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	hartrees
Energy at 0K	-168.207383
Energy at 298.15K	-168.211248
HF Energy	-167.895378
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3611	3399	23.30
2	A'	3295	3101	7.50
3	A'	3192	3005	1.51
4	A'	1709	1608	2.40
5	A'	1521	1432	6.20
6	A'	1365	1284	79.57
7	A'	1226	1154	8.15
8	A'	906	853	49.53
9	A'	513	483	10.61
10	A"	1048	987	47.77
11	A"	813	765	0.27
12	A"	367	345	178.82

Atom	x (Å)	y (Å)
C1	1.152	0.016
N2	0.000	0.576
O3	-1.044	-0.475
H4	1.287	-1.059
H5	2.020	0.661
H6	-1.869	0.065

	C1	N2	O3	H4	H5	H6
C1		1.2808	2.2500	1.0837	1.0811	3.0216
N2	1.2808		1.4811	2.0806	2.0220	1.9378
O3	2.2500	1.4811		2.4025	3.2676	0.9863
H4	1.0837	2.0806	2.4025		1.8693	3.3501
H5	1.0811	2.0220	3.2676	1.8693		3.9348
H6	3.0216	1.9378	0.9863	3.3501	3.9348

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	108.888	N2	C1	H4	123.058
N2	C1	H5	117.518	N2	O3	H6	101.625
H4	C1	H5	119.425

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: CISD/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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All results from a given calculation for CH2NOH (formaldoxime)

using model chemistry: CISD/3-21G

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)