# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Tue Apr 21 00:43:16 2020
#   Inital geometry file: a 135 line input string
#   Ligand name: 2-[(2S)-1-(6-{[(4,5-difluoro-1H-benzimidazol-2-yl)methyl]amino}-9-ethyl-9H-purin-2-yl)piperidin-2-yl]ethan-1-ol
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CCn1cnc2c(NCc3[nH]c4ccc(F)c(F)c4n3)nc(nc12)N5CCCC[C@H]5CCO
#
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
 CJM  CJM  2-[(2S)-1-(6-{[(4,5-difluoro-1H-benzimidazol-2-yl)methyl]amino}-9-ethyl-9H-purin-2-yl)piperidin-2-yl]ethan-1-ol  ligand  59  33  .  2021-08-07  2021-08-07  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK
;

data_comp_CJM
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
 CJM  C1   C  CH3   0  -0.671  -4.7684  -3.6145  -0.6605
 CJM  C2   C  CH2   0  -0.308  -4.0019  -3.7680   0.6418
 CJM  C7   C  CR56  0   0.499  -2.3124  -1.9206   0.4547
 CJM  C9   C  CR6   0   0.618  -2.4708   0.2845   0.3202
 CJM  C11  C  CR6   0   0.520  -0.3522  -0.6386   0.1941
 CJM  C13  C  CH2   0  -0.325   1.5790   0.8133  -0.1187
 CJM  C14  C  CR5   0   0.457   3.0542   0.6438  -0.2451
 CJM  C16  C  CR56  0  -0.020   4.9991  -0.1888  -0.3704
 CJM  N18  N  NR15  0  -0.708   3.8899   1.6956  -0.4071
 CJM  C19  C  CR16  0  -0.294   6.4062   1.7990  -0.6608
 CJM  C20  C  CR16  0  -0.435   7.5055   0.9604  -0.7053
 CJM  C21  C  CR6   0   0.371   7.3547  -0.4199  -0.5845
 CJM  C22  C  CR6   0   0.345   6.1203  -1.0079  -0.4165
 CJM  N25  N  NT    0  -0.505  -3.2152   1.4289   0.3262
 CJM  C27  C  CH2   0  -0.437  -3.2624   3.8739   0.5952
 CJM  C30  C  CH1   0  -0.098  -4.6716   1.3205   0.2670
 CJM  C31  C  CH2   0  -0.467  -5.1564   1.1031  -1.1728
 CJM  C32  C  CH2   0  -0.142  -6.5977   0.6321  -1.2353
 CJM  N3   N  NR5   0  -0.497  -2.6557  -3.2350   0.5569
 CJM  C4   C  CR15  0   0.087  -1.4866  -3.9421   0.4839
 CJM  N5   N  N     0  -0.456  -0.4315  -3.1919   0.3532
 CJM  C6   C  CR56  0  -0.056  -0.9328  -1.9140   0.3321
 CJM  N8   N  N     0  -0.522  -3.1232  -0.8697   0.4588
 CJM  N10  N  N     0  -0.554  -1.1389   0.4292   0.1850
 CJM  N15  N  N     0  -0.490   3.6748  -0.5032  -0.2168
 CJM  C17  C  CR56  0   0.348   5.1651   1.1990  -0.4938
 CJM  F23  F  F     0  -0.297   6.0018  -2.3315  -0.3006
 CJM  F24  F  F     0  -0.316   8.4414  -1.2057  -0.6329
 CJM  C26  C  CH2   0  -0.300  -2.6342   2.6874  -0.1174
 CJM  C28  C  CH2   0  -0.448  -4.7767   3.8549   0.4577
 CJM  C29  C  CH2   0  -0.435  -5.3094   2.5228   0.9643
 CJM  O33  O  OH1   0  -0.675  -6.9231   0.3463  -2.5795
 CJM  H1   H  HCH3  0   0.240  -5.7657  -4.0403  -0.5520
