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	hartrees
Energy at 0K	-169.422512
Energy at 298.15K	-169.426180
HF Energy	-168.853699
Nuclear repulsion energy	69.629466

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3147	3053
2	A'	3024	2933
3	A'	1574	1527
4	A'	1440	1397
5	A'	1361	1320
6	A'	1142	1108
7	A'	858	833
8	A'	569	552
9	A"	3124	3030
10	A"	1444	1401
11	A"	967	938
12	A"	148	143

Atom	x (Å)	y (Å)	z (Å)
C1	-0.958	-0.569	0.000
N2	0.000	0.581	0.000
O3	1.170	0.223	0.000
H4	-0.420	-1.531	0.000
H5	-1.596	-0.451	0.893
H6	-1.596	-0.451	-0.893

	C1	N2	O3	H4	H5	H6
C1		1.4971	2.2710	1.1024	1.1038	1.1038
N2	1.4971		1.2237	2.1534	2.0998	2.0998
O3	2.2710	1.2237		2.3672	2.9836	2.9836
H4	1.1024	2.1534	2.3672		1.8300	1.8300
H5	1.1038	2.0998	2.9836	1.8300		1.7865
H6	1.1038	2.0998	2.9836	1.8300	1.7865

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.779	N2	C1	H4	110.951
N2	C1	H5	106.689	N2	C1	H6	106.689
H4	C1	H5	112.083	H4	C1	H6	112.083
H5	C1	H6	108.042

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: QCISD(T)=FULL/aug-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: QCISD(T)=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)