%chk=000122963.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122963

0 1
 O   0.7630000      0.4827000      0.3407000    
 O   0.5644000      -1.421900     -0.9892000    
 N   -6.686200      0.4649000      0.3101000    
 C    4.885300      8.2500003E-02  6.7599997E-02
 C    2.151000      0.3481000      0.2496000    
 C   -1.384300     -0.2910000     -0.2087000    
 C    4.194500      0.8449000     -0.8743000    
 C    4.191000     -0.5453000       1.101700    
 C    2.809300      0.9794000     -0.7820000    
 C    2.805600     -0.4108000       1.193900    
 C    6.366400     -6.0899999E-02 -3.0300001E-02
 C   4.8799999E-02 -0.4951000     -0.3484000    
 C   -2.250300      -1.384200     -0.2315000    
 C   -1.892700      0.9982000     -5.0200000E-02
 C   -3.624700      -1.188300     -9.6100003E-02
 C   -3.267100       1.194200      8.5500002E-02
 C   -4.133000      0.1009000      6.2500000E-02
 C   -5.541100      0.3016000      0.1991000    
 H    4.724000       1.337500      -1.685500    
 H    4.717800      -1.143300       1.840700    
 H    2.271200       1.572600      -1.514600    
 H    2.264800     -0.8991000       1.998500    
 H   -1.870300      -2.395500     -0.3511000    
 H   -1.244100       1.870300     -4.1600000E-02
 H    6.818100     -0.1798000      0.9604000    
 H    6.619800     -0.9348000     -0.6386000    
 H    6.820400      0.8264000     -0.4845000    
 H   -4.287100      -2.050500     -0.1156000    
 H   -3.648800       2.205400      0.2050000    


%chk=000122963-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122963

0 1
O 0.778089 0.060512 0.129299
O 0.244978 -0.950497 -1.931413
N -6.779326 0.234843 1.003459
C 5.038448 0.223603 0.120680
C 2.206173 0.066105 0.027077
C -1.520086 -0.272805 -0.398883
C 4.367704 -0.304483 -1.010806
C 4.247202 0.679758 1.208163
C 2.958833 -0.393968 -1.078051
C 2.841338 0.603100 1.168240
C 6.554653 0.277428 0.180591
C -0.101846 -0.437770 -0.841664
C -2.538334 -0.731129 -1.275555
C -1.871197 0.317198 0.843256
C -3.891837 -0.603623 -0.920203
C -3.223951 0.447995 1.205374
C -4.243934 -0.011614 0.325587
C -5.629026 0.122660 0.695774
H 4.955025 -0.657566 -1.866822
H 4.735998 1.100291 2.094712
H 2.463699 -0.804252 -1.958096
H 2.228389 0.955670 2.003281
H -2.245194 -1.182620 -2.228436
H -1.081336 0.667805 1.511514
H 6.906511 1.116854 0.805656
H 6.968100 -0.652703 0.616926
H 6.996688 0.391770 -0.824608
H -4.679110 -0.955716 -1.593378
H -3.500951 0.902256 2.161424


