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	hartrees
Energy at 0K	-208.874208
Energy at 298.15K	-208.880584
HF Energy	-208.039376
Nuclear repulsion energy	121.615203

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3778	3683
2	A'	3526	3437
3	A'	3155	3076
4	A'	3056	2979
5	A'	1743	1699
6	A'	1496	1458
7	A'	1458	1421
8	A'	1394	1358
9	A'	1274	1242
10	A'	1121	1092
11	A'	1021	995
12	A'	877	854
13	A'	549	535
14	A'	420	409
15	A"	3128	3049
16	A"	1482	1445
17	A"	1071	1044
18	A"	858	837
19	A"	621	605
20	A"	519	506
21	A"	138	134

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.131	0.000
C2	0.921	-1.054	0.000
N3	0.282	1.373	0.000
O4	-1.300	-0.257	0.000
H5	1.962	-0.737	0.000
H6	0.728	-1.669	0.881
H7	0.728	-1.669	-0.881
H8	1.290	1.498	0.000
H9	-1.810	0.565	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5016	1.2731	1.3570	2.1455	2.1321	2.1321	1.8793	1.8612
C2	1.5016		2.5099	2.3604	1.0882	1.0910	1.0910	2.5786	3.1752
N3	1.2731	2.5099		2.2717	2.6967	3.1977	3.1977	1.0159	2.2427
O4	1.3570	2.3604	2.2717		3.2975	2.6236	2.6236	3.1289	0.9671
H5	2.1455	1.0882	2.6967	3.2975		1.7796	1.7796	2.3331	3.9903
H6	2.1321	1.0910	3.1977	2.6236	1.7796		1.7612	3.3343	3.4938
H7	2.1321	1.0910	3.1977	2.6236	1.7796	1.7612		3.3343	3.4938
H8	1.8793	2.5786	1.0159	3.1289	2.3331	3.3343	3.3343		3.2376
H9	1.8612	3.1752	2.2427	0.9671	3.9903	3.4938	3.4938	3.2376

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.876	C1	C2	H6	109.635
C1	C2	H7	109.635	C1	N3	H8	109.867
C1	O4	H9	105.176	C2	C1	N3	129.344
C2	C1	O4	111.221	N3	C1	O4	119.435
H5	C2	H6	109.497	H5	C2	H7	109.497
H6	C2	H7	107.638

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

using model chemistry: CCSD(T)/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 CH3C(OH)=NH (Ethaninidic acid)

using model chemistry: CCSD(T)/cc-pVTZ

States and conformations

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