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	hartrees
Energy at 0K	-169.374552
Energy at 298.15K	-169.378180
HF Energy	-168.840243
Nuclear repulsion energy	69.743288

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3169	3102
2	A'	3043	2979
3	A'	1606	1572
4	A'	1446	1416
5	A'	1364	1335
6	A'	1141	1116
7	A'	856	838
8	A'	574	562
9	A"	3148	3082
10	A"	1451	1420
11	A"	961	941
12	A"	125	122

Atom	x (Å)	y (Å)	z (Å)
C1	-0.953	-0.572	0.000
N2	0.000	0.584	0.000
O3	1.164	0.225	0.000
H4	-0.408	-1.532	0.000
H5	-1.594	-0.463	0.894
H6	-1.594	-0.463	-0.894

	C1	N2	O3	H4	H5	H6
C1		1.4986	2.2624	1.1043	1.1054	1.1054
N2	1.4986		1.2186	2.1556	2.1062	2.1062
O3	2.2624	1.2186		2.3576	2.9797	2.9797
H4	1.1043	2.1556	2.3576		1.8302	1.8302
H5	1.1054	2.1062	2.9797	1.8302		1.7888
H6	1.1054	2.1062	2.9797	1.8302	1.7888

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.328	N2	C1	H4	110.909
N2	C1	H5	106.992	N2	C1	H6	106.992
H4	C1	H5	111.839	H4	C1	H6	111.839
H5	C1	H6	108.015

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: CCSD(T)/cc-pVDZ

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: CCSD(T)/cc-pVDZ

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)