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	hartrees
Energy at 0K	-169.411602
Energy at 298.15K	-169.415532
HF Energy	-168.873411
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3903	3903	84.49
2	A'	3299	3299	3.33
3	A'	3162	3162	3.64
4	A'	1737	1737	3.06
5	A'	1473	1473	20.89
6	A'	1381	1381	70.78
7	A'	1196	1196	10.41
8	A'	949	949	100.49
9	A'	540	540	6.30
10	A"	985	985	34.86
11	A"	800	800	4.56
12	A"	412	412	130.26

Atom	x (Å)	y (Å)
C1	1.140	-0.038
N2	0.000	0.545
O3	-1.034	-0.401
H4	1.240	-1.129
H5	2.017	0.609
H6	-1.827	0.142

	C1	N2	O3	H4	H5	H6
C1		1.2807	2.2040	1.0956	1.0900	2.9729
N2	1.2807		1.4011	2.0836	2.0178	1.8710
O3	2.2040	1.4011		2.3879	3.2135	0.9615
H4	1.0956	2.0836	2.3879		1.9044	3.3205
H5	1.0900	2.0178	3.2135	1.9044		3.8723
H6	2.9729	1.8710	0.9615	3.3205	3.8723

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	110.459	N2	C1	H4	122.328
N2	C1	H5	116.448	N2	O3	H6	103.155
H4	C1	H5	121.224

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: MP3=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 CH2NOH (formaldoxime)

using model chemistry: MP3=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)