# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sun Mar 27 19:22:28 2022
#   Inital geometry file: a 375 line input string
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: Oc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc6cc(cc(Cc7cc(cc(Cc8cc(cc(Cc9cc(cc(Cc1cc(c2)[S](O)(=O)=O)c9O)[S](O)(=O)=O)c8O)[S](O)(=O)=O)c7O)[S](O)(=O)=O)c6O)[S](O)(=O)=O)c5O)[S](O)(=O)=O)c4O)[S](O)(=O)=O)c3O)[S](O)(=O)=O
#
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
 EVB  EVB  'None                     '  ligand  136  96  .  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_EVB
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
 EVB  C11  C  CR16   0  -0.339  72.2744  72.2326  -37.0731
 EVB  C12  C  CR6    0   0.106  73.1835  71.1844  -37.1432
 EVB  C13  C  CR6    0   0.278  73.2228  70.2581  -36.0992
 EVB  C14  C  CH2    0  -0.661  74.1165  71.0865  -38.3292
 EVB  C15  C  CH2    0  -0.645  72.5839  64.5670  -35.1902
 EVB  C17  C  CR16   0  -0.313  72.4811  63.1346  -33.1500
 EVB  C18  C  CR6    0  -0.190  73.0459  62.4258  -32.1027
 EVB  C19  C  CR16   0  -0.345  74.4222  62.4367  -31.9368
 EVB  C20  C  CR6    0   0.106  75.2392  63.1578  -32.7967
 EVB  C21  C  CR6    0   0.276  74.6492  63.8718  -33.8425
 EVB  C22  C  CR6    0   0.106  75.3932  71.8803  -38.1536
 EVB  C23  C  CR6    0   0.253  76.5147  71.3677  -37.4933
 EVB  C1   C  CR16   0  -0.340  70.3728  68.0399  -33.9547
 EVB  C2   C  CR6    0   0.134  71.7574  68.1255  -34.0693
 EVB  C3   C  CR6    0   0.241  72.4588  66.9853  -34.4483
 EVB  C4   C  CR6    0   0.145  71.8152  65.7897  -34.7594
 EVB  C5   C  CR16   0  -0.351  70.4331  65.7432  -34.6458
 EVB  C6   C  CR6    0  -0.178  69.7131  66.8554  -34.2309
 EVB  C7   C  CH2    0  -0.676  72.4450  69.4440  -33.8034
 EVB  C8   C  CR6    0   0.103  72.3912  70.3936  -34.9799
 EVB  C9   C  CR16   0  -0.337  71.4965  71.4543  -34.9498
 EVB  C10  C  CR6    0  -0.191  71.4253  72.3708  -35.9890
 EVB  C16  C  CR6    0   0.080  73.2661  63.8595  -34.0396
 EVB  C24  C  CR6    0   0.101  77.6929  72.1127  -37.3790
 EVB  C25  C  CR16   0  -0.322  77.7328  73.3871  -37.9244
 EVB  C26  C  CR6    0  -0.195  76.6267  73.9219  -38.5672
 EVB  C27  C  CR16   0  -0.345  75.4703  73.1663  -38.6769
 EVB  C28  C  CH2    0  -0.663  78.9095  71.5622  -36.6700
 EVB  C29  C  CH2    0  -0.652  76.7379  63.1286  -32.6102
 EVB  C30  C  C      0   0.068  79.9806  71.0217  -37.5914
 EVB  C31  C  C      0   0.252  79.8592  69.7803  -38.2429
 EVB  C32  C  C      0   0.057  80.9008  69.2996  -39.0450
 EVB  C33  C  C1     0  -0.314  82.0418  70.0772  -39.2092
 EVB  C34  C  C      0  -0.199  82.1655  71.3087  -38.5919
 EVB  C35  C  C1     0  -0.339  81.1340  71.7656  -37.7825
 EVB  C36  C  CR6    0   0.102  77.3996  62.0399  -33.4270
 EVB  C37  C  CR16   0  -0.338  77.4506  60.7493  -32.9096
 EVB  C38  C  CR6    0  -0.190  78.0555  59.7186  -33.6078
 EVB  C39  C  CR16   0  -0.330  78.6212  59.9734  -34.8485
 EVB  C40  C  CR6    0   0.110  78.5816  61.2436  -35.4025
 EVB  C41  C  CR6    0   0.265  77.9624  62.2713  -34.6842
 EVB  C42  C  CH2    0  -0.568  80.8099  67.9701  -39.7631
 EVB  C43  C  CH2    0  -0.665  79.2023  61.4859  -36.7580
 EVB  C44  C  CR6    0   0.062  81.9331  67.0258  -39.4198
 EVB  C45  C  CR6    0   0.258  81.9602  66.3784  -38.1737
 EVB  C46  C  CR6    0   0.071  82.9921  65.4926  -37.8517
 EVB  C47  C  CR16   0  -0.336  83.9889  65.2541  -38.7960
 EVB  C48  C  CR6    0  -0.201  83.9734  65.8818  -40.0269
 EVB  C49  C  CR16   0  -0.336  82.9436  66.7671  -40.3297
 EVB  C50  C  CR6    0   0.079  80.6811  61.8009  -36.7083
 EVB  C51  C  CR16   0  -0.335  81.5962  60.7653  -36.8542
 EVB  C52  C  CR6    0  -0.194  82.9619  61.0028  -36.8583
 EVB  C53  C  CR16   0  -0.347  83.4241  62.3035  -36.7314
 EVB  C54  C  CR6    0   0.100  82.5422  63.3664  -36.5855
 EVB  C55  C  CR6    0   0.299  81.1688  63.1030  -36.5487
 EVB  O1   O  OH1    0  -0.645  80.9670  66.6713  -37.3132
 EVB  O2   O  OH1    0  -0.645  78.7671  69.0074  -38.1357
 EVB  O3   O  OH1    0  -0.701  76.5498  70.1224  -36.9670
 EVB  O4   O  OH1    0  -0.699  74.1163  69.2475  -36.2368
 EVB  O5   O  OH1    0  -0.701  73.8320  67.0389  -34.5872
 EVB  O6   O  OH1    0  -0.685  75.4909  64.5460  -34.6716
