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	hartrees
Energy at 0K	-1811.089625
Energy at 298.15K	-1811.093805
HF Energy	-1810.446520
Nuclear repulsion energy	769.201426

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	689	689	0.00
5	A₂	206	206	0.00
6	B₁	668	668	0.00
7	B₁	314	314	0.00
8	B₂	948	948	52.73
9	B₂	542	542	84.61
10	B₂	138	138	0.01
11	E	793	793	0.19
11	E	793	793	0.19
12	E	645	645	77.44
12	E	645	645	77.44
13	E	488	488	17.25
13	E	488	488	17.25
14	E	293	293	17.72
14	E	293	293	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	1.483	0.953
S6	0.000	-1.483	0.953
S7	1.483	0.000	-0.953
S8	-1.483	0.000	-0.953

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.6643	3.7679	2.6643	1.6447	3.2565	1.6447	3.2565
N2	2.6643		2.6643	3.7679	1.6447	3.2565	3.2565	1.6447
N3	3.7679	2.6643		2.6643	3.2565	1.6447	3.2565	1.6447
N4	2.6643	3.7679	2.6643		3.2565	1.6447	1.6447	3.2565
S5	1.6447	1.6447	3.2565	3.2565		2.9651	2.8333	2.8333
S6	3.2565	3.2565	1.6447	1.6447	2.9651		2.8333	2.8333
S7	1.6447	3.2565	3.2565	1.6447	2.8333	2.8333		2.9651
S8	3.2565	1.6447	1.6447	3.2565	2.8333	2.8333	2.9651

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	108.183	N1	S7	N4	108.183
N2	S8	N3	108.183	N3	S6	N4	108.183
S5	N1	S7	118.931	S5	N2	S8	118.931
S6	N3	S8	118.931	S6	N4	S7	118.931

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

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

States and conformations

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