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	hartrees
Energy at 0K	-1811.089615
Energy at 298.15K
HF Energy	-1810.446527
Nuclear repulsion energy	769.236673

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	662	662	0.00
2	A₁	564	564	0.00
3	A₁	159	159	0.00
4	A₂	690	690	0.00
5	A₂	205	205	0.00
6	B₁	668	668	0.00
7	B₁	314	314	0.00
8	B₂	949	949	52.63
9	B₂	542	542	84.68
10	B₂	138	138	0.01
11	E	794	794	0.20
11	E	794	794	0.20
12	E	645	645	77.40
12	E	645	645	77.40
13	E	488	488	17.26
13	E	488	488	17.26
14	E	292	292	17.72
14	E	292	292	17.72

Atom	x (Å)	y (Å)	z (Å)
N1	1.332	1.332	0.000
N2	-1.332	1.332	0.000
N3	-1.332	-1.332	0.000
N4	1.332	-1.332	0.000
S5	0.000	1.482	0.953
S6	0.000	-1.482	0.953
S7	1.482	0.000	-0.953
S8	-1.482	0.000	-0.953

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.6643	3.7678	2.6643	1.6447	3.2563	1.6447	3.2563
N2	2.6643		2.6643	3.7678	1.6447	3.2563	3.2563	1.6447
N3	3.7678	2.6643		2.6643	3.2563	1.6447	3.2563	1.6447
N4	2.6643	3.7678	2.6643		3.2563	1.6447	1.6447	3.2563
S5	1.6447	1.6447	3.2563	3.2563		2.9646	2.8331	2.8331
S6	3.2563	3.2563	1.6447	1.6447	2.9646		2.8331	2.8331
S7	1.6447	3.2563	3.2563	1.6447	2.8331	2.8331		2.9646
S8	3.2563	1.6447	1.6447	3.2563	2.8331	2.8331	2.9646

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	108.179	N1	S7	N4	108.179
N2	S8	N3	108.179	N3	S6	N4	108.179
S5	N1	S7	118.917	S5	N2	S8	118.917
S6	N3	S8	118.917	S6	N4	S7	118.917

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

using model chemistry: B2PLYP=FULLultrafine/6-311G*

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: B2PLYP=FULLultrafine/6-311G*

States and conformations

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