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	hartrees
Energy at 0K	-208.751053
Energy at 298.15K	-208.757336
HF Energy	-208.031449
Nuclear repulsion energy	121.365481

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3781	3639
2	A'	3525	3393
3	A'	3163	3044
4	A'	3065	2950
5	A'	1734	1669
6	A'	1504	1448
7	A'	1460	1405
8	A'	1408	1356
9	A'	1284	1236
10	A'	1121	1079
11	A'	1028	990
12	A'	872	839
13	A'	552	531
14	A'	424	408
15	A"	3141	3023
16	A"	1480	1424
17	A"	1071	1031
18	A"	846	815
19	A"	573	552
20	A"	488	470
21	A"	114	110

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.132	0.000
C2	0.935	-1.047	0.000
N3	0.266	1.378	0.000
O4	-1.300	-0.272	0.000
H5	1.973	-0.714	0.000
H6	0.750	-1.662	0.884
H7	0.750	-1.662	-0.884
H8	1.275	1.515	0.000
H9	-1.824	0.543	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5048	1.2743	1.3614	2.1467	2.1361	2.1361	1.8809	1.8698
C2	1.5048		2.5158	2.3653	1.0902	1.0924	1.0924	2.5843	3.1843
N3	1.2743	2.5158		2.2756	2.6999	3.2029	3.2029	1.0180	2.2515
O4	1.3614	2.3653	2.2756		3.3025	2.6297	2.6297	3.1346	0.9691
H5	2.1467	1.0902	2.6999	3.3025		1.7819	1.7819	2.3353	3.9997
H6	2.1361	1.0924	3.2029	2.6297	1.7819		1.7676	3.3390	3.5028
H7	2.1361	1.0924	3.2029	2.6297	1.7819	1.7676		3.3390	3.5028
H8	1.8809	2.5843	1.0180	3.1346	2.3353	3.3390	3.3390		3.2483
H9	1.8698	3.1843	2.2515	0.9691	3.9997	3.5028	3.5028	3.2483

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.615	C1	C2	H6	109.639
C1	C2	H7	109.639	C1	N3	H8	109.773
C1	O4	H9	105.465	C2	C1	N3	129.522
C2	C1	O4	111.122	N3	C1	O4	119.356
H5	C2	H6	109.451	H5	C2	H7	109.451
H6	C2	H7	108.002

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

using model chemistry: CCSD(T)/TZVP

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: CCSD(T)/TZVP

States and conformations

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