17 
neopentane molec optimized by B3LYPp2p, SG=-43m
  C         0.00000000     0.00000000     0.00000000
  C         0.88931300     0.88931300     0.88931300
  C        -0.88931300    -0.88931300     0.88931300
  C        -0.88931300     0.88931300    -0.88931300
  C         0.88931300    -0.88931300    -0.88931300
  H         1.53566200     1.53566200     0.28255500
  H         0.28255500     1.53566200     1.53566200
  H         1.53566200     0.28255500     1.53566200
  H        -1.53566200    -1.53566200     0.28255500
  H        -0.28255500    -1.53566200     1.53566200
  H        -1.53566200    -0.28255500     1.53566200
  H        -1.53566200     1.53566200    -0.28255500
  H        -0.28255500     1.53566200    -1.53566200
  H        -1.53566200     0.28255500    -1.53566200
  H         1.53566200    -1.53566200    -0.28255500
  H         0.28255500    -1.53566200    -1.53566200
  H         1.53566200    -0.28255500    -1.53566200
