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	hartrees
Energy at 0K	-643.771347
Energy at 298.15K	-643.778222
HF Energy	-643.771347
Nuclear repulsion energy	258.007507

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3524	3369	41.54
2	A'	3267	3122	1.74
3	A'	3129	2991	0.36
4	A'	1606	1535	42.27
5	A'	1483	1417	16.80
6	A'	1390	1329	5.32
7	A'	1044	998	25.80
8	A'	866	828	167.63
9	A'	842	805	29.65
10	A'	649	621	16.15
11	A'	543	519	217.35
12	A'	368	352	23.23
13	A'	334	320	36.47
14	A'	231	221	5.09
15	A"	3687	3524	53.21
16	A"	3273	3129	1.54
17	A"	1487	1421	15.45
18	A"	1150	1099	49.89
19	A"	1027	982	11.63
20	A"	941	900	24.89
21	A"	304	291	2.86
22	A"	247	236	12.23
23	A"	159	152	1.07
24	A"	152	145	41.62

Atom	x (Å)	y (Å)	z (Å)
C1	-0.557	1.664	0.000
S2	-0.105	-0.132	0.000
N3	1.678	-0.049	0.000
O4	-0.557	-0.784	1.419
O5	-0.557	-0.784	-1.419
H6	-1.645	1.710	0.000
H7	-0.131	2.096	0.903
H8	-0.131	2.096	-0.903
H9	2.048	-0.447	0.859
H10	2.048	-0.447	-0.859

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.8523	2.8164	2.8295	2.8295	1.0890	1.0879	1.0879	3.4619	3.4619
S2	1.8523		1.7849	1.6256	1.6256	2.4014	2.4039	2.4039	2.3392	2.3392
N3	2.8164	1.7849		2.7480	2.7480	3.7603	2.9472	2.9472	1.0168	1.0168
O4	2.8295	1.6256	2.7480		2.8372	3.0686	2.9566	3.7235	2.6860	3.4771
O5	2.8295	1.6256	2.7480	2.8372		3.0686	3.7235	2.9566	3.4771	2.6860
H6	1.0890	2.4014	3.7603	3.0686	3.0686		1.8052	1.8052	4.3628	4.3628
H7	1.0879	2.4039	2.9472	2.9566	3.7235	1.8052		1.8057	3.3490	3.7840
H8	1.0879	2.4039	2.9472	3.7235	2.9566	1.8052	1.8057		3.7840	3.3490
H9	3.4619	2.3392	1.0168	2.6860	3.4771	4.3628	3.3490	3.7840		1.7185
H10	3.4619	2.3392	1.0168	3.4771	2.6860	4.3628	3.7840	3.3490	1.7185

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	101.474	C1	S2	O4	108.717
C1	S2	O5	108.717	S2	C1	H6	106.563
S2	C1	H7	106.791	S2	C1	H8	106.791
S2	N3	H9	110.178	S2	N3	H10	110.178
N3	S2	O4	107.273	N3	S2	O5	107.273
O4	S2	O5	121.536	H6	C1	H7	112.038
H6	C1	H8	112.038	H7	C1	H8	112.168
H9	N3	H10	115.354

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: PBE1PBE/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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Number	Element	Mulliken
1	C	-0.694
2	S	1.250
3	N	-0.877
4	O	-0.593
5	O	-0.593
6	H	0.258
7	H	0.252
8	H	0.252
9	H	0.373
10	H	0.373

	x	y	z	Total
	2.752	3.531	0.000	4.477
CHELPG
AIM
ESP

	x	y	z
x	6.549	-0.163	0.000
y	-0.163	6.013	0.000
z	0.000	0.000	6.865

<r²>	135.841
(<r²>)^1/2	11.655

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: PBE1PBE/6-31G

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)