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	hartrees
Energy at 0K	-865.010052
Energy at 298.15K	-865.010715
Nuclear repulsion energy	139.446249

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1134	1113	84.42
2	A'	678	666	41.53
3	A'	362	356	9.13

Atom	x (Å)	y (Å)
O1	1.488	0.831
S2	0.000	0.669
S3	-0.744	-1.084

	O1	S2	S3
O1		1.4965	2.9405
S2	1.4965		1.9041
S3	2.9405	1.9041

Number	Element	Mulliken
1	O	-0.314
2	S	0.471
3	S	-0.157

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

using model chemistry: LSDA/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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-0.992	0.758	0.000	1.249
CHELPG
AIM
ESP

	x	y	z
x	4.858	2.498	0.000
y	2.498	6.315	0.000
z	0.000	0.000	2.327

<r²>	0.000
(<r²>)^1/2	0.000