# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sat Mar 26 22:37:43 2022
#   Inital geometry file: a 160 line input string
#   Ligand name: (2R,5R,7R,8R,10R,12aR,14R,15aS,16R)-7-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-16-hydroxy-14-[(pyrimidin-4-yl)oxy]-2,10-disulfanyldecahydro-2H,10H-5,8-methano-2lambda~5~,10lambda~5~-cyclopenta[l][1,3,6,9,11,2,10]pentaoxadiphosphacyclotetradecine-2,10-dione
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: NC1=Nc2n(cnc2C(=O)N1)[C@@H]3O[C@@H]4CO[P@](S)(=O)O[C@H]5C[C@@H](C[C@@H]5CO[P@](S)(=O)O[C@@H]3[C@@H]4O)Oc6ccncn6
#
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
 X4M  X4M  (2R,5R,7R,8R,10R,12aR,14R,15aS,16R)-7-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-16-hydroxy-14-[(pyrimidin-4-yl)oxy]-2,10-disulfanyldecahydro-2H,10H-5,8-methano-2lambda~5~,10lambda~5~-cyclopenta[l][1,3,6,9,11,2,10]pentaoxadiphosphacyclotetradecine-2,10-dione  ligand  66  41  .  2022-03-29  2022-03-29
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_X4M
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
 X4M  C4   C  CR15  0   0.083  41.5995   7.8832  19.4092
 X4M  C5   C  CR56  0  -0.093  40.5706   9.6061  18.7431
 X4M  C6   C  CR6   0   0.566  44.8254   9.3198  16.8110
 X4M  C7   C  CR56  0   0.522  39.7440   8.5422  18.4392
 X4M  C8   C  CR6   0   0.509  40.1342  10.9239  18.4263
 X4M  C10  C  CH2   0  -0.461  45.7962   5.9709  15.8136
 X4M  C13  C  CH2   0  -0.199  41.6798   3.8476  20.7798
 X4M  C15  C  CR15  0   0.054  44.8748   5.6612  18.0579
 X4M  C17  C  CR15  0  -0.049  40.7523   5.1313  17.9555
 X4M  C20  C  CR15  0   0.223  39.9355   6.0823  18.8307
 X4M  C1   C  CR16  0  -0.397  43.6726  10.0675  16.5445
 X4M  C2   C  CR16  0  -0.027  43.6891  11.3709  16.9730
 X4M  C3   C  CR16  0   0.061  45.7632  11.1149  17.8007
 X4M  C9   C  CR6   0   0.692  38.1247   9.7749  17.5736
 X4M  C11  C  CH2   0  -0.497  45.9808   6.7048  18.0790
 X4M  C12  C  CH2   0  -0.215  43.5958   4.6643  16.0811
 X4M  C14  C  CR15  0  -0.294  44.9522   5.0000  16.6683
 X4M  C16  C  CR15  0  -0.022  40.3829   4.1424  20.0488
 X4M  C18  C  CR15  0  -0.017  45.9860   7.2310  16.6515
 X4M  C19  C  CR15  0  -0.038  40.3870   3.7811  18.5526
 X4M  N21  N  N     0  -0.418  44.7350  11.9149  17.6065
 X4M  N22  N  N     0  -0.460  45.8645   9.8416  17.4357
 X4M  N23  N  N     0  -0.440  41.7203   9.1712  19.3516
 X4M  N24  N  N     0  -0.515  38.5358   8.5648  17.8648
 X4M  N25  N  NR5   0  -0.553  40.4164   7.4348  18.8627
 X4M  N26  N  NR16  0  -0.728  38.8681  10.8923  17.8261
 X4M  N27  N  NH2   0  -0.831  36.9124   9.9570  17.0335
