# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Mon May  4 20:54:03 2020
#   Inital geometry file: a 140 line input string
#   Ligand name: N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]-2-(naphthalen-1-yl)acetamide
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: NCCCNCCCCNCCCNC(=O)Cc1cccc2ccccc12
#
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
 GYY  GYY  N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]-2-(naphthalen-1-yl)acetamide  ligand  61  27  .  2021-08-10  2021-08-10  
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_GYY
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
 GYY  CAA   C  CR16  0  -0.244    8.3663   1.8021   0.4025
 GYY  CAB   C  CR16  0  -0.341    7.0548   2.0972  -0.0226
 GYY  CAD   C  CR16  0  -0.333    8.7915   0.5060   0.4647
 GYY  CAE   C  CR6   0   0.157    6.1762   1.1085  -0.3805
 GYY  CAF   C  CH2   0  -0.733    4.7904   1.4614  -0.8301
 GYY  CAG   C  C     0   0.556    3.7272   1.1098   0.1999
 GYY  CAI   C  CH2   0  -0.236    1.3432   0.6484   0.5231
 GYY  CAJ   C  CH2   0  -0.499    0.0936   0.5197  -0.3318
 GYY  CAK   C  CH2   0  -0.249   -1.1490   0.3288   0.5230
 GYY  CAM   C  CH2   0  -0.248   -3.5523   0.0745   0.4826
 GYY  CAN   C  CH2   0  -0.444   -4.7839   0.0029  -0.4061
 GYY  CAO   C  CH2   0  -0.445   -6.0716  -0.1283   0.3963
 GYY  CAP   C  CH2   0  -0.247   -7.3083  -0.1856  -0.4865
 GYY  CAR   C  CH2   0  -0.252   -9.7235  -0.3279  -0.5030
 GYY  CAS   C  CH2   0  -0.454  -10.9717  -0.3797   0.3638
 GYY  CAT   C  CH2   0  -0.273  -12.2492  -0.4305  -0.4599
 GYY  CAV   C  CR66  0   0.112    7.9208  -0.5493   0.1024
 GYY  CAW   C  CR66  0   0.100    6.5990  -0.2508  -0.3254
 GYY  CAX   C  CR16  0  -0.311    8.3436  -1.8981   0.1582
 GYY  CAY   C  CR16  0  -0.331    5.7500  -1.3270  -0.6812
 GYY  CAZ   C  CR16  0  -0.261    7.4982  -2.9144  -0.1930
 GYY  CBA   C  CR16  0  -0.249    6.1869  -2.6230  -0.6181
 GYY  NAH   N  NH1   0  -0.643    2.5075   0.8808  -0.3067
 GYY  NAL   N  NH1   0  -0.601   -2.3398   0.2340  -0.2974
 GYY  NAQ   N  NH1   0  -0.600   -8.5192  -0.2923   0.3045
 GYY  NAU   N  NH2   0  -0.800  -13.4215  -0.4571   0.4042
 GYY  OAC   O  O     0  -0.485    3.9662   1.0724   1.3974
 GYY  HAA1  H  HCR6  0   0.257    9.0317   2.6105   0.6767
 GYY  HAB1  H  HCR6  0   0.253    6.7371   3.1320  -0.0681
 GYY  HAD1  H  HCR6  0   0.255    9.7976   0.2687   0.7895
