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	hartrees
Energy at 0K	-169.651704
Energy at 298.15K	-169.655732
HF Energy	-168.977460
Nuclear repulsion energy	71.310249

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3960	3960	94.33
2	A'	3613	3613	13.18
3	A'	3134	3134	33.98
4	A'	1813	1813	208.98
5	A'	1454	1454	19.33
6	A'	1369	1369	173.89
7	A'	1227	1227	35.73
8	A'	1094	1094	202.89
9	A'	628	628	1.17
10	A"	1073	1073	1.81
11	A"	856	856	62.13
12	A"	398	398	70.15

Atom	x (Å)	y (Å)
C1	0.000	0.372
O2	-0.998	-0.528
N3	1.191	-0.016
H4	-0.325	1.407
H5	-1.838	-0.076
H6	1.810	0.780

	C1	O2	N3	H4	H5	H6
C1		1.3442	1.2527	1.0849	1.8914	1.8559
O2	1.3442		2.2481	2.0492	0.9537	3.0984
N3	1.2527	2.2481		2.0796	3.0292	1.0091
H4	1.0849	2.0492	2.0796		2.1184	2.2256
H5	1.8914	0.9537	3.0292	2.1184		3.7471
H6	1.8559	3.0984	1.0091	2.2256	3.7471

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H5	109.622	C1	N3	H6	109.805
O2	C1	N3	119.882	O2	C1	H4	114.623
N3	C1	H4	125.495

All results from a given calculation for HOCHNH (hydroxymethylimine)

using model chemistry: MP3=FULL/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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