%chk=000096507.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096507

0 1
 O    1.005100      -2.333700      2.6000000E-03
 O    2.708300     -0.9486000      9.9999997E-05
 N   -1.225900       1.165400     -1.5000000E-03
 N  -0.2309000       2.068800     -3.0000001E-04
 N    1.464500      -1.158900      5.0000002E-04
 N   -2.332200      -2.217200       0.000000    
 C   0.5771000     -6.7800000E-02 -2.0000001E-03
 C   0.8681000       1.309700     -5.0000002E-04
 C  -0.7951000     -0.1288000     -2.3000001E-03
 C    2.193100       1.955400      8.9999998E-04
 C   -2.594400       1.629300      3.7000000E-03
 C   -1.637700      -1.273600     -1.1000000E-03
 H    2.110300       3.047800      1.2000001E-03
 H    2.763600       1.670500      0.8908000    
 H    2.765300       1.671100     -0.8880000    
 H   -2.611300       2.722300     -1.0400000E-02
 H   -3.094600       1.240700     -0.8869000    
 H   -3.079300       1.263200      0.9120000    


%chk=000096507-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096507

0 1
O 1.011821 -2.382963 -0.000838
O 2.787524 -0.933852 -0.000865
N -1.262654 1.135823 0.000736
N -0.221982 2.060243 0.001181
N 1.517136 -1.190921 -0.000309
N -2.494387 -2.169051 -0.000391
C 0.607310 -0.072845 0.000386
C 0.934037 1.321615 0.000879
C -0.808326 -0.171380 0.000450
C 2.268253 2.000494 0.000811
C -2.654244 1.604105 0.003225
C -1.689962 -1.283684 -0.000021
H 2.125939 3.092571 0.000800
H 2.862403 1.706675 0.883286
H 2.862360 1.706580 -0.881650
H -2.625025 2.702243 -0.012799
H -3.188851 1.231752 -0.886413
H -3.177353 1.258195 0.910331


