# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Wed Apr  1 05:13:35 2020
#   Inital geometry file: a 142 line input string
#   Ligand name: tert-butyl {(3R,5R)-1-[2-amino-6-(3-amino-2H-indazol-6-yl)pyrimidin-4-yl]-5-methylpiperidin-3-yl}carbamate
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: C[C@@H]1C[C@H](CN(C1)c2cc(nc(N)n2)c3ccc4c(N)[nH]nc4c3)NC(=O)OC(C)(C)C
#
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
 3Q6  3Q6  'tert-butyl {(3R,5R)-1-[2-amino-6-(3-amino-2H-indazol-6-yl)pyrimidin-4-yl]-5-methylpiperidin-3-yl}carbamate'  ligand  62  32  .  2021-08-04  2021-08-04  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_3Q6
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
 3Q6  C1    C  CR16  0  -0.280  -2.7630  -2.0965   0.0999
 3Q6  C2    C  CR16  0  -0.345  -2.0135  -0.9870   0.3699
 3Q6  C3    C  CR16  0  -0.351  -3.6782   0.5052  -0.5967
 3Q6  C4    C  CR16  0  -0.491  -0.2667   1.3820   0.5578
 3Q6  C5    C  CR56  0  -0.140  -4.0042  -1.9260  -0.5416
 3Q6  C6    C  CR6   0   0.042  -2.4642   0.3255   0.0188
 3Q6  C7    C  CR56  0   0.281  -4.4689  -0.6283  -0.8933
 3Q6  C8    C  CR6   0   0.285  -1.6200   1.5093   0.3090
 3Q6  C9    C  CR6   0   0.570   0.4567   2.5693   0.7986
 3Q6  C10   C  CR5   0   0.510  -5.0239  -2.7846  -0.9742
 3Q6  C11   C  CR6   0   0.523  -1.4543   3.7605   0.4914
 3Q6  C12   C  C     0   0.763   3.2943  -1.4427  -0.0611
 3Q6  C13   C  C     0  -0.458   4.1097   2.1448  -0.5219
 3Q6  C14   C  C     0  -0.324   2.6405   3.6967   0.8208
 3Q6  C15   C  C     0  -0.346   2.5277   1.3258   1.2036
 3Q6  C16   C  CR16  0  -0.249   3.3876   3.4998  -0.5043
 3Q6  C17   C  CR16  0  -0.058   3.1836   0.9926  -0.1370
 3Q6  C18   C  CH3   0  -0.664   2.4680   3.6746  -1.7088
 3Q6  C19   C  CH3   0  -0.659   5.0891  -4.5314   0.5224
 3Q6  C20   C  CH3   0  -0.669   3.2308  -4.3042  -1.1253
 3Q6  C21   C  CH3   0  -0.674   2.7851  -4.0548   1.3485
 3Q6  C22   C  CT    0   0.190   3.7761  -3.8220   0.2132
 3Q6  N23   N  N     0  -0.515  -2.2282   2.6974   0.2832
 3Q6  N24   N  N     0  -0.515  -0.1494   3.7532   0.7505
 3Q6  N25   N  NR15  0  -0.475  -5.9474  -1.9832  -1.5141
 3Q6  N26   N  N     0  -0.352  -5.6562  -0.6677  -1.4900
 3Q6  N27   N  NR6   0  -0.478   1.7804   2.5581   1.1000
 3Q6  N28   N  NH2   0  -0.844  -5.1030  -4.1473  -0.9612
 3Q6  N29   N  NH2   0  -0.826  -2.0654   4.9698   0.4814
 3Q6  N30   N  NH1   0  -0.669   3.9228  -0.2467  -0.0732
 3Q6  O31   O  O     0  -0.511   2.0968  -1.5806  -0.2210
 3Q6  O32   O  O2    0  -0.504   4.1712  -2.4264   0.1338
