# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Thu Apr 23 05:30:02 2020
#   Inital geometry file: a 150 line input string
#   Ligand name: ethyl (2S)-3-[7-(diaminomethyl)naphthalen-2-yl]-2-[4-(pyrrolidin-3-yloxy)phenyl]propanoate
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CCOC(=O)[C@@H](Cc1ccc2ccc(cc2c1)C(N)N)c3ccc(OC4CCNC4)cc3
#
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
 DCH  DCH  'ethyl (2S)-3-[7-(diaminomethyl)naphthalen-2-yl]-2-[4-(pyrrolidin-3-yloxy)phenyl]propanoate'  ligand  63  32  .  2021-08-08  2021-08-08  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as OK
;

data_comp_DCH
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
 DCH  CZ    C  CH1   0  -0.013  -0.0152  5.9477   3.2034
 DCH  NZ1   N  NH2   0  -0.779  -0.8342  4.7560   3.0231
 DCH  NZ2   N  NH2   0  -0.781   0.1206  6.5730   1.9109
 DCH  C11   C  CR6   0   0.114   1.2713  5.5559   3.9143
 DCH  C12   C  CR16  0  -0.406   2.4830  5.4801   3.2838
 DCH  C13   C  CR66  0   0.186   3.6557  5.1001   3.9812
 DCH  C14   C  CR16  0  -0.357   4.9052  4.9995   3.3312
 DCH  C15   C  CR6   0   0.132   6.0324  4.6018   4.0023
 DCH  C16   C  CR16  0  -0.300   5.9398  4.3154   5.3843
 DCH  C17   C  CR16  0  -0.300   4.7479  4.4139   6.0477
 DCH  C18   C  CR66  0   0.082   3.5730  4.7976   5.3619
 DCH  C19   C  CR16  0  -0.303   2.3151  4.8942   6.0023
 DCH  C1A   C  CR16  0  -0.296   1.2030  5.2607   5.2987
 DCH  CA1   C  CH2   0  -0.503   7.3277  4.3601   3.2810
 DCH  CA2   C  CH1   0  -0.509   7.4950  2.8488   2.9748
 DCH  CA3   C  C     0   0.636   8.7892  2.5394   2.2478
 DCH  OA3   O  O     0  -0.440   8.8890  1.8099   1.2936
 DCH  OA4   O  O2    0  -0.454   9.8195  3.1393   2.8213
 DCH  CA5   C  CH2   0  -0.179  11.1340  2.8935   2.2953
 DCH  CA6   C  CH3   0  -0.688  12.1103  3.7151   3.1012
 DCH  C21   C  CR6   0   0.169   6.2761  2.3283   2.2651
 DCH  C22   C  CR16  0  -0.283   5.3353  1.5909   2.9728
 DCH  C23   C  CR16  0  -0.305   4.1056  1.2719   2.4172
 DCH  C24   C  CR6   0   0.318   3.8023  1.6861   1.1280
 DCH  C25   C  CR16  0  -0.311   4.7496  2.3877   0.3905
 DCH  C26   C  CR16  0  -0.284   5.9726  2.7062   0.9597
 DCH  OB    O  O2    0  -0.514   2.5754  1.4046   0.6010
 DCH  C31   C  CH1   0   0.043   1.5952  2.4168   0.8147
 DCH  C32   C  CH2   0  -0.355   0.1867  1.8227   0.7584
 DCH  N33   N  NH1   0  -0.612  -0.6841  2.9453   0.4676
 DCH  C34   C  CH2   0  -0.329   0.0505  3.7293  -0.5246
 DCH  C35   C  CH2   0  -0.513   1.5610  3.5162  -0.2602
 DCH  HZ    H  HCH1  0   0.222  -0.5098  6.6859   3.8514
 DCH  HZ11  H  HNH2  0   0.359  -1.7946  5.0335   2.8584
