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	hartrees
Energy at 0K	-3181.053160
Energy at 298.15K	-3181.054374
HF Energy	-3180.075505
Nuclear repulsion energy	1202.593538

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	490	459	0.00
2	A₁	221	207	0.00
3	B₁	453	424	0.00
4	B₂	256	240	7.77
5	E₁	484	454	0.77
5	E₁	484	454	0.77
6	E₁	199	187	3.33
6	E₁	199	187	3.33
7	E₂	491	460	0.00
7	E₂	491	460	0.00
8	E₂	155	145	0.00
8	E₂	155	145	0.00
9	E₂	74	69	0.00
9	E₂	74	69	0.00
10	E₃	466	436	0.00
10	E₃	466	436	0.00
11	E₃	255	239	0.00
11	E₃	255	239	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	2.372	0.495
S2	2.372	0.000	0.495
S3	0.000	-2.372	0.495
S4	-2.372	0.000	0.495
S5	-1.677	1.677	-0.495
S6	-1.677	-1.677	-0.495
S7	1.677	-1.677	-0.495
S8	1.677	1.677	-0.495

	S1	S2	S3	S4	S5	S6	S7	S8
S1		3.3548	4.7443	3.3548	2.0677	4.4935	4.4935	2.0677
S2	3.3548		3.3548	4.7443	4.4935	4.4935	2.0677	2.0677
S3	4.7443	3.3548		3.3548	4.4935	2.0677	2.0677	4.4935
S4	3.3548	4.7443	3.3548		2.0677	2.0677	4.4935	4.4935
S5	2.0677	4.4935	4.4935	2.0677		3.3548	4.7443	3.3548
S6	4.4935	4.4935	2.0677	2.0677	3.3548		3.3548	4.7443
S7	4.4935	2.0677	2.0677	4.4935	4.7443	3.3548		3.3548
S8	2.0677	2.0677	4.4935	4.4935	3.3548	4.7443	3.3548

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S5	S4	108.435	S1	S8	S2	108.435
S2	S7	S3	108.435	S3	S6	S4	108.435
S5	S1	S8	108.435	S5	S4	S6	108.435
S6	S3	S7	108.435	S7	S2	S8	108.435

All results from a given calculation for S₈ (Octasulfur)

using model chemistry: MP2/6-31G**

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 S8 (Octasulfur)

using model chemistry: MP2/6-31G**

States and conformations

All results from a given calculation for S₈ (Octasulfur)