# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Thu Jul 22 12:20:01 2021
#   Inital geometry file: a 147 line input string
#   Ligand name: methyl 1-[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-ethyl-amino]phenyl]carbonylpiperidine-4-carboxylate
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CCN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N4CCC(CC4)C(=O)OC
#
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
 KM5  KM5  'methyl 1-[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-ethyl-amino]phenyl]carbonylpiperidine-4-carboxylate'  ligand  62  34  .  2022-03-22  2022-07-25
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_KM5
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
 KM5  CAO  C  CR16  0  -0.339   7.3135  -18.0754  15.7792
 KM5  CAS  C  CR6   0   0.417   6.1514  -17.2896  15.9081
 KM5  CAT  C  CR16  0  -0.251   7.8249  -18.7774  16.8530
 KM5  CAU  C  CR6   0  -0.102   7.2157  -18.7466  18.1061
 KM5  CAV  C  CH2   0  -0.280   9.4161  -20.6526  20.5133
 KM5  CBG  C  CH3   0  -0.423  13.3565  -18.0672  23.5156
 KM5  OBE  O  O2    0  -0.454  12.9545  -18.4256  22.1935
 KM5  OBF  O  O     0  -0.444  11.7011  -20.0860  22.9937
 KM5  CAZ  C  CH1   0  -0.366  11.7398  -19.6535  20.6128
 KM5  CBA  C  CH2   0  -0.486  10.9065  -20.9184  20.3965
 KM5  CAY  C  CH2   0  -0.456  10.9746  -18.4137  20.0965
 KM5  CAX  C  CH2   0  -0.315  10.0174  -18.7967  18.9788
 KM5  NAW  N  NT    0  -0.460   8.9940  -19.7069  19.4824
 KM5  CBB  C  C     0   0.522   7.6682  -19.5718  19.2563
 KM5  OBC  O  O     0  -0.508   6.8408  -20.1401  19.9657
 KM5  CAQ  C  CR16  0  -0.261   6.0517  -17.9903  18.2330
 KM5  CAR  C  CR16  0  -0.348   5.5368  -17.2675  17.1764
 KM5  N10  N  NT    0  -0.488   5.6288  -16.5978  14.8536
 KM5  CAP  C  CH2   0  -0.337   4.5907  -15.5991  15.0340
 KM5  CBH  C  CH3   0  -0.655   3.1831  -16.1657  14.9161
 KM5  C9   C  CH2   0  -0.420   6.2228  -16.6725  13.5509
 KM5  C6   C  CR6   0   0.159   7.4114  -15.7561  13.3725
 KM5  N5   N  N     0  -0.371   7.7680  -14.9628  14.3502
 KM5  C4A  C  CR66  0   0.010   8.8129  -14.1626  14.1429
 KM5  C4   C  CR6   0   0.482   9.2663  -13.2677  15.1795
 KM5  N4   N  NH2   0  -0.804   8.6354  -13.2624  16.3477
 KM5  N3   N  N     0  -0.502  10.2894  -12.4716  14.9673
 KM5  C2   C  CR6   0   0.550  10.8907  -12.5301  13.7568
 KM5  N2   N  NH2   0  -0.816  11.9254  -11.6949  13.5957
 KM5  N1   N  N     0  -0.510  10.5711  -13.3140  12.7363
 KM5  C8A  C  CR66  0   0.384   9.5293  -14.1310  12.9365
 KM5  N8   N  N     0  -0.390   9.1549  -14.9566  11.9348
 KM5  C7   C  CR16  0  -0.088   8.1314  -15.7393  12.1568
