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	hartrees
Energy at 0K	-39.847027
Energy at 298.15K	-39.852838
HF Energy	-39.277608
Nuclear repulsion energy	67.398014

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3753	3563	37.66
2	A	3609	3426	43.33
3	A	3219	3056	13.50
4	A	3205	3043	17.83
5	A	3106	2949	10.14
6	A	1791	1700	332.79
7	A	1651	1568	91.20
8	A	1519	1443	9.78
9	A	1500	1424	8.35
10	A	1440	1367	76.99
11	A	1361	1293	114.75
12	A	1139	1081	0.24
13	A	1074	1020	5.45
14	A	999	948	9.50
15	A	865	821	2.15
16	A	652	619	26.00
17	A	542	515	25.89
18	A	514	488	23.15
19	A	425	404	6.22
20	A	319	303	272.55
21	A	28	26	3.78

Atom	x (Å)	y (Å)	z (Å)
C1	-1.384	-0.332	-0.000
C2	0.075	0.147	-0.002
N3	1.033	-0.862	-0.053
O4	0.386	1.350	0.008
H5	-1.938	0.257	-0.749
H6	-1.484	-1.407	-0.225
H7	-1.820	-0.121	0.991
H8	1.995	-0.572	0.114
H9	0.784	-1.817	0.190

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5355	2.4745	2.4410	1.1017	1.1028	1.1036	3.3895	2.6349
C2	1.5355		1.3915	1.2425	2.1505	2.2124	2.1563	2.0533	2.0968
N3	2.4745	1.3915		2.3052	3.2499	2.5807	3.1267	1.0192	1.0167
O4	2.4410	1.2425	2.3052		2.6777	3.3390	2.8273	2.5089	3.1973
H5	1.1017	2.1505	3.2499	2.6777		1.8021	1.7844	4.1115	3.5488
H6	1.1028	2.2124	2.5807	3.3390	1.8021		1.8015	3.5941	2.3420
H7	1.1036	2.1563	3.1267	2.8273	1.7844	1.8015		3.9403	3.2095
H8	3.3895	2.0533	1.0192	2.5089	4.1115	3.5941	3.9403		1.7388
H9	2.6349	2.0968	1.0167	3.1973	3.5488	2.3420	3.2095	1.7388

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	115.338	C1	C2	O4	122.619
C2	C1	H5	108.137	C2	C1	H6	112.946
C2	C1	H7	108.474	C2	N3	H8	115.945
C2	N3	H9	120.275	N3	C2	O4	122.021
H5	C1	H6	109.657	H5	C1	H7	108.030
H6	C1	H7	109.468	H8	N3	H9	117.314

All results from a given calculation for CH₃CONH₂ (Acetamide)

using model chemistry: MP2/CEP-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 CH3CONH2 (Acetamide)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for CH₃CONH₂ (Acetamide)