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	hartrees
Energy at 0K	-1808.772863
Energy at 298.15K	-1808.777368
HF Energy	-1807.502404
Nuclear repulsion energy	786.519417

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	725	684	0.00
2	A₁	590	558	0.00
3	A₁	205	193	0.00
4	A₂	758	716	0.00
5	A₂	251	237	0.00
6	B₁	742	701	0.00
7	B₁	345	325	0.00
8	B₂	1004	948	82.03
9	B₂	572	541	98.58
10	B₂	169	160	0.17
11	E	751	709	3.50
11	E	751	709	3.51
12	E	709	670	114.80
12	E	709	670	114.79
13	E	517	488	11.19
13	E	517	488	11.18
14	E	265	250	38.84
14	E	265	250	38.89

Atom	x (Å)	y (Å)	z (Å)
N1	1.312	1.312	0.000
N2	-1.312	1.312	0.000
N3	-1.312	-1.312	0.000
N4	1.312	-1.312	0.000
S5	0.000	1.388	0.977
S6	0.000	-1.388	0.977
S7	1.388	0.000	-0.977
S8	-1.388	0.000	-0.977

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.6235	3.7102	2.6235	1.6376	3.1564	1.6376	3.1564
N2	2.6235		2.6235	3.7102	1.6376	3.1564	3.1564	1.6376
N3	3.7102	2.6235		2.6235	3.1564	1.6376	3.1564	1.6376
N4	2.6235	3.7102	2.6235		3.1564	1.6376	1.6376	3.1564
S5	1.6376	1.6376	3.1564	3.1564		2.7755	2.7699	2.7699
S6	3.1564	3.1564	1.6376	1.6376	2.7755		2.7699	2.7699
S7	1.6376	3.1564	3.1564	1.6376	2.7699	2.7699		2.7755
S8	3.1564	1.6376	1.6376	3.1564	2.7699	2.7699	2.7755

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	106.458	N1	S7	N4	106.458
N2	S8	N3	106.458	N3	S6	N4	106.458
S5	N1	S7	115.502	S5	N2	S8	115.502
S6	N3	S8	115.502	S6	N4	S7	115.502

All results from a given calculation for S₄N₄ (Tetrasulfur tetranitride)

using model chemistry: CCSD/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 S4N4 (Tetrasulfur tetranitride)

using model chemistry: CCSD/6-31G*

States and conformations

All results from a given calculation for S₄N₄ (Tetrasulfur tetranitride)