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	hartrees
Energy at 0K	-176.284339
Energy at 298.15K
HF Energy	-175.716208
Nuclear repulsion energy	55.718007

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3524	3524	94.12
2	Σ	2356	2356	125.86
3	Σ	1103	1103	82.94
4	Π	626	626	45.64
4	Π	626	626	45.64
5	Π	407	407	0.80
5	Π	407	407	0.80

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.094
C2	0.000	0.000	-1.287
F3	0.000	0.000	1.181
H4	0.000	0.000	-2.346

	C1	C2	F3	H4
C1		1.1923	1.2755	2.2515
C2	1.1923		2.4678	1.0592
F3	1.2755	2.4678		3.5270
H4	2.2515	1.0592	3.5270

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: MP3/aug-cc-pCVTZ

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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