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	hartrees
Energy at 0K	-408.335836
Energy at 298.15K	-408.334460
HF Energy	-407.012445
Nuclear repulsion energy	320.659808

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2187	2044	0.00
2	A₁	590	551	0.00
3	E	563	526	0.00
3	E	563	526	0.00
4	E	110	103	0.00
4	E	110	103	0.00
5	T₁	334	312	0.00
5	T₁	334	312	0.00
5	T₁	334	312	0.00
6	T₂	2194	2050	29.56
6	T₂	2194	2050	29.56
6	T₂	2194	2050	29.56
7	T₂	1099	1027	28.25
7	T₂	1099	1027	28.25
7	T₂	1099	1027	28.25
8	T₂	549	513	0.04
8	T₂	549	513	0.04
8	T₂	549	513	0.04
9	T₂	144	134	12.49
9	T₂	144	134	12.49
9	T₂	144	134	12.49

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.854	0.854	0.854
C3	-0.854	-0.854	0.854
C4	-0.854	0.854	-0.854
C5	0.854	-0.854	-0.854
N6	1.536	1.536	1.536
N7	-1.536	-1.536	1.536
N8	-1.536	1.536	-1.536
N9	1.536	-1.536	-1.536

	C1	C2	C3	C4	C5	N6	N7	N8	N9
C1		1.4791	1.4791	1.4791	1.4791	2.6606	2.6606	2.6606	2.6606
C2	1.4791		2.4153	2.4153	2.4153	1.1815	3.4481	3.4481	3.4481
C3	1.4791	2.4153		2.4153	2.4153	3.4481	1.1815	3.4481	3.4481
C4	1.4791	2.4153	2.4153		2.4153	3.4481	3.4481	1.1815	3.4481
C5	1.4791	2.4153	2.4153	2.4153		3.4481	3.4481	3.4481	1.1815
N6	2.6606	1.1815	3.4481	3.4481	3.4481		4.3447	4.3447	4.3447
N7	2.6606	3.4481	1.1815	3.4481	3.4481	4.3447		4.3447	4.3447
N8	2.6606	3.4481	3.4481	1.1815	3.4481	4.3447	4.3447		4.3447
N9	2.6606	3.4481	3.4481	3.4481	1.1815	4.3447	4.3447	4.3447

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: MP2=FULL/6-31G**

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: MP2=FULL/6-31G**

States and conformations

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