======== 0: 37 warnings for c:/temp/iupac/henry/v_acs/icl-ifd/v_acs ! WARNING: local source directory does not exist (ignored): https://doi.org/10.14469/hpc/10386 -- Extractor.phase1CheckSource ! DefaultStructureHelper WARNING: SMILES could not be created for 73/73.cdxml MF=H 76 C 44 N 4 O 13 U 1 ! WARNING: 11/11-X-ray/AB2238_x.cif property IFD.property.structure.molecular_formula can't set value 'H 72 C 56 N 8 O 20 Na 3', as it is already set to 'H 19 C 14 N 2 O 6 Na 1' from 11/11.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 12/12-X-ray/AB2120_x.cif property IFD.property.structure.molecular_formula can't set value 'H 22 C 24 N 4 O 9 Na 2', as it is already set to 'H 15 C 12 N 2 O 5 Na 1' from 12/12.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 14/14-X-ray/AB2204_x.cif property IFD.property.structure.molecular_formula can't set value 'H 60 C 48 N 16 O 24 Na 4', as it is already set to 'H 7 C 6 N 2 O 3 Na 1' from 14/14.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 15/15-X-ray/AB2111.cif property IFD.property.structure.molecular_formula can't set value 'H 38 C 30 N 4 O 10 Mg 1', as it is already set to 'H 42 C 32 N 4 O 10 Mg 1' from 15/15.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 15/15-X-ray/AB2111.cif property IFD.property.structure.empirical_formula can't set value 'H 38 C 30 N 4 O 10 Mg 1', as it is already set to 'H 42 C 32 N 4 O 10 Mg 1' from 15/15-solvate-X-ray/AB2118b.cif -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 15/15-X-ray/AB2111.cif property IFD.property.structure.cell_formula can't set value 'H 38 C 30 N 4 O 10 Mg 1', as it is already set to 'H 42 C 32 N 4 O 10 Mg 1' from 15/15-solvate-X-ray/AB2118b.cif -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 19/19-X-ray/AB2119_x.cif property IFD.property.structure.molecular_formula can't set value 'H 21 C 16 N 2 O 5 Ca 1', as it is already set to 'H 42 C 32 N 4 O 10 Ca 1' from 19/19.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 20/20-X-ray/AB2117_x.cif property IFD.property.structure.molecular_formula can't set value 'H 60 C 52 N 8 O 16 Ca 2', as it is already set to 'H 29 C 26 N 4 O 8 Ca 1' from 20/20.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 21/21-X-ray/AB2144_x.cif property IFD.property.structure.molecular_formula can't set value 'H 21 C 20 N 2 O 4 Ca 1', as it is already set to 'H 42 C 40 N 4 O 8 Ca 1' from 21/21.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 24/24-X-ray/AB2123_x.cif property IFD.property.structure.molecular_formula can't set value 'H 35 C 36 N 6 O 10 Sc 1', as it is already set to 'H 34 C 36 N 6 O 10 Sc 1' from 24/24.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 28/28-X-ray/AB2218_x.cif property IFD.property.structure.molecular_formula can't set value 'H 41 C 38 N 6 O 11 Y 1', as it is already set to 'H 35 C 36 N 6 O 11 Y 1' from 28/28.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 34/34-X-Ray/AB2124_x.cif property IFD.property.structure.molecular_formula can't set value 'H 45 C 49 N 8 O 12 Cl 3 Zr 1', as it is already set to 'H 44 C 48 N 8 O 12 Zr 1' from 34/34.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 37/37-X-ray/AB2149_x.cif property IFD.property.structure.molecular_formula can't set value 'H 35 C 33 N 4 O 8 Cl 1 Zr 1', as it is already set to 'H 39 C 33 N 4 O 8 Cl 1 Zr 1' from 37/37.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 38/38-X-ray/AB2157_x.cif property IFD.property.structure.molecular_formula can't set value 'H 54 C 58 N 8 O 13 Zr 2', as it is already set to 'H 62 C 58 N 8 O 13 Zr 2' from 38/38.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 39/39b-X-ray/AB2143_x.cif property IFD.property.structure.molecular_formula can't set value 'H 44 C 36 N 4 O 16 Rh 2', as it is already set to 'H 50 C 38 N 4 O 16 Rh 2' from 39/39.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 39/39-X-ray/AB2146_x.cif property IFD.property.structure.molecular_formula can't set value 'H 49 C 42 N 4 O 16 Cl 1 Rh 2', as it is already set to 'H 50 C 38 N 4 O 16 Rh 2' from 39/39.