 X4M  O28  O  O     0  -0.466  40.7054  11.9843  18.6146
 X4M  O31  O  O2    0  -0.572  42.8484   5.8818  15.9662
 X4M  O32  O  O2    0  -0.589  42.8064   4.1151  19.9383
 X4M  O33  O  O     0  -0.489  40.0546   5.5324  20.1139
 X4M  O34  O  O2    0  -0.583  45.0405   4.6731  19.0920
 X4M  O35  O  O2    0  -0.582  40.4520   5.2083  16.5756
 X4M  O36  O  OH1   0  -0.658  39.1116   3.4458  18.0835
 X4M  O39  O  O2    0  -0.465  44.8447   8.0635  16.4014
 X4M  P40  P  P     0   1.261  41.3296   6.0699  15.5389
 X4M  P41  P  P     0   1.263  44.1873   4.7482  20.4356
 X4M  H1   H  HCR5  0   0.293  42.3175   7.2112  19.8549
 X4M  H2   H  HCH2  0   0.266  45.3593   6.1884  14.8384
 X4M  H3   H  HCH2  0   0.266  46.7789   5.5374  15.6274
 X4M  H4   H  HCH2  0   0.267  41.7220   4.4264  21.7055
 X4M  H5   H  HCH2  0   0.262  41.7011   2.7881  21.0400
 X4M  H6   H  HCR5  0   0.263  43.9117   6.1625  18.1795
 X4M  H7   H  HCR5  0   0.289  41.8110   5.3157  18.1362
 X4M  H8   H  HCR5  0   0.273  38.8961   6.1272  18.4888
 X4M  H9   H  HCR6  0   0.277  42.8156   9.6341  16.0481
 X4M  H10  H  HCR6  0   0.275  42.8311  12.0113  16.8101
 X4M  H11  H  HCR6  0   0.260  46.6228  11.5331  18.3137
 X4M  H12  H  HCH2  0   0.264  46.9432   6.2214  18.2694
 X4M  H13  H  HCH2  0   0.273  45.8356   7.4704  18.8403
 X4M  H14  H  HCH2  0   0.261  43.0729   3.9463  16.7193
 X4M  H15  H  HCH2  0   0.270  43.7088   4.2147  15.0916
 X4M  H16  H  HCR5  0   0.287  45.4788   4.0470  16.7647
 X4M  H17  H  HCR5  0   0.280  39.6034   3.5776  20.5711
 X4M  H18  H  HCR5  0   0.270  46.8988   7.7720  16.4006
 X4M  H19  H  HCR5  0   0.275  41.1264   3.0081  18.3158
 X4M  H20  H  HNR6  0   0.425  38.4814  11.7949  17.5792
 X4M  H21  H  HNH2  0   0.412  36.4145   9.1439  16.7125
 X4M  H22  H  HNH2  0   0.415  36.6481  10.8383  16.6266
 X4M  H23  H  HSH1  0   0.268  41.1590   3.8283  14.1947
 X4M  H24  H  HSH1  0   0.273  45.7671   4.0344  22.3406
 X4M  H25  H  HOH1  0   0.463  38.8607   2.5931  18.4531
 X4M  S29  S  S2    0  -0.350  40.9804   5.0810  13.7500
 X4M  S30  S  S2    0  -0.345  44.9881   3.2311  21.6036
 X4M  O37  O  O     0  -0.645  40.9976   7.5010  15.4101
 X4M  O38  O  O     0  -0.662  44.1037   6.0707  21.0912

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
 X4M  S29  P40  single    2.074  0.020  2.074
 X4M  P40  O37  double    1.475  0.020  1.475
 X4M  P40  O31  single    1.589  0.020  1.589
 X4M  P40  O35  single    1.609  0.020  1.609
 X4M  C10  C18  single    1.525  0.020  1.525
 X4M  C10  C14  single    1.544  0.020  1.544
 X4M  O31  C12  single    1.433  0.020  1.433
