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	hartrees
Energy at 0K	-698.764311
Energy at 298.15K	-698.769536
HF Energy	-698.037307
Nuclear repulsion energy	289.015469

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3886	3598	58.42
2	A	1279	1185	209.06
3	A	1248	1155	111.82
4	A	889	823	112.56
5	A	572	530	80.35
6	A	451	418	22.74
7	A	381	353	2.86
8	A	252	233	122.96
9	B	3881	3593	275.06
10	B	1542	1427	352.53
11	B	1262	1169	120.88
12	B	953	882	373.35
13	B	573	530	54.66
14	B	511	473	54.23
15	B	332	307	78.78

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.159
O2	0.000	1.260	0.825
O3	0.000	-1.260	0.825
O4	1.234	-0.033	-0.846
O5	-1.234	0.033	-0.846
H6	-1.466	-0.871	-1.099
H7	1.466	0.871	-1.099

	S1	O2	O3	O4	O5	H6	H7
S1		1.4253	1.4253	1.5920	1.5920	2.1188	2.1188
O2	1.4253		2.5205	2.4468	2.4126	3.2236	2.4494
O3	1.4253	2.5205		2.4126	2.4468	2.4494	3.2236
O4	1.5920	2.4468	2.4126		2.4698	2.8388	0.9670
O5	1.5920	2.4126	2.4468	2.4698		0.9670	2.8388
H6	2.1188	3.2236	2.4494	2.8388	0.9670		3.4106
H7	2.1188	2.4494	3.2236	0.9670	2.8388	3.4106

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	O4	H7	109.348	S1	O5	H6	109.348
O2	S1	O3	124.302	O2	S1	O4	108.247
O2	S1	O5	106.052	O3	S1	O4	106.052
O3	S1	O5	108.247	O4	S1	O5	101.737

All results from a given calculation for H₂SO₄ (Sulfuric acid)

using model chemistry: CISD/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for H2SO4 (Sulfuric acid)

using model chemistry: CISD/6-31G*

States and conformations

All results from a given calculation for H₂SO₄ (Sulfuric acid)