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	hartrees
Energy at 0K	-169.082204
Energy at 298.15K	-169.085842
HF Energy	-168.728436
Nuclear repulsion energy	68.015852

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3182	3023	10.43
2	A'	3066	2913	3.18
3	A'	1535	1459	16.95
4	A'	1461	1388	8.81
5	A'	1298	1233	9.57
6	A'	1152	1094	14.65
7	A'	851	808	13.23
8	A'	553	526	1.84
9	A"	3175	3017	6.32
10	A"	1533	1456	11.92
11	A"	1028	977	2.52
12	A"	137	131	2.43

Atom	x (Å)	y (Å)	z (Å)
C1	-0.998	-0.540	0.000
N2	0.000	0.594	0.000
O3	1.216	0.178	0.000
H4	-0.491	-1.513	0.000
H5	-1.625	-0.415	0.891
H6	-1.625	-0.415	-0.891

	C1	N2	O3	H4	H5	H6
C1		1.5109	2.3278	1.0968	1.0966	1.0966
N2	1.5109		1.2855	2.1633	2.1100	2.1100
O3	2.3278	1.2855		2.4027	3.0358	3.0358
H4	1.0968	2.1633	2.4027		1.8121	1.8121
H5	1.0966	2.1100	3.0358	1.8121		1.7825
H6	1.0966	2.1100	3.0358	1.8121	1.7825

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.454	N2	C1	H4	111.122
N2	C1	H5	106.969	N2	C1	H6	106.969
H4	C1	H5	111.419	H4	C1	H6	111.419
H5	C1	H6	108.734

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: MP2=FULL/6-31G

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=FULL/6-31G

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)