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	hartrees
Energy at 0K	-169.660967
Energy at 298.15K	-169.664977
HF Energy	-168.972140
Nuclear repulsion energy	70.906647

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3882	3714
2	A'	3545	3392
3	A'	3091	2958
4	A'	1764	1688
5	A'	1436	1374
6	A'	1350	1292
7	A'	1206	1154
8	A'	1069	1023
9	A'	616	589
10	A"	1053	1007
11	A"	841	804
12	A"	401	384

Atom	x (Å)	y (Å)
C1	0.000	0.375
O2	-1.004	-0.532
N3	1.198	-0.018
H4	-0.332	1.411
H5	-1.839	-0.061
H6	1.812	0.788

	C1	O2	N3	H4	H5	H6
C1		1.3533	1.2614	1.0874	1.8898	1.8588
O2	1.3533		2.2614	2.0557	0.9592	3.1104
N3	1.2614	2.2614		2.0941	3.0377	1.0137
H4	1.0874	2.0557	2.0941		2.1057	2.2330
H5	1.8898	0.9592	3.0377	2.1057		3.7486
H6	1.8588	3.1104	1.0137	2.2330	3.7486

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H5	108.416	C1	N3	H6	109.086
O2	C1	N3	119.703	O2	C1	H4	114.325
N3	C1	H4	125.972

All results from a given calculation for HOCHNH (hydroxymethylimine)

using model chemistry: QCISD(T)=FULL/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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