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	hartrees
Energy at 0K	-238.963652
Energy at 298.15K
HF Energy	-238.963652
Nuclear repulsion energy	76.592296

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2971	2971	54.16	124.19	0.09	0.16
2	A₁	1497	1497	0.73	4.90	0.68	0.81
3	A₁	1076	1076	95.64	3.67	0.29	0.45
4	A₁	513	513	3.35	1.75	0.69	0.82
5	A₂	1241	1241	0.00	7.68	0.75	0.86
6	B₁	3037	3037	56.95	50.72	0.75	0.86
7	B₁	1159	1159	16.37	1.77	0.75	0.86
8	B₂	1428	1428	14.75	2.68	0.75	0.86
9	B₂	1037	1037	241.93	2.33	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.504
H2	-0.916	0.000	1.108
H3	0.916	0.000	1.108
F4	0.000	1.113	-0.291
F5	0.000	-1.113	-0.291

	C1	H2	H3	F4	F5
C1		1.0970	1.0970	1.3678	1.3678
H2	1.0970		1.8315	2.0085	2.0085
H3	1.0970	1.8315		2.0085	2.0085
F4	1.3678	2.0085	2.0085		2.2269
F5	1.3678	2.0085	2.0085	2.2269

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	113.184	H2	C1	F4	108.650
H2	C1	F5	108.650	H3	C1	F4	108.650
H3	C1	F5	108.650	F4	C1	F5	108.985

All results from a given calculation for CH₂F₂ (Methane, difluoro-)

using model chemistry: B97D3/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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Number	Element	Mulliken
1	C	0.266
2	H	0.053
3	H	0.053
4	F	-0.186
5	F	-0.186

	x	y	z	Total
	0.000	0.000	1.763	1.763
CHELPG
AIM
ESP

<r²>	39.698
(<r²>)^1/2	6.301

All results from a given calculation for CH2F2 (Methane, difluoro-)

using model chemistry: B97D3/cc-pCVTZ

States and conformations

All results from a given calculation for CH₂F₂ (Methane, difluoro-)