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	hartrees
Energy at 0K	-244.063069
Energy at 298.15K
HF Energy	-243.569333
Nuclear repulsion energy	119.336000

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3206	3095	8.10
2	A'	3076	2970	7.37
3	A'	1519	1466	16.92
4	A'	1467	1416	1.36
5	A'	1311	1265	22.39
6	A'	1171	1130	0.04
7	A'	862	832	2.56
8	A'	617	596	30.37
9	A'	548	529	1.58
10	A"	3227	3115	1.60
11	A"	1803	1740	5.56
12	A"	1523	1470	17.60
13	A"	1158	1117	0.48
14	A"	453	437	0.47
15	A"	13	12	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.002	-1.368	0.000
N2	-0.012	0.155	0.000
H3	1.053	-1.690	0.000
H4	-0.509	-1.700	0.911
H5	-0.509	-1.700	-0.911
O6	0.002	0.763	-1.154
O7	0.002	0.763	1.154

	C1	N2	H3	H4	H5	O6	O7
C1		1.5228	1.0987	1.0964	1.0964	2.4228	2.4228
N2	1.5228		2.1304	2.1257	2.1257	1.3040	1.3040
H3	1.0987	2.1304		1.8080	1.8080	2.9070	2.9070
H4	1.0964	2.1257	1.8080		1.8223	3.2544	2.5272
H5	1.0964	2.1257	1.8080	1.8223		2.5272	3.2544
O6	2.4228	1.3040	2.9070	3.2544	2.5272		2.3073
O7	2.4228	1.3040	2.9070	2.5272	3.2544	2.3073

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O6	117.771	C1	N2	O7	117.771
N2	C1	H3	107.608	N2	C1	H4	107.384
N2	C1	H5	107.384	H3	C1	H4	110.901
H3	C1	H5	110.901	H4	C1	H5	112.416
O6	N2	O7	124.422

All results from a given calculation for CH₃NO₂ (Methane, nitro-)

using model chemistry: MP2/SDD

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 CH3NO2 (Methane, nitro-)

using model chemistry: MP2/SDD

States and conformations

All results from a given calculation for CH₃NO₂ (Methane, nitro-)