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	hartrees
Energy at 0K	-644.083356
Energy at 298.15K	-644.091101
HF Energy	-643.801158
Nuclear repulsion energy	275.663518

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3544	3375	39.50
2	A'	3224	3070	0.04
3	A'	3112	2964	0.41
4	A'	1613	1536	44.03
5	A'	1482	1412	6.57
6	A'	1388	1322	8.98
7	A'	1121	1068	189.48
8	A'	1011	963	19.89
9	A'	885	842	117.02
10	A'	725	690	19.97
11	A'	681	649	227.06
12	A'	487	464	42.64
13	A'	461	439	14.81
14	A'	290	276	4.53
15	A"	3662	3488	57.20
16	A"	3232	3078	0.10
17	A"	1484	1413	3.21
18	A"	1331	1267	271.56
19	A"	1098	1046	6.32
20	A"	998	950	0.59
21	A"	391	372	0.04
22	A"	327	311	3.59
23	A"	232	221	0.85
24	A"	180	172	41.86

Atom	x (Å)	y (Å)	z (Å)
C1	-1.681	-0.060	0.000
S2	0.107	-0.135	0.000
N3	0.534	1.500	0.000
O4	0.534	-0.703	1.285
O5	0.534	-0.703	-1.285
H6	-2.037	-1.089	0.000
H7	-2.005	0.461	0.898
H8	-2.005	0.461	-0.898
H9	1.062	1.721	0.839
H10	1.062	1.721	-0.839

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7895	2.7093	2.6404	2.6404	1.0889	1.0877	1.0877	3.3762	3.3762
S2	1.7895		1.6902	1.4684	1.4684	2.3465	2.3717	2.3717	2.2498	2.2498
N3	2.7093	1.6902		2.5505	2.5505	3.6488	2.8871	2.8871	1.0155	1.0155
O4	2.6404	1.4684	2.5505		2.5702	2.9002	2.8206	3.5455	2.5206	3.2659
O5	2.6404	1.4684	2.5505	2.5702		2.9002	3.5455	2.8206	3.2659	2.5206
H6	1.0889	2.3465	3.6488	2.9002	2.9002		1.7917	1.7917	4.2665	4.2665
H7	1.0877	2.3717	2.8871	2.8206	3.5455	1.7917		1.7956	3.3167	3.7435
H8	1.0877	2.3717	2.8871	3.5455	2.8206	1.7917	1.7956		3.7435	3.3167
H9	3.3762	2.2498	1.0155	2.5206	3.2659	4.2665	3.3167	3.7435		1.6780
H10	3.3762	2.2498	1.0155	3.2659	2.5206	4.2665	3.7435	3.3167	1.6780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	102.226	C1	S2	O4	107.874
C1	S2	O5	107.874	S2	C1	H6	106.671
S2	C1	H7	108.568	S2	C1	H8	108.568
S2	N3	H9	109.984	S2	N3	H10	109.984
N3	S2	O4	107.491	N3	S2	O5	107.491
O4	S2	O5	122.125	H6	C1	H7	110.807
H6	C1	H8	110.807	H7	C1	H8	111.259
H9	N3	H10	111.410

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: B2PLYP/6-31+G**

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	-0.475
2	S	1.227
3	N	-0.807
4	O	-0.609
5	O	-0.609
6	H	0.202
7	H	0.194
8	H	0.194
9	H	0.341
10	H	0.341

	x	y	z	Total
	-1.825	3.077	0.000	3.577
CHELPG
AIM
ESP

	x	y	z
x	7.021	0.158	0.000
y	0.158	6.827	0.000
z	0.000	0.000	7.033

<r²>	122.618
(<r²>)^1/2	11.073

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: B2PLYP/6-31+G**

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)