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	hartrees
Energy at 0K	-210.719022
Energy at 298.15K	-210.720225
Nuclear repulsion energy	64.894491

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3202	2834	16.26
2	A'	1891	1673	70.43
3	A'	1439	1274	3.87
4	A'	1206	1067	60.20
5	A'	624	552	15.36
6	A"	941	833	0.67

Atom	x (Å)	y (Å)
C1	0.000	0.409
O2	1.200	0.088
F3	-1.021	-0.513
H4	-0.414	1.459

	C1	O2	F3	H4
C1		1.2426	1.3756	1.1287
O2	1.2426		2.3007	2.1185
F3	1.3756	2.3007		2.0633
H4	1.1287	2.1185	2.0633

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	F3	122.897		O2	C1	H4	126.541
F3	C1	H4	110.562

All results from a given calculation for HFCO (formyl fluoride)

using model chemistry: B3PW91/STO-3G

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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Number	Element	Mulliken
1	C	0.159
2	O	-0.179
3	F	-0.058
4	H	0.078

	x	y	z	Total
	-1.138	0.799	0.000	1.390
CHELPG
AIM
ESP

	x	y	z
x	1.769	0.028	0.000
y	0.028	1.046	0.000
z	0.000	0.000	0.393

<r²>	0.000
(<r²>)^1/2	0.000