System
1.0
4.004435497687281 0.0 0.0
0.0 4.004435497687281 0.0
0.0 0.0 4.12970148504781
Ba Ti O
1 1 3
direct
0.5 0.5 0.014194491887641202 
0.0 0.0 0.5320530003552821 
0.5 0.0 0.49426408393281923 
0.0 0.5 0.49426408393281923 
0.0 0.0 0.9792233398914434 