 CJM  H2   H  HCH3  0   0.243  -4.8761  -2.5639  -0.9288
 CJM  H3   H  HCH3  0   0.233  -4.2651  -4.1320  -1.4770
 CJM  H4   H  HCH2  0   0.258  -4.5221  -3.2588   1.4535
 CJM  H5   H  HCH2  0   0.263  -3.9176  -4.8176   0.9206
 CJM  H6   H  HCH2  0   0.277   1.3633   1.4837   0.7195
 CJM  H7   H  HCH2  0   0.276   1.1936   1.3117  -1.0149
 CJM  H8   H  HNR5  0   0.429   3.6243   2.6674  -0.4561
 CJM  H9   H  HCR6  0   0.283   6.5204   2.8699  -0.7526
 CJM  H10  H  HCR6  0   0.291   8.5001   1.3655  -0.8360
 CJM  H11  H  HCH2  0   0.217  -2.9897   3.8455   1.6549
 CJM  H12  H  HCH2  0   0.234  -2.8405   4.7921   0.1812
 CJM  H13  H  HCH1  0   0.257  -4.9435   0.4314   0.8348
 CJM  H14  H  HCH2  0   0.224  -5.0413   2.0112  -1.7718
 CJM  H15  H  HCH2  0   0.237  -4.5259   0.3359  -1.6307
 CJM  H16  H  HCH2  0   0.188  -6.7073  -0.2570  -0.5981
 CJM  H17  H  HCH2  0   0.193  -7.2682   1.3974  -0.8241
 CJM  H18  H  HCR5  0   0.283  -1.4849  -5.0210   0.5386
 CJM  H19  H  HNH1  0   0.408   1.5674  -1.2857   0.0454
 CJM  H21  H  HCH2  0   0.268  -1.5652   2.6594   0.0702
 CJM  H22  H  HCH2  0   0.214  -2.7613   2.8046  -1.2025
 CJM  H23  H  HCH2  0   0.236  -5.2269   4.6777   1.0167
 CJM  H24  H  HCH2  0   0.217  -5.0540   4.0043  -0.5907
 CJM  H25  H  HCH2  0   0.236  -6.3940   2.4703   0.8525
 CJM  H26  H  HCH2  0   0.230  -5.1085   2.4436   2.0371
 CJM  H27  H  HOH1  0   0.452  -7.8450   0.0765  -2.6117
 CJM  N12  N  NH1   0  -0.680   0.9707  -0.4731   0.0684

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
 CJM  C19  C20  aromatic  1.383  0.020  1.383
 CJM  C19  C17  aromatic  1.389  0.020  1.389
 CJM  N18  C17  aromatic  1.371  0.020  1.371
 CJM  N18  C14  aromatic  1.353  0.020  1.353
 CJM  N5   C4   aromatic  1.301  0.020  1.301
 CJM  N5   C6   aromatic  1.373  0.020  1.373
 CJM  C20  C21  aromatic  1.394  0.020  1.394
 CJM  C4   N3   aromatic  1.368  0.020  1.368
 CJM  C17  C16  aromatic  1.403  0.020  1.403
 CJM  N12  C13  single    1.435  0.020  1.435
 CJM  N12  C11  single    1.339  0.020  1.339
 CJM  C14  C13  single    1.490  0.020  1.490
 CJM  C14  N15  aromatic  1.305  0.020  1.305
 CJM  C6   C11  aromatic  1.408  0.020  1.408
 CJM  C6   C7   aromatic  1.385  0.020  1.385
 CJM  N3   C7   aromatic  1.362  0.020  1.362
 CJM  N3   C2   single    1.450  0.020  1.450
 CJM  C11  N10  aromatic  1.326  0.020  1.326
 CJM  C21  F24  single    1.342  0.020  1.342
 CJM  C21  C22  aromatic  1.378  0.020  1.378
 CJM  C16  N15  aromatic  1.370  0.020  1.370
 CJM  C16  C22  aromatic  1.389  0.020  1.389
 CJM  C7   N8   aromatic  1.327  0.020  1.327
