# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sun Apr 26 05:36:05 2020
#   Inital geometry file: a 155 line input string
#   Ligand name: ~{N}1-[(4-chlorophenyl)methyl]-~{N}1-cyclopentyl-~{N}4-(phenylmethyl)benzene-1,4-disulfonamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: Clc1ccc(CN(C2CCCC2)[S](=O)(=O)c3ccc(cc3)[S](=O)(=O)NCc4ccccc4)cc1
#
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
 NH6  NH6  ~{N}1-[(4-chlorophenyl)methyl]-~{N}1-cyclopentyl-~{N}4-(phenylmethyl)benzene-1,4-disulfonamide  ligand  61  34  .  2021-08-15  2021-08-15  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_NH6
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
 NH6  CBC  C   CR16  0  -0.303  -1.7349  -3.1159   0.7297
 NH6  CBD  C   CR16  0  -0.195  -0.5600  -3.6619   1.2260
 NH6  CBE  C   CR6   0  -0.055   0.0312  -3.0835   2.3375
 NH6  CL   CL  CL    0  -0.123   1.5057  -3.7484   2.9613
 NH6  CBF  C   CR16  0  -0.192  -0.5461  -1.9927   2.9692
 NH6  CBG  C   CR16  0  -0.317  -1.7212  -1.4648   2.4574
 NH6  CAW  C   CR6   0   0.148  -2.3179  -1.9994   1.3194
 NH6  CAV  C   CH2   0  -0.429  -3.5678  -1.3823   0.7442
 NH6  NAU  N   N     0  -0.597  -3.3477  -0.2327  -0.1341
 NH6  CAX  C   CH1   0  -0.074  -2.7812  -0.3834  -1.4789
 NH6  CAY  C   CH2   0  -0.457  -3.4118  -1.4985  -2.3205
 NH6  CAZ  C   CH2   0  -0.446  -2.3538  -1.7451  -3.3895
 NH6  CBA  C   CH2   0  -0.442  -1.0524  -1.7402  -2.5856
 NH6  CBB  C   CH2   0  -0.462  -1.2472  -0.6194  -1.5565
 NH6  SAR  S   S     0   1.384  -3.5106   1.3020   0.4293
 NH6  OAS  O   OS    0  -0.642  -4.3528   2.0653  -0.4776
 NH6  OAT  O   OS    0  -0.643  -3.8785   1.2284   1.8349
 NH6  CAO  C   CR6   0  -0.175  -1.8778   2.0049   0.3066
 NH6  CAP  C   CR16  0  -0.209  -0.9560   1.7535   1.3152
 NH6  CAQ  C   CR16  0  -0.228   0.3488   2.1805   1.1602
 NH6  CAN  C   CR16  0  -0.231  -1.5320   2.7289  -0.8230
 NH6  CAM  C   CR16  0  -0.219  -0.2195   3.1497  -0.9854
 NH6  CAL  C   CR6   0  -0.198   0.7089   2.8521  -0.0025
 NH6  SAI  S   S     0   1.383   2.4294   3.2270  -0.2543
 NH6  OAJ  O   OS    0  -0.645   2.5419   3.9996  -1.4775
 NH6  OAK  O   OS    0  -0.644   2.9773   3.7281   0.9922
 NH6  NAH  N   NC1   0  -0.726   3.1326   1.7660  -0.5274
 NH6  CAA  C   CH2   0  -0.360   2.6744   0.9738  -1.6768
 NH6  CAB  C   CR6   0   0.078   3.1499  -0.4417  -1.5165
 NH6  CAC  C   CR16  0  -0.289   4.3187  -0.8720  -2.1357
 NH6  CAD  C   CR16  0  -0.241   4.7687  -2.1742  -1.9634
 NH6  CAE  C   CR16  0  -0.261   4.0550  -3.0564  -1.1636
