%chk=000035017.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035017

0 1
 O   -1.729900       2.065700      3.9999999E-04
 O    2.732800      0.8464000      6.0000003E-04
 N  -0.5640000      -2.444400     -6.0000003E-04
 N    1.124300     -0.8168000     -1.0000000E-03
 N   -1.190400     -0.1843000     -1.2000001E-03
 N   0.5147000       1.504000     -1.5000000E-03
 C  -0.1919000      -1.082300     -1.0000000E-03
 C  -0.7622000       1.088300     -1.5000000E-03
 C    1.402600      0.4968000     -1.3000000E-03
 C   -1.926600      -2.875700      1.5000000E-03
 C   -3.079500       1.623100      2.7000001E-03
 C    3.670000     -0.2208000      2.9000000E-03
 H   0.1854000      -3.126200     -3.9999999E-04
 H   -2.456300      -2.522400     -0.8893000    
 H   -2.453600      -2.522200      0.8937000    
 H   -1.969900      -3.969400      1.7000000E-03
 H   -3.305800       1.043700     -0.8989000    
 H   -3.724100       2.507100      4.0000002E-03
 H   -3.302500       1.043200      0.9046000    
 H    3.570500     -0.8347000     -0.8987000    
 H    3.567500     -0.8335000      0.9050000    
 H    4.674500      0.2129000      4.4000000E-03


%chk=000035017-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035017

0 1
O -1.706019 2.088705 0.001581
O 2.725931 0.860903 0.001452
N -0.568642 -2.478006 0.000816
N 1.127210 -0.867603 0.001392
N -1.228332 -0.216520 0.001485
N 0.514398 1.492931 0.001940
C -0.223251 -1.156383 0.001151
C -0.780515 1.073829 0.001980
C 1.410797 0.464762 0.001817
C -1.955654 -2.951312 0.001034
C -3.130426 1.704183 0.001048
C 3.749642 -0.201456 0.000954
H 0.209663 -3.137589 0.000970
H -2.499217 -2.588758 -0.889959
H -2.498671 -2.589874 0.892833
H -1.955355 -4.053815 0.000334
H -3.374840 1.110673 -0.896685
H -3.669188 2.662918 0.000928
H -3.375464 1.110545 0.898531
H 3.654079 -0.836254 -0.896813
H 3.654530 -0.836659 0.898480
H 4.704922 0.343283 0.000830