 CJM  C2   C1   single    1.519  0.020  1.519
 CJM  C22  F23  single    1.334  0.020  1.334
 CJM  N10  C9   aromatic  1.347  0.020  1.347
 CJM  N8   C9   aromatic  1.333  0.020  1.333
 CJM  C9   N25  single    1.365  0.020  1.365
 CJM  N25  C26  single    1.455  0.020  1.455
 CJM  N25  C30  single    1.462  0.020  1.462
 CJM  C26  C27  single    1.520  0.020  1.520
 CJM  C30  C29  single    1.529  0.020  1.529
 CJM  C30  C31  single    1.535  0.020  1.535
 CJM  O33  C32  single    1.412  0.020  1.412
 CJM  C28  C27  single    1.521  0.020  1.521
 CJM  C28  C29  single    1.521  0.020  1.521
 CJM  C32  C31  single    1.518  0.020  1.518
 CJM  C1   H1   single    0.970  0.020  1.090
 CJM  C1   H2   single    0.970  0.020  1.090
 CJM  C1   H3   single    0.970  0.020  1.090
 CJM  C2   H4   single    0.970  0.020  1.090
 CJM  C2   H5   single    0.970  0.020  1.090
 CJM  C13  H6   single    0.970  0.020  1.090
 CJM  C13  H7   single    0.970  0.020  1.090
 CJM  N18  H8   single    0.860  0.020  1.020
 CJM  C19  H9   single    0.930  0.020  1.080
 CJM  C20  H10  single    0.930  0.020  1.080
 CJM  C27  H11  single    0.970  0.020  1.090
 CJM  C27  H12  single    0.970  0.020  1.090
 CJM  C30  H13  single    0.970  0.020  1.090
 CJM  C31  H14  single    0.970  0.020  1.090
 CJM  C31  H15  single    0.970  0.020  1.090
 CJM  C32  H16  single    0.970  0.020  1.090
 CJM  C32  H17  single    0.970  0.020  1.090
 CJM  C4   H18  single    0.930  0.020  1.080
 CJM  N12  H19  single    0.860  0.020  1.020
 CJM  C26  H21  single    0.970  0.020  1.090
 CJM  C26  H22  single    0.970  0.020  1.090
 CJM  C28  H23  single    0.970  0.020  1.090
 CJM  C28  H24  single    0.970  0.020  1.090
 CJM  C29  H25  single    0.970  0.020  1.090
 CJM  C29  H26  single    0.970  0.020  1.090
 CJM  O33  H27  single    0.850  0.020  0.980

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
 CJM  H3   C1   H2   108.60  3.000
 CJM  H3   C1   H1   108.16  3.000
 CJM  H2   C1   H1   108.10  3.000
 CJM  H3   C1   C2   111.18  3.000
 CJM  H2   C1   C2   111.00  3.000
 CJM  H1   C1   C2   109.69  3.000
 CJM  H5   C2   H4   107.24  3.000
 CJM  H5   C2   N3   107.29  3.000
 CJM  H4   C2   N3   108.35  3.000
 CJM  H5   C2   C1   110.84  3.000
 CJM  H4   C2   C1   110.51  3.000
 CJM  N3   C2   C1   112.40  3.000
 CJM  N8   C7   C6   127.22  3.000
 CJM  N8   C7   N3   127.57  3.000
 CJM  C6   C7   N3   105.21  3.000
 CJM  N10  C9   N8   125.98  3.000
 CJM  N8   C9   N25  117.29  3.000
 CJM  N10  C9   N25  116.73  3.000
 CJM  N12  C11  N10  119.07  3.000
