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	hartrees
Energy at 0K	-408.670352
Energy at 298.15K	-408.668954
HF Energy	-407.161939
Nuclear repulsion energy	322.136230

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2175	2069	0.00
2	A₁	588	560	0.00
3	E	560	533	0.00
3	E	560	533	0.00
4	E	109	104	0.00
4	E	109	104	0.00
5	T₁	330	314	0.00
5	T₁	330	314	0.00
5	T₁	330	314	0.00
6	T₂	2181	2075	28.23
6	T₂	2181	2075	28.23
6	T₂	2181	2075	28.23
7	T₂	1084	1031	25.89
7	T₂	1084	1031	25.89
7	T₂	1084	1031	25.89
8	T₂	546	520	0.00
8	T₂	546	520	0.00
8	T₂	546	520	0.00
9	T₂	141	135	13.32
9	T₂	141	135	13.32
9	T₂	141	135	13.32

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.852	0.852	0.852
C3	-0.852	-0.852	0.852
C4	-0.852	0.852	-0.852
C5	0.852	-0.852	-0.852
N6	1.523	1.523	1.523
N7	-1.523	-1.523	1.523
N8	-1.523	1.523	-1.523
N9	1.523	-1.523	-1.523

	C1	C2	C3	C4	C5	N6	N7	N8	N9
C1		1.4751	1.4751	1.4751	1.4751	2.6379	2.6379	2.6379	2.6379
C2	1.4751		2.4089	2.4089	2.4089	1.1627	3.4247	3.4247	3.4247
C3	1.4751	2.4089		2.4089	2.4089	3.4247	1.1627	3.4247	3.4247
C4	1.4751	2.4089	2.4089		2.4089	3.4247	3.4247	1.1627	3.4247
C5	1.4751	2.4089	2.4089	2.4089		3.4247	3.4247	3.4247	1.1627
N6	2.6379	1.1627	3.4247	3.4247	3.4247		4.3076	4.3076	4.3076
N7	2.6379	3.4247	1.1627	3.4247	3.4247	4.3076		4.3076	4.3076
N8	2.6379	3.4247	3.4247	1.1627	3.4247	4.3076	4.3076		4.3076
N9	2.6379	3.4247	3.4247	3.4247	1.1627	4.3076	4.3076	4.3076

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 (tetracyanomethane)

using model chemistry: MP2/Def2TZVPP

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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