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	hartrees
Energy at 0K	-169.585150
Energy at 298.15K	-169.589172
HF Energy	-168.972900
Nuclear repulsion energy	71.153009

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3975	3975	95.61
2	A'	3609	3609	12.45
3	A'	3123	3123	34.93
4	A'	1800	1800	205.49
5	A'	1456	1456	15.91
6	A'	1366	1366	175.60
7	A'	1218	1218	39.00
8	A'	1092	1092	198.76
9	A'	627	627	1.08
10	A"	1065	1065	3.01
11	A"	852	852	60.91
12	A"	399	399	72.76

Atom	x (Å)	y (Å)
C1	0.000	0.373
O2	-1.001	-0.527
N3	1.194	-0.019
H4	-0.325	1.414
H5	-1.841	-0.075
H6	1.815	0.780

	C1	O2	N3	H4	H5	H6
C1		1.3460	1.2564	1.0906	1.8944	1.8601
O2	1.3460		2.2523	2.0553	0.9543	3.1043
N3	1.2564	2.2523		2.0883	3.0349	1.0123
H4	1.0906	2.0553	2.0883		2.1243	2.2322
H5	1.8944	0.9543	3.0349	2.1243		3.7543
H6	1.8601	3.1043	1.0123	2.2322	3.7543

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H5	109.709	C1	N3	H6	109.682
O2	C1	N3	119.834	O2	C1	H4	114.626
N3	C1	H4	125.540

All results from a given calculation for HOCHNH (hydroxymethylimine)

using model chemistry: MP3/6-311+G(3df,2p)

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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