 GYY  HAF1  H  HCH2  0   0.309    4.7283   2.5411  -0.9926
 GYY  HAF2  H  HCH2  0   0.281    4.5553   1.0017  -1.7939
 GYY  HAI1  H  HCH2  0   0.231    1.2224   1.4732   1.2314
 GYY  HAI2  H  HCH2  0   0.233    1.4848  -0.2593   1.1166
 GYY  HAJ2  H  HCH2  0   0.235   -0.0281   1.4157  -0.9473
 GYY  HAJ1  H  HCH2  0   0.235    0.2034  -0.3274  -1.0172
 GYY  HAK1  H  HCH2  0   0.190   -1.0129  -0.5473   1.1784
 GYY  HAK2  H  HCH2  0   0.218   -1.2630   1.1897   1.1896
 GYY  HAM2  H  HCH2  0   0.213   -3.6429   0.9374   1.1510
 GYY  HAM1  H  HCH2  0   0.185   -3.5209  -0.8136   1.1356
 GYY  HAN2  H  HCH2  0   0.217   -4.8239   0.8999  -1.0317
 GYY  HAN1  H  HCH2  0   0.215   -4.6908  -0.8484  -1.0898
 GYY  HAO2  H  HCH2  0   0.217   -6.0343  -1.0268   1.0200
 GYY  HAO1  H  HCH2  0   0.214   -6.1580   0.7218   1.0828
 GYY  HAP1  H  HCH2  0   0.183   -7.3187   0.6914  -1.1555
 GYY  HAP2  H  HCH2  0   0.212   -7.2458  -1.0627  -1.1395
 GYY  HAR1  H  HCH2  0   0.212   -9.6850  -1.2207  -1.1367
 GYY  HAR2  H  HCH2  0   0.183   -9.7934   0.5309  -1.1917
 GYY  HAS2  H  HCH2  0   0.219  -10.9260  -1.2513   1.0225
 GYY  HAS1  H  HCH2  0   0.214  -10.9971   0.5047   1.0116
 GYY  HAT2  H  HCH2  0   0.189  -12.2502   0.4085  -1.1709
 GYY  HAT1  H  HCH2  0   0.213  -12.2483  -1.3424  -1.0638
 GYY  HAX1  H  HCR6  0   0.256    9.3531  -2.1156   0.4860
 GYY  HAY1  H  HCR6  0   0.243    4.7383  -1.1316  -1.0122
 GYY  HAZ1  H  HCR6  0   0.258    7.8322  -3.9427  -0.1456
 GYY  HBA1  H  HCR6  0   0.259    5.5215  -3.4304  -0.8951
 GYY  HAH1  H  HNH1  0   0.404    2.3766   0.9525  -1.3031
 GYY  H1    H  HNH1  0   0.336   -2.2450  -0.5619  -0.9189
 GYY  H2    H  HNH1  0   0.333   -8.5704   0.5091   0.9243
 GYY  H3    H  HNH2  0   0.337  -13.4920   0.4292   0.8900
 GYY  HAU2  H  HNH2  0   0.345  -14.2569  -0.5191  -0.1637

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
 GYY  NAU  CAT   single    1.457  0.020  1.457
 GYY  CAT  CAS   single    1.521  0.020  1.521
 GYY  CAS  CAR   single    1.521  0.020  1.521
 GYY  CAR  NAQ   single    1.450  0.020  1.450
 GYY  NAQ  CAP   single    1.450  0.020  1.450
 GYY  CAP  CAO   single    1.521  0.020  1.521
 GYY  CAO  CAN   single    1.523  0.020  1.523
 GYY  CAN  CAM   single    1.520  0.020  1.520
 GYY  CAM  NAL   single    1.451  0.020  1.451
 GYY  NAL  CAK   single    1.449  0.020  1.449
 GYY  CAK  CAJ   single    1.520  0.020  1.520
 GYY  CAJ  CAI   single    1.520  0.020  1.520