 X4M  C12  C14  single    1.516  0.020  1.516
 X4M  O39  C18  single    1.435  0.020  1.435
 X4M  O39  C6   single    1.322  0.020  1.322
 X4M  O35  C17  single    1.414  0.020  1.414
 X4M  C18  C11  single    1.521  0.020  1.521
 X4M  C1   C6   aromatic  1.400  0.020  1.400
 X4M  C1   C2   aromatic  1.372  0.020  1.372
 X4M  C14  C15  single    1.541  0.020  1.541
 X4M  C6   N22  aromatic  1.320  0.020  1.320
 X4M  N27  C9   single    1.340  0.020  1.340
 X4M  C2   N21  aromatic  1.338  0.020  1.338
 X4M  N22  C3   aromatic  1.328  0.020  1.328
 X4M  C9   N24  double    1.311  0.020  1.311
 X4M  C9   N26  single    1.366  0.020  1.366
 X4M  N21  C3   aromatic  1.317  0.020  1.317
 X4M  O36  C19  single    1.400  0.020  1.400
 X4M  N24  C7   single    1.338  0.020  1.338
 X4M  C17  C19  single    1.521  0.020  1.521
 X4M  C17  C20  single    1.529  0.020  1.529
 X4M  N26  C8   single    1.402  0.020  1.402
 X4M  C15  C11  single    1.521  0.020  1.521
 X4M  C15  O34  single    1.440  0.020  1.440
 X4M  C19  C16  single    1.539  0.020  1.539
 X4M  C7   C5   aromatic  1.381  0.020  1.381
 X4M  C7   N25  aromatic  1.363  0.020  1.363
 X4M  C8   O28  double    1.219  0.020  1.219
 X4M  C8   C5   single    1.424  0.020  1.424
 X4M  C20  N25  single    1.436  0.020  1.436
 X4M  C20  O33  single    1.401  0.020  1.401
 X4M  C5   N23  aromatic  1.372  0.020  1.372
 X4M  N25  C4   aromatic  1.378  0.020  1.378
 X4M  O34  P41  single    1.593  0.020  1.593
 X4M  N23  C4   aromatic  1.295  0.020  1.295
 X4M  C16  O33  single    1.430  0.020  1.430
 X4M  C16  C13  single    1.518  0.020  1.518
 X4M  O32  P41  single    1.598  0.020  1.598
 X4M  O32  C13  single    1.431  0.020  1.431
 X4M  P41  O38  double    1.478  0.020  1.478
 X4M  P41  S30  single    2.075  0.020  2.075
 X4M  C4   H1   single    0.930  0.020  1.080
 X4M  C10  H2   single    0.970  0.020  1.090
 X4M  C10  H3   single    0.970  0.020  1.090
 X4M  C13  H4   single    0.970  0.020  1.090
 X4M  C13  H5   single    0.970  0.020  1.090
 X4M  C15  H6   single    0.970  0.020  1.090
 X4M  C17  H7   single    0.970  0.020  1.090
 X4M  C20  H8   single    0.970  0.020  1.090
 X4M  C1   H9   single    0.930  0.020  1.080
 X4M  C2   H10  single    0.930  0.020  1.080
 X4M  C3   H11  single    0.930  0.020  1.080
 X4M  C11  H12  single    0.970  0.020  1.090
 X4M  C11  H13  single    0.970  0.020  1.090
 X4M  C12  H14  single    0.970  0.020  1.090
 X4M  C12  H15  single    0.970  0.020  1.090
 X4M  C14  H16  single    0.970  0.020  1.090
 X4M  C16  H17  single    0.970  0.020  1.090
 X4M  C18  H18  single    0.970  0.020  1.090
