44 
anthracenePh2b molec optimized by CAM-B3LYPp2p, SG=mmm
  C         3.65156500     0.71090300     0.00000000
  C         2.47720500     1.39753500     0.00000000
  C         1.21672600     0.71781900     0.00000000
  C         0.00000000     1.41951400     0.00000000
  C        -1.21672600     0.71781900     0.00000000
  C        -2.47720500     1.39753500     0.00000000
  C        -3.65156500     0.71090300     0.00000000
  C        -3.65156500    -0.71090300     0.00000000
  C        -2.47720500    -1.39753500     0.00000000
  C        -1.21672600    -0.71781900     0.00000000
  C         0.00000000    -1.41951400     0.00000000
  C         1.21672600    -0.71781900     0.00000000
  C         2.47720500    -1.39753500     0.00000000
  C         3.65156500    -0.71090300     0.00000000
  C         0.00000000     2.91408700     0.00000000
  C         0.00000000     3.62588800     1.20126700
  C         0.00000000     5.01621800     1.20210300
  C         0.00000000     5.71503100     0.00000000
  C         0.00000000     5.01621800    -1.20210300
  C         0.00000000     3.62588800    -1.20126700
  C         0.00000000    -2.91408700     0.00000000
  C         0.00000000    -3.62588800    -1.20126700
  C         0.00000000    -5.01621800    -1.20210300
  C         0.00000000    -5.71503100     0.00000000
  C         0.00000000    -5.01621800     1.20210300
  C         0.00000000    -3.62588800     1.20126700
  H         4.59525000     1.24765700     0.00000000
  H         2.47975500     2.48112200     0.00000000
  H        -2.47975500     2.48112200     0.00000000
  H        -4.59525000     1.24765700     0.00000000
  H        -4.59525000    -1.24765700     0.00000000
  H        -2.47975500    -2.48112200     0.00000000
  H         2.47975500    -2.48112200     0.00000000
  H         4.59525000    -1.24765700     0.00000000
  H         0.00000000     3.08052100     2.14027300
  H         0.00000000     5.55444300     2.14514700
  H         0.00000000     6.80071400     0.00000000
  H         0.00000000     5.55444300    -2.14514700
  H         0.00000000     3.08052100    -2.14027300
  H         0.00000000    -3.08052100    -2.14027300
  H         0.00000000    -5.55444300    -2.14514700
  H         0.00000000    -6.80071400     0.00000000
  H         0.00000000    -5.55444300     2.14514700
  H         0.00000000    -3.08052100     2.14027300