 EVB  O7   O  OH1    0  -0.708  77.9724  63.5051  -35.2519
 EVB  O8   O  OH1    0  -0.699  80.3511  64.1686  -36.3912
 EVB  S64  S  S      0   1.405  85.2246  65.5486  -41.2598
 EVB  S65  S  S      0   1.404  83.6259  72.3215  -38.7792
 EVB  S66  S  S      0   1.408  76.6785  75.6084  -39.1667
 EVB  S67  S  S      0   1.408  70.2873  73.7506  -35.8781
 EVB  S68  S  S      0   1.411  67.9233  66.7593  -34.1312
 EVB  S69  S  S      0   1.408  72.0006  61.4229  -31.0464
 EVB  S70  S  S      0   1.409  78.0648  58.0474  -32.9638
 EVB  S71  S  S      0   1.407  84.0987  59.6218  -36.9532
 EVB  C72  C  CH2    0  -0.647  83.0704  64.7798  -36.5181
 EVB  O9   O  OS     0  -0.753  85.6903  66.8722  -41.7115
 EVB  O10  O  OS    -1  -0.745  86.2678  64.7661  -40.5728
 EVB  O11  O  OS     0  -0.757  84.5258  64.7972  -42.3182
 EVB  O12  O  OS     0  -0.745  84.5049  71.6005  -39.7173
 EVB  O13  O  OS     0  -0.756  83.1377  73.6099  -39.3042
 EVB  O14  O  OS    -1  -0.758  84.1908  72.4341  -37.4217
 EVB  O15  O  OS     0  -0.745  75.6402  75.6936  -40.2089
 EVB  O16  O  OS    -1  -0.755  76.3851  76.4343  -37.9824
 EVB  O17  O  OS     0  -0.748  78.0467  75.7957  -39.6821
 EVB  O18  O  OS     0  -0.749  68.9954  73.1673  -35.4758
 EVB  O19  O  OS     0  -0.742  70.2671  74.3481  -37.2248
 EVB  O20  O  OS    -1  -0.753  70.8625  74.6348  -34.8498
 EVB  O21  O  OS    -1  -0.740  67.5237  67.7716  -33.1397
 EVB  O22  O  OS     0  -0.742  67.6342  65.3785  -33.7093
 EVB  O23  O  OS     0  -0.751  67.4628  67.0616  -35.4964
 EVB  O24  O  OS     0  -0.747  70.8088  62.2452  -30.7753
 EVB  O25  O  OS    -1  -0.743  72.8048  61.1390  -29.8451
 EVB  O26  O  OS     0  -0.753  71.7036  60.2229  -31.8476
 EVB  O27  O  OS     0  -0.754  76.9596  57.3654  -33.6593
 EVB  O28  O  OS    -1  -0.743  77.8472  58.1801  -31.5128
 EVB  O29  O  OS     0  -0.747  79.3919  57.5104  -33.3133
 EVB  O30  O  OS     0  -0.744  85.3985  60.1914  -37.3506
 EVB  O31  O  OS    -1  -0.756  84.1035  59.0538  -35.5937
 EVB  O32  O  OS     0  -0.749  83.5292  58.7081  -37.9597
 EVB  H1   H  HCR6   0   0.261  72.2326  72.9423  -37.8898
 EVB  H2   H  HCH2   0   0.288  73.5962  71.4887  -39.1991
 EVB  H3   H  HCH2   0   0.281  74.3343  70.0452  -38.5749
 EVB  H4   H  HCH2   0   0.294  71.8788  63.8669  -35.6412
 EVB  H5   H  HCH2   0   0.277  73.2842  64.8137  -35.9901
 EVB  H6   H  HCR6   0   0.264  71.4066  63.1285  -33.2943
 EVB  H7   H  HCR6   0   0.261  74.8767  61.8883  -31.1211
 EVB  H8   H  HCR6   0   0.266  69.8184  68.9149  -33.6378
 EVB  H9   H  HCR6   0   0.264  69.9210  64.8160  -34.8709
 EVB  H10  H  HCH2   0   0.283  73.4765  69.3090  -33.4701
 EVB  H11  H  HCH2   0   0.298  71.9414  69.9271  -32.9654
 EVB  H12  H  HCR6   0   0.262  70.8491  71.5568  -34.0867
 EVB  H13  H  HCR6   0   0.259  78.6463  73.9646  -37.8396
 EVB  H14  H  HCR6   0   0.259  74.6102  73.5673  -39.1993
 EVB  H15  H  HCH2   0   0.281  78.6220  70.8107  -35.9319
 EVB  H16  H  HCH2   0   0.285  79.3557  72.3740  -36.0940
 EVB  H17  H  HCH2   0   0.277  77.1779  64.1056  -32.8174
 EVB  H18  H  HCH2   0   0.288  76.9437  62.9297  -31.5578
 EVB  H19  H  H      0   0.253  82.8432  69.7049  -39.8359
 EVB  H20  H  H      0   0.255  81.2202  72.7203  -37.2759
 EVB  H21  H  HCR6   0   0.261  77.0241  60.5622  -31.9316
 EVB  H22  H  HCR6   0   0.261  79.1013  59.1763  -35.4042
 EVB  H23  H  HCH2   0   0.263  80.8379  68.1551  -40.8400
 EVB  H24  H  HCH2   0   0.267  79.8525  67.4942  -39.5607
 EVB  H25  H  HCH2   0   0.280  78.6580  62.2607  -37.3011
 EVB  H26  H  HCH2   0   0.288  79.0814  60.5772  -37.3488
 EVB  H27  H  HCR6   0   0.257  84.7925  64.5721  -38.5455
 EVB  H28  H  HCR6   0   0.254  82.9163  67.2649  -41.2923
 EVB  H29  H  HCR6   0   0.260  81.2189  59.7577  -36.9863
 EVB  H30  H  HCR6   0   0.257  84.4879  62.5053  -36.7496
 EVB  H31  H  HOH1   0   0.486  80.7559  65.8904  -36.7720
 EVB  H32  H  HOH1   0   0.494  78.0626  69.3847  -37.5812
 EVB  H33  H  HOH1   0   0.504  75.6670  69.7334  -36.7916
 EVB  H34  H  HOH1   0   0.500  74.0681  68.5494  -35.5559
 EVB  H35  H  HOH1   0   0.496  74.2569  67.1958  -33.7316
 EVB  H36  H  HOH1   0   0.489  75.0677  65.3237  -35.0610
 EVB  H37  H  HOH1   0   0.501  77.1739  64.0223  -35.0311
