%chk=000017222.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017222

0 1
 O    5.346200      -1.097800      0.2701000    
 O    5.346500       1.097500      0.2701000    
 N  -0.8081000     -9.9999997E-05 -0.6051000    
 N   -1.398200       0.000000      0.5009000    
 N    4.744300     -9.9999997E-05  0.1848000    
 C   0.5834000       0.000000     -0.4072000    
 C    3.338400      9.9999997E-05 -1.4900000E-02
 C    1.266900      -1.208000     -0.3101000    
 C    1.266900       1.208000     -0.3097000    
 C    2.647800      -1.207900     -0.1133000    
 C    2.647900       1.208200     -0.1131000    
 C   -2.782600      1.9999999E-04  0.3045000    
 C   -3.473200      -1.207900      0.2064000    
 C   -3.473300       1.208200      0.2061000    
 C   -4.854100      -1.208100      9.7000003E-03
 C   -4.854200       1.207900      9.4999997E-03
 C   -5.544600     -3.0000001E-04 -8.8799998E-02
 H   0.7364000      -2.153300     -0.3865000    
 H   0.7363000       2.153300     -0.3859000    
 H    3.152600      -2.167900     -4.1700002E-02
 H    3.152700       2.168200     -4.1400000E-02
 H   -2.944100      -2.154300      0.2825000    
 H   -2.944500       2.154700      0.2820000    
 H   -5.391600      -2.148600     -6.6600002E-02
 H   -5.392100       2.148300     -6.7100003E-02
 H   -6.619800     -3.0000001E-04 -0.2418000    


%chk=000017222-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017222

0 1
O 5.539550 -1.142029 0.132181
O 5.539078 1.141122 0.141919
N -0.743424 0.000941 -0.505499
N -1.506131 0.001428 0.533189
N 4.934604 -0.000360 0.085571
C 0.678351 0.000258 -0.264949
C 3.461186 -0.000130 -0.040233
C 1.377103 -1.233108 -0.222699
C 1.376579 1.233502 -0.211964
C 2.777800 -1.235427 -0.102972
C 2.777295 1.235367 -0.092377
C -2.933402 0.000393 0.242296
C -3.625433 -1.230588 0.169946
C -3.624854 1.230940 0.158078
C -5.026466 -1.223175 -0.009047
C -5.025919 1.222459 -0.020662
C -5.730871 -0.000621 -0.104540
H 0.822438 -2.174423 -0.280133
H 0.821509 2.175053 -0.261093
H 3.347729 -2.166731 -0.052544
H 3.346842 2.166438 -0.033956
H -3.075697 -2.173861 0.253458
H -3.074668 2.174722 0.232419
H -5.565461 -2.174410 -0.075923
H -5.564485 2.173261 -0.096541
H -6.817352 -0.001023 -0.240524


