Al1 
1.0
6.6146943697405836e-01 0.0000000000000000e+00 0.0000000000000000e+00 
7.5311939800441674e-01 1.4380427233774489e-02 0.0000000000000000e+00 
6.3888769875715334e-01 -1.6310546934199758e-03 1.1825304039599110e-02 
Al 
1 
cartesian
   0.0000000000    0.0000000000    0.0000000000
