%chk=000107643.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107643

0 1
 O   -1.687200     -0.5409000       1.018100    
 O   -1.547100       2.354500      -1.092900    
 O   -3.725200       1.550600      0.3382000    
 O   -2.640200      -3.069500      0.2665000    
 O    1.243800       2.310600      0.7221000    
 N   0.3970000      0.2114000      0.2732000    
 N    2.757500      0.7055000      0.1888000    
 N    4.303000     -0.9432000     -0.3601000    
 N    5.324500     -5.6600001E-02 -0.1378000    
 C   -1.674700      0.9782000     -0.8006000    
 C   -3.107000      0.5827000     -0.5094000    
 C  -0.9716000      0.5866000      0.4877000    
 C   -2.927300     -0.6980000      0.2941000    
 C   -2.814400      -1.943300     -0.5752000    
 C   0.6805000      -1.098900     -8.0399998E-02
 C    1.461200       1.138200      0.4109000    
 C    1.919700      -1.534200     -0.2994000    
 C    3.007600     -0.5337000     -0.1438000    
 H   -1.300400      0.4061000      -1.658000    
 H   -3.727500      0.4778000      -1.403100    
 H   -1.009100       1.395600       1.226900    
 H   -3.715200     -0.8351000       1.043500    
 H   -1.977400      -1.898100      -1.276000    
 H   -3.735400      -2.085600      -1.150100    
 H  -0.5981000       2.547300      -1.180400    
 H   -3.248400       1.581800       1.184200    
 H  -0.1331000      -1.799700     -0.1807000    
 H   -2.584400      -3.851500     -0.3088000    
 H    2.148600      -2.555100     -0.5744000    
 H    4.536800      -1.909300     -0.5659000    
 H    6.081100     -0.2605000     -0.7892000    
 H    5.703300     -0.2225000      0.7937000    


%chk=000107643-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107643

0 1
O -1.767558 -0.649122 1.093179
O -1.580286 2.544941 -0.551984
O -3.819344 1.514448 0.417759
O -2.422915 -3.108066 -0.104707
O 1.038455 2.152420 -0.112741
N 0.445369 -0.058360 0.361671
N 2.730075 0.525383 -0.167354
N 4.369480 -1.132627 -0.235792
N 5.394358 -0.197671 -0.534019
C -1.613758 1.099890 -0.589872
C -3.087031 0.624989 -0.468798
C -0.933391 0.452340 0.659289
C -2.952935 -0.762174 0.188640
C -2.759513 -1.883946 -0.841485
C 0.770585 -1.393299 0.475174
C 1.430274 0.940697 0.012991
C 2.072086 -1.810907 0.263270
C 3.044978 -0.788182 -0.046948
H -1.147387 0.704400 -1.515366
H -3.579132 0.575594 -1.462124
H -0.844473 1.197116 1.472436
H -3.807268 -0.984320 0.846930
H -1.951347 -1.624972 -1.560122
H -3.710004 -1.998061 -1.405513
H -0.606542 2.772692 -0.403665
H -3.378808 2.407476 0.331184
H -0.055999 -2.060852 0.739361
H -2.493957 -3.886454 -0.712007
H 2.339737 -2.865678 0.351596
H 4.668559 -2.104644 -0.165381
H 5.168237 0.302130 -1.407245
H 5.480352 0.486016 0.233341


