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	hartrees
Energy at 0K	-722.926552
Energy at 298.15K
HF Energy	-722.039831
Nuclear repulsion energy	283.622744

Atom	x (Å)	y (Å)	z (Å)
O1	-1.226	-0.819	0.209
H2	-2.012	-0.249	0.213
S3	0.078	0.014	-0.146
F4	0.470	0.475	1.317
O5	-0.279	1.205	-0.862
O6	1.073	-0.918	-0.563

	O1	H2	S3	F4	O5	O6
O1		0.9713	1.5875	2.4040	2.4782	2.4270
H2	0.9713		2.1368	2.8116	2.5047	3.2507
S3	1.5875	2.1368		1.5831	1.4346	1.4256
F4	2.4040	2.8116	1.5831		2.4169	2.4161
O5	2.4782	2.5047	1.4346	2.4169		2.5340
O6	2.4270	3.2507	1.4256	2.4161	2.5340

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	S3	F4	98.614	O1	S3	O5	110.073
O1	S3	O6	107.194	H2	O1	S3	110.944
F4	S3	O5	106.329	F4	S3	O6	106.725
O5	S3	O6	124.742

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

using model chemistry: MP2/6-31+G**

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: MP2/6-31+G**

States and conformations

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