# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Tue Mar 22 04:11:32 2022
#   Inital geometry file: a 165 line input string
#   Ligand name: (2~{S},3~{R})-~{N}-[(5~{S},8~{S},10~{S})-5-methyl-10-oxidanyl-2,7-bis(oxidanylidene)-1,6-diazacyclododec-8-yl]-3-oxidanyl-2-(3-phenylpropanoylamino)butanamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: C[C@@H](O)[C@H](NC(=O)CCc1ccccc1)C(=O)N[C@H]2C[C@@H](O)CCNC(=O)CC[C@H](C)NC2=O
#
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
 QOE  QOE  (2~{S},3~{R})-~{N}-[(5~{S},8~{S},10~{S})-5-methyl-10-oxidanyl-2,7-bis(oxidanylidene)-1,6-diazacyclododec-8-yl]-3-oxidanyl-2-(3-phenylpropanoylamino)butanamide  ligand  70  34  .  2022-03-23  2022-03-23
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK
;

data_comp_QOE
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
 QOE  C4   C  CR16  0  -0.308  55.3561  -133.4582  32.4072
 QOE  C5   C  CR16  0  -0.238  54.3032  -132.7550  31.8358
 QOE  C6   C  CR16  0  -0.272  53.2663  -132.2851  32.6308
 QOE  C7   C  CR16  0  -0.237  53.2906  -132.5245  33.9991
 QOE  C8   C  CR16  0  -0.305  54.3450  -133.2284  34.5648
 QOE  C15  C  C     0   0.534  60.8886  -134.1654  37.6967
 QOE  C17  C  CH1   0  -0.202  61.4483  -135.7188  39.5212
 QOE  C21  C  CH2   0  -0.484  58.9394  -138.4086  40.8505
 QOE  C22  C  CH2   0  -0.307  59.3950  -138.7713  42.2653
 QOE  C24  C  C     0   0.549  61.5055  -137.8162  43.1285
 QOE  C26  C  CH2   0  -0.579  63.0012  -138.0514  43.2475
 QOE  C28  C  CH1   0  -0.081  64.1745  -136.0463  42.1410
 QOE  C27  C  CH2   0  -0.440  63.8292  -136.7841  43.4345
 QOE  C29  C  CH3   0  -0.648  64.9912  -134.7904  42.4205
 QOE  N30  N  NH1   0  -0.628  62.9695  -135.7423  41.3893
 QOE  C31  C  C     0   0.536  62.8786  -135.8190  40.0524
 QOE  O32  O  O     0  -0.484  63.8253  -136.0446  39.3145
 QOE  O25  O  O     0  -0.497  60.9587  -136.8435  43.6347
 QOE  N23  N  NH1   0  -0.627  60.8281  -138.7771  42.4744
 QOE  C19  C  CH1   0   0.067  59.4051  -137.0305  40.3676
 QOE  O20  O  OH1   0  -0.671  58.5325  -136.4794  39.4014
 QOE  C18  C  CH2   0  -0.469  60.7786  -137.0980  39.7200
 QOE  N16  N  NH1   0  -0.618  61.4489  -135.2987  38.1454
 QOE  O33  O  O     0  -0.479  60.2736  -133.3796  38.3977
 QOE  C14  C  CH1   0  -0.174  61.1236  -133.8800  36.2098
 QOE  C34  C  CH1   0   0.026  62.2296  -132.8258  36.0664
 QOE  C36  C  CH3   0  -0.699  63.5564  -133.2924  36.6440
 QOE  O35  O  OH1   0  -0.665  62.3345  -132.5591  34.6835
 QOE  N13  N  NH1   0  -0.652  59.9158  -133.3853  35.6008
 QOE  C12  C  C     0   0.571  58.7895  -134.1172  35.5614
