SCSD model generated from precomputed using C2v symmetry, available as bodipy

Table 1; Model atom positions

xyzat
0.00.0-1.2741B
2.554-0.01.497C
3.3646-0.00.3858C
2.51620.0-0.7301C
-2.51620.0-0.7301C
-3.3646-0.00.3858C
-2.554-0.01.497C
-0.0-0.01.7428C
1.2126-0.01.04C
-1.2126-0.01.04C
0.01.1244-2.0829F
0.0-1.1244-2.0829F
1.23150.0-0.3442N
-1.23150.0-0.3442N