 KM5  H1   H  HCR6  0   0.260   7.8412  -18.1400  14.8382
 KM5  H2   H  HCR6  0   0.258   8.7158  -19.3716  16.6926
 KM5  H3   H  HCH2  0   0.233   9.1753  -20.2730  21.5119
 KM5  H4   H  HCH2  0   0.253   8.8643  -21.5839  20.3876
 KM5  H5   H  HCH3  0   0.251  14.0354  -17.2272  23.4043
 KM5  H6   H  HCH3  0   0.238  12.5035  -17.7633  24.1220
 KM5  H7   H  HCH3  0   0.238  13.8744  -18.8873  24.0119
 KM5  H8   H  HCH1  0   0.292  12.6711  -19.7408  20.0458
 KM5  H9   H  HCH2  0   0.255  11.1183  -21.3184  19.4026
 KM5  H10  H  HCH2  0   0.263  11.1846  -21.6995  21.1036
 KM5  H11  H  HCH2  0   0.267  11.6687  -17.6595  19.7274
 KM5  H12  H  HCH2  0   0.249  10.3944  -17.9456  20.8965
 KM5  H13  H  HCH2  0   0.242  10.5737  -19.2471  18.1502
 KM5  H14  H  HCH2  0   0.275   9.5446  -17.8954  18.5953
 KM5  H15  H  HCR6  0   0.251   5.5322  -17.9583  19.1825
 KM5  H16  H  HCR6  0   0.262   4.6318  -16.6999  17.3406
 KM5  H17  H  HCH2  0   0.259   4.7362  -14.8294  14.2749
 KM5  H18  H  HCH2  0   0.246   4.7255  -15.0916  15.9911
 KM5  H19  H  HCH3  0   0.231   2.4442  -15.3733  15.0388
 KM5  H20  H  HCH3  0   0.229   3.0278  -16.6193  13.9363
 KM5  H21  H  HCH3  0   0.228   2.9871  -16.9266  15.6721
 KM5  H22  H  HCH2  0   0.296   5.4622  -16.4149  12.8086
 KM5  H23  H  HCH2  0   0.280   6.5103  -17.6997  13.3112
 KM5  H24  H  HNH2  0   0.408   8.9265  -12.6467  17.0876
 KM5  H25  H  HNH2  0   0.411   7.8537  -13.8770  16.5012
 KM5  H26  H  HNH2  0   0.399  12.4153  -11.6527  12.7202
 KM5  H27  H  HNH2  0   0.400  12.1943  -11.0692  14.3332
 KM5  H28  H  HCR6  0   0.277   7.8351  -16.4034  11.3499
 KM5  CBD  C  C     0   0.600  12.1138  -19.4439  22.0604

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
 KM5  C7   N8   aromatic  1.308  0.020  1.308
 KM5  C7   C6   aromatic  1.413  0.020  1.413
 KM5  N8   C8A  aromatic  1.351  0.020  1.351
 KM5  C9   C6   single    1.511  0.020  1.511
 KM5  C9   N10  single    1.434  0.020  1.434
 KM5  C6   N5   aromatic  1.309  0.020  1.309
 KM5  C8A  N1   aromatic  1.339  0.020  1.339
 KM5  C8A  C4A  aromatic  1.403  0.020  1.403
 KM5  N1   C2   aromatic  1.326  0.020  1.326
 KM5  N5   C4A  aromatic  1.332  0.020  1.332
 KM5  CBH  CAP  single    1.522  0.020  1.522
 KM5  C4A  C4   aromatic  1.442  0.020  1.442
 KM5  CAP  N10  single    1.452  0.020  1.452
 KM5  C2   N2   single    1.340  0.020  1.340
 KM5  C2   N3   aromatic  1.353  0.020  1.353
 KM5  N10  CAS  single    1.365  0.020  1.365
 KM5  C4   N3   aromatic  1.314  0.020  1.314
 KM5  C4   N4   single    1.328  0.020  1.328
 KM5  CAS  CAO  aromatic  1.409  0.020  1.409
 KM5  CAS  CAR  aromatic  1.410  0.020  1.410
 KM5  CAO  CAT  aromatic  1.381  0.020  1.381