 NH6  CAF  C   CR16  0  -0.230   2.8899  -2.6326  -0.5376
 NH6  CAG  C   CR16  0  -0.273   2.4399  -1.3324  -0.7146
 NH6  H1   H   HCR6  0   0.268  -2.1982  -3.5811  -0.1323
 NH6  H2   H   HCR6  0   0.284  -0.1202  -4.5301   0.7541
 NH6  H3   H   HCR6  0   0.282  -0.0934  -1.5639   3.8529
 NH6  H4   H   HCR6  0   0.273  -2.1869  -0.6340   2.9723
 NH6  H5   H   HCH2  0   0.288  -4.1171  -2.1268   0.1694
 NH6  H6   H   HCH2  0   0.299  -4.2375  -1.0819   1.5465
 NH6  H7   H   HCH1  0   0.279  -3.0090   0.5425  -2.0101
 NH6  H8   H   HCH2  0   0.232  -3.5461  -2.4155  -1.7438
 NH6  H9   H   HCH2  0   0.254  -4.3882  -1.2118  -2.7114
 NH6  H10  H   HCH2  0   0.241  -2.5155  -2.6744  -3.9361
 NH6  H11  H   HCH2  0   0.227  -2.3538  -0.9295  -4.1179
 NH6  H12  H   HCH2  0   0.225  -0.9332  -2.7020  -2.0814
 NH6  H13  H   HCH2  0   0.239  -0.1672  -1.5944  -3.2050
 NH6  H14  H   HCH2  0   0.247  -0.7522   0.2931  -1.8897
 NH6  H15  H   HCH2  0   0.248  -0.8270  -0.8705  -0.5833
 NH6  H16  H   HCR6  0   0.290  -1.2393   1.2341   2.2181
 NH6  H17  H   HCR6  0   0.304   1.0705   1.9832   1.9420
 NH6  H18  H   HCR6  0   0.302  -2.2591   2.9485  -1.5922
 NH6  H19  H   HCR6  0   0.302   0.0632   3.6914  -1.8771
 NH6  H20  H   HNC1  0   0.422   3.2515   1.2349   0.3294
 NH6  H21  H   HCH2  0   0.258   1.5814   0.9827  -1.7612
 NH6  H22  H   HCH2  0   0.285   3.0743   1.4129  -2.5895
 NH6  H23  H   HCR6  0   0.259   4.8769  -0.1870  -2.7620
 NH6  H24  H   HCR6  0   0.261   5.6768  -2.4990  -2.4542
 NH6  H25  H   HCR6  0   0.261   4.4032  -4.0722  -1.0297
 NH6  H26  H   HCR6  0   0.247   2.3329  -3.3162   0.0889
 NH6  H27  H   HCR6  0   0.235   1.5235  -1.0144  -0.2284

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
 NH6  CAD  CAC  aromatic  1.389  0.020  1.389
 NH6  CAD  CAE  aromatic  1.388  0.020  1.388
 NH6  CAC  CAB  aromatic  1.391  0.020  1.391
 NH6  CAE  CAF  aromatic  1.389  0.020  1.389
 NH6  OAJ  SAI  double    1.451  0.020  1.451
 NH6  CAB  CAA  single    1.502  0.020  1.502
 NH6  CAB  CAG  aromatic  1.393  0.020  1.393
 NH6  CAZ  CBA  single    1.530  0.020  1.530
 NH6  CAZ  CAY  single    1.524  0.020  1.524
 NH6  CAF  CAG  aromatic  1.387  0.020  1.387
 NH6  SAI  OAK  double    1.451  0.020  1.451
 NH6  SAI  NAH  single    1.644  0.020  1.644
 NH6  SAI  CAL  single    1.779  0.020  1.779
 NH6  CAA  NAH  single    1.469  0.020  1.469
 NH6  CBA  CBB  single    1.534  0.020  1.534
 NH6  CAY  CAX  single    1.533  0.020  1.533
