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	hartrees
Energy at 0K	-238.844428
Energy at 298.15K	-238.847214
HF Energy	-238.844428
Nuclear repulsion energy	76.377942

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	2966	2933	42.79	132.20	0.06	0.12
2	A₁	1467	1451	0.05	3.55	0.70	0.82
3	A₁	1070	1058	90.11	6.43	0.16	0.28
4	A₁	505	499	3.73	1.30	0.63	0.77
5	A₂	1215	1202	0.00	4.56	0.75	0.86
6	B₁	3035	3001	32.79	49.26	0.75	0.86
7	B₁	1135	1122	12.79	0.62	0.75	0.86
8	B₂	1389	1373	8.12	0.73	0.75	0.86
9	B₂	1025	1013	257.42	2.38	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.508
H2	-0.921	0.000	1.109
H3	0.921	0.000	1.109
F4	0.000	1.115	-0.293
F5	0.000	-1.115	-0.293

	C1	H2	H3	F4	F5
C1		1.1003	1.1003	1.3726	1.3726
H2	1.1003		1.8429	2.0143	2.0143
H3	1.1003	1.8429		2.0143	2.0143
F4	1.3726	2.0143	2.0143		2.2296
F5	1.3726	2.0143	2.0143	2.2296

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	113.747	H2	C1	F4	108.592
H2	C1	F5	108.592	H3	C1	F4	108.592
H3	C1	F5	108.592	F4	C1	F5	108.620

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

using model chemistry: PBEPBEultrafine/aug-cc-pVTZ

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	0.152
2	H	0.229
3	H	0.229
4	F	-0.305
5	F	-0.305

	x	y	z	Total
	0.000	0.000	1.856	1.856
CHELPG
AIM
ESP

<r²>	40.125
(<r²>)^1/2	6.334

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

using model chemistry: PBEPBEultrafine/aug-cc-pVTZ

States and conformations

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