SCSD model generated from precomputed using D_2h symmetry, available as tcnq

Table 1; Model atom positions

x	y	z	at
-2.8901	0.0	0.0	C
-0.6888	1.1899	0.0	C
-0.6888	-1.1899	0.0	C
-3.6106	-1.1815	0.0	C
-1.4208	0.0	0.0	C
-3.6106	1.1815	0.0	C
2.8901	-0.0	-0.0	C
0.6888	-1.1899	-0.0	C
0.6888	1.1899	-0.0	C
3.6106	1.1815	-0.0	C
1.4208	-0.0	-0.0	C
3.6106	-1.1815	-0.0	C
-4.1863	-2.1917	0.0	N
-4.1863	2.1917	0.0	N
4.1863	2.1917	-0.0	N
4.1863	-2.1917	-0.0	N