%chk=000043659.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043659

0 1
 O   -3.520900      0.1441000     -0.8685000    
 O   -2.446000      0.8845000      0.9904000    
 O    3.528000     -0.7673000      0.3773000    
 N    1.774100      0.3580000      5.1700000E-02
 N    2.660600     -0.4791000     -0.4560000    
 C  -0.2824000     -0.9250000      0.4190000    
 C   0.4089000      0.1514000     -0.4189000    
 C   -1.718300      -1.179900     -2.8999999E-02
 C    2.169700       1.756900     -0.1634000    
 C   -2.573700      5.6299999E-02  9.7400002E-02
 H  -0.2742000     -0.6311000       1.476700    
 H   0.2698000      -1.870500      0.3487000    
 H   0.3780000     -0.1043000      -1.487400    
 H  -0.1659000       1.080100     -0.3157000    
 H   -2.174100      -1.970300      0.5762000    
 H   -1.718300      -1.508900      -1.074500    
 H    2.157800       2.031700      -1.225700    
 H    3.175800       1.951900      0.2293000    
 H    1.498500       2.435500      0.3767000    
 H   -4.075500      0.9467000     -0.7659000    


%chk=000043659-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043659

0 1
O -3.903136 -0.068781 -0.570562
O -2.225600 1.456509 -0.076467
O 4.049309 -0.156612 -0.390516
N 1.855232 0.288002 -0.392748
N 2.881348 -0.556339 -0.768655
C -0.311795 -0.664407 0.452174
C 0.497479 -0.144179 -0.760954
C -1.774078 -0.980016 0.083009
C 2.115701 1.527430 0.363337
C -2.600281 0.266835 -0.183136
H -0.297410 0.093331 1.257311
H 0.173892 -1.576564 0.844585
H 0.619709 -0.942895 -1.514319
H -0.034375 0.705941 -1.225787
H -2.273493 -1.536371 0.899101
H -1.840432 -1.635803 -0.806588
H 1.174944 2.092265 0.449945
H 2.877736 2.129656 -0.162037
H 2.515306 1.299911 1.368618
H -4.428156 0.762787 -0.727911


