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	hartrees
Energy at 0K	-636.501946
Energy at 298.15K	-636.508057
HF Energy	-636.501946
Nuclear repulsion energy	254.595273

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3586	3586	3.35
2	A'	3487	3487	23.04
3	A'	3382	3382	22.21
4	A'	1808	1808	4.83
5	A'	1635	1635	4.99
6	A'	1452	1452	2.84
7	A'	1074	1074	51.26
8	A'	1006	1006	10.13
9	A'	843	843	39.96
10	A'	685	685	50.03
11	A'	656	656	45.06
12	A'	295	295	12.34
13	A'	262	262	26.03
14	A'	224	224	6.83
15	A"	3685	3685	2.42
16	A"	3587	3587	4.12
17	A"	1641	1641	4.58
18	A"	1187	1187	3.99
19	A"	1040	1040	29.19
20	A"	925	925	4.33
21	A"	275	275	11.59
22	A"	191	191	1.87
23	A"	114	114	45.25
24	A"	77	77	0.30

Atom	x (Å)	y (Å)	z (Å)
C1	-0.535	1.702	0.000
S2	-0.152	-0.157	0.000
N3	1.717	0.086	0.000
O4	-0.535	-0.833	1.418
O5	-0.535	-0.833	-1.418
H6	-1.621	1.834	0.000
H7	-0.085	2.130	0.901
H8	-0.085	2.130	-0.901
H9	1.987	-0.536	0.822
H10	1.987	-0.536	-0.822

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.8973	2.7716	2.9045	2.9045	1.0945	1.0942	1.0942	3.4702	3.4702
S2	1.8973		1.8852	1.6169	1.6169	2.4735	2.4584	2.4584	2.3233	2.3233
N3	2.7716	1.8852		2.8153	2.8153	3.7682	2.8703	2.8703	1.0653	1.0653
O4	2.9045	1.6169	2.8153		2.8358	3.2096	3.0409	3.7892	2.6086	3.3862
O5	2.9045	1.6169	2.8153	2.8358		3.2096	3.7892	3.0409	3.3862	2.6086
H6	1.0945	2.4735	3.7682	3.2096	3.2096		1.8053	1.8053	4.3944	4.3944
H7	1.0942	2.4584	2.8703	3.0409	3.7892	1.8053		1.8025	3.3773	3.7907
H8	1.0942	2.4584	2.8703	3.7892	3.0409	1.8053	1.8025		3.7907	3.3773
H9	3.4702	2.3233	1.0653	2.6086	3.3862	4.3944	3.3773	3.7907		1.6438
H10	3.4702	2.3233	1.0653	3.3862	2.6086	4.3944	3.7907	3.3773	1.6438

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	94.236	C1	S2	O4	111.234
C1	S2	O5	111.234	S2	C1	H6	108.537
S2	C1	H7	107.476	S2	C1	H8	107.476
S2	N3	H9	100.168	S2	N3	H10	100.168
N3	S2	O4	106.757	N3	S2	O5	106.757
O4	S2	O5	122.551	H6	C1	H7	111.137
H6	C1	H8	111.137	H7	C1	H8	110.907
H9	N3	H10	100.985

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: M06-2X/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	-0.287
2	S	0.847
3	N	-0.410
4	O	-0.376
5	O	-0.376
6	H	0.096
7	H	0.102
8	H	0.102
9	H	0.151
10	H	0.151

	x	y	z	Total
	0.833	1.388	0.000	1.619
CHELPG
AIM
ESP

	x	y	z
x	4.767	-0.404	0.000
y	-0.404	4.284	0.000
z	0.000	0.000	4.396

<r²>	136.619
(<r²>)^1/2	11.688

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: M06-2X/STO-3G

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)