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	hartrees
Energy at 0K	-208.185887
Energy at 298.15K	-208.191675
Nuclear repulsion energy	122.070783

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3647	3609	40.16
2	A	3507	3471	31.65
3	A	3077	3045	11.24
4	A	3076	3044	0.61
5	A	2986	2955	5.20
6	A	1792	1773	307.24
7	A	1548	1532	154.48
8	A	1428	1413	23.25
9	A	1391	1376	12.45
10	A	1346	1332	125.74
11	A	1305	1291	5.97
12	A	1084	1072	0.64
13	A	1005	994	8.46
14	A	942	933	2.33
15	A	848	839	2.31
16	A	677	670	14.71
17	A	528	522	13.47
18	A	513	507	12.68
19	A	418	414	4.89
20	A	299	296	189.73
21	A	39	39	6.42

Atom	x (Å)	y (Å)	z (Å)
C1	-1.346	-0.338	-0.000
C2	0.075	0.144	-0.000
N3	1.018	-0.830	0.000
O4	0.360	1.326	-0.000
H5	-1.853	0.077	-0.883
H6	-1.460	-1.432	-0.000
H7	-1.853	0.076	0.884
H8	1.993	-0.541	0.000
H9	0.788	-1.817	-0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5009	2.4147	2.3834	1.0996	1.0998	1.0996	3.3455	2.5967
C2	1.5009		1.3553	1.2158	2.1218	2.2003	2.1218	2.0367	2.0868
N3	2.4147	1.3553		2.2539	3.1374	2.5503	3.1372	1.0170	1.0139
O4	2.3834	1.2158	2.2539		2.6902	3.3046	2.6904	2.4806	3.1723
H5	1.0996	2.1218	3.1374	2.6902		1.7918	1.7670	3.9942	3.3678
H6	1.0998	2.2003	2.5503	3.3046	1.7918		1.7918	3.5665	2.2810
H7	1.0996	2.1218	3.1372	2.6904	1.7670	1.7918		3.9941	3.3675
H8	3.3455	2.0367	1.0170	2.4806	3.9942	3.5665	3.9941		1.7553
H9	2.5967	2.0868	1.0139	3.1723	3.3678	2.2810	3.3675	1.7553

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	115.335	C1	C2	O4	122.283
C2	C1	H5	108.366	C2	C1	H6	114.691
C2	C1	H7	108.366	C2	N3	H8	117.587
C2	N3	H9	122.821	N3	C2	O4	122.382
H5	C1	H6	109.109	H5	C1	H7	106.921
H6	C1	H7	109.108	H8	N3	H9	119.592

All results from a given calculation for CH₃CONH₂ (Acetamide)

using model chemistry: SVWN/6-311G**

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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Number	Element	Mulliken
1	C	-0.456
2	C	0.252
3	N	-0.470
4	O	-0.321
5	H	0.184
6	H	0.135
7	H	0.184
8	H	0.250
9	H	0.242

	x	y	z	Total
	0.007	-3.754	0.000	3.754
CHELPG
AIM
ESP

	x	y	z
x	5.783	-0.228	0.000
y	-0.228	5.752	0.000
z	0.000	0.000	3.421

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH3CONH2 (Acetamide)

using model chemistry: SVWN/6-311G**

States and conformations

All results from a given calculation for CH₃CONH₂ (Acetamide)