%chk=000094978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094978

0 1
 O   -3.708400     -0.4333000      1.1000000E-03
 O   -2.969200       1.633800     -9.9999997E-05
 N    2.155400      0.8983000     -7.9999998E-04
 N    2.541800      -1.290500      5.0000002E-04
 N   -2.767400      0.3960000      9.9999997E-05
 C   0.9175000      0.3081000     -6.0000003E-04
 C    1.185600      -1.058000       0.000000    
 C  -0.3742000      0.8357000     -1.1000000E-03
 C   -1.429200     -8.2599998E-02 -6.0000003E-04
 C   0.1135000      -1.966300      1.9999999E-04
 C    3.092400     -9.7099997E-02  9.9999997E-05
 C   -1.191800      -1.459100     -1.9999999E-04
 C    2.434100       2.315000      1.3000000E-03
 H  -0.5260000       1.909700     -1.4000000E-03
 H   0.2879000      -3.037600      6.9999998E-04
 H    4.155300      0.1031000      7.9999998E-04
 H   -2.006400      -2.180200      9.9999997E-05
 H    3.515200       2.475200      2.0000001E-03
 H    1.994400       2.754800     -0.8973000    
 H    1.993400       2.752400      0.9008000    


%chk=000094978-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094978

0 1
O -3.771829 -0.462380 -0.000372
O -2.994361 1.681787 -0.000180
N 2.188581 0.920923 0.000414
N 2.573076 -1.346117 0.000376
N -2.809596 0.400160 -0.000204
C 0.923331 0.312355 0.000272
C 1.184725 -1.106970 0.000216
C -0.374388 0.846251 0.000127
C -1.418297 -0.103579 -0.000058
C 0.105172 -2.022277 0.000021
C 3.124132 -0.119380 0.000500
C -1.203031 -1.512779 -0.000116
C 2.460399 2.361756 0.000937
H -0.608152 1.913760 0.000152
H 0.297741 -3.098547 -0.000024
H 4.195568 0.076922 0.000599
H -2.074348 -2.171927 -0.000260
H 3.549510 2.525831 0.000833
H 2.032709 2.841151 -0.897222
H 2.032959 2.840462 0.899586


