SCSD model generated from precomputed using D3h symmetry, available as triptycene

Table 1; Model atom positions

xyzat
0.0-0.0-1.2995C
0.0-0.01.2995C
-1.4017-0.0-0.7021C
-2.59740.0-1.4048C
-3.80420.0001-0.6953C
-3.80420.00010.6953C
-2.59740.01.4048C
-1.4017-0.00.7021C
0.70091.2139-0.7021C
1.29872.2494-1.4048C
1.9023.2946-0.6953C
1.9023.29460.6953C
1.29872.24941.4048C
0.70091.21390.7021C
0.7009-1.214-0.7021C
1.2987-2.2494-1.4048C
1.9021-3.2946-0.6953C
1.9021-3.29460.6953C
1.2987-2.24941.4048C
0.7009-1.2140.7021C