SCSD model generated from precomputed using D2h symmetry, available as dhbq

Table 1; Model atom positions

xyzat
-1.20280.751-0.0C
-1.2028-0.7510.0C
-0.01.4626-0.0C
0.0-1.46260.0C
1.20280.751-0.0C
1.2028-0.7510.0C
-2.3541.3321-0.0O
-2.354-1.33210.0O
2.3541.3321-0.0O
2.354-1.33210.0O