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	hartrees
Energy at 0K	-169.901491
Energy at 298.15K	-169.905452
HF Energy	-169.901491
Nuclear repulsion energy	70.184898

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3674	3661	54.50
2	A'	3412	3400	9.39
3	A'	2943	2933	62.21
4	A'	1672	1666	197.39
5	A'	1361	1356	11.25
6	A'	1277	1273	150.60
7	A'	1147	1143	45.65
8	A'	998	994	223.65
9	A'	597	595	1.59
10	A"	984	981	1.74
11	A"	793	791	67.38
12	A"	417	416	56.45

Atom	x (Å)	y (Å)
C1	0.000	0.383
O2	-1.008	-0.548
N3	1.206	-0.007
H4	-0.354	1.425
H5	-1.866	-0.089
H6	1.846	0.792

	C1	O2	N3	H4	H5	H6
C1		1.3723	1.2673	1.1009	1.9252	1.8904
O2	1.3723		2.2795	2.0788	0.9728	3.1527
N3	1.2673	2.2795		2.1176	3.0734	1.0230
H4	1.1009	2.0788	2.1176		2.1403	2.2892
H5	1.9252	0.9728	3.0734	2.1403		3.8151
H6	1.8904	3.1527	1.0230	2.2892	3.8151

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H5	109.175	C1	N3	H6	110.806
O2	C1	N3	119.387	O2	C1	H4	113.946
N3	C1	H4	126.667

All results from a given calculation for HOCHNH (hydroxymethylimine)

using model chemistry: BLYP/aug-cc-pVTZ

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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Number	Element	Mulliken
1	C	0.027
2	O	-0.269
3	N	-0.402
4	H	0.383
5	H	0.160
6	H	0.102

	x	y	z	Total
	-1.982	2.994	0.000	3.591
CHELPG
AIM
ESP

	x	y	z
x	6.141	0.003	0.000
y	0.003	4.246	0.000
z	0.000	0.000	3.186

<r²>	42.237
(<r²>)^1/2	6.499