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	hartrees
Energy at 0K	-698.760884
Energy at 298.15K	-698.766119
HF Energy	-698.037446
Nuclear repulsion energy	289.175394

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3891	3594	59.19
2	A	1284	1186	214.39
3	A	1249	1154	108.97
4	A	892	824	114.00
5	A	574	530	81.02
6	A	453	418	22.92
7	A	382	353	2.90
8	A	253	234	123.07
9	B	3885	3589	278.21
10	B	1547	1429	358.29
11	B	1264	1168	121.90
12	B	954	882	375.54
13	B	575	531	55.24
14	B	512	473	54.34
15	B	333	307	79.09

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.159
O2	0.000	1.259	0.824
O3	0.000	-1.259	0.824
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		1.4244	1.4244	1.5912	1.5912	2.1185	2.1185
O2	1.4244		2.5187	2.4454	2.4113	3.2225	2.4490
O3	1.4244	2.5187		2.4113	2.4454	2.4490	3.2225
O4	1.5912	2.4454	2.4113		2.4685	2.8378	0.9668
O5	1.5912	2.4113	2.4454	2.4685		0.9668	2.8378
H6	2.1185	3.2225	2.4490	2.8378	0.9668		3.4095
H7	2.1185	2.4490	3.2225	0.9668	2.8378	3.4095

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	O4	H7	109.395	S1	O5	H6	109.395
O2	S1	O3	124.288	O2	S1	O4	108.249
O2	S1	O5	106.059	O3	S1	O4	106.059
O3	S1	O5	108.249	O4	S1	O5	101.736

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

using model chemistry: CID/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: CID/6-31G*

States and conformations

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