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	hartrees
Energy at 0K	-169.104502
Energy at 298.15K	-169.108120
HF Energy	-168.762358
Nuclear repulsion energy	67.265619

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3157	3047	17.39
2	A'	3023	2918	9.08
3	A'	1507	1455	19.71
4	A'	1435	1385	8.54
5	A'	1285	1240	8.80
6	A'	1137	1098	15.98
7	A'	847	818	11.64
8	A'	534	515	2.00
9	A"	3151	3041	14.00
10	A"	1503	1451	15.83
11	A"	1007	972	2.97
12	A"	142	137	1.92

Atom	x (Å)	y (Å)	z (Å)
C1	-1.011	-0.540	0.000
N2	0.000	0.604	0.000
O3	1.231	0.169	0.000
H4	-0.508	-1.521	0.000
H5	-1.640	-0.410	0.896
H6	-1.640	-0.410	-0.896

	C1	N2	O3	H4	H5	H6
C1		1.5260	2.3515	1.1029	1.1025	1.1025
N2	1.5260		1.3058	2.1847	2.1259	2.1259
O3	2.3515	1.3058		2.4253	3.0629	3.0629
H4	1.1029	2.1847	2.4253		1.8216	1.8216
H5	1.1025	2.1259	3.0629	1.8216		1.7927
H6	1.1025	2.1259	3.0629	1.8216	1.7927

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.044	N2	C1	H4	111.395
N2	C1	H5	106.854	N2	C1	H6	106.854
H4	C1	H5	111.370	H4	C1	H6	111.370
H5	C1	H6	108.781

All results from a given calculation for CH₃NO (nitrosomethane)

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 CH3NO (nitrosomethane)

using model chemistry: MP2/SDD

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)