34 
TTPb molec optimized by CAM-B3LYPa3p, SG=mmm
  N         0.00000000     1.39364200     0.00000000
  N         0.00000000    -1.39364200     0.00000000
  C         1.13788100     0.71218400     0.00000000
  C         1.13788100    -0.71218400     0.00000000
  C        -1.13788100     0.71218400     0.00000000
  C        -1.13788100    -0.71218400     0.00000000
  C         2.39268600     1.41484000     0.00000000
  C         2.39268600    -1.41484000     0.00000000
  C        -2.39268600     1.41484000     0.00000000
  C        -2.39268600    -1.41484000     0.00000000
  C         3.58223000     0.70999300     0.00000000
  C         3.58223000    -0.70999300     0.00000000
  C        -3.58223000     0.70999300     0.00000000
  C        -3.58223000    -0.70999300     0.00000000
  C         2.60006700     2.82438700     0.00000000
  C         2.60006700    -2.82438700     0.00000000
  C        -2.60006700     2.82438700     0.00000000
  C        -2.60006700    -2.82438700     0.00000000
  C         3.91089600     3.15018500     0.00000000
  C         3.91089600    -3.15018500     0.00000000
  C        -3.91089600     3.15018500     0.00000000
  C        -3.91089600    -3.15018500     0.00000000
  S         4.93602600     1.76792400     0.00000000
  S         4.93602600    -1.76792400     0.00000000
  S        -4.93602600     1.76792400     0.00000000
  S        -4.93602600    -1.76792400     0.00000000
  H         1.79354400     3.54036200     0.00000000
  H         1.79354400    -3.54036200     0.00000000
  H        -1.79354400     3.54036200     0.00000000
  H        -1.79354400    -3.54036200     0.00000000
  H         4.34627400     4.13576900     0.00000000
  H         4.34627400    -4.13576900     0.00000000
  H        -4.34627400     4.13576900     0.00000000
  H        -4.34627400    -4.13576900     0.00000000
