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	hartrees
Energy at 0K	-96.078190
Energy at 298.15K
HF Energy	-95.648582
Nuclear repulsion energy	47.118600

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3115	2951	30.82
2	A₁	2552	2418	68.99
3	A₁	1351	1280	90.38
4	A₁	1135	1075	17.97
5	A₁	844	800	28.72
6	A₂	289	274	0.00
7	E	3216	3047	7.19
7	E	3216	3047	7.19
8	E	1524	1444	605.51
8	E	1524	1444	605.52
9	E	1473	1395	1372.62
9	E	1473	1395	1372.62
10	E	1233	1168	0.01
10	E	1233	1168	0.01
11	E	865	819	2.61
11	E	865	819	2.61
12	E	884i	837i	6442.95
12	E	884i	837i	6442.96

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.795
N2	0.000	0.000	0.711
H3	0.000	-1.036	-1.128
H4	-0.897	0.518	-1.128
H5	0.897	0.518	-1.128
H6	0.000	1.028	1.059
H7	-0.891	-0.514	1.059
H8	0.891	-0.514	1.059

	C1	N2	H3	H4	H5	H6	H7	H8
C1		1.5057	1.0885	1.0884	1.0884	2.1205	2.1205	2.1205
N2	1.5057		2.1105	2.1105	2.1105	1.0860	1.0860	1.0860
H3	1.0885	2.1105		1.7950	1.7950	3.0078	2.4186	2.4186
H4	1.0884	2.1105	1.7950		1.7950	2.4186	2.4186	3.0078
H5	1.0884	2.1105	1.7950	1.7950		2.4186	3.0078	2.4186
H6	2.1205	1.0860	3.0078	2.4186	2.4186		1.7814	1.7814
H7	2.1205	1.0860	2.4186	2.4186	3.0078	1.7814		1.7814
H8	2.1205	1.0860	2.4186	3.0078	2.4186	1.7814	1.7814

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	108.728	C1	N2	H7	108.728
C1	N2	H8	108.728	N2	C1	H3	107.803
N2	C1	H4	107.803	N2	C1	H5	107.803
H3	C1	H4	111.086	H3	C1	H5	111.086
H4	C1	H5	111.086	H6	N2	H7	110.204
H6	N2	H8	110.204	H7	N2	H8	110.204

All results from a given calculation for CH₃NH₃ (methyl ammonium radical)

using model chemistry: QCISD/6-31G(2df,p)

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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All results from a given calculation for CH3NH3 (methyl ammonium radical)

using model chemistry: QCISD/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₃NH₃ (methyl ammonium radical)