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	hartrees
Energy at 0K	-168.268778
Energy at 298.15K	-168.272622
HF Energy	-167.939532
Nuclear repulsion energy	69.581224

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3606	3606	14.93
2	A'	3408	3408	1.15
3	A'	3056	3056	56.34
4	A'	1779	1779	86.95
5	A'	1477	1477	7.85
6	A'	1329	1329	117.30
7	A'	1204	1204	86.68
8	A'	1021	1021	255.25
9	A'	620	620	1.24
10	A"	1089	1089	6.93
11	A"	850	850	62.59
12	A"	263	263	96.95

Atom	x (Å)	y (Å)
C1	0.000	0.395
O2	-1.012	-0.566
N3	1.209	0.009
H4	-0.359	1.430
H5	-1.892	-0.122
H6	1.883	0.787

	C1	O2	N3	H4	H5	H6
C1		1.3956	1.2691	1.0961	1.9612	1.9230
O2	1.3956		2.2947	2.1008	0.9853	3.1953
N3	1.2691	2.2947		2.1161	3.1039	1.0285
H4	1.0961	2.1008	2.1161		2.1820	2.3319
H5	1.9612	0.9853	3.1039	2.1820		3.8824
H6	1.9230	3.1953	1.0285	2.3319	3.8824

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H5	109.716	C1	N3	H6	113.225
O2	C1	N3	118.814	O2	C1	H4	114.406
N3	C1	H4	126.779

All results from a given calculation for HOCHNH (hydroxymethylimine)

using model chemistry: MP3=FULL/3-21G*

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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