 GYY  CAI  NAH   single    1.449  0.020  1.449
 GYY  NAH  CAG   single    1.340  0.020  1.340
 GYY  CAG  OAC   double    1.222  0.020  1.222
 GYY  CAG  CAF   single    1.522  0.020  1.522
 GYY  CAF  CAE   single    1.499  0.020  1.499
 GYY  CAE  CAB   aromatic  1.370  0.020  1.370
 GYY  CAE  CAW   aromatic  1.425  0.020  1.425
 GYY  CAB  CAA   aromatic  1.410  0.020  1.410
 GYY  CAY  CAW   aromatic  1.416  0.020  1.416
 GYY  CAY  CBA   aromatic  1.369  0.020  1.369
 GYY  CAW  CAV   aromatic  1.421  0.020  1.421
 GYY  CAA  CAD   aromatic  1.366  0.020  1.366
 GYY  CBA  CAZ   aromatic  1.409  0.020  1.409
 GYY  CAV  CAD   aromatic  1.415  0.020  1.415
 GYY  CAV  CAX   aromatic  1.415  0.020  1.415
 GYY  CAZ  CAX   aromatic  1.368  0.020  1.368
 GYY  CAA  HAA1  single    0.930  0.020  1.080
 GYY  CAB  HAB1  single    0.930  0.020  1.080
 GYY  CAD  HAD1  single    0.930  0.020  1.080
 GYY  CAF  HAF1  single    0.970  0.020  1.090
 GYY  CAF  HAF2  single    0.970  0.020  1.090
 GYY  CAI  HAI1  single    0.970  0.020  1.090
 GYY  CAI  HAI2  single    0.970  0.020  1.090
 GYY  CAJ  HAJ2  single    0.970  0.020  1.090
 GYY  CAJ  HAJ1  single    0.970  0.020  1.090
 GYY  CAK  HAK1  single    0.970  0.020  1.090
 GYY  CAK  HAK2  single    0.970  0.020  1.090
 GYY  CAM  HAM2  single    0.970  0.020  1.090
 GYY  CAM  HAM1  single    0.970  0.020  1.090
 GYY  CAN  HAN2  single    0.970  0.020  1.090
 GYY  CAN  HAN1  single    0.970  0.020  1.090
 GYY  CAO  HAO2  single    0.970  0.020  1.090
 GYY  CAO  HAO1  single    0.970  0.020  1.090
 GYY  CAP  HAP1  single    0.970  0.020  1.090
 GYY  CAP  HAP2  single    0.970  0.020  1.090
 GYY  CAR  HAR1  single    0.970  0.020  1.090
 GYY  CAR  HAR2  single    0.970  0.020  1.090
 GYY  CAS  HAS2  single    0.970  0.020  1.090
 GYY  CAS  HAS1  single    0.970  0.020  1.090
 GYY  CAT  HAT2  single    0.970  0.020  1.090
 GYY  CAT  HAT1  single    0.970  0.020  1.090
 GYY  CAX  HAX1  single    0.930  0.020  1.080
 GYY  CAY  HAY1  single    0.930  0.020  1.080
 GYY  CAZ  HAZ1  single    0.930  0.020  1.080
 GYY  CBA  HBA1  single    0.930  0.020  1.080
 GYY  NAH  HAH1  single    0.860  0.020  1.020
 GYY  NAL  H1    single    0.890  0.020  1.040
 GYY  NAQ  H2    single    0.890  0.020  1.040
 GYY  NAU  H3    single    0.890  0.020  1.040
 GYY  NAU  HAU2  single    0.890  0.020  1.040

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
 GYY  HAA1  CAA  CAD   120.40  3.000