 3Q6  H1    H  HCR6  0   0.253  -2.4041  -3.0791   0.3805
 3Q6  H2    H  HCR6  0   0.239  -1.0688  -1.1101   0.8814
 3Q6  H3    H  HCR6  0   0.251  -4.0210   1.4976  -0.8565
 3Q6  H4    H  HCR6  0   0.262   0.2255   0.4263   0.4864
 3Q6  H13   H  H     0   0.251   4.5454   1.9644  -1.5080
 3Q6  H13A  H  H     0   0.237   4.9419   2.1739   0.1917
 3Q6  H14   H  H     0   0.246   3.3590   3.7882   1.6413
 3Q6  H14A  H  H     0   0.268   2.0471   4.6075   0.8007
 3Q6  H15   H  H     0   0.271   1.9015   0.5130   1.5642
 3Q6  H15A  H  H     0   0.259   3.3103   1.4706   1.9559
 3Q6  H16   H  HCR6  0   0.244   4.1534   4.2801  -0.5537
 3Q6  H17   H  HCR6  0   0.252   2.4008   0.8798  -0.8930
 3Q6  H18   H  HCH3  0   0.222   1.6781   2.9231  -1.7523
 3Q6  H18A  H  HCH3  0   0.232   1.9836   4.6518  -1.6917
 3Q6  H18B  H  HCH3  0   0.233   3.0353   3.6031  -2.6382
 3Q6  H19   H  HCH3  0   0.237   5.8243  -4.3671  -0.2668
 3Q6  H19A  H  HCH3  0   0.237   5.5143  -4.1894   1.4674
 3Q6  H19B  H  HCH3  0   0.230   4.9203  -5.6051   0.6016
 3Q6  H20   H  HCH3  0   0.246   2.2973  -3.8139  -1.3919
 3Q6  H20A  H  HCH3  0   0.234   3.9554  -4.1376  -1.9242
 3Q6  H20B  H  HCH3  0   0.233   3.0400  -5.3767  -1.0716
 3Q6  H21   H  HCH3  0   0.234   2.6825  -5.1277   1.5153
 3Q6  H21A  H  HCH3  0   0.235   3.1443  -3.6118   2.2789
 3Q6  H21B  H  HCH3  0   0.247   1.7975  -3.6554   1.1299
 3Q6  HN28  H  HNH2  0   0.398  -4.5706  -4.5870  -0.2269
 3Q6  HN2A  H  HNH2  0   0.396  -6.0316  -4.5369  -1.0207
 3Q6  HN29  H  HNH2  0   0.387  -1.4871   5.7889   0.4050
 3Q6  HN2B  H  HNH2  0   0.387  -2.9747   5.0283   0.0563
 3Q6  HN30  H  HNH1  0   0.395   4.9029  -0.2110   0.1602
 3Q6  HN25  H  HNR5  0   0.422  -6.8175  -2.2815  -1.9287

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
 3Q6  C2   C1    aromatic  1.366  0.020  1.366
 3Q6  C5   C1    aromatic  1.408  0.020  1.408
 3Q6  C1   H1    single    0.930  0.020  1.080
 3Q6  C6   C2    aromatic  1.431  0.020  1.431
 3Q6  C2   H2    single    0.930  0.020  1.080
 3Q6  C3   C6    aromatic  1.373  0.020  1.373
 3Q6  C3   C7    aromatic  1.413  0.020  1.413
 3Q6  C3   H3    single    0.930  0.020  1.080
 3Q6  C9   C4    aromatic  1.411  0.020  1.411
 3Q6  C8   C4    aromatic  1.382  0.020  1.382
 3Q6  C4   H4    single    0.930  0.020  1.080
 3Q6  C7   C5    aromatic  1.423  0.020  1.423
 3Q6  C5   C10   aromatic  1.402  0.020  1.402
 3Q6  C8   C6    single    1.483  0.020  1.483
 3Q6  N26  C7    aromatic  1.329  0.020  1.329
 3Q6  N23  C8    aromatic  1.335  0.020  1.335
 3Q6  N24  C9    aromatic  1.331  0.020  1.331
