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	hartrees
Energy at 0K	-861.571068
Energy at 298.15K
HF Energy	-861.571068
Nuclear repulsion energy	129.869373

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'	953	882	17.08	6.53	0.26	0.42
2	A'	621	574	3.37	8.84	0.27	0.42
3	A'	311	288	6.16	5.69	0.66	0.80

Atom	x (Å)	y (Å)
O1	1.646	0.668
S2	0.000	0.765
S3	-0.823	-1.099

	O1	S2	S3
O1		1.6493	3.0365
S2	1.6493		2.0373
S3	3.0365	2.0373

Number	Element	Mulliken
1	O	-0.224
2	S	0.307
3	S	-0.083

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

using model chemistry: BLYP/STO-3G

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
	-0.745	0.746	0.000	1.054
CHELPG
AIM
ESP

	x	y	z
x	3.428	2.076	0.000
y	2.076	3.440	0.000
z	0.000	0.000	0.867

<r²>	81.554
(<r²>)^1/2	9.031