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	hartrees
Energy at 0K	-60.372244
Energy at 298.15K	-60.378823
HF Energy	-60.372244
Nuclear repulsion energy	101.405458

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3444	3335	28.88
2	A'	3238	3136	1.75
3	A'	3092	2994	2.94
4	A'	1575	1525	33.51
5	A'	1441	1395	14.25
6	A'	1345	1303	0.11
7	A'	1008	976	20.02
8	A'	847	821	138.12
9	A'	750	727	28.41
10	A'	600	581	42.06
11	A'	523	506	125.93
12	A'	323	313	42.98
13	A'	296	287	13.01
14	A'	217	210	7.20
15	A"	3609	3495	31.94
16	A"	3245	3142	1.62
17	A"	1445	1399	12.56
18	A"	1102	1067	24.03
19	A"	996	965	11.87
20	A"	832	806	41.09
21	A"	279	270	6.62
22	A"	237	229	8.41
23	A"	165	160	46.60
24	A"	147	142	0.10

Atom	x (Å)	y (Å)	z (Å)
C1	-0.569	1.718	0.000
S2	-0.110	-0.136	0.000
N3	1.726	-0.065	0.000
O4	-0.569	-0.792	1.461
O5	-0.569	-0.792	-1.461
H6	-1.666	1.744	0.000
H7	-0.134	2.138	0.915
H8	-0.134	2.138	-0.915
H9	2.067	-0.511	0.864
H10	2.067	-0.511	-0.864

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.9095	2.9062	2.9046	2.9046	1.0973	1.0967	1.0967	3.5582	3.5582
S2	1.9095		1.8371	1.6664	1.6664	2.4398	2.4508	2.4508	2.3718	2.3718
N3	2.9062	1.8371		2.8159	2.8159	3.8440	3.0249	3.0249	1.0299	1.0299
O4	2.9046	1.6664	2.8159		2.9221	3.1257	3.0124	3.7976	2.7173	3.5259
O5	2.9046	1.6664	2.8159	2.9221		3.1257	3.7976	3.0124	3.5259	2.7173
H6	1.0973	2.4398	3.8440	3.1257	3.1257		1.8275	1.8275	4.4455	4.4455
H7	1.0967	2.4508	3.0249	3.0124	3.7976	1.8275		1.8298	3.4441	3.8759
H8	1.0967	2.4508	3.0249	3.7976	3.0124	1.8275	1.8298		3.8759	3.4441
H9	3.5582	2.3718	1.0299	2.7173	3.5259	4.4455	3.4441	3.8759		1.7274
H10	3.5582	2.3718	1.0299	3.5259	2.7173	4.4455	3.8759	3.4441	1.7274

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	101.717	C1	S2	O4	108.446
C1	S2	O5	108.446	S2	C1	H6	105.255
S2	C1	H7	106.045	S2	C1	H8	106.045
S2	N3	H9	108.326	S2	N3	H10	108.326
N3	S2	O4	106.876	N3	S2	O5	106.876
O4	S2	O5	122.515	H6	C1	H7	112.808
H6	C1	H8	112.808	H7	C1	H8	113.068
H9	N3	H10	113.989

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: B3LYP/CEP-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	-0.398
2	S	0.611
3	N	-0.606
4	O	-0.448
5	O	-0.448
6	H	0.228
7	H	0.217
8	H	0.217
9	H	0.314
10	H	0.314

	x	y	z	Total
	2.655	3.747	0.000	4.593
CHELPG
AIM
ESP

	x	y	z
x	7.339	-0.247	0.000
y	-0.247	6.876	0.000
z	0.000	0.000	7.720

<r²>	116.239
(<r²>)^1/2	10.781

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: B3LYP/CEP-31G

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)