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	hartrees
Energy at 0K	-169.738943
Energy at 298.15K	-169.742864
HF Energy	-169.549996
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3833	3658	90.52
2	A'	3268	3118	3.26
3	A'	3136	2992	4.63
4	A'	1700	1622	4.20
5	A'	1468	1400	10.61
6	A'	1354	1292	89.06
7	A'	1193	1138	7.86
8	A'	909	867	120.64
9	A'	536	511	6.03
10	A"	980	935	38.92
11	A"	801	765	6.30
12	A"	421	402	146.68

Atom	x (Å)	y (Å)
C1	1.139	-0.022
N2	0.000	0.539
O3	-1.034	-0.414
H4	1.263	-1.101
H5	1.997	0.634
H6	-1.824	0.137

	C1	N2	O3	H4	H5	H6
C1		1.2697	2.2076	1.0858	1.0798	2.9675
N2	1.2697		1.4056	2.0700	1.9991	1.8681
O3	2.2076	1.4056		2.3975	3.2063	0.9634
H4	1.0858	2.0700	2.3975		1.8833	3.3263
H5	1.0798	1.9991	3.2063	1.8833		3.8533
H6	2.9675	1.8681	0.9634	3.3263	3.8533

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	111.108	N2	C1	H4	122.800
N2	C1	H5	116.371	N2	O3	H6	102.492
H4	C1	H5	120.829

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: B2PLYP=FULL/TZVP

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 CH2NOH (formaldoxime)

using model chemistry: B2PLYP=FULL/TZVP

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)