 CJM  N10  C11  C6   119.03  3.000
 CJM  N12  C11  C6   121.90  3.000
 CJM  H7   C13  H6   106.17  3.000
 CJM  H7   C13  N12  111.43  3.000
 CJM  H6   C13  N12  111.44  3.000
 CJM  H7   C13  C14  109.30  3.000
 CJM  H6   C13  C14  109.24  3.000
 CJM  N12  C13  C14  109.19  3.000
 CJM  N15  C14  N18  113.09  3.000
 CJM  N15  C14  C13  124.69  3.000
 CJM  N18  C14  C13  122.21  3.000
 CJM  C17  C16  N15  110.57  3.000
 CJM  N15  C16  C22  130.44  3.000
 CJM  C17  C16  C22  119.00  3.000
 CJM  H8   N18  C17  126.21  3.000
 CJM  H8   N18  C14  126.31  3.000
 CJM  C17  N18  C14  107.48  3.000
 CJM  H9   C19  C17  122.19  3.000
 CJM  H9   C19  C20  120.92  3.000
 CJM  C17  C19  C20  116.88  3.000
 CJM  H10  C20  C21  118.73  3.000
 CJM  H10  C20  C19  120.50  3.000
 CJM  C21  C20  C19  120.77  3.000
 CJM  F24  C21  C22  118.70  3.000
 CJM  C22  C21  C20  122.02  3.000
 CJM  F24  C21  C20  119.29  3.000
 CJM  F23  C22  C21  120.91  3.000
 CJM  F23  C22  C16  120.70  3.000
 CJM  C21  C22  C16  118.40  3.000
 CJM  C26  N25  C30  116.72  3.000
 CJM  C30  N25  C9   118.75  3.000
 CJM  C26  N25  C9   120.39  3.000
 CJM  H12  C27  H11  107.02  3.000
 CJM  H12  C27  C28  111.16  3.000
 CJM  H11  C27  C28  109.60  3.000
 CJM  H12  C27  C26  108.59  3.000
 CJM  H11  C27  C26  109.31  3.000
 CJM  C28  C27  C26  111.07  3.000
 CJM  H13  C30  C29  107.45  3.000
 CJM  H13  C30  C31  107.13  3.000
 CJM  C29  C30  C31  114.04  3.000
 CJM  H13  C30  N25  106.75  3.000
 CJM  C31  C30  N25  111.30  3.000
 CJM  C29  C30  N25  109.80  3.000
 CJM  H15  C31  H14  107.01  3.000
 CJM  H15  C31  C32  108.21  3.000
 CJM  H14  C31  C32  109.57  3.000
 CJM  H15  C31  C30  108.07  3.000
 CJM  H14  C31  C30  111.28  3.000
 CJM  C32  C31  C30  112.49  3.000
 CJM  H17  C32  H16  106.61  3.000
 CJM  H17  C32  O33  110.91  3.000
 CJM  H16  C32  O33  111.41  3.000
 CJM  H17  C32  C31  110.39  3.000
 CJM  H16  C32  C31  108.77  3.000
 CJM  O33  C32  C31  108.71  3.000
 CJM  C4   N3   C7   106.22  3.000
 CJM  C7   N3   C2   126.36  3.000
 CJM  C4   N3   C2   127.32  3.000
 CJM  H18  C4   N5   125.42  3.000
 CJM  H18  C4   N3   120.98  3.000
 CJM  N5   C4   N3   113.60  3.000
 CJM  C6   N5   C4   104.01  3.000
 CJM  N5   C6   C11  133.95  3.000
 CJM  C11  C6   C7   115.07  3.000
 CJM  N5   C6   C7   110.97  3.000
 CJM  C9   N8   C7   112.73  3.000
 CJM  C11  N10  C9   119.97  3.000
 CJM  C16  N15  C14  104.82  3.000
 CJM  C19  C17  N18  133.02  3.000
 CJM  N18  C17  C16  104.04  3.000
 CJM  C19  C17  C16  122.93  3.000
 CJM  H22  C26  H21  106.70  3.000
 CJM  H22  C26  C27  109.38  3.000