 GYY  HAA1  CAA  CAB   119.46  3.000
 GYY  CAD   CAA  CAB   120.14  3.000
 GYY  HAB1  CAB  CAE   119.35  3.000
 GYY  HAB1  CAB  CAA   119.04  3.000
 GYY  CAE   CAB  CAA   121.61  3.000
 GYY  HAD1  CAD  CAV   119.00  3.000
 GYY  HAD1  CAD  CAA   120.70  3.000
 GYY  CAV   CAD  CAA   120.30  3.000
 GYY  CAW   CAE  CAF   120.70  3.000
 GYY  CAW   CAE  CAB   119.22  3.000
 GYY  CAF   CAE  CAB   120.08  3.000
 GYY  HAF2  CAF  HAF1  105.78  3.000
 GYY  HAF2  CAF  CAG   110.44  3.000
 GYY  HAF1  CAF  CAG   106.80  3.000
 GYY  HAF2  CAF  CAE   111.36  3.000
 GYY  HAF1  CAF  CAE   109.24  3.000
 GYY  CAG   CAF  CAE   112.87  3.000
 GYY  OAC   CAG  NAH   122.91  3.000
 GYY  OAC   CAG  CAF   122.27  3.000
 GYY  NAH   CAG  CAF   114.80  3.000
 GYY  HAI2  CAI  HAI1  106.77  3.000
 GYY  HAI2  CAI  NAH   109.88  3.000
 GYY  HAI1  CAI  NAH   109.80  3.000
 GYY  HAI2  CAI  CAJ   109.97  3.000
 GYY  HAI1  CAI  CAJ   109.72  3.000
 GYY  NAH   CAI  CAJ   110.63  3.000
 GYY  HAJ1  CAJ  HAJ2  107.02  3.000
 GYY  HAJ1  CAJ  CAK   109.67  3.000
 GYY  HAJ2  CAJ  CAK   109.16  3.000
 GYY  HAJ1  CAJ  CAI   109.58  3.000
 GYY  HAJ2  CAJ  CAI   109.80  3.000
 GYY  CAK   CAJ  CAI   111.50  3.000
 GYY  HAK2  CAK  HAK1  106.00  3.000
 GYY  HAK2  CAK  NAL   108.09  3.000
 GYY  HAK1  CAK  NAL   112.71  3.000
 GYY  HAK2  CAK  CAJ   109.19  3.000
 GYY  HAK1  CAK  CAJ   109.46  3.000
 GYY  NAL   CAK  CAJ   111.19  3.000
 GYY  HAM1  CAM  HAM2  105.99  3.000
 GYY  HAM1  CAM  NAL   112.53  3.000
 GYY  HAM2  CAM  NAL   108.10  3.000
 GYY  HAM1  CAM  CAN   109.34  3.000
 GYY  HAM2  CAM  CAN   109.08  3.000
 GYY  NAL   CAM  CAN   111.59  3.000
 GYY  HAN1  CAN  HAN2  106.45  3.000
 GYY  HAN1  CAN  CAO   109.49  3.000
 GYY  HAN2  CAN  CAO   109.94  3.000
 GYY  HAN1  CAN  CAM   109.42  3.000
 GYY  HAN2  CAN  CAM   108.97  3.000
 GYY  CAO   CAN  CAM   112.39  3.000
 GYY  HAO1  CAO  HAO2  106.41  3.000
 GYY  HAO1  CAO  CAP   109.19  3.000
 GYY  HAO2  CAO  CAP   109.13  3.000
 GYY  HAO1  CAO  CAN   109.26  3.000
 GYY  HAO2  CAO  CAN   110.02  3.000
 GYY  CAP   CAO  CAN   112.64  3.000
 GYY  HAP2  CAP  HAP1  106.00  3.000
 GYY  HAP2  CAP  NAQ   108.29  3.000
 GYY  HAP1  CAP  NAQ   112.42  3.000
 GYY  HAP2  CAP  CAO   109.26  3.000
 GYY  HAP1  CAP  CAO   109.26  3.000
 GYY  NAQ   CAP  CAO   111.42  3.000
 GYY  HAR2  CAR  HAR1  106.00  3.000
 GYY  HAR2  CAR  NAQ   112.40  3.000
 GYY  HAR1  CAR  NAQ   108.23  3.000
 GYY  HAR2  CAR  CAS   109.29  3.000