 QOE  O37  O  O     0  -0.492  58.7267  -135.2340  36.0551
 QOE  C1   C  CH2   0  -0.576  57.6094  -133.4440  34.8933
 QOE  C3   C  CR6   0   0.124  55.3912  -133.7057  33.7775
 QOE  H1   H  HCR6  0   0.244  56.1604  -133.8238  31.7790
 QOE  H2   H  HCR6  0   0.251  54.2922  -132.5760  30.7681
 QOE  H3   H  HCR6  0   0.251  52.4438  -131.7389  32.1873
 QOE  H4   H  HCR6  0   0.251  52.4850  -132.1650  34.6269
 QOE  H5   H  HCR6  0   0.245  54.3546  -133.4127  35.6332
 QOE  H6   H  HCH1  0   0.284  60.9038  -134.9623  40.0897
 QOE  H7   H  HCH2  0   0.244  57.8455  -138.4278  40.8724
 QOE  H8   H  HCH2  0   0.232  59.2433  -139.1829  40.1387
 QOE  H9   H  HCH2  0   0.247  58.9577  -138.0727  42.9770
 QOE  H10  H  HCH2  0   0.255  59.0085  -139.7605  42.5164
 QOE  H11  H  HCH2  0   0.284  63.1390  -138.6948  44.1226
 QOE  H12  H  HCH2  0   0.257  63.3700  -138.6282  42.3948
 QOE  H13  H  HCH1  0   0.243  64.7689  -136.7187  41.5183
 QOE  H14  H  HCH2  0   0.249  64.7741  -137.0517  43.9109
 QOE  H15  H  HCH2  0   0.235  63.3240  -136.1074  44.1285
 QOE  H16  H  HCH3  0   0.228  65.9065  -135.0396  42.9586
 QOE  H17  H  HCH3  0   0.235  65.2720  -134.2928  41.4923
 QOE  H18  H  HCH3  0   0.223  64.4245  -134.0836  43.0291
 QOE  H19  H  HNH1  0   0.397  62.1573  -135.4495  41.9120
 QOE  H20  H  HNH1  0   0.398  61.3515  -139.5367  42.0682
 QOE  H21  H  HCH1  0   0.205  59.4611  -136.3664  41.2436
 QOE  H22  H  HOH1  0   0.446  57.6900  -136.2874  39.8248
 QOE  H23  H  HCH2  0   0.256  60.6910  -137.6052  38.7549
 QOE  H24  H  HCH2  0   0.260  61.4148  -137.7357  40.3309
 QOE  H25  H  HNH1  0   0.399  61.9359  -135.8895  37.4892
 QOE  H26  H  HCH1  0   0.269  61.4506  -134.7951  35.7001
 QOE  H27  H  HCH1  0   0.221  61.9036  -131.9253  36.6057
 QOE  H28  H  HCH3  0   0.238  63.5124  -133.4168  37.7250
 QOE  H29  H  HCH3  0   0.232  63.8691  -134.2395  36.2014
 QOE  H30  H  HCH3  0   0.244  64.3285  -132.5495  36.4385
 QOE  H31  H  HOH1  0   0.456  62.9233  -131.8065  34.5667
 QOE  H32  H  HNH1  0   0.402  59.9490  -132.5031  35.1150
 QOE  H33  H  HCH2  0   0.265  57.9532  -132.8191  34.0651
 QOE  H34  H  HCH2  0   0.279  57.1621  -132.7584  35.6207
 QOE  H35  H  HCH2  0   0.249  56.2016  -135.0354  35.2406
 QOE  H36  H  HCH2  0   0.249  56.9961  -135.1151  33.6789
 QOE  C2   C  CH2   0  -0.501  56.5513  -134.4298  34.4034

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
 QOE  C5   C4   aromatic  1.389  0.020  1.389
 QOE  C5   C6   aromatic  1.388  0.020  1.388
 QOE  C4   C3   aromatic  1.393  0.020  1.393
 QOE  C6   C7   aromatic  1.389  0.020  1.389
 QOE  C3   C2   single    1.504  0.020  1.504
