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	hartrees
Energy at 0K	-408.817039
Energy at 298.15K	-408.807763
HF Energy	-407.040113
Nuclear repulsion energy	325.769958

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2660	2660	0.00
2	A₁	619	619	0.00
3	E	645	645	0.00
3	E	645	645	0.00
4	E	126	126	0.00
4	E	126	126	0.00
5	T₁	392	392	0.00
5	T₁	392	392	0.00
5	T₁	392	392	0.00
6	T₂	2655	2655	0.47
6	T₂	2655	2655	0.47
6	T₂	2655	2655	0.47
7	T₂	1194	1194	53.90
7	T₂	1194	1194	53.90
7	T₂	1194	1194	53.90
8	T₂	615	615	1.75
8	T₂	615	615	1.75
8	T₂	615	615	1.75
9	T₂	167	167	17.85
9	T₂	167	167	17.85
9	T₂	167	167	17.85

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.857	0.857	0.857
C3	-0.857	-0.857	0.857
C4	-0.857	0.857	-0.857
C5	0.857	-0.857	-0.857
N6	1.510	1.510	1.510
N7	-1.510	-1.510	1.510
N8	-1.510	1.510	-1.510
N9	1.510	-1.510	-1.510

	C1	C2	C3	C4	C5	N6	N7	N8	N9
C1		1.4845	1.4845	1.4845	1.4845	2.6149	2.6149	2.6149	2.6149
C2	1.4845		2.4242	2.4242	2.4242	1.1304	3.4102	3.4102	3.4102
C3	1.4845	2.4242		2.4242	2.4242	3.4102	1.1304	3.4102	3.4102
C4	1.4845	2.4242	2.4242		2.4242	3.4102	3.4102	1.1304	3.4102
C5	1.4845	2.4242	2.4242	2.4242		3.4102	3.4102	3.4102	1.1304
N6	2.6149	1.1304	3.4102	3.4102	3.4102		4.2701	4.2701	4.2701
N7	2.6149	3.4102	1.1304	3.4102	3.4102	4.2701		4.2701	4.2701
N8	2.6149	3.4102	3.4102	1.1304	3.4102	4.2701	4.2701		4.2701
N9	2.6149	3.4102	3.4102	3.4102	1.1304	4.2701	4.2701	4.2701

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: CBS-Q

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: CBS-Q

States and conformations

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