 DCH  HZ12  H  HNH2  0   0.361  -0.8390  4.1904   3.8624
 DCH  HZ21  H  HNH2  0   0.352   0.6476  7.4345   1.9819
 DCH  HZ22  H  HNH2  0   0.350   0.6236  5.9634   1.2779
 DCH  H12   H  HCR6  0   0.230   2.5792  5.7186   2.2301
 DCH  H14   H  HCR6  0   0.238   4.9564  5.2128   2.2695
 DCH  H16   H  HCR6  0   0.249   6.8306  4.0076   5.9202
 DCH  H17   H  HCR6  0   0.251   4.6921  4.1939   7.1073
 DCH  H19   H  HCR6  0   0.252   2.2430  4.6785   7.0617
 DCH  H1A   H  HCR6  0   0.251   0.2502  5.3391   5.8111
 DCH  HA11  H  HCH2  0   0.267   8.1657  4.7062   3.8873
 DCH  HA12  H  HCH2  0   0.256   7.3492  4.9259   2.3471
 DCH  HA2   H  HCH1  0   0.306   7.5769  2.3327   3.9398
 DCH  HA51  H  HCH2  0   0.236  11.3628  1.8285   2.3708
 DCH  HA52  H  HCH2  0   0.236  11.1673  3.1708   1.2401
 DCH  HA61  H  HCH3  0   0.240  13.1209  3.5232   2.7418
 DCH  HA62  H  HCH3  0   0.237  11.9169  4.7828   2.9992
 DCH  HA63  H  HCH3  0   0.237  12.0775  3.4539   4.1589
 DCH  H22   H  HCR6  0   0.248   5.5490  1.2909   3.9917
 DCH  H23   H  HCR6  0   0.256   3.3742  0.7164   2.9912
 DCH  H25   H  HCR6  0   0.255   4.5263  2.6976  -0.6226
 DCH  H26   H  HCR6  0   0.250   6.6790  3.2880   0.3803
 DCH  H31   H  HCH1  0   0.230   1.7532  2.8656   1.8034
 DCH  H321  H  HCH2  0   0.223   0.1336  1.0813  -0.0476
 DCH  H322  H  HCH2  0   0.241  -0.1035  1.3286   1.6867
 DCH  H33   H  HNH1  0   0.368  -0.7594  3.5074   1.3171
 DCH  H341  H  HCH2  0   0.226  -0.2502  4.7766  -0.4707
 DCH  H342  H  HCH2  0   0.230  -0.2011  3.3792  -1.5287
 DCH  H351  H  HCH2  0   0.248   2.0768  3.1827  -1.1625
 DCH  H352  H  HCH2  0   0.235   2.0605  4.4275   0.0743

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
 DCH  CZ   NZ1   single    1.457  0.020  1.457
 DCH  CZ   NZ2   single    1.442  0.020  1.442
 DCH  CZ   C11   single    1.521  0.020  1.521
 DCH  CZ   HZ    single    0.970  0.020  1.090
 DCH  NZ1  HZ11  single    0.890  0.020  1.040
 DCH  NZ1  HZ12  single    0.890  0.020  1.040
 DCH  NZ2  HZ21  single    0.890  0.020  1.040
 DCH  NZ2  HZ22  single    0.890  0.020  1.040
 DCH  C11  C12   aromatic  1.368  0.020  1.368
 DCH  C11  C1A   aromatic  1.417  0.020  1.417
 DCH  C12  C13   aromatic  1.416  0.020  1.416
 DCH  C12  H12   single    0.930  0.020  1.080
 DCH  C13  C14   aromatic  1.412  0.020  1.412
 DCH  C13  C18   aromatic  1.416  0.020  1.416
 DCH  C14  C15   aromatic  1.371  0.020  1.371
 DCH  C14  H14   single    0.930  0.020  1.080
 DCH  C15  C16   aromatic  1.414  0.020  1.414
 DCH  C15  CA1   single    1.502  0.020  1.502