 QOE  C3   C8   aromatic  1.394  0.020  1.394
 QOE  O35  C34  single    1.412  0.020  1.412
 QOE  C1   C2   single    1.527  0.020  1.527
 QOE  C1   C12  single    1.514  0.020  1.514
 QOE  C7   C8   aromatic  1.388  0.020  1.388
 QOE  N13  C12  single    1.344  0.020  1.344
 QOE  N13  C14  single    1.440  0.020  1.440
 QOE  C12  O37  double    1.223  0.020  1.223
 QOE  C34  C14  single    1.535  0.020  1.535
 QOE  C34  C36  single    1.520  0.020  1.520
 QOE  C14  C15  single    1.532  0.020  1.532
 QOE  C15  O33  double    1.220  0.020  1.220
 QOE  C15  N16  single    1.342  0.020  1.342
 QOE  N16  C17  single    1.439  0.020  1.439
 QOE  C17  C18  single    1.546  0.020  1.546
 QOE  C17  C31  single    1.529  0.020  1.529
 QOE  C18  C19  single    1.520  0.020  1.520
 QOE  O32  C31  double    1.221  0.020  1.221
 QOE  O20  C19  single    1.414  0.020  1.414
 QOE  C31  N30  single    1.342  0.020  1.342
 QOE  C19  C21  single    1.533  0.020  1.533
 QOE  C21  C22  single    1.530  0.020  1.530
 QOE  N30  C28  single    1.452  0.020  1.452
 QOE  C22  N23  single    1.448  0.020  1.448
 QOE  N23  C24  single    1.345  0.020  1.345
 QOE  C28  C29  single    1.524  0.020  1.524
 QOE  C28  C27  single    1.529  0.020  1.529
 QOE  C26  C24  single    1.519  0.020  1.519
 QOE  C26  C27  single    1.525  0.020  1.525
 QOE  C24  O25  double    1.225  0.020  1.225
 QOE  C4   H1   single    0.930  0.020  1.080
 QOE  C5   H2   single    0.930  0.020  1.080
 QOE  C6   H3   single    0.930  0.020  1.080
 QOE  C7   H4   single    0.930  0.020  1.080
 QOE  C8   H5   single    0.930  0.020  1.080
 QOE  C17  H6   single    0.970  0.020  1.090
 QOE  C21  H7   single    0.970  0.020  1.090
 QOE  C21  H8   single    0.970  0.020  1.090
 QOE  C22  H9   single    0.970  0.020  1.090
 QOE  C22  H10  single    0.970  0.020  1.090
 QOE  C26  H11  single    0.970  0.020  1.090
 QOE  C26  H12  single    0.970  0.020  1.090
 QOE  C28  H13  single    0.970  0.020  1.090
 QOE  C27  H14  single    0.970  0.020  1.090
 QOE  C27  H15  single    0.970  0.020  1.090
 QOE  C29  H16  single    0.970  0.020  1.090
 QOE  C29  H17  single    0.970  0.020  1.090
 QOE  C29  H18  single    0.970  0.020  1.090
 QOE  N30  H19  single    0.860  0.020  1.020
 QOE  N23  H20  single    0.860  0.020  1.020
 QOE  C19  H21  single    0.970  0.020  1.090
 QOE  O20  H22  single    0.850  0.020  0.980
 QOE  C18  H23  single    0.970  0.020  1.090
 QOE  C18  H24  single    0.970  0.020  1.090
 QOE  N16  H25  single    0.860  0.020  1.020
 QOE  C14  H26  single    0.970  0.020  1.090
 QOE  C34  H27  single    0.970  0.020  1.090
