# nAt nEla nElb nCore nRyd
  8  15   15   0     0
# Znuc   x            y           z
C -1.11645072 -0.68348783 0.00000000
C 1.20647847 0.83714564 0.00000000
C 3.46831059 -0.28872636 0.00000000
O -3.23666415 0.19187203 0.00000000
H -0.80613858 -2.74747338 0.00000000
H 0.98699813 2.86613511 0.00000000
H 5.20930864 0.77443560 0.00000000
H 3.60951559 -2.33000749 0.00000000