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	hartrees
Energy at 0K	-169.775560
Energy at 298.15K	-169.779485
HF Energy	-169.557053
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3827	3672	94.37
2	A'	3255	3123	2.18
3	A'	3130	3003	5.39
4	A'	1699	1630	5.49
5	A'	1458	1399	12.06
6	A'	1349	1294	79.25
7	A'	1180	1132	10.74
8	A'	912	875	121.62
9	A'	535	514	6.55
10	A"	985	945	33.60
11	A"	803	770	6.49
12	A"	423	406	124.93

Atom	x (Å)	y (Å)
C1	1.138	-0.023
N2	0.000	0.537
O3	-1.032	-0.411
H4	1.258	-1.101
H5	1.994	0.631
H6	-1.824	0.136

	C1	N2	O3	H4	H5	H6
C1		1.2683	2.2040	1.0840	1.0779	2.9656
N2	1.2683		1.4011	2.0654	1.9963	1.8671
O3	2.2040	1.4011		2.3922	3.2004	0.9619
H4	1.0840	2.0654	2.3922		1.8817	3.3208
H5	1.0779	1.9963	3.2004	1.8817		3.8496
H6	2.9656	1.8671	0.9619	3.3208	3.8496

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	111.216	N2	C1	H4	122.617
N2	C1	H5	116.376	N2	O3	H6	102.818
H4	C1	H5	121.007

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: B2PLYP=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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All results from a given calculation for CH2NOH (formaldoxime)

using model chemistry: B2PLYP=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)