 QOE  C36  H28  single    0.970  0.020  1.090
 QOE  C36  H29  single    0.970  0.020  1.090
 QOE  C36  H30  single    0.970  0.020  1.090
 QOE  O35  H31  single    0.850  0.020  0.980
 QOE  N13  H32  single    0.860  0.020  1.020
 QOE  C1   H33  single    0.970  0.020  1.090
 QOE  C1   H34  single    0.970  0.020  1.090
 QOE  C2   H35  single    0.970  0.020  1.090
 QOE  C2   H36  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
 QOE  H1   C4   C3   119.44  3.000
 QOE  H1   C4   C5   119.65  3.000
 QOE  C3   C4   C5   120.91  3.000
 QOE  H2   C5   C6   120.07  3.000
 QOE  H2   C5   C4   119.80  3.000
 QOE  C6   C5   C4   120.12  3.000
 QOE  H3   C6   C7   120.25  3.000
 QOE  H3   C6   C5   120.24  3.000
 QOE  C7   C6   C5   119.51  3.000
 QOE  H4   C7   C8   119.81  3.000
 QOE  H4   C7   C6   120.06  3.000
 QOE  C8   C7   C6   120.13  3.000
 QOE  H5   C8   C3   119.46  3.000
 QOE  H5   C8   C7   119.63  3.000
 QOE  C3   C8   C7   120.91  3.000
 QOE  C14  C15  O33  121.01  3.000
 QOE  O33  C15  N16  124.24  3.000
 QOE  C14  C15  N16  114.70  3.000
 QOE  H6   C17  N16  107.21  3.000
 QOE  H6   C17  C18  109.58  3.000
 QOE  N16  C17  C18  112.56  3.000
 QOE  H6   C17  C31  109.34  3.000
 QOE  C18  C17  C31  107.58  3.000
 QOE  N16  C17  C31  110.55  3.000
 QOE  H8   C21  H7   106.15  3.000
 QOE  H8   C21  C19  110.28  3.000
 QOE  H7   C21  C19  109.01  3.000
 QOE  H8   C21  C22  110.55  3.000
 QOE  H7   C21  C22  105.96  3.000
 QOE  C19  C21  C22  114.46  3.000
 QOE  H10  C22  H9   106.80  3.000
 QOE  H10  C22  N23  108.27  3.000
 QOE  H9   C22  N23  107.80  3.000
 QOE  H10  C22  C21  108.79  3.000
 QOE  H9   C22  C21  109.44  3.000
 QOE  N23  C22  C21  115.41  3.000
 QOE  N23  C24  O25  122.90  3.000
 QOE  O25  C24  C26  122.00  3.000
 QOE  N23  C24  C26  115.05  3.000
 QOE  H12  C26  H11  105.71  3.000
 QOE  H12  C26  C27  110.53  3.000
 QOE  H11  C26  C27  108.78  3.000
 QOE  H12  C26  C24  110.65  3.000
 QOE  H11  C26  C24  106.12  3.000
 QOE  C27  C26  C24  114.56  3.000
 QOE  H13  C28  N30  106.58  3.000
 QOE  H13  C28  C29  108.68  3.000
 QOE  N30  C28  C29  111.53  3.000
 QOE  H13  C28  C27  107.95  3.000
 QOE  C29  C28  C27  111.32  3.000
 QOE  N30  C28  C27  110.58  3.000
 QOE  H15  C27  H14  105.94  3.000
 QOE  H15  C27  C28  110.05  3.000
 QOE  H14  C27  C28  106.98  3.000
 QOE  H15  C27  C26  109.96  3.000
 QOE  H14  C27  C26  108.65  3.000
 QOE  C28  C27  C26  114.83  3.000
 QOE  H18  C29  H17  108.24  3.000
 QOE  H18  C29  H16  107.98  3.000
 QOE  H17  C29  H16  107.96  3.000
 QOE  H18  C29  C28  110.96  3.000
 QOE  H17  C29  C28  110.98  3.000
