scripts/cif2cod: tests/cases/cif2cod_009.inp data_1001012: WARNING, no Hermann-Mauguin space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_009.inp data_1001012: WARNING, no Hall space group symbol found.
scripts/cif2cod: tests/cases/cif2cod_009.inp data_1001012: WARNING, at least one of the lattice parameters has an undefined value -- cell volume could not be calculated.
scripts/cif2cod: tests/cases/cif2cod_009.inp data_1001012: WARNING, data item '_cell_formula_units_Z' was not found -- the Z value will be estimated.
scripts/cif2cod: tests/cases/cif2cod_009.inp data_1001012: WARNING, not enough data to estimate Z; cell volume undefined; crystal density undefined; molecular weight undefined -- assuming Z = 1.
scripts/cif2cod: tests/cases/cif2cod_009.inp data_1001012: WARNING, summary formula could not be calculated -- cell length data item '_cell_length_a' was not found.
scripts/cif2cod: tests/cases/cif2cod_009.inp data_1001012: WARNING, unit cell summary formula could not be calculated -- cell length data item '_cell_length_a' was not found.
file;a;siga;b;sigb;c;sigc;alpha;sigalpha;beta;sigbeta;gamma;siggamma;vol;sigvol;celltemp;sigcelltemp;diffrtemp;sigdiffrtemp;cellpressure;sigcellpressure;diffrpressure;sigdiffrpressure;thermalhist;pressurehist;compoundsource;nel;sg;sgHall;commonname;chemname;mineral;formula;calcformula;cellformula;Z;Zprime;acce_code;authors;title;journal;year;volume;issue;firstpage;lastpage;doi;method;radiation;wavelength;radType;radSymbol;Rall;Robs;Rref;wRall;wRobs;wRref;RFsqd;RI;gofall;gofobs;gofgt;gofref;duplicateof;optimal;status;flags;text;onhold
"1001012";NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;"4";NULL;NULL;NULL;"CALCIUM NITRATE DIHYDRATE";NULL;"- H4 Ca N2 O8 -";NULL;NULL;NULL;NULL;NULL;"Leclaire, A; Monier, J C";"Transformation orientee de l'hydrate (H~2~ O)~2~ $-beta en hydrate (H~2~ O)~2~ $-alpha du nitrate de calcium. Interpretation structurale des formes cristallines des deux hydrates";"Acta Crystallographica A (24,1968-38,1982)";"1977";"33";NULL;"717";"722";NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;NULL;"";"Leclaire, A; Monier, J C\nTransformation orientee de l'hydrate (H~2~ O)~2~ $-beta en hydrate (H~2~ O)~2~ $-alpha du nitrate de calcium. Interpretation structurale des formes cristallines des deux hydrates\nActa Crystallographica A (24,1968-38,1982)\n33\n(1977)\n717-722";NULL
