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	hartrees
Energy at 0K	-869.880666
Energy at 298.15K
HF Energy	-869.880666
Nuclear repulsion energy	143.053048

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1338	1215	321.74	44.04	0.35	0.52
2	A'	771	701	87.66	56.73	0.28	0.43
3	A'	431	392	20.44	6.47	0.67	0.80

Atom	x (Å)	y (Å)
O1	1.438	0.780
S2	0.000	0.672
S3	-0.719	-1.062

	O1	S2	S3
O1		1.4416	2.8361
S2	1.4416		1.8767
S3	2.8361	1.8767

Number	Element	Mulliken
1	O	-0.425
2	S	0.614
3	S	-0.189

All results from a given calculation for SSO (Disulfur monoxide)

using model chemistry: HF/TZVP

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-1.908	0.686	0.000	2.027
CHELPG
AIM
ESP

	x	y	z
x	5.522	2.811	0.000
y	2.811	7.153	0.000
z	0.000	0.000	2.532

<r²>	74.852
(<r²>)^1/2	8.652