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	hartrees
Energy at 0K	-1809.402326
Energy at 298.15K	-1809.407393
HF Energy	-1807.794324
Nuclear repulsion energy	807.061381

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	757	728	0.00
2	A₁	589	566	0.00
3	A₁	246	236	0.00
4	A₂	778	749	0.00
5	A₂	288	277	0.00
6	B₁	771	742	0.00
7	B₁	362	348	0.00
8	B₂	981	945	75.62
9	B₂	572	550	63.73
10	B₂	207	199	1.05
11	E	792	762	12.15
11	E	792	762	12.15
12	E	740	712	101.43
12	E	740	712	101.43
13	E	548	528	2.73
13	E	548	528	2.73
14	E	340	327	21.42
14	E	340	327	21.42

Atom	x (Å)	y (Å)	z (Å)
N1	1.291	1.291	0.000
N2	-1.291	1.291	0.000
N3	-1.291	-1.291	0.000
N4	1.291	-1.291	0.000
S5	0.000	1.287	0.994
S6	0.000	-1.287	0.994
S7	1.287	0.000	-0.994
S8	-1.287	0.000	-0.994

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.5824	3.6520	2.5824	1.6298	3.0498	1.6298	3.0498
N2	2.5824		2.5824	3.6520	1.6298	3.0498	3.0498	1.6298
N3	3.6520	2.5824		2.5824	3.0498	1.6298	3.0498	1.6298
N4	2.5824	3.6520	2.5824		3.0498	1.6298	1.6298	3.0498
S5	1.6298	1.6298	3.0498	3.0498		2.5732	2.6957	2.6957
S6	3.0498	3.0498	1.6298	1.6298	2.5732		2.6957	2.6957
S7	1.6298	3.0498	3.0498	1.6298	2.6957	2.6957		2.5732
S8	3.0498	1.6298	1.6298	3.0498	2.6957	2.6957	2.5732

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	104.791	N1	S7	N4	104.791
N2	S8	N3	104.791	N3	S6	N4	104.791
S5	N1	S7	111.586	S5	N2	S8	111.586
S6	N3	S8	111.586	S6	N4	S7	111.586

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

using model chemistry: QCISD/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 S4N4 (Tetrasulfur tetranitride)

using model chemistry: QCISD/aug-cc-pVTZ

States and conformations

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