%chk=000095856.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095856

0 1
 O   -1.042900      -2.963300       1.071600    
 O   -3.168400      0.8513000     -0.3401000    
 N   -2.053300      -1.024900      0.3595000    
 N    1.047000      -2.143100      -2.151100    
 N  -0.9166000       3.515800     -0.3849000    
 C   0.4112000      0.3184000      0.3377000    
 C   0.4006000      -1.233300      0.2380000    
 C  -0.7559000      0.8868000     -0.5160000    
 C    1.768700      0.8694000     -0.1681000    
 C   0.2884000      0.7302000       1.829100    
 C    2.909800      0.2882000      0.6433000    
 C  -0.9455000      -1.823100      0.6154000    
 C   -2.099700      0.2674000     -0.1518000    
 C   0.7625000      -1.742900      -1.099900    
 C  -0.8459000       2.359200     -0.4425000    
 C    4.239800      0.8439000      0.1600000    
 H    1.100500      -1.657300      0.9694000    
 H  -0.5908000      0.6240000      -1.570200    
 H    1.794400       1.963000     -7.7900000E-02
 H    1.910200      0.6544000      -1.234200    
 H  -0.7374000      0.6161000       2.196500    
 H   0.9102000      0.1154000       2.488100    
 H   0.5640000       1.779300       1.985500    
 H    2.971400     -0.7996000      0.5554000    
 H    2.832000      0.5341000       1.705800    
 H   -2.953200      -1.436900      0.5910000    
 H    4.412300      0.5943000     -0.8920000    
 H    4.274200       1.933200      0.2653000    
 H    5.062900      0.4223000      0.7460000    


%chk=000095856-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095856

0 1
O -1.189954 -2.949183 1.214564
O -3.194542 0.884593 -0.433597
N -2.127641 -1.038384 0.288240
N 1.001265 -2.084361 -2.171006
N -0.787823 3.534106 -0.438466
C 0.419459 0.301013 0.427517
C 0.357704 -1.265649 0.288118
C -0.718929 0.871809 -0.505875
C 1.792944 0.847538 -0.070946
C 0.167733 0.693012 1.905667
C 3.049678 0.283521 0.633301
C -1.032081 -1.842255 0.650916
C -2.119951 0.280892 -0.218665
C 0.715334 -1.724443 -1.069945
C -0.777350 2.343175 -0.472763
C 4.340830 0.909007 0.060652
H 1.065230 -1.725123 1.001664
H -0.473150 0.574413 -1.550374
H 1.781222 1.948534 0.050317
H 1.885654 0.654358 -1.159521
H -0.820184 0.362267 2.273949
H 0.933899 0.249679 2.564239
H 0.217356 1.789872 2.019417
H 3.101380 -0.816285 0.507159
H 3.003319 0.482009 1.721555
H -3.059451 -1.432601 0.475206
H 4.439407 0.696751 -1.019940
H 4.342653 2.007192 0.190812
H 5.236491 0.506844 0.566705


