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	hartrees
Energy at 0K	-636.519286
Energy at 298.15K	-636.525117
HF Energy	-636.519286
Nuclear repulsion energy	249.152237

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3515	3137	0.56
2	A'	3345	2985	30.86
3	A'	3305	2949	19.06
4	A'	1812	1617	3.44
5	A'	1622	1448	4.13
6	A'	1398	1248	3.40
7	A'	1089	972	46.72
8	A'	952	850	14.16
9	A'	849	758	27.93
10	A'	609	543	63.69
11	A'	563	503	55.82
12	A'	286	256	12.18
13	A'	257	230	10.83
14	A'	206	184	5.47
15	A"	3540	3159	19.46
16	A"	3519	3141	1.12
17	A"	1623	1449	3.64
18	A"	1118	998	6.83
19	A"	999	891	27.43
20	A"	894	798	0.72
21	A"	267	238	9.65
22	A"	189	169	5.89
23	A"	115	103	36.24
24	A"	25	22	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	-0.565	1.740	0.000
S2	-0.155	-0.174	0.000
N3	1.810	0.114	0.000
O4	-0.565	-0.848	1.423
O5	-0.565	-0.848	-1.423
H6	-1.658	1.857	0.000
H7	-0.116	2.168	0.906
H8	-0.116	2.168	-0.906
H9	2.063	-0.540	0.819
H10	2.063	-0.540	-0.819

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.9575	2.8777	2.9538	2.9538	1.0992	1.0986	1.0986	3.5745	3.5745
S2	1.9575		1.9851	1.6275	1.6275	2.5267	2.5116	2.5116	2.3925	2.3925
N3	2.8777	1.9851		2.9311	2.9311	3.8807	2.9573	2.9573	1.0786	1.0786
O4	2.9538	1.6275	2.9311		2.8464	3.2461	3.0932	3.8377	2.7146	3.4688
O5	2.9538	1.6275	2.9311	2.8464		3.2461	3.8377	3.0932	3.4688	2.7146
H6	1.0992	2.5267	3.8807	3.2461	3.2461		1.8159	1.8159	4.5014	4.5014
H7	1.0986	2.5116	2.9573	3.0932	3.8377	1.8159		1.8129	3.4768	3.8805
H8	1.0986	2.5116	2.9573	3.8377	3.0932	1.8159	1.8129		3.8805	3.4768
H9	3.5745	2.3925	1.0786	2.7146	3.4688	4.5014	3.4768	3.8805		1.6383
H10	3.5745	2.3925	1.0786	3.4688	2.7146	4.5014	3.8805	3.4768	1.6383

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	93.756	C1	S2	O4	110.622
C1	S2	O5	110.622	S2	C1	H6	108.204
S2	C1	H7	107.172	S2	C1	H8	107.172
S2	N3	H9	98.327	S2	N3	H10	98.327
N3	S2	O4	108.046	N3	S2	O5	108.046
O4	S2	O5	121.964	H6	C1	H7	111.430
H6	C1	H8	111.430	H7	C1	H8	111.197
H9	N3	H10	98.841

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: B3LYP/STO-3G

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	-0.286
2	S	0.774
3	N	-0.384
4	O	-0.331
5	O	-0.331
6	H	0.092
7	H	0.099
8	H	0.099
9	H	0.133
10	H	0.133

	x	y	z	Total
	0.485	0.982	0.000	1.095
CHELPG
AIM
ESP

	x	y	z
x	5.312	-0.425	0.000
y	-0.425	4.660	0.000
z	0.000	0.000	4.567

<r²>	142.279
(<r²>)^1/2	11.928

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: B3LYP/STO-3G

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)