%chk=000109004.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000109004

0 1
 O   9.9399999E-02  0.4775000       1.854500    
 O   -5.564500       1.679600     -0.8361000    
 N   -2.170000      0.6631000      0.1784000    
 C   0.2989000      0.2953000      0.4383000    
 C  -0.8415000       1.111100     -0.2379000    
 C   0.1884000      -1.192100      6.9399998E-02
 C    1.712800      0.8165000      0.1337000    
 C   -3.207100       1.400600     -0.5419000    
 C   -2.335400      0.8271000       1.622200    
 C   0.4129000      -1.559500      -1.234400    
 C    2.775800      0.2276000      0.7716000    
 C  -0.1295000      -2.088200       1.059900    
 C    1.848500       1.847000     -0.7629000    
 C   -4.590300      0.9263000     -0.1259000    
 C   0.3128000      -2.909800      -1.569400    
 C    4.058700      0.7002000      0.4952000    
 C  -0.2296000      -3.438600      0.7248000    
 C    3.131400       2.319500      -1.039300    
 C  -8.2999999E-03  -3.849300     -0.5899000    
 C    4.236500       1.746000     -0.4102000    
 H  -0.7410000       2.176700      1.4700000E-02
 H  -0.7698000       1.022600      -1.329800    
 H   -3.096300       1.250300      -1.623600    
 H   -3.125100       2.483200     -0.3745000    
 H   -1.925700     -2.3399999E-02   2.172800    
 H   -3.364100      0.7835000       1.978600    
 H   -1.946100       1.781800       1.996100    
 H   0.4446000       1.351900       2.105200    
 H   0.6615000     -0.8409000      -2.008500    
 H    2.651900     -0.5825000       1.483100    
 H  -0.3016000      -1.809200       2.093100    
 H    1.029100       2.321800      -1.286800    
 H   -4.846200       1.097900      0.9178000    
 H   -4.739900     -0.1353000     -0.3501000    
 H   0.4846000      -3.229700      -2.592900    
 H    4.919100      0.2546000      0.9859000    
 H  -0.4781000      -4.170900       1.487400    
 H    3.271200       3.132500      -1.746000    
 H  -8.5900001E-02  -4.900800     -0.8506000    
 H    5.235500       2.113900     -0.6257000    
 H   -5.427800       1.516800      -1.785000    


%chk=000109004-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000109004

0 1
O 0.385385 0.295103 2.098042
O -5.128438 -0.258007 -1.124254
N -2.067376 1.134983 0.653406
C 0.384396 0.441783 0.614267
C -0.716609 1.492638 0.216227
C 0.010439 -0.933188 0.045835
C 1.798733 0.877060 0.177851
C -3.118653 1.020896 -0.373607
C -2.498866 1.736628 1.924078
C 0.260076 -1.226431 -1.318180
C 2.903136 0.128507 0.669822
C -0.649646 -1.893968 0.848047
C 2.056984 1.981611 -0.672938
C -4.045834 -0.192966 -0.125769
C -0.144133 -2.460910 -1.873810
C 4.225057 0.474026 0.323384
C -1.046601 -3.133049 0.294820
C 3.383763 2.330724 -1.020316
C -0.800096 -3.420774 -1.067604
C 4.471900 1.580848 -0.524337
H -0.407057 2.479728 0.634278
H -0.704565 1.591365 -0.886001
H -2.634534 0.887726 -1.360752
H -3.754644 1.936980 -0.440221
H -1.748494 1.529218 2.704527
H -3.451551 1.287263 2.254731
H -2.651334 2.843563 1.854412
H 0.865134 1.077684 2.473054
H 0.789460 -0.497329 -1.944002
H 2.707884 -0.731142 1.320007
H -0.836070 -1.661092 1.898940
H 1.234924 2.582062 -1.075168
H -4.574161 -0.096622 0.837032
H -3.441795 -1.121362 -0.108013
H 0.062577 -2.677907 -2.928205
H 5.062396 -0.118306 0.709339
H -1.551432 -3.872589 0.927130
H 3.564113 3.188167 -1.678679
H -1.108223 -4.382160 -1.494368
H 5.498467 1.851532 -0.795543
H -4.734914 -0.477593 -2.006161