 3Q6  C9   N27   single    1.358  0.020  1.358
 3Q6  N25  C10   aromatic  1.337  0.020  1.337
 3Q6  C10  N28   single    1.365  0.020  1.365
 3Q6  N29  C11   single    1.355  0.020  1.355
 3Q6  C11  N24   aromatic  1.330  0.020  1.330
 3Q6  C11  N23   aromatic  1.331  0.020  1.331
 3Q6  O32  C12   single    1.332  0.020  1.332
 3Q6  N30  C12   single    1.351  0.020  1.351
 3Q6  C12  O31   double    1.216  0.020  1.216
 3Q6  C17  C13   single    1.527  0.020  1.527
 3Q6  C13  C16   single    1.535  0.020  1.535
 3Q6  C13  H13   single    0.970  0.020  1.090
 3Q6  C13  H13A  single    0.970  0.020  1.090
 3Q6  N27  C14   single    1.454  0.020  1.454
 3Q6  C14  C16   single    1.534  0.020  1.534
 3Q6  C14  H14   single    0.970  0.020  1.090
 3Q6  C14  H14A  single    0.970  0.020  1.090
 3Q6  C15  N27   single    1.445  0.020  1.445
 3Q6  C15  C17   single    1.529  0.020  1.529
 3Q6  C15  H15   single    0.970  0.020  1.090
 3Q6  C15  H15A  single    0.970  0.020  1.090
 3Q6  C16  C18   single    1.525  0.020  1.525
 3Q6  C16  H16   single    0.970  0.020  1.090
 3Q6  N30  C17   single    1.444  0.020  1.444
 3Q6  C17  H17   single    0.970  0.020  1.090
 3Q6  C18  H18   single    0.970  0.020  1.090
 3Q6  C18  H18A  single    0.970  0.020  1.090
 3Q6  C18  H18B  single    0.970  0.020  1.090
 3Q6  C22  C19   single    1.524  0.020  1.524
 3Q6  C19  H19   single    0.970  0.020  1.090
 3Q6  C19  H19A  single    0.970  0.020  1.090
 3Q6  C19  H19B  single    0.970  0.020  1.090
 3Q6  C20  C22   single    1.524  0.020  1.524
 3Q6  C20  H20   single    0.970  0.020  1.090
 3Q6  C20  H20A  single    0.970  0.020  1.090
 3Q6  C20  H20B  single    0.970  0.020  1.090
 3Q6  C21  C22   single    1.525  0.020  1.525
 3Q6  C21  H21   single    0.970  0.020  1.090
 3Q6  C21  H21A  single    0.970  0.020  1.090
 3Q6  C21  H21B  single    0.970  0.020  1.090
 3Q6  O32  C22   single    1.453  0.020  1.453
 3Q6  N26  N25   aromatic  1.348  0.020  1.348
 3Q6  N28  HN28  single    0.890  0.020  1.040
 3Q6  N28  HN2A  single    0.890  0.020  1.040
 3Q6  N29  HN29  single    0.890  0.020  1.040
 3Q6  N29  HN2B  single    0.890  0.020  1.040
 3Q6  N30  HN30  single    0.860  0.020  1.020
 3Q6  N25  HN25  single    0.860  0.020  1.020

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
 3Q6  H1    C1   C5    121.34  3.000
 3Q6  H1    C1   C2    120.26  3.000
 3Q6  C5    C1   C2    118.39  3.000
 3Q6  H2    C2   C6    119.70  3.000
 3Q6  H2    C2   C1    118.71  3.000
 3Q6  C6    C2   C1    121.57  3.000
 3Q6  H3    C3   C7    120.53  3.000
 3Q6  H3    C3   C6    120.53  3.000