 DCH  C16  C17   aromatic  1.368  0.020  1.368
 DCH  C16  H16   single    0.930  0.020  1.080
 DCH  C17  C18   aromatic  1.413  0.020  1.413
 DCH  C17  H17   single    0.930  0.020  1.080
 DCH  C18  C19   aromatic  1.415  0.020  1.415
 DCH  C19  C1A   aromatic  1.366  0.020  1.366
 DCH  C19  H19   single    0.930  0.020  1.080
 DCH  C1A  H1A   single    0.930  0.020  1.080
 DCH  CA1  CA2   single    1.551  0.020  1.551
 DCH  CA1  HA11  single    0.970  0.020  1.090
 DCH  CA1  HA12  single    0.970  0.020  1.090
 DCH  CA2  CA3   single    1.516  0.020  1.516
 DCH  CA2  C21   single    1.503  0.020  1.503
 DCH  CA2  HA2   single    0.970  0.020  1.090
 DCH  CA3  OA3   double    1.205  0.020  1.205
 DCH  CA3  OA4   single    1.323  0.020  1.323
 DCH  OA4  CA5   single    1.437  0.020  1.437
 DCH  CA5  CA6   single    1.509  0.020  1.509
 DCH  CA5  HA51  single    0.970  0.020  1.090
 DCH  CA5  HA52  single    0.970  0.020  1.090
 DCH  CA6  HA61  single    0.970  0.020  1.090
 DCH  CA6  HA62  single    0.970  0.020  1.090
 DCH  CA6  HA63  single    0.970  0.020  1.090
 DCH  C21  C22   aromatic  1.389  0.020  1.389
 DCH  C21  C26   aromatic  1.392  0.020  1.392
 DCH  C22  C23   aromatic  1.387  0.020  1.387
 DCH  C22  H22   single    0.930  0.020  1.080
 DCH  C23  C24   aromatic  1.388  0.020  1.388
 DCH  C23  H23   single    0.930  0.020  1.080
 DCH  C24  C25   aromatic  1.390  0.020  1.390
 DCH  C24  OB    single    1.365  0.020  1.365
 DCH  C25  C26   aromatic  1.386  0.020  1.386
 DCH  C25  H25   single    0.930  0.020  1.080
 DCH  C26  H26   single    0.930  0.020  1.080
 DCH  OB   C31   single    1.425  0.020  1.425
 DCH  C31  C32   single    1.530  0.020  1.530
 DCH  C31  C35   single    1.538  0.020  1.538
 DCH  C31  H31   single    0.970  0.020  1.090
 DCH  C32  N33   single    1.450  0.020  1.450
 DCH  C32  H321  single    0.970  0.020  1.090
 DCH  C32  H322  single    0.970  0.020  1.090
 DCH  N33  C34   single    1.462  0.020  1.462
 DCH  N33  H33   single    0.890  0.020  1.040
 DCH  C34  C35   single    1.548  0.020  1.548
 DCH  C34  H341  single    0.970  0.020  1.090
 DCH  C34  H342  single    0.970  0.020  1.090
 DCH  C35  H351  single    0.970  0.020  1.090
 DCH  C35  H352  single    0.970  0.020  1.090

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
 DCH  HZ    CZ   C11   106.14  3.000
 DCH  HZ    CZ   NZ2   106.23  3.000
 DCH  C11   CZ   NZ2   116.80  3.000
 DCH  HZ    CZ   NZ1   111.66  3.000
 DCH  C11   CZ   NZ1   108.81  3.000
 DCH  NZ2   CZ   NZ1   107.25  3.000
 DCH  HZ12  NZ1  HZ11  106.46  3.000
 DCH  HZ12  NZ1  CZ    110.92  3.000
