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	hartrees
Energy at 0K	-510.885159
Energy at 298.15K	-510.885027
HF Energy	-510.337431
Nuclear repulsion energy	78.953627

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	2100	1994	586.23	24.69	0.37	0.54
2	Σ	890	845	6.64	28.30	0.22	0.36
3	Π	523	497	1.74	0.97	0.75	0.86
3	Π	523	497	1.74	0.97	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.524
O2	0.000	0.000	-1.692
S3	0.000	0.000	1.042

	C1	O2	S3
C1		1.1683	1.5660
O2	1.1683		2.7343
S3	1.5660	2.7343

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

using model chemistry: MP2/cc-pVTZ

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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