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	hartrees
Energy at 0K	-722.913195
Energy at 298.15K	-722.917116
HF Energy	-722.025260
Nuclear repulsion energy	284.937260

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3694	3480	152.12
2	A	1513	1426	268.46
3	A	1256	1183	176.54
4	A	1207	1138	101.04
5	A	892	841	278.90
6	A	823	775	138.89
7	A	530	499	41.72
8	A	514	485	26.38
9	A	495	466	35.24
10	A	405	382	41.37
11	A	355	334	1.18
12	A	272	257	82.80

Atom	x (Å)	y (Å)	z (Å)
O1	-1.167	-0.906	0.262
H2	-1.981	-0.362	0.206
S3	0.085	0.006	-0.149
F4	0.384	0.642	1.286
O5	-0.362	1.093	-0.984
O6	1.175	-0.876	-0.451

	O1	H2	S3	F4	O5	O6
O1		0.9807	1.6022	2.4185	2.4889	2.4479
H2	0.9807		2.1288	2.7869	2.4812	3.2645
S3	1.6022	2.1288		1.5978	1.4421	1.4338
F4	2.4185	2.7869	1.5978		2.4316	2.4384
O5	2.4889	2.4812	1.4421	2.4316		2.5540
O6	2.4479	3.2645	1.4338	2.4384	2.5540

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	S3	F4	98.189	O1	S3	O5	109.568
O1	S3	O6	107.342	H2	O1	S3	108.610
F4	S3	O5	106.128	F4	S3	O6	106.972
O5	S3	O6	125.267

All results from a given calculation for HSO₃F (Fluorosulfonic acid)

using model chemistry: MP2=FULL/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 HSO3F (Fluorosulfonic acid)

using model chemistry: MP2=FULL/6-31G*

States and conformations

All results from a given calculation for HSO₃F (Fluorosulfonic acid)