SCSD model generated from precomputed using D6h symmetry, available as cb6

Table 1; Model atom positions

xyzat
-3.4481.99071.9407C
-3.98023.19460.0C
-4.75671.84960.0C
-3.4481.9907-1.9407C
-4.8951-0.01.7551C
-4.8951-0.0-1.7551C
-3.448-1.99071.9407C
-4.7567-1.84960.0C
-3.9802-3.19460.0C
-3.448-1.9907-1.9407C
-2.4476-4.23931.7551C
-2.4476-4.2393-1.7551C
0.0-3.98141.9407C
-0.7765-5.0443-0.0C
0.7765-5.0443-0.0C
0.0-3.9814-1.9407C
-2.44764.2393-1.7551C
-2.44764.23931.7551C
3.448-1.9907-1.9407C
3.9802-3.1946-0.0C
4.7567-1.8496-0.0C
3.448-1.99071.9407C
4.89510.0-1.7551C
4.89510.01.7551C
3.4481.9907-1.9407C
4.75671.8496-0.0C
3.98023.1946-0.0C
3.4481.99071.9407C
2.44764.2393-1.7551C
2.44764.23931.7551C
-0.03.9814-1.9407C
0.77655.04430.0C
-0.77655.04430.0C
-0.03.98141.9407C
2.4476-4.23931.7551C
2.4476-4.2393-1.7551C
-3.20833.13061.2219N
-4.31531.21311.2219N
-4.31531.2131-1.2219N
-3.20833.1306-1.2219N
-4.3153-1.21311.2219N
-3.2083-3.13061.2219N
-3.2083-3.1306-1.2219N
-4.3153-1.2131-1.2219N
-1.107-4.34371.2219N
1.107-4.34371.2219N
1.107-4.3437-1.2219N
-1.107-4.3437-1.2219N
3.2083-3.1306-1.2219N
4.3153-1.2131-1.2219N
4.3153-1.21311.2219N
3.2083-3.13061.2219N
4.31531.2131-1.2219N
3.20833.1306-1.2219N
3.20833.13061.2219N
4.31531.21311.2219N
1.1074.3437-1.2219N
-1.1074.3437-1.2219N
-1.1074.34371.2219N
1.1074.34371.2219N
-2.99611.72983.0445O
-2.99611.7298-3.0445O
-2.9961-1.72983.0445O
-2.9961-1.7298-3.0445O
0.0-3.45963.0445O
0.0-3.4596-3.0445O
2.9961-1.7298-3.0445O
2.9961-1.72983.0445O
2.99611.7298-3.0445O
2.99611.72983.0445O
-0.03.4596-3.0445O
-0.03.45963.0445O