 NH6  CAQ  CAL  aromatic  1.390  0.020  1.390
 NH6  CAQ  CAP  aromatic  1.382  0.020  1.382
 NH6  CAL  CAM  aromatic  1.384  0.020  1.384
 NH6  CAX  CBB  single    1.554  0.020  1.554
 NH6  CAX  NAU  single    1.467  0.020  1.467
 NH6  CAP  CAO  aromatic  1.389  0.020  1.389
 NH6  CAM  CAN  aromatic  1.388  0.020  1.388
 NH6  CAV  NAU  single    1.463  0.020  1.463
 NH6  CAV  CAW  single    1.508  0.020  1.508
 NH6  CAO  CAN  aromatic  1.386  0.020  1.386
 NH6  CAO  SAR  single    1.782  0.020  1.782
 NH6  NAU  SAR  single    1.643  0.020  1.643
 NH6  CBG  CAW  aromatic  1.392  0.020  1.392
 NH6  CBG  CBF  aromatic  1.386  0.020  1.386
 NH6  CAW  CBC  aromatic  1.391  0.020  1.391
 NH6  SAR  OAT  double    1.455  0.020  1.455
 NH6  SAR  OAS  double    1.454  0.020  1.454
 NH6  CBF  CBE  aromatic  1.386  0.020  1.386
 NH6  CBC  CBD  aromatic  1.387  0.020  1.387
 NH6  CBE  CBD  aromatic  1.385  0.020  1.385
 NH6  CBE  CL   single    1.734  0.020  1.734
 NH6  CBC  H1   single    0.930  0.020  1.080
 NH6  CBD  H2   single    0.930  0.020  1.080
 NH6  CBF  H3   single    0.930  0.020  1.080
 NH6  CBG  H4   single    0.930  0.020  1.080
 NH6  CAV  H5   single    0.970  0.020  1.090
 NH6  CAV  H6   single    0.970  0.020  1.090
 NH6  CAX  H7   single    0.970  0.020  1.090
 NH6  CAY  H8   single    0.970  0.020  1.090
 NH6  CAY  H9   single    0.970  0.020  1.090
 NH6  CAZ  H10  single    0.970  0.020  1.090
 NH6  CAZ  H11  single    0.970  0.020  1.090
 NH6  CBA  H12  single    0.970  0.020  1.090
 NH6  CBA  H13  single    0.970  0.020  1.090
 NH6  CBB  H14  single    0.970  0.020  1.090
 NH6  CBB  H15  single    0.970  0.020  1.090
 NH6  CAP  H16  single    0.930  0.020  1.080
 NH6  CAQ  H17  single    0.930  0.020  1.080
 NH6  CAN  H18  single    0.930  0.020  1.080
 NH6  CAM  H19  single    0.930  0.020  1.080
 NH6  NAH  H20  single    0.890  0.020  1.040
 NH6  CAA  H21  single    0.970  0.020  1.090
 NH6  CAA  H22  single    0.970  0.020  1.090
 NH6  CAC  H23  single    0.930  0.020  1.080
 NH6  CAD  H24  single    0.930  0.020  1.080
 NH6  CAE  H25  single    0.930  0.020  1.080
 NH6  CAF  H26  single    0.930  0.020  1.080
 NH6  CAG  H27  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
 NH6  H1   CBC  CAW  120.18  3.000
 NH6  H1   CBC  CBD  118.54  3.000
 NH6  CAW  CBC  CBD  121.28  3.000
 NH6  H2   CBD  CBE  120.77  3.000
 NH6  H2   CBD  CBC  120.27  3.000
 NH6  CBE  CBD  CBC  118.95  3.000
 NH6  CBF  CBE  CL   119.47  3.000
 NH6  CL   CBE  CBD  119.44  3.000