 KM5  CAR  CAQ  aromatic  1.380  0.020  1.380
 KM5  CAT  CAU  aromatic  1.394  0.020  1.394
 KM5  CAQ  CAU  aromatic  1.394  0.020  1.394
 KM5  CAU  CBB  single    1.486  0.020  1.486
 KM5  CBB  NAW  single    1.352  0.020  1.352
 KM5  CBB  OBC  double    1.229  0.020  1.229
 KM5  CAX  NAW  single    1.459  0.020  1.459
 KM5  CAX  CAY  single    1.521  0.020  1.521
 KM5  NAW  CAV  single    1.461  0.020  1.461
 KM5  CAZ  CAY  single    1.546  0.020  1.546
 KM5  CAZ  CBA  single    1.530  0.020  1.530
 KM5  CAZ  CBD  single    1.510  0.020  1.510
 KM5  OBE  CBD  single    1.327  0.020  1.327
 KM5  OBE  CBG  single    1.428  0.020  1.428
 KM5  CBA  CAV  single    1.518  0.020  1.518
 KM5  CBD  OBF  double    1.206  0.020  1.206
 KM5  CAO  H1   single    0.930  0.020  1.080
 KM5  CAT  H2   single    0.930  0.020  1.080
 KM5  CAV  H3   single    0.970  0.020  1.090
 KM5  CAV  H4   single    0.970  0.020  1.090
 KM5  CBG  H5   single    0.970  0.020  1.090
 KM5  CBG  H6   single    0.970  0.020  1.090
 KM5  CBG  H7   single    0.970  0.020  1.090
 KM5  CAZ  H8   single    0.970  0.020  1.090
 KM5  CBA  H9   single    0.970  0.020  1.090
 KM5  CBA  H10  single    0.970  0.020  1.090
 KM5  CAY  H11  single    0.970  0.020  1.090
 KM5  CAY  H12  single    0.970  0.020  1.090
 KM5  CAX  H13  single    0.970  0.020  1.090
 KM5  CAX  H14  single    0.970  0.020  1.090
 KM5  CAQ  H15  single    0.930  0.020  1.080
 KM5  CAR  H16  single    0.930  0.020  1.080
 KM5  CAP  H17  single    0.970  0.020  1.090
 KM5  CAP  H18  single    0.970  0.020  1.090
 KM5  CBH  H19  single    0.970  0.020  1.090
 KM5  CBH  H20  single    0.970  0.020  1.090
 KM5  CBH  H21  single    0.970  0.020  1.090
 KM5  C9   H22  single    0.970  0.020  1.090
 KM5  C9   H23  single    0.970  0.020  1.090
 KM5  N4   H24  single    0.860  0.020  1.020
 KM5  N4   H25  single    0.860  0.020  1.020
 KM5  N2   H26  single    0.860  0.020  1.020
 KM5  N2   H27  single    0.860  0.020  1.020
 KM5  C7   H28  single    0.930  0.020  1.080

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
 KM5  H1   CAO  CAT  117.76  3.000
 KM5  H1   CAO  CAS  121.05  3.000
 KM5  CAT  CAO  CAS  121.18  3.000
 KM5  N10  CAS  CAR  121.34  3.000
 KM5  CAR  CAS  CAO  116.80  3.000
 KM5  N10  CAS  CAO  121.85  3.000
 KM5  H2   CAT  CAU  120.33  3.000
 KM5  H2   CAT  CAO  117.93  3.000
 KM5  CAU  CAT  CAO  121.73  3.000
 KM5  CAQ  CAU  CBB  119.01  3.000
 KM5  CBB  CAU  CAT  123.40  3.000
 KM5  CAQ  CAU  CAT  117.31  3.000
 KM5  H4   CAV  H3   106.86  3.000
 KM5  H4   CAV  NAW  108.99  3.000
 KM5  H3   CAV  NAW  110.82  3.000
 KM5  H4   CAV  CBA  109.78  3.000
