%chk=000087278.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087278

0 1
 O    2.339700      -1.611600     -0.1203000    
 O   2.3800001E-02   2.417100      7.9800002E-02
 N   -1.192200      0.4381000     -1.3600000E-02
 N    1.199100      0.4199000      9.1000004E-03
 N   -2.395200      -1.581600     -6.3500002E-02
 C   4.1000000E-03  -1.705300      0.1987000    
 C   -1.269200     -0.9473000      1.9700000E-02
 C    1.291400     -0.9740000     -1.0000000E-03
 C   6.2000002E-03   1.181700      3.5000000E-02
 C   -2.450900       1.179900     -9.7499996E-02
 C    2.443200       1.183100     -4.6300001E-02
 H   6.8999999E-03  -2.110600       1.217700    
 H  -7.7999998E-03  -2.555300     -0.4945000    
 H   -3.060400      0.9385000      0.7794000    
 H   -2.992200      0.8604000     -0.9941000    
 H   -2.299700       2.260900     -0.1413000    
 H    3.328200      0.5427000     -2.7000001E-02
 H    2.478100       1.867800      0.8073000    
 H    2.447800       1.778200     -0.9653000    
 H   -2.243300      -2.594000     -2.2000000E-03


%chk=000087278-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087278

0 1
O 2.428949 -1.582853 -0.050893
O 0.021326 2.412690 0.044606
N -1.203378 0.417671 0.016289
N 1.222340 0.418296 -0.001282
N -2.459415 -1.541104 -0.161495
C 0.020380 -1.741372 0.249653
C -1.281189 -0.992251 0.000272
C 1.324043 -0.983092 0.038126
C -0.000873 1.152683 0.032215
C -2.474461 1.177323 -0.062897
C 2.461393 1.229606 -0.096088
H 0.025510 -2.094705 1.300835
H 0.060737 -2.647564 -0.377998
H -3.152173 0.836236 0.735333
H -2.966334 0.984629 -1.030406
H -2.239349 2.244951 0.045743
H 3.310025 0.530786 -0.100555
H 2.526737 1.915882 0.762807
H 2.452734 1.828778 -1.020603
H -2.419403 -2.577992 -0.143564


