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	hartrees
Energy at 0K	-1811.495285
Energy at 298.15K	-1811.500197
HF Energy	-1811.495285
Nuclear repulsion energy	797.974149

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	752	752	0.00
2	A₁	599	599	0.00
3	A₁	221	221	0.00
4	A₂	767	767	0.00
5	A₂	272	272	0.00
6	B₁	750	750	0.00
7	B₁	358	358	0.00
8	B₂	1020	1020	90.77
9	B₂	590	590	97.98
10	B₂	197	197	0.59
11	E	761	761	0.19
11	E	761	761	0.19
12	E	730	730	144.81
12	E	730	730	144.81
13	E	539	539	6.92
13	E	539	539	6.92
14	E	323	323	45.13
14	E	323	323	45.13

Atom	x (Å)	y (Å)	z (Å)
N1	1.292	1.292	0.000
N2	-1.292	1.292	0.000
N3	-1.292	-1.292	0.000
N4	1.292	-1.292	0.000
S5	0.000	1.345	0.983
S6	0.000	-1.345	0.983
S7	1.345	0.000	-0.983
S8	-1.345	0.000	-0.983

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.5843	3.6548	2.5843	1.6246	3.0973	1.6246	3.0973
N2	2.5843		2.5843	3.6548	1.6246	3.0973	3.0973	1.6246
N3	3.6548	2.5843		2.5843	3.0973	1.6246	3.0973	1.6246
N4	2.5843	3.6548	2.5843		3.0973	1.6246	1.6246	3.0973
S5	1.6246	1.6246	3.0973	3.0973		2.6907	2.7364	2.7364
S6	3.0973	3.0973	1.6246	1.6246	2.6907		2.7364	2.7364
S7	1.6246	3.0973	3.0973	1.6246	2.7364	2.7364		2.6907
S8	3.0973	1.6246	1.6246	3.0973	2.7364	2.7364	2.6907

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	105.376	N1	S7	N4	105.376
N2	S8	N3	105.376	N3	S6	N4	105.376
S5	N1	S7	114.735	S5	N2	S8	114.735
S6	N3	S8	114.735	S6	N4	S7	114.735

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

using model chemistry: M06-2X/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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	N	-0.622
2	N	-0.622
3	N	-0.622
4	N	-0.622
5	S	0.622
6	S	0.622
7	S	0.622
8	S	0.622

<r²>	318.169
(<r²>)^1/2	17.837

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

using model chemistry: M06-2X/6-311G**

States and conformations

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