SCSD model generated from precomputed using D2h symmetry, available as CLA_s1

Table 1; Model atom positions

xyzat
2.4275-2.4651-0.0C
-2.4275-2.4651-0.0C
-2.42752.46510.0C
2.42752.46510.0C
1.0646-2.939-0.0C
-1.0646-2.939-0.0C
-2.839-1.0585-0.0C
-4.2374-0.7264-0.0C
-4.23740.7264-0.0C
-2.8391.0585-0.0C
-1.06462.9390.0C
1.06462.9390.0C
2.8391.05850.0C
4.23740.72640.0C
4.2374-0.72640.0C
2.839-1.05850.0C
0.00.00.0MG
0.0-2.1436-0.0N
-1.99280.0-0.0N
0.02.14360.0N
1.99280.00.0N

Figure 2; Model atom positions and symmetry operations



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