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	hartrees
Energy at 0K	-408.429235
Energy at 298.15K	-408.427980
HF Energy	-407.155878
Nuclear repulsion energy	324.300744

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2493	2331	0.00
2	A₁	600	561	0.00
3	E	576	539	0.00
3	E	576	539	0.00
4	E	112	105	0.00
4	E	112	105	0.00
5	T₁	330	309	0.00
5	T₁	330	309	0.00
5	T₁	330	309	0.00
6	T₂	2479	2318	8.40
6	T₂	2479	2318	8.40
6	T₂	2479	2318	8.40
7	T₂	1129	1056	39.20
7	T₂	1129	1056	39.20
7	T₂	1129	1056	39.20
8	T₂	571	534	0.08
8	T₂	571	534	0.08
8	T₂	571	534	0.08
9	T₂	146	137	13.70
9	T₂	146	137	13.70
9	T₂	146	137	13.70

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.856	0.856	0.856
C3	-0.856	-0.856	0.856
C4	-0.856	0.856	-0.856
C5	0.856	-0.856	-0.856
N6	1.517	1.517	1.517
N7	-1.517	-1.517	1.517
N8	-1.517	1.517	-1.517
N9	1.517	-1.517	-1.517

	C1	C2	C3	C4	C5	N6	N7	N8	N9
C1		1.4822	1.4822	1.4822	1.4822	2.6278	2.6278	2.6278	2.6278
C2	1.4822		2.4205	2.4205	2.4205	1.1455	3.4204	3.4204	3.4204
C3	1.4822	2.4205		2.4205	2.4205	3.4204	1.1455	3.4204	3.4204
C4	1.4822	2.4205	2.4205		2.4205	3.4204	3.4204	1.1455	3.4204
C5	1.4822	2.4205	2.4205	2.4205		3.4204	3.4204	3.4204	1.1455
N6	2.6278	1.1455	3.4204	3.4204	3.4204		4.2912	4.2912	4.2912
N7	2.6278	3.4204	1.1455	3.4204	3.4204	4.2912		4.2912	4.2912
N8	2.6278	3.4204	3.4204	1.1455	3.4204	4.2912	4.2912		4.2912
N9	2.6278	3.4204	3.4204	3.4204	1.1455	4.2912	4.2912	4.2912

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N6	180.000	C1	C3	N7	180.000
C1	C4	N8	180.000	C1	C5	N9	180.000
C2	C1	C3	109.471	C2	C1	C4	109.471
C2	C1	C5	109.471	C3	C1	C4	109.471
C3	C1	C5	109.471	C4	C1	C5	109.471

All results from a given calculation for C(CN)₄ (tetracyanomethane)

using model chemistry: MP3/TZVP

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 C(CN)4 (tetracyanomethane)

using model chemistry: MP3/TZVP

States and conformations

All results from a given calculation for C(CN)₄ (tetracyanomethane)