 3Q6  C7    C3   C6    118.93  3.000
 3Q6  H4    C4   C9    121.57  3.000
 3Q6  H4    C4   C8    121.14  3.000
 3Q6  C9    C4   C8    117.08  3.000
 3Q6  C10   C5   C7    104.17  3.000
 3Q6  C10   C5   C1    135.08  3.000
 3Q6  C7    C5   C1    120.75  3.000
 3Q6  C8    C6   C3    119.12  3.000
 3Q6  C8    C6   C2    120.32  3.000
 3Q6  C3    C6   C2    120.56  3.000
 3Q6  N26   C7   C5    112.07  3.000
 3Q6  N26   C7   C3    128.14  3.000
 3Q6  C5    C7   C3    119.79  3.000
 3Q6  N23   C8   C6    116.58  3.000
 3Q6  N23   C8   C4    122.12  3.000
 3Q6  C6    C8   C4    121.29  3.000
 3Q6  N27   C9   N24   117.34  3.000
 3Q6  N27   C9   C4    122.06  3.000
 3Q6  N24   C9   C4    120.59  3.000
 3Q6  N28   C10  N25   124.22  3.000
 3Q6  N28   C10  C5    130.60  3.000
 3Q6  N25   C10  C5    105.07  3.000
 3Q6  N29   C11  N24   116.66  3.000
 3Q6  N24   C11  N23   126.60  3.000
 3Q6  N29   C11  N23   116.70  3.000
 3Q6  O32   C12  O31   125.71  3.000
 3Q6  O31   C12  N30   123.87  3.000
 3Q6  O32   C12  N30   110.41  3.000
 3Q6  H13A  C13  H13   106.79  3.000
 3Q6  H13A  C13  C17   108.43  3.000
 3Q6  H13   C13  C17   110.15  3.000
 3Q6  H13A  C13  C16   109.03  3.000
 3Q6  H13   C13  C16   110.08  3.000
 3Q6  C17   C13  C16   112.19  3.000
 3Q6  H14A  C14  H14   107.58  3.000
 3Q6  H14A  C14  N27   109.68  3.000
 3Q6  H14   C14  N27   108.05  3.000
 3Q6  H14A  C14  C16   110.94  3.000
 3Q6  H14   C14  C16   109.79  3.000
 3Q6  N27   C14  C16   110.70  3.000
 3Q6  H15A  C15  H15   106.41  3.000
 3Q6  H15A  C15  N27   107.83  3.000
 3Q6  H15   C15  N27   111.31  3.000
 3Q6  H15A  C15  C17   108.93  3.000
 3Q6  H15   C15  C17   112.01  3.000
 3Q6  N27   C15  C17   110.17  3.000
 3Q6  H16   C16  C18   107.72  3.000
 3Q6  H16   C16  C14   106.75  3.000
 3Q6  C18   C16  C14   111.95  3.000
 3Q6  H16   C16  C13   107.44  3.000
 3Q6  C18   C16  C13   112.06  3.000
 3Q6  C14   C16  C13   110.62  3.000
 3Q6  H17   C17  N30   107.95  3.000
 3Q6  H17   C17  C15   108.75  3.000
 3Q6  N30   C17  C15   111.58  3.000
 3Q6  H17   C17  C13   109.72  3.000
 3Q6  N30   C17  C13   110.37  3.000
 3Q6  C15   C17  C13   108.46  3.000
 3Q6  H18B  C18  H18A  107.64  3.000
 3Q6  H18B  C18  H18   107.29  3.000
 3Q6  H18A  C18  H18   107.22  3.000
 3Q6  H18B  C18  C16   110.59  3.000
 3Q6  H18A  C18  C16   110.98  3.000
 3Q6  H18   C18  C16   112.88  3.000
 3Q6  H19B  C19  H19A  107.83  3.000
 3Q6  H19B  C19  H19   107.78  3.000
 3Q6  H19A  C19  H19   108.46  3.000
 3Q6  H19B  C19  C22   109.88  3.000
 3Q6  H19A  C19  C22   111.43  3.000
 3Q6  H19   C19  C22   111.33  3.000
