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	hartrees
Energy at 0K	-1808.785764
Energy at 298.15K	-1808.790407
HF Energy	-1807.514263
Nuclear repulsion energy	785.061589

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	732	690	0.00
2	A₁	587	553	0.00
3	A₁	201	189	0.00
4	A₂	778	733	0.00
5	A₂	249	235	0.00
6	B₁	744	701	0.00
7	B₁	333	314	0.00
8	B₂	1030	971	83.47
9	B₂	575	542	94.95
10	B₂	162	153	0.27
11	E	826	778	12.38
11	E	826	778	12.39
12	E	725	683	118.79
12	E	725	683	118.78
13	E	513	483	15.87
13	E	513	483	15.87
14	E	289	272	18.16
14	E	289	272	18.18

Atom	x (Å)	y (Å)	z (Å)
N1	1.308	1.308	0.000
N2	-1.308	1.308	0.000
N3	-1.308	-1.308	0.000
N4	1.308	-1.308	0.000
S5	0.000	1.407	0.971
S6	0.000	-1.407	0.971
S7	1.407	0.000	-0.971
S8	-1.407	0.000	-0.971

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.6170	3.7010	2.6170	1.6323	3.1666	1.6323	3.1666
N2	2.6170		2.6170	3.7010	1.6323	3.1666	3.1666	1.6323
N3	3.7010	2.6170		2.6170	3.1666	1.6323	3.1666	1.6323
N4	2.6170	3.7010	2.6170		3.1666	1.6323	1.6323	3.1666
S5	1.6323	1.6323	3.1666	3.1666		2.8136	2.7800	2.7800
S6	3.1666	3.1666	1.6323	1.6323	2.8136		2.7800	2.7800
S7	1.6323	3.1666	3.1666	1.6323	2.7800	2.7800		2.8136
S8	3.1666	1.6323	1.6323	3.1666	2.7800	2.7800	2.8136

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	106.570	N1	S7	N4	106.570
N2	S8	N3	106.570	N3	S6	N4	106.570
S5	N1	S7	116.764	S5	N2	S8	116.764
S6	N3	S8	116.764	S6	N4	S7	116.764

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

using model chemistry: CCD/6-31+G**

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: CCD/6-31+G**

States and conformations

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