$coord
   -4.95684747755556      0.18577016780000     -0.49522371434444      o
   -3.15895770595556      0.03783543340000     -0.81159617034444      h
   -5.36103793195556      1.88296733810000     -0.97287913274444      h
    0.76974251394444     -0.06437093910000     -1.02219365564444      c
    2.49606985544444     -0.35818795390000     -3.71162413794444      cl
    2.34725772974444     -0.32061926660000      1.24958429435556      c
    4.40072779854444     -0.34104686920000      1.04895460405556      h
    1.74125199414444      1.09439461260000      2.62774465315556      h
    1.72179322364444     -2.11674252310000      2.08723325945556      h
$user-defined bonds
$end
