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	hartrees
Energy at 0K	-96.168407
Energy at 298.15K	-96.175573
HF Energy	-95.722427
Nuclear repulsion energy	47.659711

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3100	3100	53.74
2	A₁	2922	2922	3.17
3	A₁	1407	1407	29.28
4	A₁	1302	1302	293.25
5	A₁	962	962	44.22
6	A₂	302	302	0.00
7	E	3199	3199	1.55
7	E	3199	3199	1.55
8	E	2666	2666	2629.68
8	E	2666	2666	2629.69
9	E	1519	1519	0.03
9	E	1519	1519	0.03
10	E	1447	1447	12.39
10	E	1447	1447	12.39
11	E	1244	1244	11.16
11	E	1244	1244	11.16
12	E	884	884	96.46
12	E	884	884	96.46

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.794
N2	0.000	0.000	0.703
H3	0.000	-1.032	-1.130
H4	-0.894	0.516	-1.130
H5	0.894	0.516	-1.130
H6	0.000	0.980	1.079
H7	-0.849	-0.490	1.079
H8	0.849	-0.490	1.079

	C1	N2	H3	H4	H5	H6	H7	H8
C1		1.4970	1.0853	1.0853	1.0853	2.1144	2.1144	2.1144
N2	1.4970		2.1037	2.1037	2.1037	1.0497	1.0497	1.0497
H3	1.0853	2.1037		1.7873	1.7873	2.9884	2.4284	2.4284
H4	1.0853	2.1037	1.7873		1.7873	2.4284	2.4284	2.9884
H5	1.0853	2.1037	1.7873	1.7873		2.4284	2.9884	2.4284
H6	2.1144	1.0497	2.9884	2.4284	2.4284		1.6970	1.6970
H7	2.1144	1.0497	2.4284	2.4284	2.9884	1.6970		1.6970
H8	2.1144	1.0497	2.4284	2.9884	2.4284	1.6970	1.6970

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	111.031	C1	N2	H7	111.031
C1	N2	H8	111.031	N2	C1	H3	108.044
N2	C1	H4	108.044	N2	C1	H5	108.044
H3	C1	H4	110.860	H3	C1	H5	110.860
H4	C1	H5	110.860	H6	N2	H7	107.868
H6	N2	H8	107.868	H7	N2	H8	107.868

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

using model chemistry: CCD/Def2TZVPP

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/Def2TZVPP

States and conformations

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