 NH6  CBF  CBE  CBD  121.09  3.000
 NH6  H3   CBF  CBG  120.36  3.000
 NH6  H3   CBF  CBE  120.66  3.000
 NH6  CBG  CBF  CBE  118.97  3.000
 NH6  H4   CBG  CAW  119.95  3.000
 NH6  H4   CBG  CBF  118.77  3.000
 NH6  CAW  CBG  CBF  121.27  3.000
 NH6  CAV  CAW  CBG  120.67  3.000
 NH6  CBG  CAW  CBC  118.39  3.000
 NH6  CAV  CAW  CBC  120.95  3.000
 NH6  H6   CAV  H5   105.52  3.000
 NH6  H6   CAV  NAU  108.57  3.000
 NH6  H5   CAV  NAU  107.22  3.000
 NH6  H6   CAV  CAW  110.00  3.000
 NH6  H5   CAV  CAW  109.85  3.000
 NH6  NAU  CAV  CAW  115.20  3.000
 NH6  SAR  NAU  CAX  116.66  3.000
 NH6  SAR  NAU  CAV  120.87  3.000
 NH6  CAX  NAU  CAV  121.84  3.000
 NH6  H7   CAX  CBB  108.10  3.000
 NH6  H7   CAX  CAY  105.31  3.000
 NH6  CBB  CAX  CAY  105.56  3.000
 NH6  H7   CAX  NAU  106.16  3.000
 NH6  CBB  CAX  NAU  116.27  3.000
 NH6  CAY  CAX  NAU  114.78  3.000
 NH6  H9   CAY  H8   107.47  3.000
 NH6  H9   CAY  CAZ  114.37  3.000
 NH6  H8   CAY  CAZ  108.67  3.000
 NH6  H9   CAY  CAX  111.96  3.000
 NH6  H8   CAY  CAX  111.82  3.000
 NH6  CAZ  CAY  CAX  102.55  3.000
 NH6  H11  CAZ  H10  107.56  3.000
 NH6  H11  CAZ  CBA  110.34  3.000
 NH6  H10  CAZ  CBA  113.11  3.000
 NH6  H11  CAZ  CAY  110.28  3.000
 NH6  H10  CAZ  CAY  112.75  3.000
 NH6  CBA  CAZ  CAY  102.79  3.000
 NH6  H13  CBA  H12  106.94  3.000
 NH6  H13  CBA  CBB  112.74  3.000
 NH6  H12  CBA  CBB  110.33  3.000
 NH6  H13  CBA  CAZ  113.12  3.000
 NH6  H12  CBA  CAZ  109.42  3.000
 NH6  CBB  CBA  CAZ  104.29  3.000
 NH6  H15  CBB  H14  106.91  3.000
 NH6  H15  CBB  CBA  112.46  3.000
 NH6  H14  CBB  CBA  110.41  3.000
 NH6  H15  CBB  CAX  111.78  3.000
 NH6  H14  CBB  CAX  109.65  3.000
 NH6  CBA  CBB  CAX  105.65  3.000
 NH6  CAO  SAR  OAT  108.55  3.000
 NH6  OAT  SAR  OAS  118.86  3.000
 NH6  CAO  SAR  OAS  106.30  3.000
 NH6  OAS  SAR  NAU  109.51  3.000
 NH6  OAT  SAR  NAU  108.01  3.000
 NH6  CAO  SAR  NAU  104.71  3.000
 NH6  CAN  CAO  CAP  121.38  3.000
 NH6  CAN  CAO  SAR  119.40  3.000
 NH6  CAP  CAO  SAR  119.12  3.000
 NH6  H16  CAP  CAQ  119.37  3.000
 NH6  H16  CAP  CAO  121.34  3.000
 NH6  CAQ  CAP  CAO  119.30  3.000
 NH6  H17  CAQ  CAL  121.30  3.000
 NH6  H17  CAQ  CAP  119.51  3.000
 NH6  CAL  CAQ  CAP  119.19  3.000
 NH6  H18  CAN  CAM  119.42  3.000
 NH6  H18  CAN  CAO  121.22  3.000
 NH6  CAM  CAN  CAO  119.33  3.000
 NH6  H19  CAM  CAL  121.20  3.000
 NH6  H19  CAM  CAN  119.73  3.000
 NH6  CAL  CAM  CAN  119.07  3.000
 NH6  SAI  CAL  CAM  120.19  3.000
 NH6  CAM  CAL  CAQ  121.60  3.000
