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	hartrees
Energy at 0K	-96.328389
Energy at 298.15K	-96.335375
HF Energy	-96.328389
Nuclear repulsion energy	46.721505

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2969	2958	115.52
2	A₁	2589	2579	77.64
3	A₁	1297	1292	121.53
4	A₁	1191	1187	128.77
5	A₁	796	793	30.88
6	A₂	260	259	0.00
7	E	3058	3046	21.87
7	E	3058	3046	21.86
8	E	2161	2152	2821.84
8	E	2161	2152	2822.49
9	E	1430	1424	9.87
9	E	1430	1424	9.86
10	E	1281	1276	6.99
10	E	1281	1276	6.98
11	E	1132	1128	158.53
11	E	1132	1128	158.46
12	E	839	836	39.92
12	E	839	836	39.93

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.813
N2	0.000	0.000	0.718
H3	0.000	-1.046	-1.140
H4	-0.905	0.523	-1.140
H5	0.905	0.523	-1.140
H6	0.000	1.014	1.090
H7	-0.878	-0.507	1.090
H8	0.878	-0.507	1.090

	C1	N2	H3	H4	H5	H6	H7	H8
C1		1.5310	1.0956	1.0956	1.0956	2.1564	2.1564	2.1564
N2	1.5310		2.1325	2.1325	2.1325	1.0802	1.0802	1.0802
H3	1.0956	2.1325		1.8109	1.8109	3.0361	2.4570	2.4570
H4	1.0956	2.1325	1.8109		1.8109	2.4570	2.4570	3.0361
H5	1.0956	2.1325	1.8109	1.8109		2.4570	3.0361	2.4570
H6	2.1564	1.0802	3.0361	2.4570	2.4570		1.7566	1.7566
H7	2.1564	1.0802	2.4570	2.4570	3.0361	1.7566		1.7566
H8	2.1564	1.0802	2.4570	3.0361	2.4570	1.7566	1.7566

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.144	C1	N2	H7	110.144
C1	N2	H8	110.144	N2	C1	H3	107.393
N2	C1	H4	107.393	N2	C1	H5	107.393
H3	C1	H4	111.467	H3	C1	H5	111.467
H4	C1	H5	111.467	H6	N2	H7	108.790
H6	N2	H8	108.790	H7	N2	H8	108.790

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

using model chemistry: BLYP/6-311G**

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	N	-0.111
3	H	0.101
4	H	0.101
5	H	0.101
6	H	-0.014
7	H	-0.014
8	H	-0.014

	x	y	z
x	12.052	0.000	0.000
y	0.000	12.054	-0.000
z	0.000	-0.000	8.727

<r²>	32.762
(<r²>)^1/2	5.724

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

using model chemistry: BLYP/6-311G**

States and conformations

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