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State	Conformation	minimum conformation	conformer description	state description
1	1	yes	CS	¹A^'
1	2	no	CS	¹A^'

	hartrees
Energy at 0K	-189.814184
Energy at 298.15K	-189.816854
HF Energy	-189.814184
Nuclear repulsion energy	69.420711

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3560	3548	40.08	89.98	0.17	0.29
2	A'	2960	2950	43.70	140.70	0.26	0.41
3	A'	1729	1723	334.03	15.07	0.10	0.19
4	A'	1358	1353	1.39	5.29	0.69	0.81
5	A'	1250	1245	2.76	2.25	0.27	0.42
6	A'	1051	1047	249.40	2.75	0.39	0.56
7	A'	601	599	33.58	4.03	0.31	0.48
8	A"	1001	998	4.18	1.29	0.75	0.86
9	A"	664	662	123.86	0.63	0.75	0.86

All results from a given calculation for HCOOH (Formic acid)

using model chemistry: BLYP/aug-cc-pVTZ

States and conformations

Conformer 1 (CS)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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