%chk=000145472.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145472

0 1
 O  -0.4682000      -1.537800       1.247500    
 O  -0.5673000      -1.580400      -1.143900    
 N   -1.386400      0.3106000      3.3799998E-02
 N   -2.525800       2.030800     -0.6459000    
 C  -0.3539000     -0.7694000      3.1199999E-02
 C    1.024200     -8.8000000E-02 -1.7600000E-02
 C    1.365400      0.7641000       1.002500    
 C    1.849500     -0.3637000      -1.078700    
 C   -2.283700      0.4980000       1.006200    
 C   -1.534600       1.218000     -0.9372000    
 C    2.615200       1.381900      0.9585000    
 C    3.099300      0.2542000      -1.122500    
 C   -2.996700       1.587800      0.5647000    
 C    3.482100       1.126900     -0.1040000    
 C   0.4972000      -2.571600       1.411400    
 C   -1.816600      -2.261500      -1.206000    
 H   0.7044000      0.9647000       1.839500    
 H    1.584900      -1.038100      -1.885300    
 H   -2.374500     -0.1013000       1.901100    
 H  -0.9295000       1.267600      -1.832500    
 H    2.914300       2.059900       1.752500    
 H    3.775100      5.5399999E-02  -1.949300    
 H   -3.825800       2.075400       1.056700    
 H   0.2001000      -3.173400       2.274900    
 H    1.488400      -2.159200       1.617200    
 H   0.5326000      -3.224400      0.5346000    
 H   -1.793900      -2.923800      -2.076000    
 H   -2.644300      -1.560400      -1.340000    
 H   -1.979500      -2.873800     -0.3148000    
 H    4.455600       1.607400     -0.1380000    


%chk=000145472-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145472

0 1
O -0.501891 -1.500363 1.252203
O -0.515819 -1.558421 -1.152809
N -1.403851 0.297114 0.116118
N -2.700525 2.052676 -0.500789
C -0.336251 -0.721333 0.020317
C 1.051382 -0.083400 -0.083319
C 1.412224 0.897775 0.872821
C 1.984565 -0.487600 -1.064991
C -2.451254 0.362890 1.051081
C -1.602567 1.335590 -0.800440
C 2.700115 1.473096 0.844208
C 3.273437 0.092638 -1.093145
C -3.231366 1.450164 0.657618
C 3.635080 1.071506 -0.139766
C 0.510126 -2.556879 1.429703
C -1.849163 -2.183162 -1.265057
H 0.682838 1.209390 1.628714
H 1.691050 -1.240045 -1.801550
H -2.518637 -0.335672 1.877354
H -0.930804 1.515982 -1.635441
H 2.972729 2.235352 1.582171
H 3.991978 -0.217843 -1.859715
H -4.131345 1.838271 1.128886
H 0.159489 -3.144339 2.291710
H 1.502595 -2.121320 1.646193
H 0.572769 -3.196240 0.530400
H -1.761242 -2.892311 -2.101678
H -2.618566 -1.423189 -1.491908
H -2.113441 -2.715809 -0.334048
H 4.633946 1.521382 -0.164243