 CJM  H21  C26  C27  110.25  3.000
 CJM  H22  C26  N25  110.31  3.000
 CJM  H21  C26  N25  108.55  3.000
 CJM  C27  C26  N25  111.53  3.000
 CJM  H24  C28  H23  106.43  3.000
 CJM  H24  C28  C29  110.47  3.000
 CJM  H23  C28  C29  110.17  3.000
 CJM  H24  C28  C27  109.71  3.000
 CJM  H23  C28  C27  110.79  3.000
 CJM  C29  C28  C27  109.24  3.000
 CJM  H26  C29  H25  106.22  3.000
 CJM  H26  C29  C28  109.00  3.000
 CJM  H25  C29  C28  110.85  3.000
 CJM  H26  C29  C30  108.27  3.000
 CJM  H25  C29  C30  109.26  3.000
 CJM  C28  C29  C30  112.98  3.000
 CJM  H27  O33  C32  108.04  3.000
 CJM  H19  N12  C13  117.94  3.000
 CJM  H19  N12  C11  119.15  3.000
 CJM  C13  N12  C11  122.80  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
 CJM  CONST_01  C4   N5   C6   C7      0.00   0.0  0
 CJM  CONST_02  N10  C11  C6   C7      0.00   0.0  0
 CJM  CONST_03  N5   C4   N3   C7      0.00   0.0  0
 CJM  CONST_04  N10  C9   N8   C7      0.00   0.0  0
 CJM  CONST_05  C6   C11  N10  C9      0.00   0.0  0
 CJM  CONST_06  C6   C7   N8   C9      0.00   0.0  0
 CJM  CONST_07  N3   C7   N8   C9    180.00   0.0  0
 CJM  CONST_08  C4   N5   C6   C11   180.00   0.0  0
 CJM  CONST_09  N3   C7   C6   C11   180.00   0.0  0
 CJM  CONST_10  N8   C7   C6   C11     0.00   0.0  0
 CJM  CONST_11  N8   C9   N10  C11     0.00   0.0  0
 CJM  CONST_12  C19  C17  N18  C14   180.00   0.0  0
 CJM  CONST_13  C16  C17  N18  C14     0.00   0.0  0
 CJM  CONST_14  C17  C16  N15  C14     0.00   0.0  0
 CJM  CONST_15  C22  C16  N15  C14   180.00   0.0  0
 CJM  CONST_16  C20  C19  C17  C16     0.00   0.0  0
 CJM  CONST_17  N18  C14  N15  C16     0.00   0.0  0
 CJM  CONST_18  C20  C21  C22  C16     0.00   0.0  0
 CJM  CONST_19  C20  C19  C17  N18   180.00   0.0  0
 CJM  CONST_20  N15  C16  C17  N18     0.00   0.0  0
 CJM  CONST_21  C22  C16  C17  N18   180.00   0.0  0
 CJM  CONST_22  C22  C21  C20  C19     0.00   0.0  0
 CJM  CONST_23  N15  C16  C17  C19   180.00   0.0  0
 CJM  CONST_24  C22  C16  C17  C19     0.00   0.0  0
 CJM  CONST_25  C17  C19  C20  C21     0.00   0.0  0
 CJM  CONST_26  C17  C16  C22  C21     0.00   0.0  0
 CJM  CONST_27  N15  C16  C22  C21   180.00   0.0  0
 CJM  CONST_28  C6   N5   C4   N3      0.00   0.0  0
 CJM  CONST_29  N5   C6   C7   N3      0.00   0.0  0
 CJM  CONST_30  C6   C7   N3   C4      0.00   0.0  0
 CJM  CONST_31  N8   C7   N3   C4    180.00   0.0  0
 CJM  CONST_32  N10  C11  C6   N5    180.00   0.0  0
 CJM  CONST_33  N8   C7   C6   N5    180.00   0.0  0
 CJM  CONST_34  C17  N18  C14  N15     0.00   0.0  0
 CJM  CONST_35  N25  C9   N8   C7    180.00   0.0  0
