$grad
  cycle =      1    SCF energy =    -5.07054433890   |dE/dxyz| =  0.000470
   -0.10100275134776      0.06423190124437      0.00726147178812      O 
    0.38015902705761     -0.97565505001632     -1.39706658546551      H 
    1.21841214758069     -0.06094136123031      1.24481571358229      H 
  -2.0285270841028E-04  -2.7262053900219E-05  -2.7706678372038E-04
  -2.1882924802120E-05   4.9323113020443E-05   6.7656194508191E-05
   2.2473563321239E-04  -2.2061059120215E-05   2.0941058921219E-04
$end
