%chk=000101502.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101502

0 1
 O    3.095900     -0.9864000     -0.1140000    
 O   -4.769000       2.158800     -0.1628000    
 N   -3.132400      2.8800000E-02  0.5586000    
 N   -4.511800     -5.4299999E-02  0.5120000    
 C    5.070600      0.3050000      0.2936000    
 C    5.827200       1.590700     -2.7899999E-02
 C    3.755300      0.2215000     -0.4679000    
 C   -1.051800     -0.9729000     -0.2768000    
 C    1.726200     -0.9822000     -0.1682000    
 C   -2.541800     -0.9689000     -0.3353000    
 C    7.119300       1.690400      0.7670000    
 C  -0.3922000      -1.792700      0.6389000    
 C  -0.3173000     -0.1579000      -1.138200    
 C    1.001600      -1.797400      0.6933000    
 C    1.076400     -0.1625000      -1.083800    
 C   -5.235800       1.063200      0.1405000    
 C   -6.720500      0.8168000      0.1709000    
 H    4.869700      0.2425000       1.370600    
 H    5.687800     -0.5698000      5.3100001E-02
 H    6.058000       1.629000      -1.098800    
 H    5.200000       2.460300      0.2002000    
 H    3.945800      0.2242000      -1.547400    
 H    3.157700       1.102800     -0.2004000    
 H   -2.862500     -0.7786000      -1.368400    
 H   -2.914500      -1.972300     -8.6900003E-02
 H  -0.9525000      -2.431400       1.316800    
 H  -0.8193000      0.4819000      -1.859400    
 H    7.645800       2.617600      0.5201000    
 H    7.784800      0.8512000      0.5404000    
 H    6.919200       1.689700       1.843200    
 H    1.511400      -2.436600       1.408500    
 H    1.610700      0.4653000      -1.790200    
 H   -2.861900     -0.1751000       1.520600    
 H   -4.954000     -0.9268000      0.7850000    
 H   -7.224400       1.541200     -0.4751000    
 H   -6.954800     -0.1894000     -0.1885000    
 H   -7.084100      0.9298000       1.195700    


%chk=000101502-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101502

0 1
O 2.992099 -0.448272 0.562934
O -4.902405 1.530537 -0.407318
N -3.414805 -0.561850 0.790832
N -4.829154 -0.559820 0.602569
C 5.260222 0.376522 0.412300
C 6.238606 1.411663 -0.190313
C 3.826853 0.583743 -0.080885
C -1.171259 -0.704909 -0.230961
C 1.623126 -0.469699 0.255255
C -2.661561 -0.831678 -0.486701
C 7.688763 1.201935 0.295630
C -0.510716 -1.589933 0.664988
C -0.406603 0.300132 -0.865924
C 0.868800 -1.479273 0.907931
C 0.983504 0.427251 -0.635522
C -5.511823 0.500133 0.013219
C -7.025746 0.334716 -0.062985
H 5.273087 0.443891 1.517073
H 5.585792 -0.648207 0.149216
H 6.208064 1.349835 -1.297416
H 5.904617 2.435459 0.075462
H 3.766457 0.475982 -1.184632
H 3.451931 1.591597 0.196961
H -2.974892 -0.134889 -1.291009
H -2.925594 -1.859251 -0.798876
H -1.093240 -2.363663 1.177413
H -0.900868 0.999080 -1.551479
H 8.373162 1.950051 -0.144104
H 8.058839 0.197934 0.015492
H 7.754348 1.288301 1.396415
H 1.386111 -2.157485 1.593588
H 1.543953 1.215903 -1.145435
H -3.134863 0.359442 1.167753
H -5.327883 -1.356530 1.000939
H -7.341334 0.408862 -1.117756
H -7.383930 -0.624421 0.350100
H -7.508857 1.162411 0.484241