 QOE  H16  C29  C28  110.60  3.000
 QOE  H19  N30  C31  118.56  3.000
 QOE  H19  N30  C28  117.41  3.000
 QOE  C31  N30  C28  124.03  3.000
 QOE  O32  C31  N30  124.05  3.000
 QOE  N30  C31  C17  113.93  3.000
 QOE  O32  C31  C17  121.82  3.000
 QOE  H20  N23  C24  118.21  3.000
 QOE  H20  N23  C22  117.30  3.000
 QOE  C24  N23  C22  124.44  3.000
 QOE  H21  C19  C18  108.66  3.000
 QOE  H21  C19  O20  109.89  3.000
 QOE  C18  C19  O20  106.50  3.000
 QOE  H21  C19  C21  107.89  3.000
 QOE  O20  C19  C21  112.22  3.000
 QOE  C18  C19  C21  111.65  3.000
 QOE  H22  O20  C19  108.52  3.000
 QOE  H24  C18  H23  105.68  3.000
 QOE  H24  C18  C19  108.37  3.000
 QOE  H23  C18  C19  108.91  3.000
 QOE  H24  C18  C17  109.98  3.000
 QOE  H23  C18  C17  109.57  3.000
 QOE  C19  C18  C17  113.99  3.000
 QOE  H25  N16  C17  116.84  3.000
 QOE  H25  N16  C15  118.62  3.000
 QOE  C17  N16  C15  124.50  3.000
 QOE  H26  C14  N13  109.87  3.000
 QOE  H26  C14  C34  108.34  3.000
 QOE  N13  C14  C34  109.20  3.000
 QOE  H26  C14  C15  109.94  3.000
 QOE  C34  C14  C15  109.22  3.000
 QOE  N13  C14  C15  110.22  3.000
 QOE  H27  C34  O35  110.35  3.000
 QOE  H27  C34  C36  108.90  3.000
 QOE  O35  C34  C36  111.41  3.000
 QOE  H27  C34  C14  107.65  3.000
 QOE  C36  C34  C14  112.50  3.000
 QOE  O35  C34  C14  105.95  3.000
 QOE  H30  C36  H29  108.17  3.000
 QOE  H30  C36  H28  107.06  3.000
 QOE  H29  C36  H28  108.36  3.000
 QOE  H30  C36  C34  109.70  3.000
 QOE  H29  C36  C34  111.24  3.000
 QOE  H28  C36  C34  112.14  3.000
 QOE  H31  O35  C34  108.18  3.000
 QOE  H32  N13  C12  119.36  3.000
 QOE  H32  N13  C14  118.48  3.000
 QOE  C12  N13  C14  121.88  3.000
 QOE  C1   C12  O37  122.98  3.000
 QOE  O37  C12  N13  121.91  3.000
 QOE  C1   C12  N13  115.09  3.000
 QOE  H34  C1   H33  105.89  3.000
 QOE  H34  C1   C2   109.53  3.000
 QOE  H33  C1   C2   110.12  3.000
 QOE  H34  C1   C12  107.68  3.000
 QOE  H33  C1   C12  110.09  3.000
 QOE  C2   C1   C12  113.24  3.000
 QOE  C2   C3   C8   120.59  3.000
 QOE  C8   C3   C4   118.42  3.000
 QOE  C2   C3   C4   120.96  3.000
 QOE  H36  C2   H35  106.94  3.000
 QOE  H36  C2   C3   109.89  3.000
 QOE  H35  C2   C3   109.84  3.000
 QOE  H36  C2   C1   109.62  3.000
 QOE  H35  C2   C1   109.53  3.000
 QOE  C3   C2   C1   110.93  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
 QOE  CONST_01  C7   C6   C5   C4     0.00   0.0  0
 QOE  CONST_02  C7   C8   C3   C4     0.00   0.0  0
 QOE  CONST_03  C8   C3   C4   C5     0.00   0.0  0
 QOE  CONST_04  C8   C7   C6   C5     0.00   0.0  0
 QOE  CONST_05  C3   C4   C5   C6     0.00   0.0  0
