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	hartrees
Energy at 0K	-169.448845
Energy at 298.15K	-169.452793
HF Energy	-168.861430
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3919	3712	81.80
2	A'	3307	3132	2.97
3	A'	3180	3012	2.05
4	A'	1755	1662	1.02
5	A'	1488	1409	23.61
6	A'	1398	1324	71.92
7	A'	1218	1154	12.28
8	A'	988	935	85.42
9	A'	544	515	7.09
10	A"	1003	950	30.19
11	A"	817	774	3.60
12	A"	416	394	128.12

Atom	x (Å)	y (Å)
C1	1.133	-0.039
N2	0.000	0.538
O3	-1.028	-0.396
H4	1.236	-1.121
H5	2.005	0.600
H6	-1.812	0.156

	C1	N2	O3	H4	H5	H6
C1		1.2711	2.1897	1.0863	1.0812	2.9506
N2	1.2711		1.3886	2.0685	2.0056	1.8516
O3	2.1897	1.3886		2.3774	3.1918	0.9580
H4	1.0863	2.0685	2.3774		1.8843	3.3041
H5	1.0812	2.0056	3.1918	1.8843		3.8421
H6	2.9506	1.8516	0.9580	3.3041	3.8421

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	110.753	N2	C1	H4	122.477
N2	C1	H5	116.759	N2	O3	H6	102.644
H4	C1	H5	120.764

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: CCD/6-31G(2df,p)

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: CCD/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)