 40

  C   -3.448959    1.668976    0.658981
  C   -4.673325    2.339767    0.639100
  C   -5.863770    1.614685    0.587800
  C   -5.819870    0.220490    0.557388
  C   -4.593140   -0.451904    0.578506
  C   -3.392624    0.269791    0.629593
  C   -2.152359   -0.384933    0.654100
  C   -2.154251   -1.784454    0.611252
  C   -3.341110   -2.515518    0.563019
  C   -4.564423   -1.848328    0.548553
  H   -2.540756    2.258743    0.699570
  H   -4.701248    3.423462    0.664368
  H   -6.816940    2.131271    0.572205
  H   -6.749817   -0.334763    0.517776
  H   -5.483292   -2.422119    0.510895
  H   -3.312988   -3.599136    0.536224
  H   -1.220566   -2.333191    0.617188
  O   -0.997650    0.338760    0.688690
  C    0.323944   -0.142075    0.629959
  C    1.251526    1.075500    0.681458
  C    2.731720    0.684921    0.575394
  N    3.556000    1.873352    0.561264
  C    4.985229    1.637466    0.655441
  C    5.541290    0.830475   -0.528549
  C    5.691895    3.000168    0.752243
  O    0.936264    1.931473   -0.390625
  H    0.442398   -0.700897   -0.327225
  H    0.489548   -0.810806    1.506348
  H    1.074112    1.661423    1.615463
  H    3.005005    0.045273    1.446976
  H    2.888504    0.107224   -0.364151
  H    3.331207    2.431030   -0.265518
  H    5.189072    1.082611    1.603500
  H    5.165100   -0.217636   -0.537079
  H    5.269745    1.305023   -1.499298
  H    6.652603    0.766342   -0.480698
  H    5.533859    3.599136   -0.174118
  H    5.301804    3.594437    1.610733
  H    6.789978    2.880753    0.899353
  H    0.045944    2.221893   -0.263702