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 39/39-X-ray/AB2146_x.cif property IFD.property.structure.empirical_formula can't set value '?', as it is already set to 'H 22 C 18 N 2 O 8 Rh 1' from 39/39b-X-ray/AB2143_x.cif -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 39/39-X-ray/AB2146_x.cif property IFD.property.structure.cell_formula can't set value '?', as it is already set to 'H 44 C 36 N 4 O 16 Rh 2' from 39/39b-X-ray/AB2143_x.cif -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 40/40-X-ray/AB2130_x.cif property IFD.property.structure.molecular_formula can't set value 'H 36 C 32 N 4 O 14 Rh 2', as it is already set to 'H 12 C 8 O 8 Rh 2' from 40/40.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 49/49-X-ray/AB2133b_x.cif property IFD.property.structure.molecular_formula can't set value 'H 60 C 56 N 8 O 16 Zn 4', as it is already set to 'H 21 C 14 N 4 O 6 Zn 1' from 49/49.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 53/53-X-ray/AB2208_x.cif property IFD.property.structure.molecular_formula can't set value 'H 40 C 38 N 6 O 8 Cu 1', as it is already set to 'H 42 C 32 N 4 O 10 Cu 1' from 53/53.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 54/54-X-ray/AB2153_x.cif property IFD.property.structure.molecular_formula can't set value 'H 44 C 48 N 8 O 12 Cu 4', as it is already set to 'H 11 C 12 N 2 O 3 Cu 1' from 54/54.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 55/55-X-ray/AB2246_x.cif property IFD.property.structure.molecular_formula can't set value 'H 60 C 72 N 8 O 12 Cu 2', as it is already set to 'H 15 C 18 N 2 O 3 Cu 1' from 55/55.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 56/56-X-ray/AB2226_x.cif property IFD.property.structure.molecular_formula can't set value 'H 24 C 22 N 6 O 6 Cu 1', as it is already set to 'H 26 C 16 N 4 O 8 Cu 1' from 56/56.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 57/57-x-ray/AB2212_x.cif property IFD.property.structure.molecular_formula can't set value 'H 40 C 38 N 6 O 8 Ni 1', as it is already set to 'H 42 C 32 N 4 O 10 Ni 1' from 57/57.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 58/58-X-ray/AB2237_x.cif property IFD.property.structure.molecular_formula can't set value 'H 32 C 34 N 6 O 6 Ni 1', as it is already set to 'H 34 C 28 N 4 O 8 Ni 1' from 58/58.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 60/60-X-ray/AB2241_x.cif property IFD.property.structure.molecular_formula can't set value 'H 24 C 22 N 6 O 6 Ni 1', as it is already set to 'H 26 C 16 N 4 O 8 Ni 1' from 60/60.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 61/61-X-Ray/AB2223_x.cif property IFD.property.structure.molecular_formula can't set value 'H 52 C 56 N 8 O 16 Na 3 La 2', as it is already set to 'H 60 C 56 N 8 O 16 La 1' from 61/61.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 62/62-X-Ray/AB2151_x.cif property IFD.property.structure.molecular_formula can't set value 'H 41 C 38 N 6 O 11 La 1', as it is already set to 'H 35 C 36 N 6 O 11 La 1' from 62/62.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 65/65-X-ray/AB2222_x.cif property IFD.property.structure.molecular_formula can't set value 'H 52 C 56 N 8 O 16 Na 3 Dy 2', as it is already set to 'H 60 C 56 N 8 O 16 Dy 1' from 65/65.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 66/66-X-ray/AB2202_x.cif property IFD.property.structure.molecular_formula can't set value 'H 37 C 36 N 6 O 11 Dy 1', as it is already set to 'H 33 C 36 N 6 O 9 Dy 1' from 66/66.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 70/70-X-ray/AB2205_x.cif property IFD.property.structure.molecular_formula can't set value 'H 41 C 38 N 6 O 11 Yb 1', as it is already set to 'H 33 C 36 N 6 O 9 Yb 1' from 70/70.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 73/73-x-ray/AB2301.cif property IFD.property.structure.molecular_formula can't set value 'H 70 C 60 N 8 O 23 U 2', as it is already set to 'H 76 C 44 N 4 O 13 U 1' from 73/73.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 74/74-x-ray/LBTML2.cif property IFD.property.structure.molecular_formula can't set value 'H 27 C 29 N 5 O 8 U 1', as it is already set to 'H 44 C 32 N 5 O 9 U 1' from 74/74.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive ! WARNING: 76/76-x-ray/LB-UO2L4.cif property IFD.property.structure.molecular_formula can't set value 'H 19 C 17 N 5 O 8 U 1', as it is already set to 'H 29 C 17 N 5 O 8 U 1' from 76/76.cdxml -- Extractor.setPropertyIfNotAlreadySet Archive 37 warnings