 KM5  H3   CAV  CBA  110.28  3.000
 KM5  NAW  CAV  CBA  110.03  3.000
 KM5  H7   CBG  H6   109.18  3.000
 KM5  H7   CBG  H5   109.38  3.000
 KM5  H6   CBG  H5   109.31  3.000
 KM5  H7   CBG  OBE  111.52  3.000
 KM5  H6   CBG  OBE  111.41  3.000
 KM5  H5   CBG  OBE  105.98  3.000
 KM5  CBD  OBE  CBG  117.64  3.000
 KM5  H8   CAZ  CAY  108.20  3.000
 KM5  H8   CAZ  CBA  108.93  3.000
 KM5  CAY  CAZ  CBA  110.26  3.000
 KM5  H8   CAZ  CBD  107.29  3.000
 KM5  CBA  CAZ  CBD  112.66  3.000
 KM5  CAY  CAZ  CBD  109.36  3.000
 KM5  H10  CBA  H9   106.17  3.000
 KM5  H10  CBA  CAZ  111.22  3.000
 KM5  H9   CBA  CAZ  109.01  3.000
 KM5  H10  CBA  CAV  109.03  3.000
 KM5  H9   CBA  CAV  108.93  3.000
 KM5  CAZ  CBA  CAV  112.27  3.000
 KM5  H12  CAY  H11  106.83  3.000
 KM5  H12  CAY  CAX  108.15  3.000
 KM5  H11  CAY  CAX  109.05  3.000
 KM5  H12  CAY  CAZ  111.20  3.000
 KM5  H11  CAY  CAZ  110.68  3.000
 KM5  CAX  CAY  CAZ  110.81  3.000
 KM5  H14  CAX  H13  107.15  3.000
 KM5  H14  CAX  NAW  109.49  3.000
 KM5  H13  CAX  NAW  111.16  3.000
 KM5  H14  CAX  CAY  108.92  3.000
 KM5  H13  CAX  CAY  109.88  3.000
 KM5  NAW  CAX  CAY  110.17  3.000
 KM5  CBB  NAW  CAX  124.60  3.000
 KM5  CAX  NAW  CAV  116.40  3.000
 KM5  CBB  NAW  CAV  117.77  3.000
 KM5  OBC  CBB  NAW  121.16  3.000
 KM5  OBC  CBB  CAU  119.90  3.000
 KM5  NAW  CBB  CAU  118.92  3.000
 KM5  H15  CAQ  CAR  118.49  3.000
 KM5  H15  CAQ  CAU  119.77  3.000
 KM5  CAR  CAQ  CAU  121.74  3.000
 KM5  H16  CAR  CAQ  118.11  3.000
 KM5  H16  CAR  CAS  120.67  3.000
 KM5  CAQ  CAR  CAS  121.20  3.000
 KM5  C9   N10  CAP  116.42  3.000
 KM5  CAP  N10  CAS  121.76  3.000
 KM5  C9   N10  CAS  121.12  3.000
 KM5  H18  CAP  H17  105.41  3.000
 KM5  H18  CAP  CBH  110.80  3.000
 KM5  H17  CAP  CBH  109.40  3.000
 KM5  H18  CAP  N10  109.90  3.000
 KM5  H17  CAP  N10  107.67  3.000
 KM5  CBH  CAP  N10  113.30  3.000
 KM5  H21  CBH  H20  107.88  3.000
 KM5  H21  CBH  H19  107.90  3.000
 KM5  H20  CBH  H19  107.87  3.000
 KM5  H21  CBH  CAP  111.86  3.000
 KM5  H20  CBH  CAP  110.85  3.000
 KM5  H19  CBH  CAP  110.33  3.000
 KM5  H23  C9   H22  104.80  3.000
 KM5  H23  C9   C6   109.70  3.000
 KM5  H22  C9   C6   108.90  3.000
 KM5  H23  C9   N10  110.92  3.000
 KM5  H22  C9   N10  108.44  3.000
 KM5  C6   C9   N10  113.67  3.000
 KM5  C7   C6   N5   119.79  3.000
 KM5  N5   C6   C9   119.58  3.000
 KM5  C7   C6   C9   120.63  3.000
 KM5  C4A  N5   C6   117.49  3.000
 KM5  C8A  C4A  C4   116.31  3.000
 KM5  C4   C4A  N5   120.49  3.000
 KM5  C8A  C4A  N5   123.20  3.000
 KM5  N3   C4   N4   120.65  3.000
 KM5  N4   C4   C4A  119.04  3.000
 KM5  N3   C4   C4A  120.31  3.000
 KM5  H25  N4   H24  119.11  3.000
