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	hartrees
Energy at 0K	-208.597714
Energy at 298.15K	-208.604041
HF Energy	-207.949603
Nuclear repulsion energy	120.935544

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3671	3522
2	A'	3480	3338
3	A'	3166	3037
4	A'	3069	2944
5	A'	1763	1691
6	A'	1532	1470
7	A'	1484	1424
8	A'	1427	1369
9	A'	1298	1245
10	A'	1136	1090
11	A'	1037	995
12	A'	883	847
13	A'	550	527
14	A'	422	405
15	A"	3145	3017
16	A"	1515	1453
17	A"	1087	1043
18	A"	865	830
19	A"	627	601
20	A"	513	492
21	A"	120	115

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.131	0.000
C2	0.958	-1.031	0.000
N3	0.234	1.391	0.000
O4	-1.294	-0.303	0.000
H5	1.996	-0.682	0.000
H6	0.783	-1.654	0.886
H7	0.783	-1.654	-0.886
H8	1.243	1.568	0.000
H9	-1.838	0.512	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5064	1.2807	1.3648	2.1552	2.1416	2.1416	1.8999	1.8769
C2	1.5064		2.5277	2.3665	1.0950	1.0971	1.0971	2.6153	3.1932
N3	1.2807	2.5277		2.2809	2.7203	3.2182	3.2182	1.0243	2.2506
O4	1.3648	2.3665	2.2809		3.3114	2.6314	2.6314	3.1522	0.9796
H5	2.1552	1.0950	2.7203	3.3114		1.7890	1.7890	2.3733	4.0152
H6	2.1416	1.0971	3.2182	2.6314	1.7890		1.7721	3.3737	3.5136
H7	2.1416	1.0971	3.2182	2.6314	1.7890	1.7721		3.3737	3.5136
H8	1.8999	2.6153	1.0243	3.1522	2.3733	3.3737	3.3737		3.2568
H9	1.8769	3.1932	2.2506	0.9796	4.0152	3.5136	3.5136	3.2568

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.896	C1	C2	H6	109.689
C1	C2	H7	109.689	C1	N3	H8	110.530
C1	O4	H9	105.181	C2	C1	N3	129.990
C2	C1	O4	110.927	N3	C1	O4	119.084
H5	C2	H6	109.390	H5	C2	H7	109.390
H6	C2	H7	107.726

All results from a given calculation for CH₃C(OH)=NH (Ethaninidic acid)

using model chemistry: QCISD(T)/6-31G*

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 CH3C(OH)=NH (Ethaninidic acid)

using model chemistry: QCISD(T)/6-31G*

States and conformations

All results from a given calculation for CH₃C(OH)=NH (Ethaninidic acid)