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	hartrees
Energy at 0K	-2873.642472
Energy at 298.15K	-2873.642442
HF Energy	-2873.642472
Nuclear repulsion energy	304.388224

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	491	469	0.00
2	Σ_u	666	635	100.85
3	Π_u	122	116	5.58
3	Π_u	122	116	5.58

Atom	x (Å)	y (Å)	z (Å)
Ge1	0.000	0.000	0.000
S2	0.000	0.000	2.003
S3	0.000	0.000	-2.003

	Ge1	S2	S3
Ge1		2.0027	2.0027
S2	2.0027		4.0055
S3	2.0027	4.0055

Number	Element	Mulliken
1	Ge	0.531
2	S	-0.266
3	S	-0.266

All results from a given calculation for GeS₂ (Germanium disulfide)

using model chemistry: mPW1PW91/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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<r²>	155.835
(<r²>)^1/2	12.483

All results from a given calculation for GeS2 (Germanium disulfide)

using model chemistry: mPW1PW91/TZVP

States and conformations

All results from a given calculation for GeS₂ (Germanium disulfide)