 EVB  H38  H  HOH1   0   0.504  79.4522  63.9394  -36.0795
 EVB  H39  H  HCH2   0   0.282  84.1191  64.7352  -36.2205
 EVB  H40  H  HCH2   0   0.271  82.5679  65.3496  -35.7335

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
 EVB  O11  S64  deloc     1.474  0.020  1.474
 EVB  O9   S64  deloc     1.474  0.020  1.474
 EVB  S64  O10  deloc     1.474  0.020  1.474
 EVB  S64  C48  single    1.788  0.020  1.788
 EVB  O12  S65  deloc     1.474  0.020  1.474
 EVB  O13  S65  deloc     1.474  0.020  1.474
 EVB  C49  C48  aromatic  1.391  0.020  1.391
 EVB  C49  C44  single    1.384  0.020  1.384
 EVB  C48  C47  aromatic  1.382  0.020  1.382
 EVB  C42  C44  single    1.507  0.020  1.507
 EVB  C42  C32  single    1.514  0.020  1.514
 EVB  S65  C34  single    1.787  0.020  1.787
 EVB  S65  O14  deloc     1.475  0.020  1.475
 EVB  C33  C34  aromatic  1.383  0.020  1.383
 EVB  C33  C32  single    1.391  0.020  1.391
 EVB  C44  C45  aromatic  1.405  0.020  1.405
 EVB  C34  C35  aromatic  1.388  0.020  1.388
 EVB  C32  C31  aromatic  1.400  0.020  1.400
 EVB  O15  S66  deloc     1.474  0.020  1.474
 EVB  C47  C46  single    1.394  0.020  1.394
 EVB  O17  S66  deloc     1.474  0.020  1.474
 EVB  C45  C46  aromatic  1.397  0.020  1.397
 EVB  C45  O1   single    1.346  0.020  1.346
 EVB  C35  C30  single    1.386  0.020  1.386
 EVB  C31  O2   single    1.342  0.020  1.342
 EVB  C31  C30  aromatic  1.407  0.020  1.407
 EVB  S66  C26  single    1.791  0.020  1.791
 EVB  S66  O16  deloc     1.473  0.020  1.473
 EVB  C46  C72  single    1.514  0.020  1.514
 EVB  O32  S71  deloc     1.474  0.020  1.474
 EVB  C27  C26  aromatic  1.386  0.020  1.386
 EVB  C27  C22  single    1.390  0.020  1.390
 EVB  C14  C22  single    1.514  0.020  1.514
 EVB  C14  C12  single    1.512  0.020  1.512
 EVB  C26  C25  aromatic  1.387  0.020  1.387
 EVB  C22  C23  aromatic  1.399  0.020  1.399
 EVB  C30  C28  single    1.513  0.020  1.513
 EVB  O30  S71  deloc     1.474  0.020  1.474
 EVB  C25  C24  single    1.387  0.020  1.387
 EVB  C23  C24  aromatic  1.399  0.020  1.399
 EVB  C23  O3   single    1.352  0.020  1.352
 EVB  C24  C28  single    1.512  0.020  1.512
 EVB  S71  C52  single    1.791  0.020  1.791
 EVB  S71  O31  deloc     1.473  0.020  1.473
 EVB  C53  C52  aromatic  1.386  0.020  1.386
 EVB  C53  C54  single    1.389  0.020  1.389
 EVB  C12  C11  single    1.389  0.020  1.389
 EVB  C12  C13  aromatic  1.396  0.020  1.396
 EVB  C52  C51  aromatic  1.386  0.020  1.386
 EVB  C72  C54  single    1.510  0.020  1.510
 EVB  O19  S67  deloc     1.473  0.020  1.473
 EVB  C54  C55  aromatic  1.399  0.020  1.399
 EVB  C11  C10  aromatic  1.384  0.020  1.384
 EVB  C51  C50  single    1.390  0.020  1.390
 EVB  C55  C50  aromatic  1.399  0.020  1.399
 EVB  C55  O8   single    1.352  0.020  1.352
 EVB  C50  C43  single    1.513  0.020  1.513
 EVB  O4   C13  single    1.356  0.020  1.356
 EVB  O23  S68  deloc     1.472  0.020  1.472
 EVB  C43  C40  single    1.510  0.020  1.510
 EVB  C13  C8   aromatic  1.401  0.020  1.401
 EVB  C15  C4   single    1.507  0.020  1.507
 EVB  C15  C16  single    1.513  0.020  1.513
 EVB  C10  S67  single    1.792  0.020  1.792
 EVB  C10  C9   aromatic  1.387  0.020  1.387
 EVB  S67  O18  deloc     1.473  0.020  1.473
 EVB  S67  O20  deloc     1.473  0.020  1.473
 EVB  C4   C5   single    1.388  0.020  1.388
 EVB  C4   C3   aromatic  1.393  0.020  1.393
 EVB  C5   C6   aromatic  1.388  0.020  1.388
 EVB  O5   C3   single    1.381  0.020  1.381
 EVB  O7   C41  single    1.358  0.020  1.358
 EVB  C3   C2   aromatic  1.391  0.020  1.391
 EVB  C8   C9   single    1.388  0.020  1.388
 EVB  C8   C7   single    1.513  0.020  1.513
 EVB  C16  C17  single    1.390  0.020  1.390
 EVB  C16  C21  aromatic  1.397  0.020  1.397
 EVB  C6   S68  single    1.795  0.020  1.795
 EVB  C6   C1   aromatic  1.384  0.020  1.384
 EVB  S68  O22  deloc     1.472  0.020  1.472
 EVB  S68  O21  deloc     1.472  0.020  1.472
 EVB  O6   C21  single    1.360  0.020  1.360
 EVB  C40  C41  aromatic  1.398  0.020  1.398
 EVB  C40  C39  single    1.386  0.020  1.386
 EVB  C2   C1   single    1.392  0.020  1.392
 EVB  C2   C7   single    1.511  0.020  1.511
 EVB  C17  C18  aromatic  1.385  0.020  1.385