 3Q6  H20B  C20  H20A  107.59  3.000
 3Q6  H20B  C20  H20   107.78  3.000
 3Q6  H20A  C20  H20   108.76  3.000
 3Q6  H20B  C20  C22   109.30  3.000
 3Q6  H20A  C20  C22   110.92  3.000
 3Q6  H20   C20  C22   112.32  3.000
 3Q6  H21B  C21  H21A  108.74  3.000
 3Q6  H21B  C21  H21   107.86  3.000
 3Q6  H21A  C21  H21   107.45  3.000
 3Q6  H21B  C21  C22   112.61  3.000
 3Q6  H21A  C21  C22   111.03  3.000
 3Q6  H21   C21  C22   108.98  3.000
 3Q6  O32   C22  C21   111.36  3.000
 3Q6  O32   C22  C20   110.69  3.000
 3Q6  C21   C22  C20   111.91  3.000
 3Q6  O32   C22  C19   102.94  3.000
 3Q6  C21   C22  C19   109.74  3.000
 3Q6  C20   C22  C19   109.83  3.000
 3Q6  C11   N23  C8    116.28  3.000
 3Q6  C11   N24  C9    117.29  3.000
 3Q6  HN25  N25  N26   118.84  3.000
 3Q6  HN25  N25  C10   125.77  3.000
 3Q6  N26   N25  C10   115.39  3.000
 3Q6  N25   N26  C7    103.29  3.000
 3Q6  C15   N27  C14   112.07  3.000
 3Q6  C15   N27  C9    121.81  3.000
 3Q6  C14   N27  C9    121.85  3.000
 3Q6  HN2A  N28  HN28  111.14  3.000
 3Q6  HN2A  N28  C10   116.00  3.000
 3Q6  HN28  N28  C10   114.32  3.000
 3Q6  HN2B  N29  HN29  116.14  3.000
 3Q6  HN2B  N29  C11   117.58  3.000
 3Q6  HN29  N29  C11   117.92  3.000
 3Q6  HN30  N30  C17   118.52  3.000
 3Q6  HN30  N30  C12   118.78  3.000
 3Q6  C17   N30  C12   121.45  3.000
 3Q6  C22   O32  C12   122.58  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
 3Q6  CONST_01  C3    C6   C2   C1      0.00   0.0  0
 3Q6  CONST_02  C8    C6   C2   C1    180.00   0.0  0
 3Q6  CONST_03  C3    C7   C5   C1      0.00   0.0  0
 3Q6  CONST_04  N26   C7   C5   C1    180.00   0.0  0
 3Q6  CONST_05  N25   C10  C5   C1    180.00   0.0  0
 3Q6  CONST_06  C7    C5   C1   C2      0.00   0.0  0
 3Q6  CONST_07  C10   C5   C1   C2    180.00   0.0  0
 3Q6  CONST_08  C7    C3   C6   C2      0.00   0.0  0
 3Q6  CONST_13  C10   C5   C7   C3    180.00   0.0  0
 3Q6  CONST_14  N25   N26  C7   C3    180.00   0.0  0
 3Q6  CONST_15  C11   N24  C9   C4      0.00   0.0  0
 3Q6  CONST_16  C11   N23  C8   C4      0.00   0.0  0
 3Q6  CONST_17  C6    C2   C1   C5      0.00   0.0  0
 3Q6  CONST_18  C6    C3   C7   C5      0.00   0.0  0
 3Q6  CONST_19  N25   N26  C7   C5      0.00   0.0  0
 3Q6  CONST_20  N26   N25  C10  C5      0.00   0.0  0
 3Q6  CONST_21  N26   C7   C3   C6    180.00   0.0  0
 3Q6  CONST_22  C9    C4   C8   C6    180.00   0.0  0
 3Q6  CONST_23  C11   N23  C8   C6    180.00   0.0  0
 3Q6  CONST_24  C8    C6   C3   C7    180.00   0.0  0
 3Q6  CONST_25  N25   C10  C5   C7      0.00   0.0  0
 3Q6  CONST_26  C10   N25  N26  C7      0.00   0.0  0
