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	hartrees
Energy at 0K	-40.240903
Energy at 298.15K	-40.243929
HF Energy	-40.240903
Nuclear repulsion energy	13.393611

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	3063	2942	0.00	103.61	0.00	0.00
2	E	1638	1573	0.00	36.66	0.75	0.86
2	E	1638	1573	0.00	36.66	0.75	0.86
3	T₂	3181	3055	19.19	47.66	0.75	0.86
3	T₂	3181	3055	19.19	47.66	0.75	0.86
3	T₂	3181	3055	19.19	47.66	0.75	0.86
4	T₂	1406	1350	31.55	2.99	0.75	0.86
4	T₂	1406	1350	31.55	2.99	0.75	0.86
4	T₂	1406	1350	31.55	2.99	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
H2	0.631	0.631	0.631
H3	-0.631	-0.631	0.631
H4	-0.631	0.631	-0.631
H5	0.631	-0.631	-0.631

	C1	H2	H3	H4	H5
C1		1.0934	1.0934	1.0934	1.0934
H2	1.0934		1.7855	1.7855	1.7855
H3	1.0934	1.7855		1.7855	1.7855
H4	1.0934	1.7855	1.7855		1.7855
H5	1.0934	1.7855	1.7855	1.7855

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	109.471	H2	C1	H4	109.471
H2	C1	H5	109.471	H3	C1	H4	109.471
H3	C1	H5	109.471	H4	C1	H5	109.471

All results from a given calculation for CH₄ (Methane)

using model chemistry: PBE1PBE/3-21G

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	-0.861
2	H	0.215
3	H	0.215
4	H	0.215
5	H	0.215

<r²>	9.926
(<r²>)^1/2	3.151

All results from a given calculation for CH4 (Methane)

using model chemistry: PBE1PBE/3-21G

States and conformations

All results from a given calculation for CH₄ (Methane)