 EVB  C21  C20  aromatic  1.397  0.020  1.397
 EVB  C41  C36  aromatic  1.397  0.020  1.397
 EVB  O26  S69  deloc     1.473  0.020  1.473
 EVB  C39  C38  aromatic  1.387  0.020  1.387
 EVB  C18  S69  single    1.793  0.020  1.793
 EVB  C18  C19  aromatic  1.386  0.020  1.386
 EVB  C20  C19  single    1.388  0.020  1.388
 EVB  C20  C29  single    1.510  0.020  1.510
 EVB  S69  O24  deloc     1.473  0.020  1.473
 EVB  S69  O25  deloc     1.473  0.020  1.473
 EVB  C36  C29  single    1.513  0.020  1.513
 EVB  C36  C37  single    1.391  0.020  1.391
 EVB  C38  C37  aromatic  1.384  0.020  1.384
 EVB  C38  S70  single    1.791  0.020  1.791
 EVB  O29  S70  deloc     1.474  0.020  1.474
 EVB  S70  O27  deloc     1.473  0.020  1.473
 EVB  S70  O28  deloc     1.473  0.020  1.473
 EVB  C11  H1   single    0.930  0.020  1.080
 EVB  C14  H2   single    0.970  0.020  1.090
 EVB  C14  H3   single    0.970  0.020  1.090
 EVB  C15  H4   single    0.970  0.020  1.090
 EVB  C15  H5   single    0.970  0.020  1.090
 EVB  C17  H6   single    0.930  0.020  1.080
 EVB  C19  H7   single    0.930  0.020  1.080
 EVB  C1   H8   single    0.930  0.020  1.080
 EVB  C5   H9   single    0.930  0.020  1.080
 EVB  C7   H10  single    0.970  0.020  1.090
 EVB  C7   H11  single    0.970  0.020  1.090
 EVB  C9   H12  single    0.930  0.020  1.080
 EVB  C25  H13  single    0.930  0.020  1.080
 EVB  C27  H14  single    0.930  0.020  1.080
 EVB  C28  H15  single    0.970  0.020  1.090
 EVB  C28  H16  single    0.970  0.020  1.090
 EVB  C29  H17  single    0.970  0.020  1.090
 EVB  C29  H18  single    0.970  0.020  1.090
 EVB  C33  H19  single    0.930  0.020  1.080
 EVB  C35  H20  single    0.930  0.020  1.080
 EVB  C37  H21  single    0.930  0.020  1.080
 EVB  C39  H22  single    0.930  0.020  1.080
 EVB  C42  H23  single    0.970  0.020  1.090
 EVB  C42  H24  single    0.970  0.020  1.090
 EVB  C43  H25  single    0.970  0.020  1.090
 EVB  C43  H26  single    0.970  0.020  1.090
 EVB  C47  H27  single    0.930  0.020  1.080
 EVB  C49  H28  single    0.930  0.020  1.080
 EVB  C51  H29  single    0.930  0.020  1.080
 EVB  C53  H30  single    0.930  0.020  1.080
 EVB  O1   H31  single    0.850  0.020  0.980
 EVB  O2   H32  single    0.850  0.020  0.980
 EVB  O3   H33  single    0.850  0.020  0.980
 EVB  O4   H34  single    0.850  0.020  0.980
 EVB  O5   H35  single    0.850  0.020  0.980
 EVB  O6   H36  single    0.850  0.020  0.980
 EVB  O7   H37  single    0.850  0.020  0.980
 EVB  O8   H38  single    0.850  0.020  0.980
 EVB  C72  H39  single    0.970  0.020  1.090
 EVB  C72  H40  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
 EVB  H1   C11  C10  120.12  3.000
 EVB  H1   C11  C12  118.79  3.000
 EVB  C10  C11  C12  121.08  3.000
 EVB  C14  C12  C13  121.74  3.000
 EVB  C13  C12  C11  118.77  3.000
 EVB  C14  C12  C11  119.48  3.000
 EVB  O4   C13  C8   122.98  3.000
 EVB  C8   C13  C12  121.10  3.000
 EVB  O4   C13  C12  115.92  3.000
 EVB  H3   C14  H2   105.51  3.000
 EVB  H3   C14  C22  110.98  3.000
 EVB  H2   C14  C22  107.55  3.000
 EVB  H3   C14  C12  111.18  3.000
 EVB  H2   C14  C12  107.90  3.000
 EVB  C22  C14  C12  113.30  3.000
 EVB  H5   C15  H4   104.88  3.000
 EVB  H5   C15  C16  111.95  3.000
 EVB  H4   C15  C16  107.80  3.000
 EVB  H5   C15  C4   110.70  3.000
 EVB  H4   C15  C4   108.00  3.000
 EVB  C16  C15  C4   113.07  3.000
 EVB  H6   C17  C16  118.52  3.000
 EVB  H6   C17  C18  120.12  3.000
 EVB  C16  C17  C18  121.36  3.000
 EVB  S69  C18  C19  120.85  3.000
 EVB  C19  C18  C17  119.42  3.000
 EVB  S69  C18  C17  119.61  3.000
 EVB  H7   C19  C20  118.86  3.000
 EVB  H7   C19  C18  120.19  3.000
 EVB  C20  C19  C18  120.95  3.000
 EVB  C29  C20  C21  121.42  3.000
 EVB  C29  C20  C19  119.83  3.000
 EVB  C21  C20  C19  118.73  3.000
 EVB  O6   C21  C16  122.07  3.000
 EVB  O6   C21  C20  116.63  3.000
 EVB  C16  C21  C20  121.28  3.000
 EVB  C27  C22  C23  118.18  3.000
 EVB  C23  C22  C14  122.60  3.000
 EVB  C27  C22  C14  119.22  3.000
 EVB  O3   C23  C24  115.90  3.000
 EVB  O3   C23  C22  122.82  3.000
 EVB  C24  C23  C22  121.25  3.000
 EVB  H8   C1   C6   120.39  3.000
 EVB  H8   C1   C2   118.91  3.000
 EVB  C6   C1   C2   120.70  3.000