 3Q6  CONST_27  N24   C9   C4   C8      0.00   0.0  0
 3Q6  CONST_28  N24   C11  N23  C8      0.00   0.0  0
 3Q6  CONST_29  N23   C8   C4   C9      0.00   0.0  0
 3Q6  CONST_30  N23   C11  N24  C9      0.00   0.0  0
 3Q6  CONST_31  N26   C7   C5   C10     0.00   0.0  0
 3Q6  CONST_32  N27   C9   C4   C8    180.00   0.0  0
 3Q6  CONST_33  N27   C9   N24  C11   180.00   0.0  0
 3Q6  CONST_34  N28   C10  C5   C1      0.00   0.0  0
 3Q6  CONST_35  N28   C10  C5   C7    180.00   0.0  0
 3Q6  CONST_36  N29   C11  N23  C8    180.00   0.0  0
 3Q6  CONST_37  N29   C11  N24  C9    180.00   0.0  0
 3Q6  CONST_38  N28   C10  N25  N26   180.00   0.0  0
 3Q6  CONST_39  H3    C3   C6   C2    180.00   0.0  0
 3Q6  CONST_40  H2    C2   C6   C3    180.00   0.0  0
 3Q6  CONST_41  HN25  N25  C10  C5    180.00   0.0  0
 3Q6  CONST_42  H1    C1   C2   C6    180.00   0.0  0
 3Q6  CONST_43  H4    C4   C8   C6      0.00   0.0  0
 3Q6  Var_01    C14   N27  C9   C4    154.41  30.0  2
 3Q6  Var_02    C16   C14  N27  C9    -97.06  30.0  1
 3Q6  Var_03    C17   C15  N27  C9     93.14  30.0  1
 3Q6  Var_04    O32   C12  N30  C17  -173.87  30.0  2
 3Q6  Var_05    C19   C22  O32  C12  -176.69  30.0  3
 3Q6  Var_06    N30   C12  O32  C22   179.05  30.0  3
 3Q6  Var_07    H20   C20  C22  C19  -179.34  30.0  3
 3Q6  Var_08    H21   C21  C22  C19   -54.42  30.0  3
 3Q6  Var_09    H19   C19  C22  C20    57.57  30.0  3

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
 3Q6  chir_01  C16  C13  C14  C18  positiv
 3Q6  chir_02  C17  N30  C13  C15  positiv

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
 3Q6  plan-1  C4    0.020
 3Q6  plan-1  C6    0.020
 3Q6  plan-1  C8    0.020
 3Q6  plan-1  C9    0.020
 3Q6  plan-1  C11   0.020
 3Q6  plan-1  N23   0.020
 3Q6  plan-1  N24   0.020
 3Q6  plan-1  N27   0.020
 3Q6  plan-1  N29   0.020
 3Q6  plan-1  H4    0.020
 3Q6  plan-2  C1    0.020
 3Q6  plan-2  C2    0.020
 3Q6  plan-2  C3    0.020
 3Q6  plan-2  C5    0.020
 3Q6  plan-2  C6    0.020
 3Q6  plan-2  C7    0.020
 3Q6  plan-2  C8    0.020
 3Q6  plan-2  C10   0.020
 3Q6  plan-2  N25   0.020
 3Q6  plan-2  N26   0.020
 3Q6  plan-2  N28   0.020
 3Q6  plan-2  H1    0.020
 3Q6  plan-2  H2    0.020
 3Q6  plan-2  H3    0.020
 3Q6  plan-2  HN25  0.020
 3Q6  plan-3  C10   0.020
 3Q6  plan-3  N28   0.020
 3Q6  plan-3  HN28  0.020
 3Q6  plan-3  HN2A  0.020
 3Q6  plan-4  C11   0.020
 3Q6  plan-4  N29   0.020
 3Q6  plan-4  HN29  0.020
 3Q6  plan-4  HN2B  0.020
 3Q6  plan-5  C12   0.020
 3Q6  plan-5  N30   0.020
 3Q6  plan-5  O31   0.020
 3Q6  plan-5  O32   0.020