 KM5  H25  N4   C4   120.07  3.000
 KM5  H24  N4   C4   120.82  3.000
 KM5  C2   N3   C4   117.68  3.000
 KM5  N1   C2   N2   117.53  3.000
 KM5  N2   C2   N3   115.09  3.000
 KM5  N1   C2   N3   127.38  3.000
 KM5  H27  N2   H26  118.93  3.000
 KM5  H27  N2   C2   120.48  3.000
 KM5  H26  N2   C2   120.53  3.000
 KM5  C8A  N1   C2   115.67  3.000
 KM5  N8   C8A  N1   118.53  3.000
 KM5  N1   C8A  C4A  122.64  3.000
 KM5  N8   C8A  C4A  118.83  3.000
 KM5  C7   N8   C8A  117.18  3.000
 KM5  H28  C7   N8   116.96  3.000
 KM5  H28  C7   C6   119.53  3.000
 KM5  N8   C7   C6   123.51  3.000
 KM5  CAZ  CBD  OBF  125.70  3.000
 KM5  OBF  CBD  OBE  123.21  3.000
 KM5  CAZ  CBD  OBE  111.08  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
 KM5  CONST_01  CAQ  CAR  CAS  CAO     0.00   0.0  0
 KM5  CONST_02  CAQ  CAU  CAT  CAO     0.00   0.0  0
 KM5  CONST_03  CAU  CAT  CAO  CAS     0.00   0.0  0
 KM5  CONST_04  CAU  CAQ  CAR  CAS     0.00   0.0  0
 KM5  CONST_05  CAR  CAS  CAO  CAT     0.00   0.0  0
 KM5  CONST_06  CAR  CAQ  CAU  CAT     0.00   0.0  0
 KM5  CONST_07  C8A  N8   C7   C6      0.00   0.0  0
 KM5  CONST_08  C8A  C4A  N5   C6      0.00   0.0  0
 KM5  CONST_09  C4   C4A  N5   C6    180.00   0.0  0
 KM5  CONST_10  N8   C7   C6   N5      0.00   0.0  0
 KM5  CONST_11  N8   C8A  C4A  N5      0.00   0.0  0
 KM5  CONST_12  N1   C8A  C4A  N5    180.00   0.0  0
 KM5  CONST_13  N3   C4   C4A  N5    180.00   0.0  0
 KM5  CONST_14  C7   N8   C8A  C4A     0.00   0.0  0
 KM5  CONST_15  C2   N1   C8A  C4A     0.00   0.0  0
 KM5  CONST_16  C7   C6   N5   C4A     0.00   0.0  0
 KM5  CONST_17  C2   N3   C4   C4A     0.00   0.0  0
 KM5  CONST_18  N8   C8A  C4A  C4    180.00   0.0  0
 KM5  CONST_19  N1   C8A  C4A  C4      0.00   0.0  0
 KM5  CONST_20  N1   C2   N3   C4      0.00   0.0  0
 KM5  CONST_21  C8A  N1   C2   N3      0.00   0.0  0
 KM5  CONST_22  C8A  C4A  C4   N3      0.00   0.0  0
 KM5  CONST_23  N8   C8A  N1   C2    180.00   0.0  0
 KM5  CONST_24  C7   N8   C8A  N1    180.00   0.0  0
 KM5  CONST_25  CBB  CAU  CAT  CAO   180.00   0.0  0
 KM5  CONST_26  N10  CAS  CAO  CAT   180.00   0.0  0
 KM5  CONST_27  CAR  CAQ  CAU  CBB   180.00   0.0  0
 KM5  CONST_28  N10  CAS  CAR  CAQ   180.00   0.0  0
 KM5  CONST_29  N8   C7   C6   C9    180.00   0.0  0
 KM5  CONST_30  C4A  N5   C6   C9    180.00   0.0  0
 KM5  CONST_31  N4   C4   C4A  N5      0.00   0.0  0
 KM5  CONST_32  N2   C2   N3   C4    180.00   0.0  0
 KM5  CONST_33  C8A  C4A  C4   N4    180.00   0.0  0
 KM5  CONST_34  C2   N3   C4   N4    180.00   0.0  0
 KM5  CONST_35  C8A  N1   C2   N2    180.00   0.0  0
 KM5  CONST_37  CAV  NAW  CBB  CAU   180.00   0.0  0