 NH6  SAI  CAL  CAQ  118.08  3.000
 NH6  NAH  SAI  OAK  106.74  3.000
 NH6  NAH  SAI  OAJ  107.45  3.000
 NH6  OAK  SAI  OAJ  120.73  3.000
 NH6  NAH  SAI  CAL  104.47  3.000
 NH6  OAK  SAI  CAL  108.45  3.000
 NH6  OAJ  SAI  CAL  107.85  3.000
 NH6  H20  NAH  CAA  114.50  3.000
 NH6  H20  NAH  SAI  112.01  3.000
 NH6  CAA  NAH  SAI  118.40  3.000
 NH6  H22  CAA  H21  107.35  3.000
 NH6  H22  CAA  CAB  110.69  3.000
 NH6  H21  CAA  CAB  109.37  3.000
 NH6  H22  CAA  NAH  108.89  3.000
 NH6  H21  CAA  NAH  111.52  3.000
 NH6  CAB  CAA  NAH  109.03  3.000
 NH6  CAG  CAB  CAC  119.13  3.000
 NH6  CAG  CAB  CAA  120.17  3.000
 NH6  CAC  CAB  CAA  120.68  3.000
 NH6  H23  CAC  CAD  119.86  3.000
 NH6  H23  CAC  CAB  119.66  3.000
 NH6  CAD  CAC  CAB  120.48  3.000
 NH6  H24  CAD  CAE  120.14  3.000
 NH6  H24  CAD  CAC  119.81  3.000
 NH6  CAE  CAD  CAC  120.05  3.000
 NH6  H25  CAE  CAF  120.04  3.000
 NH6  H25  CAE  CAD  120.15  3.000
 NH6  CAF  CAE  CAD  119.81  3.000
 NH6  H26  CAF  CAG  119.95  3.000
 NH6  H26  CAF  CAE  120.01  3.000
 NH6  CAG  CAF  CAE  120.04  3.000
 NH6  H27  CAG  CAF  119.44  3.000
 NH6  H27  CAG  CAB  120.07  3.000
 NH6  CAF  CAG  CAB  120.49  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
 NH6  CONST_01  CBF  CBG  CAW  CBC     0.00   0.0  0
 NH6  CONST_02  CBF  CBE  CBD  CBC     0.00   0.0  0
 NH6  CONST_03  CBG  CAW  CBC  CBD     0.00   0.0  0
 NH6  CONST_04  CBG  CBF  CBE  CBD     0.00   0.0  0
 NH6  CONST_05  CAW  CBG  CBF  CBE     0.00   0.0  0
 NH6  CONST_06  CAW  CBC  CBD  CBE     0.00   0.0  0
 NH6  CONST_07  CAL  CAQ  CAP  CAO     0.00   0.0  0
 NH6  CONST_08  CAL  CAM  CAN  CAO     0.00   0.0  0
 NH6  CONST_09  CAM  CAL  CAQ  CAP     0.00   0.0  0
 NH6  CONST_10  CAM  CAN  CAO  CAP     0.00   0.0  0
 NH6  CONST_11  CAN  CAM  CAL  CAQ     0.00   0.0  0
 NH6  CONST_12  CAN  CAO  CAP  CAQ     0.00   0.0  0
 NH6  CONST_13  CAE  CAD  CAC  CAB     0.00   0.0  0
 NH6  CONST_14  CAE  CAF  CAG  CAB     0.00   0.0  0
 NH6  CONST_15  CAF  CAE  CAD  CAC     0.00   0.0  0
 NH6  CONST_16  CAF  CAG  CAB  CAC     0.00   0.0  0
 NH6  CONST_17  CAG  CAB  CAC  CAD     0.00   0.0  0
 NH6  CONST_18  CAG  CAF  CAE  CAD     0.00   0.0  0
 NH6  CONST_19  CL   CBE  CBD  CBC   180.00   0.0  0
 NH6  CONST_20  CAV  CAW  CBC  CBD   180.00   0.0  0
 NH6  CONST_21  CBG  CBF  CBE  CL    180.00   0.0  0
 NH6  CONST_22  CAV  CAW  CBG  CBF   180.00   0.0  0
 NH6  CONST_23  CAQ  CAP  CAO  SAR   180.00   0.0  0
 NH6  CONST_24  CAM  CAN  CAO  SAR   180.00   0.0  0