 EVB  C7   C2   C3   122.26  3.000
 EVB  C7   C2   C1   119.47  3.000
 EVB  C3   C2   C1   118.26  3.000
 EVB  O5   C3   C4   118.05  3.000
 EVB  O5   C3   C2   119.79  3.000
 EVB  C4   C3   C2   122.09  3.000
 EVB  C5   C4   C3   118.08  3.000
 EVB  C3   C4   C15  121.63  3.000
 EVB  C5   C4   C15  120.29  3.000
 EVB  H9   C5   C6   120.19  3.000
 EVB  H9   C5   C4   118.86  3.000
 EVB  C6   C5   C4   120.95  3.000
 EVB  S68  C6   C5   119.39  3.000
 EVB  S68  C6   C1   120.67  3.000
 EVB  C5   C6   C1   119.88  3.000
 EVB  H11  C7   H10  104.85  3.000
 EVB  H11  C7   C8   107.65  3.000
 EVB  H10  C7   C8   110.39  3.000
 EVB  H11  C7   C2   108.16  3.000
 EVB  H10  C7   C2   112.06  3.000
 EVB  C8   C7   C2   113.25  3.000
 EVB  C9   C8   C7   119.06  3.000
 EVB  C7   C8   C13  122.65  3.000
 EVB  C9   C8   C13  118.29  3.000
 EVB  H12  C9   C10  120.23  3.000
 EVB  H12  C9   C8   118.33  3.000
 EVB  C10  C9   C8   121.44  3.000
 EVB  S67  C10  C9   119.66  3.000
 EVB  C9   C10  C11  119.30  3.000
 EVB  S67  C10  C11  121.00  3.000
 EVB  C21  C16  C17  118.25  3.000
 EVB  C21  C16  C15  123.33  3.000
 EVB  C17  C16  C15  118.41  3.000
 EVB  C28  C24  C25  119.72  3.000
 EVB  C28  C24  C23  121.48  3.000
 EVB  C25  C24  C23  118.79  3.000
 EVB  H13  C25  C26  120.20  3.000
 EVB  H13  C25  C24  118.88  3.000
 EVB  C26  C25  C24  120.92  3.000
 EVB  S66  C26  C27  120.74  3.000
 EVB  C27  C26  C25  119.48  3.000
 EVB  S66  C26  C25  119.70  3.000
 EVB  H14  C27  C26  119.93  3.000
 EVB  H14  C27  C22  118.68  3.000
 EVB  C26  C27  C22  121.38  3.000
 EVB  H16  C28  H15  105.25  3.000
 EVB  H16  C28  C30  107.33  3.000
 EVB  H15  C28  C30  110.62  3.000
 EVB  H16  C28  C24  107.81  3.000
 EVB  H15  C28  C24  110.84  3.000
 EVB  C30  C28  C24  114.47  3.000
 EVB  H18  C29  H17  105.68  3.000
 EVB  H18  C29  C36  107.88  3.000
 EVB  H17  C29  C36  111.42  3.000
 EVB  H18  C29  C20  108.05  3.000
 EVB  H17  C29  C20  111.06  3.000
 EVB  C36  C29  C20  112.40  3.000
 EVB  C35  C30  C31  118.78  3.000
 EVB  C31  C30  C28  122.42  3.000
 EVB  C35  C30  C28  118.78  3.000
 EVB  O2   C31  C32  116.97  3.000
 EVB  O2   C31  C30  122.76  3.000
 EVB  C32  C31  C30  120.27  3.000
 EVB  C42  C32  C33  118.98  3.000
 EVB  C33  C32  C31  119.09  3.000
 EVB  C42  C32  C31  121.92  3.000
 EVB  H19  C33  C34  119.87  3.000
 EVB  H19  C33  C32  118.89  3.000
 EVB  C34  C33  C32  121.24  3.000
 EVB  S65  C34  C35  118.79  3.000
 EVB  C35  C34  C33  119.13  3.000
 EVB  S65  C34  C33  122.07  3.000
 EVB  H20  C35  C34  120.21  3.000
 EVB  H20  C35  C30  118.32  3.000
 EVB  C34  C35  C30  121.47  3.000
 EVB  C41  C36  C37  118.27  3.000
 EVB  C37  C36  C29  118.86  3.000
 EVB  C41  C36  C29  122.87  3.000
 EVB  H21  C37  C38  119.93  3.000
 EVB  H21  C37  C36  118.78  3.000
 EVB  C38  C37  C36  121.28  3.000
 EVB  S70  C38  C39  119.40  3.000
 EVB  S70  C38  C37  121.04  3.000
 EVB  C39  C38  C37  119.52  3.000
 EVB  H22  C39  C40  118.79  3.000
 EVB  H22  C39  C38  120.28  3.000
 EVB  C40  C39  C38  120.93  3.000
 EVB  C43  C40  C41  121.67  3.000
 EVB  C41  C40  C39  118.74  3.000
 EVB  C43  C40  C39  119.60  3.000
 EVB  O7   C41  C40  116.72  3.000
 EVB  C40  C41  C36  121.26  3.000
 EVB  O7   C41  C36  121.99  3.000
 EVB  H24  C42  H23  106.25  3.000
 EVB  H24  C42  C44  109.84  3.000
 EVB  H23  C42  C44  108.15  3.000
 EVB  H24  C42  C32  110.41  3.000
 EVB  H23  C42  C32  108.49  3.000
 EVB  C44  C42  C32  113.43  3.000
 EVB  H26  C43  H25  105.46  3.000
 EVB  H26  C43  C50  107.44  3.000
 EVB  H25  C43  C50  110.85  3.000
 EVB  H26  C43  C40  107.88  3.000
 EVB  H25  C43  C40  110.82  3.000
 EVB  C50  C43  C40  113.93  3.000
 EVB  C49  C44  C45  118.88  3.000
 EVB  C45  C44  C42  120.35  3.000
 EVB  C49  C44  C42  120.76  3.000
 EVB  O1   C45  C46  122.37  3.000
 EVB  O1   C45  C44  116.90  3.000
 EVB  C46  C45  C44  120.72  3.000
 EVB  C72  C46  C47  118.64  3.000
 EVB  C72  C46  C45  122.65  3.000
 EVB  C47  C46  C45  118.71  3.000
 EVB  H27  C47  C48  120.01  3.000
 EVB  H27  C47  C46  118.79  3.000
 EVB  C48  C47  C46  121.19  3.000
 EVB  S64  C48  C49  119.11  3.000
 EVB  C49  C48  C47  119.42  3.000
 EVB  S64  C48  C47  121.45  3.000
 EVB  H28  C49  C48  120.27  3.000