 X4M  C19  H19  single    0.970  0.020  1.090
 X4M  N26  H20  single    0.860  0.020  1.020
 X4M  N27  H21  single    0.890  0.020  1.040
 X4M  N27  H22  single    0.890  0.020  1.040
 X4M  S29  H23  single    1.200  0.020  1.300
 X4M  S30  H24  single    1.200  0.020  1.300
 X4M  O36  H25  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
 X4M  H1   C4   N25  122.15  3.000
 X4M  H1   C4   N23  125.13  3.000
 X4M  N25  C4   N23  112.71  3.000
 X4M  N23  C5   C8   130.47  3.000
 X4M  N23  C5   C7   110.80  3.000
 X4M  C8   C5   C7   118.72  3.000
 X4M  O39  C6   N22  120.73  3.000
 X4M  N22  C6   C1   121.83  3.000
 X4M  O39  C6   C1   117.44  3.000
 X4M  N25  C7   N24  126.34  3.000
 X4M  N25  C7   C5   105.20  3.000
 X4M  N24  C7   C5   128.45  3.000
 X4M  O28  C8   N26  120.60  3.000
 X4M  O28  C8   C5   128.83  3.000
 X4M  N26  C8   C5   110.56  3.000
 X4M  H3   C10  H2   106.73  3.000
 X4M  H3   C10  C18  108.07  3.000
 X4M  H2   C10  C18  112.11  3.000
 X4M  H3   C10  C14  109.71  3.000
 X4M  H2   C10  C14  113.66  3.000
 X4M  C18  C10  C14  106.46  3.000
 X4M  H5   C13  H4   108.16  3.000
 X4M  H5   C13  O32  107.83  3.000
 X4M  H4   C13  O32  111.64  3.000
 X4M  H5   C13  C16  108.67  3.000
 X4M  H4   C13  C16  109.77  3.000
 X4M  O32  C13  C16  110.67  3.000
 X4M  H6   C15  O34  109.66  3.000
 X4M  H6   C15  C14  109.97  3.000
 X4M  O34  C15  C14  110.33  3.000
 X4M  H6   C15  C11  108.95  3.000
 X4M  O34  C15  C11  112.17  3.000
 X4M  C14  C15  C11  105.69  3.000
 X4M  H7   C17  O35  111.03  3.000
 X4M  H7   C17  C19  108.57  3.000
 X4M  O35  C17  C19  112.36  3.000
 X4M  H7   C17  C20  108.59  3.000
 X4M  C19  C17  C20  101.49  3.000
 X4M  O35  C17  C20  114.28  3.000
 X4M  H8   C20  O33  112.50  3.000
 X4M  H8   C20  N25  106.63  3.000
 X4M  O33  C20  N25  108.71  3.000
 X4M  H8   C20  C17  110.72  3.000
 X4M  O33  C20  C17  103.58  3.000
 X4M  N25  C20  C17  114.82  3.000
 X4M  H9   C1   C2   122.26  3.000
 X4M  H9   C1   C6   121.75  3.000
 X4M  C2   C1   C6   115.98  3.000
 X4M  H10  C2   N21  116.75  3.000
 X4M  H10  C2   C1   120.34  3.000
 X4M  N21  C2   C1   122.91  3.000
 X4M  H11  C3   N22  116.03  3.000
 X4M  H11  C3   N21  117.01  3.000
 X4M  N22  C3   N21  126.95  3.000
 X4M  N27  C9   N26  117.12  3.000
 X4M  N26  C9   N24  122.93  3.000
 X4M  N27  C9   N24  119.93  3.000
 X4M  H13  C11  H12  107.84  3.000
 X4M  H13  C11  C18  114.40  3.000
 X4M  H12  C11  C18  108.25  3.000
 X4M  H13  C11  C15  113.26  3.000
 X4M  H12  C11  C15  109.82  3.000
 X4M  C18  C11  C15  103.11  3.000
 X4M  H15  C12  H14  107.92  3.000
 X4M  H15  C12  O31  109.32  3.000