 CJM  CONST_36  N25  C9   N10  C11   180.00   0.0  0
 CJM  CONST_37  N5   C4   N3   C2    180.00   0.0  0
 CJM  CONST_38  C6   C7   N3   C2    180.00   0.0  0
 CJM  CONST_39  N8   C7   N3   C2      0.00   0.0  0
 CJM  CONST_40  N12  C11  C6   C7    180.00   0.0  0
 CJM  CONST_41  N12  C11  N10  C9    180.00   0.0  0
 CJM  CONST_42  C17  N18  C14  C13   180.00   0.0  0
 CJM  CONST_43  C16  N15  C14  C13   180.00   0.0  0
 CJM  CONST_44  F24  C21  C22  C16   180.00   0.0  0
 CJM  CONST_45  F24  C21  C20  C19   180.00   0.0  0
 CJM  CONST_46  F23  C22  C21  C20   180.00   0.0  0
 CJM  CONST_47  N12  C11  C6   N5      0.00   0.0  0
 CJM  CONST_48  F23  C22  C16  N15     0.00   0.0  0
 CJM  CONST_49  F23  C22  C16  C17   180.00   0.0  0
 CJM  CONST_50  H18  C4   N3   C7    180.00   0.0  0
 CJM  CONST_51  H9   C19  C17  C16   180.00   0.0  0
 CJM  CONST_52  H8   N18  C17  C16   180.00   0.0  0
 CJM  CONST_53  H10  C20  C21  C22   180.00   0.0  0
 CJM  CONST_54  C6   C11  N12  C13   180.00   0.0  0
 CJM  CONST_55  N10  C11  N12  C13     0.00   0.0  0
 CJM  CONST_56  H19  N12  C11  C6      0.00   0.0  0
 CJM  Var_01    C27  C26  N25  C9   -150.17  30.0  1
 CJM  Var_02    C28  C27  C26  N25   -53.79  30.0  1
 CJM  Var_03    C30  C29  C28  C27   -55.46  30.0  1
 CJM  Var_04    N10  C9   N25  C30   170.89  30.0  2
 CJM  Var_05    C29  C28  C27  C26    55.35  30.0  1
 CJM  Var_06    C4   N3   C2   C1   -106.32  30.0  2
 CJM  Var_07    C14  C13  N12  C11  -179.03  30.0  3
 CJM  Var_08    N12  C13  C14  N18  -178.82  30.0  2
 CJM  Var_09    O33  C32  C31  C30  -174.94  30.0  2
 CJM  Var_10    H1   C1   C2   N3    179.23  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
 CJM  chir_01  C30  N25  C29  C31  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
 CJM  plan-1  C13  0.020
 CJM  plan-1  C14  0.020
 CJM  plan-1  C16  0.020
 CJM  plan-1  N18  0.020
 CJM  plan-1  C19  0.020
 CJM  plan-1  C20  0.020
 CJM  plan-1  C21  0.020
 CJM  plan-1  C22  0.020
 CJM  plan-1  N15  0.020
 CJM  plan-1  C17  0.020
 CJM  plan-1  F23  0.020
 CJM  plan-1  F24  0.020
 CJM  plan-1  H8   0.020
 CJM  plan-1  H9   0.020
 CJM  plan-1  H10  0.020
 CJM  plan-2  C2   0.020
 CJM  plan-2  C7   0.020
 CJM  plan-2  C9   0.020
 CJM  plan-2  C11  0.020
 CJM  plan-2  N25  0.020
 CJM  plan-2  N3   0.020
 CJM  plan-2  C4   0.020
 CJM  plan-2  N5   0.020
 CJM  plan-2  C6   0.020
 CJM  plan-2  N8   0.020
 CJM  plan-2  N10  0.020
 CJM  plan-2  H18  0.020
 CJM  plan-2  N12  0.020
 CJM  plan-3  C11  0.020
 CJM  plan-3  C13  0.020
 CJM  plan-3  H19  0.020
 CJM  plan-3  N12  0.020