 EVB  H28  C49  C44  118.65  3.000
 EVB  C48  C49  C44  121.08  3.000
 EVB  C55  C50  C51  118.42  3.000
 EVB  C55  C50  C43  122.56  3.000
 EVB  C51  C50  C43  119.01  3.000
 EVB  H29  C51  C52  120.12  3.000
 EVB  H29  C51  C50  118.44  3.000
 EVB  C52  C51  C50  121.42  3.000
 EVB  S71  C52  C53  121.11  3.000
 EVB  C53  C52  C51  119.28  3.000
 EVB  S71  C52  C51  119.56  3.000
 EVB  H30  C53  C54  118.88  3.000
 EVB  H30  C53  C52  120.05  3.000
 EVB  C54  C53  C52  121.07  3.000
 EVB  C72  C54  C55  121.22  3.000
 EVB  C55  C54  C53  118.82  3.000
 EVB  C72  C54  C53  119.92  3.000
 EVB  O8   C55  C54  116.64  3.000
 EVB  O8   C55  C50  122.39  3.000
 EVB  C54  C55  C50  120.95  3.000
 EVB  H31  O1   C45  109.93  3.000
 EVB  H32  O2   C31  114.29  3.000
 EVB  H33  O3   C23  114.30  3.000
 EVB  H34  O4   C13  115.44  3.000
 EVB  H35  O5   C3   110.72  3.000
 EVB  H36  O6   C21  111.91  3.000
 EVB  H37  O7   C41  112.37  3.000
 EVB  H38  O8   C55  114.08  3.000
 EVB  O11  S64  O10  113.55  3.000
 EVB  O10  S64  O9   113.33  3.000
 EVB  O11  S64  O9   112.80  3.000
 EVB  O10  S64  C48  105.83  3.000
 EVB  O9   S64  C48  105.37  3.000
 EVB  O11  S64  C48  104.97  3.000
 EVB  O14  S65  O13  112.83  3.000
 EVB  O14  S65  O12  113.26  3.000
 EVB  O13  S65  O12  113.47  3.000
 EVB  O14  S65  C34  105.06  3.000
 EVB  O13  S65  C34  105.19  3.000
 EVB  O12  S65  C34  106.07  3.000
 EVB  O17  S66  O16  113.24  3.000
 EVB  O16  S66  O15  113.32  3.000
 EVB  O17  S66  O15  113.54  3.000
 EVB  O16  S66  C26  104.66  3.000
 EVB  O17  S66  C26  105.28  3.000
 EVB  O15  S66  C26  105.72  3.000
 EVB  O20  S67  O19  113.58  3.000
 EVB  O20  S67  O18  112.92  3.000
 EVB  O19  S67  O18  113.45  3.000
 EVB  O20  S67  C10  104.92  3.000
 EVB  O18  S67  C10  105.60  3.000
 EVB  O19  S67  C10  105.33  3.000
 EVB  O23  S68  O22  113.38  3.000
 EVB  O22  S68  O21  113.49  3.000
 EVB  O23  S68  O21  113.48  3.000
 EVB  O21  S68  C6   105.74  3.000
 EVB  O22  S68  C6   105.18  3.000
 EVB  O23  S68  C6   104.44  3.000
 EVB  O26  S69  O25  113.36  3.000
 EVB  O25  S69  O24  113.53  3.000
 EVB  O26  S69  O24  113.06  3.000
 EVB  O25  S69  C18  105.66  3.000
 EVB  O24  S69  C18  105.54  3.000
 EVB  O26  S69  C18  104.64  3.000
 EVB  O29  S70  O28  113.54  3.000
 EVB  O28  S70  O27  113.32  3.000
 EVB  O29  S70  O27  113.26  3.000
 EVB  O28  S70  C38  105.63  3.000
 EVB  O27  S70  C38  104.97  3.000
 EVB  O29  S70  C38  105.04  3.000
 EVB  O32  S71  O31  113.11  3.000
 EVB  O31  S71  O30  113.26  3.000
 EVB  O32  S71  O30  113.35  3.000
 EVB  O31  S71  C52  104.50  3.000
 EVB  O30  S71  C52  106.03  3.000
 EVB  O32  S71  C52  105.60  3.000
 EVB  H40  C72  H39  105.52  3.000
 EVB  H40  C72  C54  111.06  3.000
 EVB  H39  C72  C54  108.06  3.000
 EVB  H40  C72  C46  111.31  3.000
 EVB  H39  C72  C46  108.01  3.000
 EVB  C54  C72  C46  112.53  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
 EVB  CONST_01   C8   C13  C12  C11     0.00   0.0  0
 EVB  CONST_02   C8   C9   C10  C11     0.00   0.0  0
 EVB  CONST_03   C9   C10  C11  C12     0.00   0.0  0
 EVB  CONST_04   C9   C8   C13  C12     0.00   0.0  0
 EVB  CONST_05   C10  C11  C12  C13     0.00   0.0  0
 EVB  CONST_06   C10  C9   C8   C13     0.00   0.0  0
 EVB  CONST_07   C20  C21  C16  C17     0.00   0.0  0
 EVB  CONST_08   C20  C19  C18  C17     0.00   0.0  0
 EVB  CONST_09   C21  C16  C17  C18     0.00   0.0  0
 EVB  CONST_10   C21  C20  C19  C18     0.00   0.0  0
 EVB  CONST_11   C16  C17  C18  C19     0.00   0.0  0
 EVB  CONST_12   C16  C21  C20  C19     0.00   0.0  0
 EVB  CONST_13   C25  C26  C27  C22     0.00   0.0  0
 EVB  CONST_14   C25  C24  C23  C22     0.00   0.0  0
 EVB  CONST_15   C26  C27  C22  C23     0.00   0.0  0
 EVB  CONST_16   C26  C25  C24  C23     0.00   0.0  0
 EVB  CONST_17   C4   C5   C6   C1      0.00   0.0  0
 EVB  CONST_18   C4   C3   C2   C1      0.00   0.0  0
 EVB  CONST_19   C5   C4   C3   C2      0.00   0.0  0
 EVB  CONST_20   C5   C6   C1   C2      0.00   0.0  0
 EVB  CONST_21   C6   C5   C4   C3      0.00   0.0  0
 EVB  CONST_22   C6   C1   C2   C3      0.00   0.0  0
 EVB  CONST_23   C27  C26  C25  C24     0.00   0.0  0
 EVB  CONST_24   C27  C22  C23  C24     0.00   0.0  0
 EVB  CONST_25   C33  C34  C35  C30     0.00   0.0  0
