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	hartrees
Energy at 0K	-96.172830
Energy at 298.15K	-96.180037
HF Energy	-95.736687
Nuclear repulsion energy	47.863433

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3100	2923	41.21
2	A₁	3087	2911	20.36
3	A₁	1438	1356	10.24
4	A₁	1380	1301	566.13
5	A₁	995	938	57.56
6	A₂	307	289	0.00
7	E	3200	3018	5.14
7	E	3200	3018	5.14
8	E	3038	2865	1331.15
8	E	3038	2865	1331.15
9	E	1550	1462	99.60
9	E	1550	1462	99.60
10	E	1515	1429	6.38
10	E	1515	1429	6.38
11	E	1273	1201	2.27
11	E	1273	1201	2.27
12	E	898	847	95.28
12	E	898	847	95.28

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.791
N2	0.000	0.000	0.700
H3	0.000	-1.032	-1.131
H4	-0.893	0.516	-1.131
H5	0.893	0.516	-1.131
H6	0.000	0.967	1.079
H7	-0.838	-0.484	1.079
H8	0.838	-0.484	1.079

	C1	N2	H3	H4	H5	H6	H7	H8
C1		1.4916	1.0860	1.0860	1.0860	2.1050	2.1050	2.1050
N2	1.4916		2.1018	2.1018	2.1018	1.0384	1.0384	1.0384
H3	1.0860	2.1018		1.7867	1.7867	2.9792	2.4254	2.4254
H4	1.0860	2.1018	1.7867		1.7867	2.4254	2.4254	2.9792
H5	1.0860	2.1018	1.7867	1.7867		2.4254	2.9792	2.4254
H6	2.1050	1.0384	2.9792	2.4254	2.4254		1.6752	1.6752
H7	2.1050	1.0384	2.4254	2.4254	2.9792	1.6752		1.6752
H8	2.1050	1.0384	2.4254	2.9792	2.4254	1.6752	1.6752

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	111.350	C1	N2	H7	111.350
C1	N2	H8	111.350	N2	C1	H3	108.225
N2	C1	H4	108.225	N2	C1	H5	108.225
H3	C1	H4	110.688	H3	C1	H5	110.688
H4	C1	H5	110.688	H6	N2	H7	107.528
H6	N2	H8	107.528	H7	N2	H8	107.529

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

using model chemistry: CCD/6-311+G(3df,2p)

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: CCD/6-311+G(3df,2p)

States and conformations

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