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	hartrees
Energy at 0K	-408.964359
Energy at 298.15K
HF Energy	-408.964359
Nuclear repulsion energy	323.118155

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	1.523	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		1.4819	1.4819	1.4819	1.4819	2.6382	2.6382	2.6382	2.6382
C2	1.4819		2.4199	2.4199	2.4199	1.1563	3.4296	3.4296	3.4296
C3	1.4819	2.4199		2.4199	2.4199	3.4296	1.1563	3.4296	3.4296
C4	1.4819	2.4199	2.4199		2.4199	3.4296	3.4296	1.1563	3.4296
C5	1.4819	2.4199	2.4199	2.4199		3.4296	3.4296	3.4296	1.1563
N6	2.6382	1.1563	3.4296	3.4296	3.4296		4.3081	4.3081	4.3081
N7	2.6382	3.4296	1.1563	3.4296	3.4296	4.3081		4.3081	4.3081
N8	2.6382	3.4296	3.4296	1.1563	3.4296	4.3081	4.3081		4.3081
N9	2.6382	3.4296	3.4296	3.4296	1.1563	4.3081	4.3081	4.3081

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

Number	Element	Mulliken
1	C	0.556
2	C	0.188
3	C	0.188
4	C	0.188
5	C	0.188
6	N	-0.327
7	N	-0.327
8	N	-0.327
9	N	-0.327

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

using model chemistry: HSEh1PBE/6-31+G**

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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<r²>	283.363
(<r²>)^1/2	16.833

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

using model chemistry: HSEh1PBE/6-31+G**

States and conformations

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