 X4M  H14  C12  O31  110.80  3.000
 X4M  H15  C12  C14  110.45  3.000
 X4M  H14  C12  C14  110.32  3.000
 X4M  O31  C12  C14  108.04  3.000
 X4M  H16  C14  C12  105.80  3.000
 X4M  H16  C14  C15  108.59  3.000
 X4M  C12  C14  C15  113.54  3.000
 X4M  H16  C14  C10  109.49  3.000
 X4M  C15  C14  C10  104.88  3.000
 X4M  C12  C14  C10  114.45  3.000
 X4M  H17  C16  O33  108.43  3.000
 X4M  H17  C16  C19  110.15  3.000
 X4M  O33  C16  C19  105.85  3.000
 X4M  H17  C16  C13  106.16  3.000
 X4M  O33  C16  C13  111.29  3.000
 X4M  C19  C16  C13  114.86  3.000
 X4M  H18  C18  O39  109.75  3.000
 X4M  H18  C18  C11  112.98  3.000
 X4M  O39  C18  C11  111.20  3.000
 X4M  H18  C18  C10  112.81  3.000
 X4M  C11  C18  C10  103.26  3.000
 X4M  O39  C18  C10  106.54  3.000
 X4M  H19  C19  O36  111.93  3.000
 X4M  H19  C19  C16  112.18  3.000
 X4M  O36  C19  C16  112.31  3.000
 X4M  H19  C19  C17  112.30  3.000
 X4M  C16  C19  C17  100.02  3.000
 X4M  O36  C19  C17  107.46  3.000
 X4M  C3   N21  C2   115.66  3.000
 X4M  C3   N22  C6   116.67  3.000
 X4M  C5   N23  C4   104.89  3.000
 X4M  C9   N24  C7   113.21  3.000
 X4M  C20  N25  C7   126.38  3.000
 X4M  C20  N25  C4   127.07  3.000
 X4M  C7   N25  C4   106.40  3.000
 X4M  H20  N26  C9   118.46  3.000
 X4M  H20  N26  C8   115.42  3.000
 X4M  C9   N26  C8   126.11  3.000
 X4M  H22  N27  H21  116.68  3.000
 X4M  H22  N27  C9   121.32  3.000
 X4M  H21  N27  C9   117.81  3.000
 X4M  P40  O31  C12  128.36  3.000
 X4M  P41  O32  C13  124.82  3.000
 X4M  C16  O33  C20  111.06  3.000
 X4M  P41  O34  C15  120.77  3.000
 X4M  P40  O35  C17  122.83  3.000
 X4M  H25  O36  C19  108.72  3.000
 X4M  C18  O39  C6   120.62  3.000
 X4M  O37  P40  O35  116.95  3.000
 X4M  O35  P40  O31  106.54  3.000
 X4M  O37  P40  O31  110.71  3.000
 X4M  O35  P40  S29  102.04  3.000
 X4M  O31  P40  S29  109.67  3.000
 X4M  O37  P40  S29  110.46  3.000
 X4M  O38  P41  O34  116.51  3.000
 X4M  O38  P41  O32  116.32  3.000
 X4M  O34  P41  O32  100.46  3.000
 X4M  O38  P41  S30  115.22  3.000
 X4M  O32  P41  S30  102.65  3.000
 X4M  O34  P41  S30  103.50  3.000
 X4M  H23  S29  P40   97.87  3.000
 X4M  H24  S30  P41   95.49  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
 X4M  CONST_01  C5   C7   N25  C4     0.00   0.0  0
 X4M  CONST_02  C7   C5   N23  C4     0.00   0.0  0
 X4M  CONST_03  N25  C4   N23  C5     0.00   0.0  0
 X4M  CONST_04  N21  C2   C1   C6     0.00   0.0  0
 X4M  CONST_05  N21  C3   N22  C6     0.00   0.0  0
 X4M  CONST_06  N23  C4   N25  C7     0.00   0.0  0
 X4M  CONST_07  C3   N22  C6   C1     0.00   0.0  0
 X4M  CONST_08  C3   N21  C2   C1     0.00   0.0  0
