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	hartrees
Energy at 0K	-167.318163
Energy at 298.15K
HF Energy	-167.255155
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3769	3769	11.74
2	A'	3568	3568	1.92
3	A'	3386	3386	15.63
4	A'	1708	1708	3.24
5	A'	1562	1562	11.54
6	A'	1450	1450	38.49
7	A'	1249	1249	8.78
8	A'	1048	1048	29.81
9	A'	505	505	2.97
10	A"	940	940	29.71
11	A"	812	812	0.67
12	A"	452	452	69.33

Atom	x (Å)	y (Å)
C1	1.168	-0.057
N2	0.000	0.577
O3	-1.061	-0.416
H4	1.275	-1.154
H5	2.072	0.566
H6	-1.868	0.218

	C1	N2	O3	H4	H5	H6
C1		1.3291	2.2574	1.1016	1.0977	3.0484
N2	1.3291		1.4527	2.1495	2.0716	1.9022
O3	2.2574	1.4527		2.4496	3.2826	1.0259
H4	1.1016	2.1495	2.4496		1.8953	3.4291
H5	1.0977	2.0716	3.2826	1.8953		3.9550
H6	3.0484	1.9022	1.0259	3.4291	3.9550

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	108.404	N2	C1	H4	124.074
N2	C1	H5	116.900	N2	O3	H6	98.792
H4	C1	H5	119.026

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: B2PLYP=FULLultrafine/STO-3G

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=FULLultrafine/STO-3G

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)