6  N22   0.020
 Z34  plan-6  C28   0.020
 Z34  plan-6  C29   0.020
 Z34  plan-7  C32   0.020
 Z34  plan-7  C33   0.020
 Z34  plan-7  O34   0.020
 Z34  plan-7  O35   0.020
 Z34  plan-7  H35   0.020

