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	hartrees
Energy at 0K	-189.335439
Energy at 298.15K
HF Energy	-188.788935
Nuclear repulsion energy	69.453800

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3812	3812	59.34
2	A'	3032	3032	63.56
3	A'	1841	1841	283.32
4	A'	1415	1415	0.31
5	A'	1301	1301	290.46
6	A'	1106	1106	67.01
7	A'	651	651	9.83
8	A"	1028	1028	0.02
9	A"	508	508	83.34

Atom	x (Å)	y (Å)
C1	0.000	0.390
O2	-0.905	-0.629
O3	1.188	0.194
H4	-0.462	1.399
H5	-1.798	-0.257

	C1	O2	O3	H4	H5
C1		1.3629	1.2038	1.1103	1.9112
O2	1.3629		2.2490	2.0762	0.9674
O3	1.2038	2.2490		2.0433	3.0200
H4	1.1103	2.0762	2.0433		2.1284
H5	1.9112	0.9674	3.0200	2.1284

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	O2	H5	109.022		O2	C1	O3	122.255
O2	C1	H4	113.785		O3	C1	H4	123.960

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

using model chemistry: QCISD/daug-cc-pVDZ

States and conformations

Conformer 1 (CS)

Conformer 2 (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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