%chk=000037119.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037119

0 1
 O    2.872400      0.4637000       1.008200    
 N   0.9618000     -0.7025000      0.5583000    
 N    1.910900      0.8100000      -1.032900    
 C  -0.1668000      -1.161500     -0.2621000    
 C  -0.4821000      -2.636800      5.9400000E-02
 C   -1.356000     -0.2327000     -9.7099997E-02
 C    1.878400      0.2007000      0.1116000    
 C   0.7238000      -3.553500     -0.1112000    
 C   -2.187000     -7.8999996E-03  -1.177900    
 C   -1.576100      0.3640000       1.129700    
 C    3.823600       1.227600      0.2841000    
 C    3.065700       1.706600     -0.9287000    
 C   -3.279600      0.8459000      -1.026200    
 C   -2.668600       1.217800       1.281300    
 C   -3.520500       1.458700      0.2035000    
 H   0.1487000      -1.128700      -1.314300    
 H  -0.8484000      -2.727500       1.090100    
 H   -1.292600      -2.987300     -0.5917000    
 H    1.042800      -1.073200       1.500900    
 H    1.516700      -3.318300      0.6051000    
 H    1.135100      -3.474900      -1.122500    
 H   0.4278000      -4.594600      5.3300001E-02
 H   -2.008400     -0.4824000      -2.138200    
 H  -0.9414000      0.1809000       1.991100    
 H    4.665100      0.5804000      1.5799999E-02
 H    4.193000       2.055700      0.8957000    
 H    2.714100       2.735700     -0.7955000    
 H    3.684900       1.672100      -1.830000    
 H   -3.943200       1.032900      -1.865300    
 H   -2.858900       1.691700       2.239900    
 H   -4.371800       2.122400      0.3219000    


%chk=000037119-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037119

0 1
O 2.949871 0.666238 0.798175
N 1.021262 -0.646709 0.609290
N 1.919083 0.512092 -1.309845
C -0.165848 -1.223012 -0.073075
C -0.402187 -2.668763 0.425626
C -1.384239 -0.292926 0.067747
C 1.907412 0.169981 -0.042220
C 0.744989 -3.625227 0.042018
C -1.503037 0.812381 -0.816696
C -2.371496 -0.471614 1.070254
C 3.739662 1.582323 -0.085515
C 3.159240 1.322189 -1.519376
C -2.579977 1.717839 -0.698246
C -3.450026 0.434878 1.190489
C -3.558137 1.533031 0.307212
H 0.111906 -1.260848 -1.142720
H -0.534128 -2.670703 1.527641
H -1.356419 -3.030655 -0.002839
H 1.045647 -0.639548 1.629956
H 1.710451 -3.261530 0.436553
H 0.841023 -3.705512 -1.056865
H 0.568131 -4.640030 0.442308
H -0.733121 0.959067 -1.583524
H -2.311505 -1.322088 1.759205
H 4.801754 1.312752 0.025625
H 3.568959 2.614072 0.268294
H 2.913515 2.265930 -2.037364
H 3.871549 0.761042 -2.154120
H -2.658186 2.564911 -1.389376
H -4.206637 0.281955 1.968877
H -4.396111 2.233485 0.398813