 GYY  HAR1  CAR  CAS   109.32  3.000
 GYY  NAQ   CAR  CAS   111.41  3.000
 GYY  HAS1  CAS  HAS2  106.74  3.000
 GYY  HAS1  CAS  CAT   109.11  3.000
 GYY  HAS2  CAS  CAT   109.55  3.000
 GYY  HAS1  CAS  CAR   109.17  3.000
 GYY  HAS2  CAS  CAR   109.65  3.000
 GYY  CAT   CAS  CAR   112.45  3.000
 GYY  HAT1  CAT  HAT2  106.21  3.000
 GYY  HAT1  CAT  NAU   108.24  3.000
 GYY  HAT2  CAT  NAU   113.37  3.000
 GYY  HAT1  CAT  CAS   109.04  3.000
 GYY  HAT2  CAT  CAS   108.99  3.000
 GYY  NAU   CAT  CAS   110.81  3.000
 GYY  CAX   CAV  CAW   119.35  3.000
 GYY  CAX   CAV  CAD   121.13  3.000
 GYY  CAW   CAV  CAD   119.52  3.000
 GYY  CAY   CAW  CAV   118.27  3.000
 GYY  CAV   CAW  CAE   119.21  3.000
 GYY  CAY   CAW  CAE   122.51  3.000
 GYY  HAX1  CAX  CAZ   120.29  3.000
 GYY  HAX1  CAX  CAV   118.81  3.000
 GYY  CAZ   CAX  CAV   120.91  3.000
 GYY  HAY1  CAY  CBA   118.90  3.000
 GYY  HAY1  CAY  CAW   120.00  3.000
 GYY  CBA   CAY  CAW   121.09  3.000
 GYY  HAZ1  CAZ  CBA   119.80  3.000
 GYY  HAZ1  CAZ  CAX   120.27  3.000
 GYY  CBA   CAZ  CAX   119.93  3.000
 GYY  HBA1  CBA  CAZ   119.68  3.000
 GYY  HBA1  CBA  CAY   119.88  3.000
 GYY  CAZ   CBA  CAY   120.44  3.000
 GYY  HAH1  NAH  CAI   118.26  3.000
 GYY  HAH1  NAH  CAG   118.68  3.000
 GYY  CAI   NAH  CAG   122.84  3.000
 GYY  H1    NAL  CAM   108.74  3.000
 GYY  H1    NAL  CAK   108.75  3.000
 GYY  CAM   NAL  CAK   112.93  3.000
 GYY  H2    NAQ  CAR   108.52  3.000
 GYY  H2    NAQ  CAP   108.50  3.000
 GYY  CAR   NAQ  CAP   113.04  3.000
 GYY  HAU2  NAU  H3    105.38  3.000
 GYY  HAU2  NAU  CAT   109.42  3.000
 GYY  H3    NAU  CAT   108.93  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
 GYY  CONST_01  CAW   CAE  CAB  CAA     0.00   0.0  0
 GYY  CONST_02  CAW   CAV  CAD  CAA     0.00   0.0  0
 GYY  CONST_03  CAX   CAV  CAD  CAA   180.00   0.0  0
 GYY  CONST_04  CAY   CAW  CAE  CAB   180.00   0.0  0
 GYY  CONST_05  CAV   CAW  CAE  CAB     0.00   0.0  0
 GYY  CONST_06  CAV   CAD  CAA  CAB     0.00   0.0  0
 GYY  CONST_07  CAE   CAB  CAA  CAD     0.00   0.0  0
 GYY  CONST_08  CAE   CAW  CAV  CAD     0.00   0.0  0
 GYY  CONST_09  CAY   CAW  CAV  CAD   180.00   0.0  0
 GYY  CONST_10  CAZ   CAX  CAV  CAD   180.00   0.0  0
 GYY  CONST_11  CBA   CAY  CAW  CAE   180.00   0.0  0
 GYY  CONST_12  CAX   CAV  CAW  CAE   180.00   0.0  0
 GYY  CONST_13  CBA   CAY  CAW  CAV     0.00   0.0  0
 GYY  CONST_14  CBA   CAZ  CAX  CAV     0.00   0.0  0