 NH6  CONST_25  SAI  CAL  CAQ  CAP   180.00   0.0  0
 NH6  CONST_26  SAI  CAL  CAM  CAN   180.00   0.0  0
 NH6  CONST_27  CAD  CAC  CAB  CAA   180.00   0.0  0
 NH6  CONST_28  CAF  CAG  CAB  CAA   180.00   0.0  0
 NH6  CONST_29  H4   CBG  CAW  CBC   180.00   0.0  0
 NH6  CONST_30  H3   CBF  CBE  CBD   180.00   0.0  0
 NH6  CONST_31  H1   CBC  CBD  CBE   180.00   0.0  0
 NH6  CONST_32  H2   CBD  CBE  CBF   180.00   0.0  0
 NH6  CONST_33  H17  CAQ  CAP  CAO   180.00   0.0  0
 NH6  CONST_34  H19  CAM  CAN  CAO   180.00   0.0  0
 NH6  CONST_35  H18  CAN  CAO  CAP   180.00   0.0  0
 NH6  CONST_36  H16  CAP  CAO  CAN   180.00   0.0  0
 NH6  CONST_37  H24  CAD  CAC  CAB   180.00   0.0  0
 NH6  CONST_38  H26  CAF  CAG  CAB   180.00   0.0  0
 NH6  CONST_39  H25  CAE  CAD  CAC   180.00   0.0  0
 NH6  CONST_40  H27  CAG  CAB  CAC   180.00   0.0  0
 NH6  CONST_41  H23  CAC  CAD  CAE   180.00   0.0  0
 NH6  Var_01    CBA  CAZ  CAY  CAX    43.63  30.0  1
 NH6  Var_02    CAZ  CBA  CBB  CAX    19.47  30.0  1
 NH6  Var_03    CBB  CBA  CAZ  CAY   -39.27  30.0  1
 NH6  Var_04    NAU  CAV  CAW  CBC   -96.97  30.0  3
 NH6  Var_05    CAX  NAU  CAV  CAW    72.04  30.0  3
 NH6  Var_06    CAP  CAO  SAR  NAU   -82.56  30.0  2
 NH6  Var_07    CAO  SAR  NAU  CAX   -55.44  30.0  3
 NH6  Var_08    OAJ  SAI  CAL  CAQ  -176.25  30.0  2
 NH6  Var_09    CAC  CAB  CAA  NAH   -96.12  30.0  3
 NH6  Var_10    CAA  NAH  SAI  CAL    60.19  30.0  3
 NH6  Var_11    CAB  CAA  NAH  SAI  -164.18  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
 NH6  chir_01  CAX  CAY  CBB  NAU  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
 NH6  plan-1  CBC  0.020
 NH6  plan-1  CBD  0.020
 NH6  plan-1  CBE  0.020
 NH6  plan-1  CL   0.020
 NH6  plan-1  CBF  0.020
 NH6  plan-1  CBG  0.020
 NH6  plan-1  CAW  0.020
 NH6  plan-1  CAV  0.020
 NH6  plan-1  H1   0.020
 NH6  plan-1  H2   0.020
 NH6  plan-1  H3   0.020
 NH6  plan-1  H4   0.020
 NH6  plan-2  SAR  0.020
 NH6  plan-2  CAO  0.020
 NH6  plan-2  CAP  0.020
 NH6  plan-2  CAQ  0.020
 NH6  plan-2  CAN  0.020
 NH6  plan-2  CAM  0.020
 NH6  plan-2  CAL  0.020
 NH6  plan-2  SAI  0.020
 NH6  plan-2  H16  0.020
 NH6  plan-2  H17  0.020
 NH6  plan-2  H18  0.020
 NH6  plan-2  H19  0.020
 NH6  plan-3  CAA  0.020
 NH6  plan-3  CAB  0.020
 NH6  plan-3  CAC  0.020
 NH6  plan-3  CAD  0.020
 NH6  plan-3  CAE  0.020
 NH6  plan-3  CAF  0.020
 NH6  plan-3  CAG  0.020
 NH6  plan-3  H23  0.020
 NH6  plan-3  H24  0.020
 NH6  plan-3  H25  0.020
 NH6  plan-3  H26  0.020
 NH6  plan-3  H27  0.020