 X4M  CONST_09  N22  C6   C1   C2     0.00   0.0  0
 X4M  CONST_10  N22  C3   N21  C2     0.00   0.0  0
 X4M  CONST_11  N25  C7   C5   N23    0.00   0.0  0
 X4M  CONST_12  C20  N25  C7   C5   180.00   0.0  0
 X4M  CONST_13  N24  C7   N25  C20    0.00   0.0  0
 X4M  CONST_14  N23  C4   N25  C20  180.00   0.0  0
 X4M  CONST_15  C9   N26  C8   C5     0.00   0.0  0
 X4M  CONST_16  N26  C9   N24  C7     0.00   0.0  0
 X4M  CONST_17  N24  C9   N26  C8     0.00   0.0  0
 X4M  CONST_18  O39  C6   C1   C2   180.00   0.0  0
 X4M  CONST_19  O39  C6   N22  C3   180.00   0.0  0
 X4M  CONST_20  N27  C9   N24  C7   180.00   0.0  0
 X4M  CONST_21  N27  C9   N26  C8   180.00   0.0  0
 X4M  CONST_22  O28  C8   N26  C9   180.00   0.0  0
 X4M  CONST_23  H1   C4   N23  C5   180.00   0.0  0
 X4M  CONST_24  H10  C2   C1   C6   180.00   0.0  0
 X4M  CONST_25  H11  C3   N22  C6   180.00   0.0  0
 X4M  CONST_26  H9   C1   C2   N21  180.00   0.0  0
 X4M  CONST_27  H20  N26  C8   C5   180.00   0.0  0
 X4M  CONST_28  H21  N27  C9   N24    0.00   0.0  0
 X4M  CONST_29  H22  N27  C9   N24  180.00   0.0  0
 X4M  Var_01    O34  P41  O32  C13  175.41  30.0  1
 X4M  Var_02    O32  P41  O34  C15   80.19  30.0  1
 X4M  Var_03    O31  P40  O35  C17   38.98  30.0  1
 X4M  Var_04    O35  P40  O31  C12   57.95  30.0  1
 X4M  Var_05    N22  C6   O39  C18    1.29  30.0  2
 X4M  Var_06    H14  C12  O31  P40  -52.84  30.0  1
 X4M  Var_07    H4   C13  O32  P41   19.94  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
 X4M  chir_01  C15  C14  C11  O34  positiv
 X4M  chir_02  C17  O35  C19  C20  positiv
 X4M  chir_03  C20  O33  N25  C17  negativ
 X4M  chir_04  C14  C10  C12  C15  positiv
 X4M  chir_05  C16  O33  C19  C13  negativ
 X4M  chir_06  C18  C10  O39  C11  negativ
 X4M  chir_07  C19  O36  C17  C16  negativ
 X4M  chir_08  P40  O37  O31  O35  both
 X4M  chir_09  P41  O32  O38  S30  both

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
 X4M  plan-1  C6   0.020
 X4M  plan-1  C1   0.020
 X4M  plan-1  C2   0.020
 X4M  plan-1  C3   0.020
 X4M  plan-1  N21  0.020
 X4M  plan-1  N22  0.020
 X4M  plan-1  O39  0.020
 X4M  plan-1  H9   0.020
 X4M  plan-1  H10  0.020
 X4M  plan-1  H11  0.020
 X4M  plan-2  C4   0.020
 X4M  plan-2  C5   0.020
 X4M  plan-2  C7   0.020
 X4M  plan-2  C8   0.020
 X4M  plan-2  C20  0.020
 X4M  plan-2  C9   0.020
 X4M  plan-2  N23  0.020
 X4M  plan-2  N24  0.020
 X4M  plan-2  N25  0.020
 X4M  plan-2  N26  0.020
 X4M  plan-2  N27  0.020
 X4M  plan-2  O28  0.020
 X4M  plan-2  H1   0.020
 X4M  plan-2  H20  0.020
 X4M  plan-2  H21  0.020
 X4M  plan-2  H22  0.020