 GYY  CONST_15  CAZ   CBA  CAY  CAW     0.00   0.0  0
 GYY  CONST_16  CAZ   CAX  CAV  CAW     0.00   0.0  0
 GYY  CONST_17  CAY   CAW  CAV  CAX     0.00   0.0  0
 GYY  CONST_18  CAY   CBA  CAZ  CAX     0.00   0.0  0
 GYY  CONST_19  CAF   CAE  CAB  CAA   180.00   0.0  0
 GYY  CONST_20  CAY   CAW  CAE  CAF     0.00   0.0  0
 GYY  CONST_21  CAV   CAW  CAE  CAF   180.00   0.0  0
 GYY  CONST_22  HAD1  CAD  CAA  CAB   180.00   0.0  0
 GYY  CONST_23  HAB1  CAB  CAA  CAD   180.00   0.0  0
 GYY  CONST_24  HAX1  CAX  CAV  CAD     0.00   0.0  0
 GYY  CONST_25  HAA1  CAA  CAB  CAE   180.00   0.0  0
 GYY  CONST_26  HAY1  CAY  CAW  CAE     0.00   0.0  0
 GYY  CONST_27  HAZ1  CAZ  CAX  CAV   180.00   0.0  0
 GYY  CONST_28  HBA1  CBA  CAY  CAW   180.00   0.0  0
 GYY  CONST_29  CAI   NAH  CAG  CAF   180.00   0.0  0
 GYY  CONST_30  OAC   CAG  NAH  CAI     0.00   0.0  0
 GYY  CONST_31  HAH1  NAH  CAG  CAF     0.00   0.0  0
 GYY  Var_01    CAG   CAF  CAE  CAB  -107.76  30.0  2
 GYY  Var_02    NAH   CAG  CAF  CAE  -153.93  30.0  2
 GYY  Var_03    CAJ   CAI  NAH  CAG   175.94  30.0  2
 GYY  Var_04    NAL   CAK  CAJ  CAI   178.84  30.0  1
 GYY  Var_05    CAM   NAL  CAK  CAJ  -178.98  30.0  1
 GYY  Var_06    CAN   CAM  NAL  CAK   179.00  30.0  1
 GYY  Var_07    NAH   CAI  CAJ  CAK  -177.80  30.0  3
 GYY  Var_08    CAP   CAO  CAN  CAM   179.39  30.0  1
 GYY  Var_09    NAQ   CAP  CAO  CAN  -179.23  30.0  1
 GYY  Var_10    CAR   NAQ  CAP  CAO   179.07  30.0  1
 GYY  Var_11    NAL   CAM  CAN  CAO  -178.51  30.0  3
 GYY  Var_12    CAS   CAR  NAQ  CAP  -177.56  30.0  1
 GYY  Var_13    NAU   CAT  CAS  CAR  -179.07  30.0  1
 GYY  Var_14    NAQ   CAR  CAS  CAT  -179.48  30.0  3
 GYY  Var_15    H3    NAU  CAT  CAS    66.98  30.0  3

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
 GYY  plan-1  CAA   0.020
 GYY  plan-1  CAB   0.020
 GYY  plan-1  CAD   0.020
 GYY  plan-1  CAE   0.020
 GYY  plan-1  CAF   0.020
 GYY  plan-1  CAV   0.020
 GYY  plan-1  CAW   0.020
 GYY  plan-1  CAX   0.020
 GYY  plan-1  CAY   0.020
 GYY  plan-1  CAZ   0.020
 GYY  plan-1  CBA   0.020
 GYY  plan-1  HAA1  0.020
 GYY  plan-1  HAB1  0.020
 GYY  plan-1  HAD1  0.020
 GYY  plan-1  HAX1  0.020
 GYY  plan-1  HAY1  0.020
 GYY  plan-1  HAZ1  0.020
 GYY  plan-1  HBA1  0.020
 GYY  plan-2  CAF   0.020
 GYY  plan-2  CAG   0.020
 GYY  plan-2  CAI   0.020
 GYY  plan-2  NAH   0.020
 GYY  plan-2  OAC   0.020
 GYY  plan-2  HAH1  0.020

