Created by AJB

4 atoms
2 atom types

-0.529177 0.529177 xlo xhi
-0.529177 0.529177 ylo yhi
-0.529177 0.529177 zlo zhi

Masses

1 1.000794	            # H nuclei mass
2 0.000544616997098749	# electron mass



Atoms 

1 1  1.0  0  0.000000 0 1.0 0.0  -0.1322943 0.000000 0.000000   # 0-tag 1-type 2-q 3-spin 4-eradius 5-etag 6-cs_re 7-cs_im 8-x 9-y 10-z
2 2 -1.0  1  0.1      3 1.0 0.0  -0.1322943 0.000000 0.000000 
3 1  1.0  0  0.000000 0 1.0 0.0   0.1322943 0.000000 0.000000 
4 2 -1.0 -1  0.1      4 1.0 0.0   0.1322943 0.000000 0.000000 


5 2 -1.0 -1  0.1      4 1.0 0.0  0.264589 0.000000 0.000000  # additional WP for the second electron