 EVB  CONST_26   C33  C32  C31  C30     0.00   0.0  0
 EVB  CONST_27   C34  C33  C32  C31     0.00   0.0  0
 EVB  CONST_28   C34  C35  C30  C31     0.00   0.0  0
 EVB  CONST_29   C35  C34  C33  C32     0.00   0.0  0
 EVB  CONST_30   C35  C30  C31  C32     0.00   0.0  0
 EVB  CONST_31   C39  C40  C41  C36     0.00   0.0  0
 EVB  CONST_32   C39  C38  C37  C36     0.00   0.0  0
 EVB  CONST_33   C40  C41  C36  C37     0.00   0.0  0
 EVB  CONST_34   C40  C39  C38  C37     0.00   0.0  0
 EVB  CONST_35   C41  C40  C39  C38     0.00   0.0  0
 EVB  CONST_36   C41  C36  C37  C38     0.00   0.0  0
 EVB  CONST_37   C47  C48  C49  C44     0.00   0.0  0
 EVB  CONST_38   C47  C46  C45  C44     0.00   0.0  0
 EVB  CONST_39   C48  C49  C44  C45     0.00   0.0  0
 EVB  CONST_40   C48  C47  C46  C45     0.00   0.0  0
 EVB  CONST_41   C49  C48  C47  C46     0.00   0.0  0
 EVB  CONST_42   C49  C44  C45  C46     0.00   0.0  0
 EVB  CONST_43   C53  C52  C51  C50     0.00   0.0  0
 EVB  CONST_44   C53  C54  C55  C50     0.00   0.0  0
 EVB  CONST_45   C54  C53  C52  C51     0.00   0.0  0
 EVB  CONST_46   C54  C55  C50  C51     0.00   0.0  0
 EVB  CONST_47   C55  C54  C53  C52     0.00   0.0  0
 EVB  CONST_48   C55  C50  C51  C52     0.00   0.0  0
 EVB  CONST_49   O4   C13  C12  C11   180.00   0.0  0
 EVB  CONST_50   S67  C10  C11  C12   180.00   0.0  0
 EVB  CONST_51   O3   C23  C22  C14     0.00   0.0  0
 EVB  CONST_52   O4   C13  C12  C14     0.00   0.0  0
 EVB  CONST_53   O5   C3   C4   C15     0.00   0.0  0
 EVB  CONST_54   O6   C21  C16  C15     0.00   0.0  0
 EVB  CONST_55   O6   C21  C16  C17   180.00   0.0  0
 EVB  CONST_56   O6   C21  C20  C19   180.00   0.0  0
 EVB  CONST_57   S69  C18  C19  C20   180.00   0.0  0
 EVB  CONST_58   S66  C26  C27  C22   180.00   0.0  0
 EVB  CONST_59   O5   C3   C2   C1    180.00   0.0  0
 EVB  CONST_60   S68  C6   C1   C2    180.00   0.0  0
 EVB  CONST_61   S68  C6   C5   C4    180.00   0.0  0
 EVB  CONST_62   O5   C3   C4   C5    180.00   0.0  0
 EVB  CONST_63   O4   C13  C8   C7      0.00   0.0  0
 EVB  CONST_64   O5   C3   C2   C7      0.00   0.0  0
 EVB  CONST_65   S67  C10  C9   C8    180.00   0.0  0
 EVB  CONST_66   O4   C13  C8   C9    180.00   0.0  0
 EVB  CONST_67   S69  C18  C17  C16   180.00   0.0  0
 EVB  CONST_68   S66  C26  C25  C24   180.00   0.0  0
 EVB  CONST_69   O3   C23  C24  C25   180.00   0.0  0
 EVB  CONST_70   O3   C23  C22  C27   180.00   0.0  0
 EVB  CONST_71   O2   C31  C30  C28     0.00   0.0  0
 EVB  CONST_72   O3   C23  C24  C28     0.00   0.0  0
 EVB  CONST_73   O6   C21  C20  C29     0.00   0.0  0
 EVB  CONST_74   O7   C41  C36  C29     0.00   0.0  0
 EVB  CONST_75   S65  C34  C35  C30   180.00   0.0  0
 EVB  CONST_76   S65  C34  C33  C32   180.00   0.0  0
 EVB  CONST_77   O2   C31  C32  C33   180.00   0.0  0
 EVB  CONST_78   O2   C31  C30  C35   180.00   0.0  0
 EVB  CONST_79   S70  C38  C37  C36   180.00   0.0  0
 EVB  CONST_80   O7   C41  C36  C37   180.00   0.0  0
 EVB  CONST_81   O7   C41  C40  C39   180.00   0.0  0
 EVB  CONST_82   S70  C38  C39  C40   180.00   0.0  0
 EVB  CONST_83   O1   C45  C44  C42     0.00   0.0  0
 EVB  CONST_84   O2   C31  C32  C42     0.00   0.0  0
 EVB  CONST_85   O8   C55  C50  C43     0.00   0.0  0
 EVB  CONST_86   O7   C41  C40  C43     0.00   0.0  0
 EVB  CONST_87   S64  C48  C49  C44   180.00   0.0  0
 EVB  CONST_88   S64  C48  C47  C46   180.00   0.0  0
 EVB  CONST_89   O1   C45  C46  C47   180.00   0.0  0
 EVB  CONST_90   O1   C45  C44  C49   180.00   0.0  0
 EVB  CONST_91   S71  C52  C51  C50   180.00   0.0  0
 EVB  CONST_92   O8   C55  C50  C51   180.00   0.0  0
 EVB  CONST_93   O8   C55  C54  C53   180.00   0.0  0
 EVB  CONST_94   S71  C52  C53  C54   180.00   0.0  0
 EVB  CONST_95   C72  C46  C45  O1      0.00   0.0  0
 EVB  CONST_96   C72  C54  C55  O8      0.00   0.0  0
 EVB  CONST_97   H12  C9   C10  C11   180.00   0.0  0
 EVB  CONST_98   H1   C11  C12  C13   180.00   0.0  0
 EVB  CONST_99   H14  C27  C22  C14     0.00   0.0  0
 EVB  CONST_100  H9   C5   C4   C15     0.00   0.0  0
 EVB  CONST_101  H6   C17  C16  C15     0.00   0.0  0
 EVB  CONST_102  H7   C19  C18  C17   180.00   0.0  0
 EVB  CONST_103  H13  C25  C24  C23   180.00   0.0  0