 KM5  CONST_38  H16  CAR  CAS  CAO   180.00   0.0  0
 KM5  CONST_39  H2   CAT  CAO  CAS   180.00   0.0  0
 KM5  CONST_40  H15  CAQ  CAR  CAS   180.00   0.0  0
 KM5  CONST_41  H1   CAO  CAT  CAU   180.00   0.0  0
 KM5  CONST_42  H28  C7   C6   N5    180.00   0.0  0
 KM5  CONST_43  OBC  CBB  NAW  CAV     0.00   0.0  0
 KM5  CONST_45  C9   N10  CAS  CAO     0.00   0.0  0
 KM5  CONST_46  CAP  N10  CAS  CAO   180.00   0.0  0
 KM5  CONST_47  C9   N10  CAS  CAR   180.00   0.0  0
 KM5  CONST_48  CAP  N10  CAS  CAR     0.00   0.0  0
 KM5  CONST_49  H24  N4   C4   C4A   180.00   0.0  0
 KM5  CONST_50  H25  N4   C4   C4A     0.00   0.0  0
 KM5  CONST_51  H26  N2   C2   N3    180.00   0.0  0
 KM5  CONST_52  H27  N2   C2   N3      0.00   0.0  0
 KM5  Var_01    CAY  CAX  NAW  CAV   -34.76  30.0  1
 KM5  Var_02    NAW  CAX  CAY  CAZ    63.55  30.0  1
 KM5  Var_03    NAW  CAV  CBA  CAZ    62.02  30.0  1
 KM5  Var_04    CAX  NAW  CAV  CBA   -25.74  30.0  1
 KM5  Var_05    NAW  CBB  CAU  CAT    41.56  30.0  2
 KM5  Var_06    C6   C9   N10  CAS   -81.92  30.0  2
 KM5  Var_07    C7   C6   C9   N10   178.21  30.0  2
 KM5  Var_08    CBH  CAP  N10  CAS   -91.25  30.0  2
 KM5  Var_09    CAZ  CBD  OBE  CBG   177.40  30.0  3
 KM5  Var_10    H5   CBG  OBE  CBD   179.84  30.0  3
 KM5  Var_11    H19  CBH  CAP  N10  -178.84  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
 KM5  chir_01  CAZ  CAY  CBA  CBD  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
 KM5  plan-1  CAO  0.020
 KM5  plan-1  CAS  0.020
 KM5  plan-1  CAT  0.020
 KM5  plan-1  CAU  0.020
 KM5  plan-1  CBB  0.020
 KM5  plan-1  CAQ  0.020
 KM5  plan-1  CAR  0.020
 KM5  plan-1  N10  0.020
 KM5  plan-1  H1   0.020
 KM5  plan-1  H2   0.020
 KM5  plan-1  H15  0.020
 KM5  plan-1  H16  0.020
 KM5  plan-2  OBE  0.020
 KM5  plan-2  OBF  0.020
 KM5  plan-2  CAZ  0.020
 KM5  plan-2  CBD  0.020
 KM5  plan-3  C9   0.020
 KM5  plan-3  C6   0.020
 KM5  plan-3  N5   0.020
 KM5  plan-3  C4A  0.020
 KM5  plan-3  C4   0.020
 KM5  plan-3  N4   0.020
 KM5  plan-3  N3   0.020
 KM5  plan-3  C2   0.020
 KM5  plan-3  N2   0.020
 KM5  plan-3  N1   0.020
 KM5  plan-3  C8A  0.020
 KM5  plan-3  N8   0.020
 KM5  plan-3  C7   0.020
 KM5  plan-3  H28  0.020
 KM5  plan-4  CAS  0.020
 KM5  plan-4  N10  0.020
 KM5  plan-4  CAP  0.020
 KM5  plan-4  C9   0.020
 KM5  plan-5  C4   0.020
 KM5  plan-5  N4   0.020
 KM5  plan-5  H24  0.020
 KM5  plan-5  H25  0.020
 KM5  plan-6  C2   0.020
 KM5  plan-6  N2   0.020
 KM5  plan-6  H26  0.020
 KM5  plan-6  H27  0.020
 KM5  plan-7  CAU  0.020
 KM5  plan-7  CAV  0.020
 KM5  plan-7  CAX  0.020
 KM5  plan-7  NAW  0.020
 KM5  plan-7  CBB  0.020
 KM5  plan-7  OBC  0.020

