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	hartrees
Energy at 0K	-3397.345391
Energy at 298.15K	-3397.344193
HF Energy	-3397.345391
Nuclear repulsion energy	454.761777

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1000	968	96.26
2	A'	372	360	47.59
3	A'	259	251	5.90
4	A'	140	135	0.28
5	A"	343	331	110.76
6	A"	229	221	0.08

Atom	x (Å)	y (Å)	z (Å)
Se1	0.075	0.254	0.000
O2	-0.641	1.773	0.000
Cl3	0.075	-0.671	1.899
Cl4	0.075	-0.671	-1.899

	Se1	O2	Cl3	Cl4
Se1		1.6797	2.1125	2.1125
O2	1.6797		3.1770	3.1770
Cl3	2.1125	3.1770		3.7988
Cl4	2.1125	3.1770	3.7988

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	Se1	Cl3	113.320		O2	Se1	Cl4	113.320
Cl3	Se1	Cl4	128.086

All results from a given calculation for SeOCl₂ (selenium oxychloride)

using model chemistry: B3LYP/aug-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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All results from a given calculation for SeOCl2 (selenium oxychloride)

using model chemistry: B3LYP/aug-cc-pVTZ

States and conformations

All results from a given calculation for SeOCl₂ (selenium oxychloride)