%chk=000079451.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079451

0 1
 O    1.429700      0.5906000     -4.9000001E-03
 N   -1.437300       1.756200     -2.0000001E-03
 N   -3.264500      0.4795000      2.3000001E-03
 N   0.3189000      -1.475100     -1.4000000E-03
 N   -2.113600      -1.662000      2.9000000E-03
 C    2.637900     -0.1599000     -6.0000001E-03
 C    3.815000      0.8033000      1.2900000E-02
 C  -0.9882000      0.4663000     -1.4000000E-03
 C   0.2600000     -0.1244000     -2.7000001E-03
 C   -2.141100     -0.3074000      1.2000001E-03
 C    5.144600      7.0799999E-02 -2.3000001E-03
 C   -2.806600       1.713100      1.9999999E-04
 C  -0.8548000      -2.151000      1.3000000E-03
 H    2.687200     -0.7826000     -0.9079000    
 H    2.678800     -0.8039000      0.8813000    
 H    3.752500       1.478000     -0.8493000    
 H    3.752400       1.443400      0.9011000    
 H  -0.8668000       2.591300     -3.8000001E-03
 H    5.243600     -0.5443000     -0.9025000    
 H    5.972300      0.7868000      1.2200000E-02
 H    5.243900     -0.5806000      0.8718000    
 H   -3.405600       2.612600      3.0000001E-04
 H  -0.7710000      -3.232500      2.4000001E-03


%chk=000079451-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079451

0 1
O 1.410651 0.537167 -0.002985
N -1.408442 1.799538 0.002391
N -3.322119 0.533854 0.002895
N 0.268557 -1.559757 -0.004750
N -2.187167 -1.687126 -0.001745
C 2.697408 -0.215750 -0.004392
C 3.819891 0.822917 0.006719
C -0.992000 0.468580 -0.000056
C 0.249510 -0.206607 -0.002557
C -2.195861 -0.315111 0.000266
C 5.206283 0.140450 0.001018
C -2.808946 1.776153 0.004144
C -0.941812 -2.225015 -0.004108
H 2.728955 -0.859732 -0.903298
H 2.723291 -0.873685 0.884402
H 3.715145 1.480308 -0.877114
H 3.713820 1.462843 0.903096
H -0.802840 2.619295 0.002785
H 5.341841 -0.488169 -0.899117
H 6.013714 0.893971 0.009607
H 5.340257 -0.506679 0.888184
H -3.403415 2.687685 0.006206
H -0.879422 -3.316929 -0.005893


