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	hartrees
Energy at 0K	-3179.740936
Energy at 298.15K	-3179.741325
Nuclear repulsion energy	1124.178511

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	414	373	0.00
2	A₁	180	162	0.00
3	B₁	456	411	0.00
4	B₂	217	195	4.23
5	E₁	418	376	0.71
5	E₁	418	376	0.71
6	E₁	161	145	0.37
6	E₁	161	145	0.37
7	E₂	447	403	0.00
7	E₂	447	403	0.00
8	E₂	137	124	0.00
8	E₂	137	124	0.00
9	E₂	45	40	0.00
9	E₂	45	40	0.00
10	E₃	458	412	0.00
10	E₃	458	412	0.00
11	E₃	202	182	0.00
11	E₃	202	182	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	2.509	0.577
S2	2.509	0.000	0.577
S3	0.000	-2.509	0.577
S4	-2.509	0.000	0.577
S5	-1.774	1.774	-0.577
S6	-1.774	-1.774	-0.577
S7	1.774	-1.774	-0.577
S8	1.774	1.774	-0.577

	S1	S2	S3	S4	S5	S6	S7	S8
S1		3.5480	5.0176	3.5480	2.2398	4.7770	4.7770	2.2398
S2	3.5480		3.5480	5.0176	4.7770	4.7770	2.2398	2.2398
S3	5.0176	3.5480		3.5480	4.7770	2.2398	2.2398	4.7770
S4	3.5480	5.0176	3.5480		2.2398	2.2398	4.7770	4.7770
S5	2.2398	4.7770	4.7770	2.2398		3.5480	5.0176	3.5480
S6	4.7770	4.7770	2.2398	2.2398	3.5480		3.5480	5.0176
S7	4.7770	2.2398	2.2398	4.7770	5.0176	3.5480		3.5480
S8	2.2398	2.2398	4.7770	4.7770	3.5480	5.0176	3.5480

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S5	S4	104.750	S1	S8	S2	104.750
S2	S7	S3	104.750	S3	S6	S4	104.750
S5	S1	S8	104.750	S5	S4	S6	104.750
S6	S3	S7	104.750	S7	S2	S8	104.750

All results from a given calculation for S₈ (Octasulfur)

using model chemistry: HF/SDD

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>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for S8 (Octasulfur)

using model chemistry: HF/SDD

States and conformations

All results from a given calculation for S₈ (Octasulfur)