%chk=000176501.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176501

0 1
 O   -3.091800      0.8137000      -1.107400    
 O    3.518900      0.2432000      2.3399999E-02
 O    2.342800       2.096700     -3.0000001E-04
 N    2.419700      0.8456000      7.7000000E-03
 N   0.2237000      -3.485600      8.9999996E-03
 N   -3.105300      0.8409000       1.185600    
 C  -2.9300001E-02  0.7065000     -1.7200001E-02
 C   -1.193000     -6.2500000E-02 -2.3900000E-02
 C    1.218500      8.3300002E-02 -1.8000000E-03
 C   -1.108800      -1.454800     -1.5600000E-02
 C   0.1390000      -2.078000     -3.0000001E-04
 C    1.302700      -1.308900      6.6000000E-03
 C  -0.1263000       2.200900     -2.6300000E-02
 C   -2.510900      0.5591000     -3.9500002E-02
 H   -2.016400      -2.054900     -2.1100000E-02
 H    2.262400      -1.821200      1.8999999E-02
 H   0.2872000       2.637900      0.8893000    
 H   0.3152000       2.628500     -0.9333000    
 H   -1.160600       2.558900     -4.6900000E-02
 H  -0.6198000      -4.043600      2.7999999E-03
 H    1.127800      -3.938900      1.8800000E-02
 H   -2.647200      0.6337000       2.067300    
 H   -4.024300       1.268000       1.233800    


%chk=000176501-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176501

0 1
O -3.190158 0.789979 -1.129038
O 3.601506 0.094012 0.015134
O 2.527641 2.093277 0.027418
N 2.517643 0.801985 0.017363
N 0.226161 -3.513942 0.007018
N -3.145074 0.816669 1.193503
C -0.032683 0.783776 0.001289
C -1.189040 -0.053867 0.010345
C 1.211995 0.081866 0.011763
C -1.110970 -1.459867 0.016524
C 0.147646 -2.125187 0.011584
C 1.315555 -1.325774 0.016454
C -0.187430 2.292879 -0.038585
C -2.581226 0.557542 -0.045068
H -2.036611 -2.047713 0.007176
H 2.314180 -1.770880 0.018744
H 0.291932 2.777918 0.829110
H 0.304725 2.721951 -0.928258
H -1.252047 2.573342 -0.065186
H -0.613365 -4.084375 -0.029291
H 1.126406 -3.984071 -0.012487
H -2.640390 0.629604 2.058732
H -4.082195 1.219376 1.235454