 DCH  HZ11  NZ1  CZ    109.20  3.000
 DCH  HZ22  NZ2  HZ21  107.31  3.000
 DCH  HZ22  NZ2  CZ    110.24  3.000
 DCH  HZ21  NZ2  CZ    110.80  3.000
 DCH  C1A   C11  C12   118.77  3.000
 DCH  C1A   C11  CZ    118.00  3.000
 DCH  C12   C11  CZ    123.23  3.000
 DCH  H12   C12  C13   117.64  3.000
 DCH  H12   C12  C11   120.94  3.000
 DCH  C13   C12  C11   121.42  3.000
 DCH  C18   C13  C14   119.04  3.000
 DCH  C18   C13  C12   119.28  3.000
 DCH  C14   C13  C12   121.68  3.000
 DCH  H14   C14  C15   119.85  3.000
 DCH  H14   C14  C13   118.59  3.000
 DCH  C15   C14  C13   121.53  3.000
 DCH  CA1   C15  C16   119.54  3.000
 DCH  CA1   C15  C14   121.37  3.000
 DCH  C16   C15  C14   118.90  3.000
 DCH  H16   C16  C17   119.78  3.000
 DCH  H16   C16  C15   119.12  3.000
 DCH  C17   C16  C15   121.09  3.000
 DCH  H17   C17  C18   119.12  3.000
 DCH  H17   C17  C16   120.31  3.000
 DCH  C18   C17  C16   120.58  3.000
 DCH  C19   C18  C17   122.55  3.000
 DCH  C19   C18  C13   118.60  3.000
 DCH  C17   C18  C13   118.85  3.000
 DCH  H19   C19  C1A   120.18  3.000
 DCH  H19   C19  C18   119.22  3.000
 DCH  C1A   C19  C18   120.60  3.000
 DCH  H1A   C1A  C19   119.42  3.000
 DCH  H1A   C1A  C11   119.26  3.000
 DCH  C19   C1A  C11   121.32  3.000
 DCH  HA12  CA1  HA11  107.21  3.000
 DCH  HA12  CA1  CA2   109.50  3.000
 DCH  HA11  CA1  CA2   109.64  3.000
 DCH  HA12  CA1  C15   110.14  3.000
 DCH  HA11  CA1  C15   110.15  3.000
 DCH  CA2   CA1  C15   110.16  3.000
 DCH  HA2   CA2  C21   108.22  3.000
 DCH  HA2   CA2  CA3   105.19  3.000
 DCH  C21   CA2  CA3   113.27  3.000
 DCH  HA2   CA2  CA1   107.02  3.000
 DCH  C21   CA2  CA1   110.06  3.000
 DCH  CA3   CA2  CA1   112.68  3.000
 DCH  OA4   CA3  OA3   123.58  3.000
 DCH  OA4   CA3  CA2   111.37  3.000
 DCH  OA3   CA3  CA2   125.01  3.000
 DCH  CA5   OA4  CA3   118.44  3.000
 DCH  HA52  CA5  HA51  107.95  3.000
 DCH  HA52  CA5  CA6   110.99  3.000
 DCH  HA51  CA5  CA6   111.01  3.000
 DCH  HA52  CA5  OA4   109.77  3.000
 DCH  HA51  CA5  OA4   109.46  3.000
 DCH  CA6   CA5  OA4   107.65  3.000
 DCH  HA63  CA6  HA62  108.68  3.000
 DCH  HA63  CA6  HA61  107.81  3.000
 DCH  HA62  CA6  HA61  107.83  3.000
 DCH  HA63  CA6  CA5   111.61  3.000
 DCH  HA62  CA6  CA5   111.62  3.000
 DCH  HA61  CA6  CA5   109.15  3.000
 DCH  C26   C21  C22   118.30  3.000
 DCH  C26   C21  CA2   121.68  3.000
 DCH  C22   C21  CA2   119.50  3.000
 DCH  H22   C22  C23   119.21  3.000
 DCH  H22   C22  C21   119.51  3.000
 DCH  C23   C22  C21   121.24  3.000
 DCH  H23   C23  C24   119.86  3.000
 DCH  H23   C23  C22   120.30  3.000
