%chk=000088372.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088372

0 1
 O    2.001900     -0.4041000     -0.1284000    
 O   0.9812000       1.610100      0.3450000    
 N   -2.784400     -0.2653000     -0.3238000    
 C   -1.583800      0.5095000     -3.6699999E-02
 C  -0.3385000     -0.3513000     -0.2282000    
 C   -3.981400      0.5652000     -0.1789000    
 C   -2.867800      -1.432900      0.5557000    
 C   0.9304000      0.4278000      3.5200000E-02
 C    3.284400      0.1928000      8.9500003E-02
 C    4.358000     -0.8518000     -0.1294000    
 H   -1.604300      0.9183000      0.9828000    
 H   -1.526200       1.366900     -0.7197000    
 H  -0.2962000     -0.7361000      -1.253700    
 H  -0.3156000      -1.188700      0.4769000    
 H   -4.105400      0.9368000      0.8449000    
 H   -4.879000     -5.0000002E-04 -0.4527000    
 H   -3.936900       1.426000     -0.8556000    
 H   -2.138900      -2.202400      0.2838000    
 H   -3.843800      -1.922000      0.4475000    
 H   -2.744600      -1.171800       1.613100    
 H    3.425500       1.021700     -0.6131000    
 H    3.340800      0.5722000       1.115900    
 H    5.353700     -0.4285000      2.9300001E-02
 H    4.219400      -1.695900      0.5541000    
 H    4.302700      -1.253900      -1.146400    


%chk=000088372-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088372

0 1
O 2.063696 -0.410303 -0.107584
O 1.043242 1.680988 -0.218491
N -2.828577 -0.243154 -0.217588
C -1.559405 0.411912 0.175930
C -0.328384 -0.382189 -0.304069
C -3.982941 0.668005 -0.067710
C -3.060410 -1.530011 0.470684
C 0.950729 0.430916 -0.201584
C 3.398277 0.266334 -0.064882
C 4.445028 -0.835419 0.064160
H -1.493174 0.569818 1.284223
H -1.525094 1.412504 -0.290477
H -0.484610 -0.646928 -1.369196
H -0.187376 -1.329468 0.243114
H -4.178689 0.969204 0.993287
H -4.894329 0.177736 -0.454644
H -3.811309 1.585758 -0.657376
H -2.249012 -2.242133 0.243041
H -4.005125 -1.973760 0.109320
H -3.129844 -1.425782 1.584481
H 3.516676 0.858707 -0.990397
H 3.406329 0.964226 0.791787
H 5.456029 -0.389855 0.098374
H 4.290798 -1.418910 0.987853
H 4.398675 -1.526096 -0.795156


