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	hartrees
Energy at 0K	-510.813159
Energy at 298.15K	-510.812960
HF Energy	-510.314031
Nuclear repulsion energy	78.268110

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	1987	1913
2	Σ	842	811
3	Π	489	471
3	Π	489	471

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.528
O2	0.000	0.000	-1.707
S3	0.000	0.000	1.051

	C1	O2	S3
C1		1.1789	1.5792
O2	1.1789		2.7581
S3	1.5792	2.7581

All results from a given calculation for OCS (Carbonyl sulfide)

using model chemistry: MP4/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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