 DCH  C24   C23  C22   119.83  3.000
 DCH  OB    C24  C25   120.78  3.000
 DCH  OB    C24  C23   119.58  3.000
 DCH  C25   C24  C23   119.63  3.000
 DCH  H25   C25  C26   120.02  3.000
 DCH  H25   C25  C24   120.02  3.000
 DCH  C26   C25  C24   119.95  3.000
 DCH  H26   C26  C25   118.63  3.000
 DCH  H26   C26  C21   120.34  3.000
 DCH  C25   C26  C21   120.99  3.000
 DCH  C31   OB   C24   114.45  3.000
 DCH  H31   C31  C35   109.91  3.000
 DCH  H31   C31  C32   108.94  3.000
 DCH  C35   C31  C32   103.38  3.000
 DCH  H31   C31  OB    109.06  3.000
 DCH  C35   C31  OB    114.73  3.000
 DCH  C32   C31  OB    110.60  3.000
 DCH  H322  C32  H321  107.84  3.000
 DCH  H322  C32  N33   111.20  3.000
 DCH  H321  C32  N33   110.30  3.000
 DCH  H322  C32  C31   112.93  3.000
 DCH  H321  C32  C31   109.52  3.000
 DCH  N33   C32  C31   105.05  3.000
 DCH  H33   N33  C34   107.83  3.000
 DCH  H33   N33  C32   107.67  3.000
 DCH  C34   N33  C32   104.44  3.000
 DCH  H342  C34  H341  106.83  3.000
 DCH  H342  C34  C35   109.72  3.000
 DCH  H341  C34  C35   113.12  3.000
 DCH  H342  C34  N33   109.63  3.000
 DCH  H341  C34  N33   110.04  3.000
 DCH  C35   C34  N33   107.48  3.000
 DCH  H352  C35  H351  106.99  3.000
 DCH  H352  C35  C34   112.57  3.000
 DCH  H351  C35  C34   111.22  3.000
 DCH  H352  C35  C31   111.86  3.000
 DCH  H351  C35  C31   110.42  3.000
 DCH  C34   C35  C31   103.86  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
 DCH  CONST_01  C14   C13  C12  C11  180.00   0.0  0
 DCH  CONST_02  C18   C13  C12  C11    0.00   0.0  0
 DCH  CONST_03  C18   C19  C1A  C11    0.00   0.0  0
 DCH  CONST_04  C19   C1A  C11  C12    0.00   0.0  0
 DCH  CONST_05  C15   C14  C13  C12  180.00   0.0  0
 DCH  CONST_06  C17   C18  C13  C12  180.00   0.0  0
 DCH  CONST_07  C19   C18  C13  C12    0.00   0.0  0
 DCH  CONST_08  C1A   C11  C12  C13    0.00   0.0  0
 DCH  CONST_09  C16   C15  C14  C13    0.00   0.0  0
 DCH  CONST_10  C16   C17  C18  C13    0.00   0.0  0
 DCH  CONST_11  C1A   C19  C18  C13    0.00   0.0  0
 DCH  CONST_12  C17   C18  C13  C14    0.00   0.0  0
 DCH  CONST_13  C19   C18  C13  C14  180.00   0.0  0
 DCH  CONST_14  C17   C16  C15  C14    0.00   0.0  0
 DCH  CONST_15  C18   C13  C14  C15    0.00   0.0  0
 DCH  CONST_16  C18   C17  C16  C15    0.00   0.0  0
 DCH  CONST_17  C19   C18  C17  C16  180.00   0.0  0
 DCH  CONST_18  C1A   C19  C18  C17  180.00   0.0  0
 DCH  CONST_19  C24   C23  C22  C21    0.00   0.0  0
 DCH  CONST_20  C24   C25  C26  C21    0.00   0.0  0
 DCH  CONST_21  C25   C26  C21  C22    0.00   0.0  0
