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	hartrees
Energy at 0K	-831.300950
Energy at 298.15K
HF Energy	-831.081496
Nuclear repulsion energy	139.169597

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3244	3022	4.32
2	A	3222	3001	2.48
3	A	3132	2917	9.15
4	A	2465	2297	24.69
5	A	1575	1467	11.32
6	A	1562	1455	12.33
7	A	1436	1338	6.13
8	A	1025	955	8.60
9	A	1017	948	3.65
10	A	820	764	3.30
11	A	649	605	1.99
12	A	428	399	0.30
13	A	236	220	28.33
14	A	210	195	0.46
15	A	149	139	1.07

Atom	x (Å)	y (Å)	z (Å)
C1	-1.676	0.805	-0.001
S2	-0.592	-0.762	0.008
S3	1.471	0.238	-0.087
H4	1.652	0.340	1.270
H5	-1.445	1.392	-0.886
H6	-2.706	0.446	-0.036
H7	-1.502	1.375	0.909

	C1	S2	S3	H4	H5	H6	H7
C1		1.9051	3.1991	3.5929	1.0873	1.0911	1.0877
S2	1.9051		2.2946	2.8005	2.4832	2.4345	2.4907
S3	3.1991	2.2946		1.3726	3.2365	4.1823	3.3351
H4	3.5929	2.8005	1.3726		3.9178	4.5508	3.3390
H5	1.0873	2.4832	3.2365	3.9178		1.7911	1.7964
H6	1.0911	2.4345	4.1823	4.5508	1.7911		1.7907
H7	1.0877	2.4907	3.3351	3.3390	1.7964	1.7907

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	98.813	S2	C1	H5	109.083
S2	C1	H6	105.441	S2	C1	H7	109.615
S2	S3	H4	96.323	H5	C1	H6	110.606
H5	C1	H7	111.364	H6	C1	H7	110.550

All results from a given calculation for CH₃SSH (Hydrogen methyl disulfide)

using model chemistry: CID/3-21G

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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All results from a given calculation for CH3SSH (Hydrogen methyl disulfide)

using model chemistry: CID/3-21G

States and conformations

All results from a given calculation for CH₃SSH (Hydrogen methyl disulfide)