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	hartrees
Energy at 0K	-40.520360
Energy at 298.15K	-40.523372
HF Energy	-40.520360
Nuclear repulsion energy	13.436585

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	3038	2929	0.00	162.11	0.00	0.00
2	E	1556	1501	0.00	24.51	0.75	0.86
2	E	1556	1501	0.00	24.51	0.75	0.86
3	T₂	3156	3043	22.19	58.50	0.75	0.86
3	T₂	3156	3043	22.19	58.50	0.75	0.86
3	T₂	3156	3043	22.19	58.50	0.75	0.86
4	T₂	1335	1287	19.99	1.34	0.75	0.86
4	T₂	1335	1287	19.99	1.34	0.75	0.86
4	T₂	1335	1287	19.99	1.34	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
H2	0.629	0.629	0.629
H3	-0.629	-0.629	0.629
H4	-0.629	0.629	-0.629
H5	0.629	-0.629	-0.629

	C1	H2	H3	H4	H5
C1		1.0899	1.0899	1.0899	1.0899
H2	1.0899		1.7798	1.7798	1.7798
H3	1.0899	1.7798		1.7798	1.7798
H4	1.0899	1.7798	1.7798		1.7798
H5	1.0899	1.7798	1.7798	1.7798

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: B3PW91/TZVP

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	-0.502
2	H	0.125
3	H	0.125
4	H	0.125
5	H	0.125

<r²>	9.985
(<r²>)^1/2	3.160

All results from a given calculation for CH4 (Methane)

using model chemistry: B3PW91/TZVP

States and conformations

All results from a given calculation for CH₄ (Methane)