SCSD model generated from precomputed using D_4h symmetry, available as porphyrinryleneimide

Table 1; Model atom positions

x	y	z	at
1.247	9.4634	0.0	C
-1.247	9.4634	0.0	C
-2.3847	-2.3847	-0.0	C
2.3847	2.3847	0.0	C
-2.3847	2.3847	0.0	C
2.3847	-2.3847	-0.0	C
-7.3474	-2.3858	-0.0	C
7.3474	2.3858	0.0	C
2.3858	-7.3474	-0.0	C
-2.3858	7.3474	0.0	C
-5.9651	-2.3974	-0.0	C
5.9651	2.3974	0.0	C
2.3974	-5.9651	-0.0	C
-2.3974	5.9651	0.0	C
-5.3819	-1.1812	-0.0	C
5.3819	1.1812	0.0	C
1.1812	-5.3819	-0.0	C
-1.1812	5.3819	0.0	C
-6.1455	0.0	0.0	C
6.1455	-0.0	-0.0	C
-0.0	-6.1455	-0.0	C
0.0	6.1455	0.0	C
-7.4459	0.0	0.0	C
7.4459	-0.0	-0.0	C
-0.0	-7.4459	-0.0	C
0.0	7.4459	0.0	C
-9.4634	1.247	0.0	C
9.4634	-1.247	-0.0	C
-1.247	-9.4634	-0.0	C
-9.4634	-1.247	-0.0	C
9.4634	1.247	0.0	C
1.247	-9.4634	-0.0	C
-2.7887	1.1209	0.0	C
2.7887	-1.1209	-0.0	C
-1.1209	-2.7887	-0.0	C
1.1209	2.7887	0.0	C
-4.0668	0.6897	0.0	C
4.0668	-0.6897	-0.0	C
-0.6897	-4.0668	-0.0	C
0.6897	4.0668	0.0	C
-4.0668	-0.6897	-0.0	C
4.0668	0.6897	0.0	C
0.6897	-4.0668	-0.0	C
-0.6897	4.0668	0.0	C
-2.7887	-1.1209	-0.0	C
2.7887	1.1209	0.0	C
1.1209	-2.7887	-0.0	C
-1.1209	2.7887	0.0	C
-5.3819	1.1812	0.0	C
5.3819	-1.1812	-0.0	C
-1.1812	-5.3819	-0.0	C
1.1812	5.3819	0.0	C
-5.9651	2.3974	0.0	C
5.9651	-2.3974	-0.0	C
-2.3974	-5.9651	-0.0	C
2.3974	5.9651	0.0	C
-7.3474	2.3858	0.0	C
7.3474	-2.3858	-0.0	C
-2.3858	-7.3474	-0.0	C
2.3858	7.3474	0.0	C
-8.0637	1.2363	0.0	C
8.0637	-1.2363	-0.0	C
-1.2363	-8.0637	-0.0	C
1.2363	8.0637	0.0	C
-8.0637	-1.2363	-0.0	C
8.0637	1.2363	0.0	C
1.2363	-8.0637	-0.0	C
-1.2363	8.0637	0.0	C
0.0	10.0635	0.0	N
-2.0296	0.0	0.0	N
2.0296	-0.0	0.0	N
-0.0	-2.0296	-0.0	N
0.0	2.0296	0.0	N
-10.0635	0.0	0.0	N
10.0635	-0.0	-0.0	N
-0.0	-10.0635	-0.0	N
2.2615	10.0774	0.0	O
-2.2615	10.0774	0.0	O
-10.0774	2.2615	0.0	O
10.0774	-2.2615	-0.0	O
-2.2615	-10.0774	-0.0	O
-10.0774	-2.2615	-0.0	O
10.0774	2.2615	0.0	O
2.2615	-10.0774	-0.0	O