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	hartrees
Energy at 0K	-644.379549
Energy at 298.15K	-644.387299
HF Energy	-644.379549
Nuclear repulsion energy	277.830797

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3548	3368	40.68
2	A'	3225	3061	0.11
3	A'	3117	2959	0.03
4	A'	1629	1547	47.01
5	A'	1483	1408	7.07
6	A'	1388	1317	17.83
7	A'	1174	1115	185.13
8	A'	1009	958	31.25
9	A'	907	861	119.98
10	A'	745	707	9.86
11	A'	695	660	260.59
12	A'	498	473	42.06
13	A'	476	452	19.78
14	A'	290	275	4.82
15	A"	3662	3476	49.73
16	A"	3234	3070	0.25
17	A"	1484	1409	0.72
18	A"	1401	1330	245.80
19	A"	1112	1056	1.54
20	A"	994	943	1.72
21	A"	396	376	0.14
22	A"	325	309	3.56
23	A"	231	220	0.39
24	A"	167	158	45.29

Atom	x (Å)	y (Å)	z (Å)
C1	-1.668	-0.056	0.000
S2	0.107	-0.135	0.000
N3	0.530	1.488	0.000
O4	0.530	-0.698	1.272
O5	0.530	-0.698	-1.272
H6	-2.034	-1.083	0.000
H7	-2.000	0.465	0.896
H8	-2.000	0.465	-0.896
H9	1.063	1.701	0.837
H10	1.063	1.701	-0.837

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7773	2.6866	2.6196	2.6196	1.0898	1.0884	1.0884	3.3536	3.3536
S2	1.7773		1.6770	1.4538	1.4538	2.3417	2.3671	2.3671	2.2324	2.2324
N3	2.6866	1.6770		2.5294	2.5294	3.6310	2.8726	2.8726	1.0143	1.0143
O4	2.6196	1.4538	2.5294		2.5432	2.8877	2.8096	3.5289	2.4963	3.2383
O5	2.6196	1.4538	2.5294	2.5432		2.8877	3.5289	2.8096	3.2383	2.4963
H6	1.0898	2.3417	3.6310	2.8877	2.8877		1.7887	1.7887	4.2474	4.2474
H7	1.0884	2.3671	2.8726	2.8096	3.5289	1.7887		1.7928	3.3034	3.7298
H8	1.0884	2.3671	2.8726	3.5289	2.8096	1.7887	1.7928		3.7298	3.3034
H9	3.3536	2.2324	1.0143	2.4963	3.2383	4.2474	3.3034	3.7298		1.6731
H10	3.3536	2.2324	1.0143	3.2383	2.4963	4.2474	3.7298	3.3034	1.6731

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	102.072	C1	S2	O4	107.917
C1	S2	O5	107.917	S2	C1	H6	107.068
S2	C1	H7	108.997	S2	C1	H8	108.997
S2	N3	H9	109.622	S2	N3	H10	109.622
N3	S2	O4	107.571	N3	S2	O5	107.571
O4	S2	O5	122.019	H6	C1	H7	110.397
H6	C1	H8	110.397	H7	C1	H8	110.886
H9	N3	H10	111.121

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: B1B95/6-31G*

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	-0.668
2	S	1.145
3	N	-0.855
4	O	-0.528
5	O	-0.528
6	H	0.233
7	H	0.225
8	H	0.225
9	H	0.375
10	H	0.375

	x	y	z	Total
	-1.507	2.988	0.000	3.347
CHELPG
AIM
ESP

	x	y	z
x	5.673	0.339	0.000
y	0.339	5.579	0.000
z	0.000	0.000	5.734

<r²>	120.133
(<r²>)^1/2	10.961

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: B1B95/6-31G*

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)