 QOE  CONST_06  C3   C8   C7   C6     0.00   0.0  0
 QOE  CONST_07  C28  N30  C31  C17  180.00   0.0  0
 QOE  CONST_08  C26  C24  N23  C22  180.00   0.0  0
 QOE  CONST_09  C2   C3   C4   C5   180.00   0.0  0
 QOE  CONST_10  C2   C3   C8   C7   180.00   0.0  0
 QOE  CONST_11  O25  C24  N23  C22    0.00   0.0  0
 QOE  CONST_12  O32  C31  N30  C28    0.00   0.0  0
 QOE  CONST_13  H3   C6   C5   C4   180.00   0.0  0
 QOE  CONST_14  H5   C8   C3   C4   180.00   0.0  0
 QOE  CONST_15  H4   C7   C6   C5   180.00   0.0  0
 QOE  CONST_16  H1   C4   C5   C6   180.00   0.0  0
 QOE  CONST_17  H2   C5   C6   C7   180.00   0.0  0
 QOE  CONST_18  H19  N30  C31  C17    0.00   0.0  0
 QOE  CONST_19  H20  N23  C24  C26    0.00   0.0  0
 QOE  CONST_20  C14  C15  N16  C17  180.00   0.0  0
 QOE  CONST_21  O33  C15  N16  C17    0.00   0.0  0
 QOE  CONST_22  C1   C12  N13  C14  180.00   0.0  0
 QOE  CONST_23  O37  C12  N13  C14    0.00   0.0  0
 QOE  CONST_24  H25  N16  C15  O33  180.00   0.0  0
 QOE  CONST_25  H32  N13  C12  O37  180.00   0.0  0
 QOE  Var_01    C24  N23  C22  C21  104.59  30.0  1
 QOE  Var_02    C28  C27  C26  C24  -83.53  30.0  1
 QOE  Var_03    N23  C24  C26  C27  155.59  30.0  1
 QOE  Var_04    C19  C21  C22  N23  -58.53  30.0  1
 QOE  Var_05    C1   C2   C3   C4    92.48  30.0  2
 QOE  Var_06    C3   C2   C1   C12  178.74  30.0  3
 QOE  Var_07    C2   C1   C12  N13  158.55  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
 QOE  chir_01  C17  N16  C18  C31  negativ
 QOE  chir_02  C28  N30  C29  C27  negativ
 QOE  chir_03  C19  O20  C18  C21  positiv
 QOE  chir_04  C14  N13  C34  C15  negativ
 QOE  chir_05  C34  O35  C14  C36  negativ

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
 QOE  plan-1  C4   0.020
 QOE  plan-1  C5   0.020
 QOE  plan-1  C6   0.020
 QOE  plan-1  C7   0.020
 QOE  plan-1  C8   0.020
 QOE  plan-1  C3   0.020
 QOE  plan-1  H1   0.020
 QOE  plan-1  H2   0.020
 QOE  plan-1  H3   0.020
 QOE  plan-1  H4   0.020
 QOE  plan-1  H5   0.020
 QOE  plan-1  C2   0.020
 QOE  plan-2  C15  0.020
 QOE  plan-2  C17  0.020
 QOE  plan-2  N16  0.020
 QOE  plan-2  O33  0.020
 QOE  plan-2  C14  0.020
 QOE  plan-2  H25  0.020
 QOE  plan-3  C22  0.020
 QOE  plan-3  C24  0.020
 QOE  plan-3  C26  0.020
 QOE  plan-3  O25  0.020
 QOE  plan-3  N23  0.020
 QOE  plan-3  H20  0.020
 QOE  plan-4  C17  0.020
 QOE  plan-4  C28  0.020
 QOE  plan-4  N30  0.020
 QOE  plan-4  C31  0.020
 QOE  plan-4  O32  0.020
 QOE  plan-4  H19  0.020
 QOE  plan-5  C14  0.020
 QOE  plan-5  N13  0.020
 QOE  plan-5  C12  0.020
 QOE  plan-5  O37  0.020
 QOE  plan-5  C1   0.020
 QOE  plan-5  H32  0.020