 EVB  CONST_104  H8   C1   C2   C3    180.00   0.0  0
 EVB  CONST_105  H20  C35  C30  C28     0.00   0.0  0
 EVB  CONST_106  H21  C37  C36  C29     0.00   0.0  0
 EVB  CONST_107  H19  C33  C32  C31   180.00   0.0  0
 EVB  CONST_108  H22  C39  C38  C37   180.00   0.0  0
 EVB  CONST_109  H28  C49  C44  C42     0.00   0.0  0
 EVB  CONST_110  H29  C51  C50  C43     0.00   0.0  0
 EVB  CONST_111  H27  C47  C46  C45   180.00   0.0  0
 EVB  CONST_112  H30  C53  C52  C51   180.00   0.0  0
 EVB  Var_01     C22  C14  C12  C11    86.82  30.0  1
 EVB  Var_02     C27  C22  C14  C12   -95.47  30.0  1
 EVB  Var_03     C2   C7   C8   C13   -77.47  30.0  1
 EVB  Var_04     C4   C15  C16  C17    73.17  30.0  1
 EVB  Var_05     C36  C29  C20  C19    92.03  30.0  1
 EVB  Var_06     C41  C36  C29  C20    95.81  30.0  1
 EVB  Var_07     C30  C28  C24  C23   100.39  30.0  1
 EVB  Var_08     C8   C7   C2   C1    -80.87  30.0  1
 EVB  Var_09     C16  C15  C4   C3     76.54  30.0  1
 EVB  Var_10     C35  C30  C28  C24   105.28  30.0  1
 EVB  Var_11     C44  C42  C32  C31  -123.43  30.0  1
 EVB  Var_12     C49  C44  C42  C32  -106.87  30.0  1
 EVB  Var_13     C50  C43  C40  C39   -86.35  30.0  1
 EVB  Var_14     C51  C50  C43  C40    93.48  30.0  1
 EVB  Var_15     C54  C72  C46  C45    98.72  30.0  1
 EVB  Var_16     C53  C54  C72  C46    97.86  30.0  1
 EVB  Var_17     O19  S67  C10  C11    13.70  30.0  2
 EVB  Var_18     O26  S69  C18  C17    76.14  30.0  2
 EVB  Var_19     O23  S68  C6   C1     92.15  30.0  2
 EVB  Var_20     O15  S66  C26  C25   158.50  30.0  2
 EVB  Var_21     O12  S65  C34  C33     2.91  30.0  3
 EVB  Var_22     O29  S70  C38  C37  -141.87  30.0  2
 EVB  Var_23     O11  S64  C48  C47   109.76  30.0  2
 EVB  Var_24     O32  S71  C52  C51    42.52  30.0  2

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
 EVB  plan-1  C11  0.020
 EVB  plan-1  C12  0.020
 EVB  plan-1  C13  0.020
 EVB  plan-1  C14  0.020
 EVB  plan-1  C7   0.020
 EVB  plan-1  C8   0.020
 EVB  plan-1  C9   0.020
 EVB  plan-1  C10  0.020
 EVB  plan-1  O4   0.020
 EVB  plan-1  S67  0.020
 EVB  plan-1  H1   0.020
 EVB  plan-1  H12  0.020
 EVB  plan-2  C15  0.020
 EVB  plan-2  C1   0.020
 EVB  plan-2  C2   0.020
 EVB  plan-2  C3   0.020
 EVB  plan-2  C4   0.020
 EVB  plan-2  C5   0.020
 EVB  plan-2  C6   0.020
 EVB  plan-2  C7   0.020
 EVB  plan-2  O5   0.020
 EVB  plan-2  S68  0.020
 EVB  plan-2  H8   0.020
 EVB  plan-2  H9   0.020
 EVB  plan-3  C15  0.020
 EVB  plan-3  C17  0.020
 EVB  plan-3  C18  0.020
 EVB  plan-3  C19  0.020
 EVB  plan-3  C20  0.020
 EVB  plan-3  C21  0.020
 EVB  plan-3  C16  0.020
 EVB  plan-3  C29  0.020
 EVB  plan-3  O6   0.020
 EVB  plan-3  S69  0.020
 EVB  plan-3  H6   0.020
 EVB  plan-3  H7   0.020
 EVB  plan-4  C14  0.020
 EVB  plan-4  C22  0.020
 EVB  plan-4  C23  0.020
 EVB  plan-4  C24  0.020
 EVB  plan-4  C25  0.020
 EVB  plan-4  C26  0.020
 EVB  plan-4  C27  0.020
 EVB  plan-4  C28  0.020
 EVB  plan-4  O3   0.020
 EVB  plan-4  S66  0.020
 EVB  plan-4  H13  0.020
 EVB  plan-4  H14  0.020
 EVB  plan-5  C28  0.020
 EVB  plan-5  C30  0.020
 EVB  plan-5  C31  0.020
 EVB  plan-5  C32  0.020
 EVB  plan-5  C33  0.020
 EVB  plan-5  C34  0.020
 EVB  plan-5  C35  0.020
 EVB  plan-5  C42  0.020
 EVB  plan-5  O2   0.020
 EVB  plan-5  S65  0.020
 EVB  plan-5  H19  0.020
 EVB  plan-5  H20  0.020
 EVB  plan-6  C29  0.020
 EVB  plan-6  C36  0.020
 EVB  plan-6  C37  0.020
 EVB  plan-6  C38  0.020
 EVB  plan-6  C39  0.020
 EVB  plan-6  C40  0.020
 EVB  plan-6  C41  0.020
 EVB  plan-6  C43  0.020
 EVB  plan-6  O7   0.020
 EVB  plan-6  S70  0.020
 EVB  plan-6  H21  0.020
 EVB  plan-6  H22  0.020
 EVB  plan-7  C42  0.020
 EVB  plan-7  C44  0.020
 EVB  plan-7  C45  0.020
 EVB  plan-7  C46  0.020
 EVB  plan-7  C47  0.020
 EVB  plan-7  C48  0.020
 EVB  plan-7  C49  0.020
 EVB  plan-7  O1   0.020
 EVB  plan-7  S64  0.020
 EVB  plan-7  C72  0.020
 EVB  plan-7  H27  0.020
 EVB  plan-7  H28  0.020
 EVB  plan-8  C43  0.020
 EVB  plan-8  C50  0.020
 EVB  plan-8  C51  0.020
 EVB  plan-8  C52  0.020
 EVB  plan-8  C53  0.020
 EVB  plan-8  C54  0.020
 EVB  plan-8  C55  0.020
 EVB  plan-8  O8   0.020
 EVB  plan-8  S71  0.020
 EVB  plan-8  C72  0.020
 EVB  plan-8  H29  0.020
 EVB  plan-8  H30  0.020

