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	hartrees
Energy at 0K	-168.238116
Energy at 298.15K	-168.241590
HF Energy	-167.849750
Nuclear repulsion energy	66.724212

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3148	3082
2	A'	3037	2972
3	A'	1537	1505
4	A'	1400	1371
5	A'	1141	1116
6	A'	1030	1008
7	A'	731	715
8	A'	517	506
9	A"	3123	3057
10	A"	1543	1510
11	A"	978	958
12	A"	103	100

Atom	x (Å)	y (Å)	z (Å)
C1	-1.017	-0.550	0.000
N2	0.000	0.632	0.000
O3	1.231	0.155	0.000
H4	-0.464	-1.495	0.000
H5	-1.641	-0.436	0.896
H6	-1.641	-0.436	-0.896

	C1	N2	O3	H4	H5	H6
C1		1.5600	2.3566	1.0951	1.0974	1.0974
N2	1.5600		1.3205	2.1773	2.1533	2.1533
O3	2.3566	1.3205		2.3654	3.0659	3.0659
H4	1.0951	2.1773	2.3654		1.8191	1.8191
H5	1.0974	2.1533	3.0659	1.8191		1.7920
H6	1.0974	2.1533	3.0659	1.8191	1.7920

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	109.516	N2	C1	H4	108.920
N2	C1	H5	106.960	N2	C1	H6	106.960
H4	C1	H5	112.131	H4	C1	H6	112.131
H5	C1	H6	109.472

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: MP4=FULL/3-21G

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: MP4=FULL/3-21G

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)