 DCH  CONST_22  C25   C24  C23  C22    0.00   0.0  0
 DCH  CONST_23  C26   C21  C22  C23    0.00   0.0  0
 DCH  CONST_24  C26   C25  C24  C23    0.00   0.0  0
 DCH  CONST_25  C13   C12  C11  CZ   180.00   0.0  0
 DCH  CONST_26  C19   C1A  C11  CZ   180.00   0.0  0
 DCH  CONST_27  CA1   C15  C14  C13  180.00   0.0  0
 DCH  CONST_28  CA1   C15  C16  C17  180.00   0.0  0
 DCH  CONST_29  C23   C22  C21  CA2  180.00   0.0  0
 DCH  CONST_30  C25   C26  C21  CA2  180.00   0.0  0
 DCH  CONST_31  OB    C24  C23  C22  180.00   0.0  0
 DCH  CONST_32  OB    C24  C25  C26  180.00   0.0  0
 DCH  CONST_33  H19   C19  C1A  C11  180.00   0.0  0
 DCH  CONST_34  H1A   C1A  C11  C12  180.00   0.0  0
 DCH  CONST_35  H14   C14  C13  C12    0.00   0.0  0
 DCH  CONST_36  H17   C17  C18  C13  180.00   0.0  0
 DCH  CONST_37  H12   C12  C13  C14    0.00   0.0  0
 DCH  CONST_38  H16   C16  C15  C14  180.00   0.0  0
 DCH  CONST_39  H23   C23  C22  C21  180.00   0.0  0
 DCH  CONST_40  H25   C25  C26  C21  180.00   0.0  0
 DCH  CONST_41  H26   C26  C21  C22  180.00   0.0  0
 DCH  CONST_42  H22   C22  C23  C24  180.00   0.0  0
 DCH  Var_01    C34   N33  C32  C31   40.55  30.0  1
 DCH  Var_02    N33   C34  C35  C31    7.48  30.0  1
 DCH  Var_03    C35   C34  N33  C32  -29.79  30.0  1
 DCH  Var_04    C12   C11  CZ   NZ1  106.04  30.0  2
 DCH  Var_05    CA2   CA1  C15  C14  -96.84  30.0  2
 DCH  Var_06    HZ11  NZ1  CZ   C11  160.41  30.0  3
 DCH  Var_07    HZ21  NZ2  CZ   C11  -60.26  30.0  3
 DCH  Var_08    CA6   CA5  OA4  CA3  178.69  30.0  3
 DCH  Var_09    HA61  CA6  CA5  OA4  178.28  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
 DCH  chir_01  CA2  CA1  CA3  C21  positiv
 DCH  chir_02  C31  OB   C32  C35  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
 DCH  plan-1  CA2  0.020
 DCH  plan-1  C21  0.020
 DCH  plan-1  C22  0.020
 DCH  plan-1  C23  0.020
 DCH  plan-1  C24  0.020
 DCH  plan-1  C25  0.020
 DCH  plan-1  C26  0.020
 DCH  plan-1  OB   0.020
 DCH  plan-1  H22  0.020
 DCH  plan-1  H23  0.020
 DCH  plan-1  H25  0.020
 DCH  plan-1  H26  0.020
 DCH  plan-2  CA2  0.020
 DCH  plan-2  CA3  0.020
 DCH  plan-2  OA3  0.020
 DCH  plan-2  OA4  0.020
 DCH  plan-3  CZ   0.020
 DCH  plan-3  C11  0.020
 DCH  plan-3  C12  0.020
 DCH  plan-3  C13  0.020
 DCH  plan-3  C14  0.020
 DCH  plan-3  C15  0.020
 DCH  plan-3  C16  0.020
 DCH  plan-3  C17  0.020
 DCH  plan-3  C18  0.020
 DCH  plan-3  C19  0.020
 DCH  plan-3  C1A  0.020
 DCH  plan-3  CA1  0.020
 DCH  plan-3  H12  0.020
 DCH  plan-3  H14  0.020
 DCH  plan-3  H16  0.020
 DCH  plan-3  H17  0.020
 DCH  plan-3  H19  0.020
 DCH  plan-3  H1A  0.020

