%chk=000227317.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227317

0 1
 O  -0.6598000       2.279400       1.117800    
 O    3.584100       1.096400      0.5733000    
 N    1.554400       1.792600     -0.4108000    
 C   0.2645000       1.493500     -0.9634000    
 C  -0.7946000       1.514500      0.1434000    
 C    2.476100      0.8490000      9.8800004E-02
 C   -1.971900      0.6692000      2.5900001E-02
 C    2.078700     -0.5677000      7.7000000E-02
 C    1.942900       3.207700     -0.3772000    
 C   -2.476500      0.3473000      -1.234100    
 C   -2.596600      0.1797000       1.173100    
 C    2.381000      -1.341700      -1.032600    
 C    1.409800      -1.103400       1.166800    
 C   -3.605600     -0.4638000      -1.347000    
 C   -3.725700     -0.6314000       1.060200    
 C    2.004700      -2.684700      -1.053300    
 C    1.033600      -2.446400       1.146000    
 C   -4.230100     -0.9532000     -0.1999000    
 C    1.331100      -3.237000      3.5900000E-02
 H   2.7999999E-03   2.237800      -1.723000    
 H   0.2845000      0.5093000      -1.437000    
 H    2.007500       3.572100      -1.406800    
 H    2.911900       3.350300      0.1075000    
 H    1.188700       3.782800      0.1655000    
 H   -2.020300      0.7257000      -2.144600    
 H   -2.214600      0.4152000       2.163100    
 H    2.905100     -0.9188000      -1.885200    
 H    1.173600     -0.4941000       2.034700    
 H   -4.000700     -0.7119000      -2.327800    
 H   -4.211500      -1.013800       1.953200    
 H    2.235800      -3.300200      -1.917700    
 H   0.5079000      -2.876100       1.993700    
 H   -5.109500      -1.584500     -0.2877000    
 H    1.037400      -4.282500      1.9600000E-02


%chk=000227317-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227317

0 1
O -0.552058 1.364420 1.650719
O 3.724893 1.379353 -0.308887
N 1.400457 1.550425 -0.358935
C 0.087884 0.994536 -0.680194
C -0.925409 1.041246 0.487292
C 2.586409 0.810271 -0.307257
C -2.354089 0.687171 0.195427
C 2.492556 -0.695270 -0.235327
C 1.473490 3.018944 -0.243959
C -2.790090 0.237152 -1.081557
C -3.301158 0.798322 1.251072
C 3.372924 -1.458395 -1.044547
C 1.657046 -1.357256 0.702040
C -4.145162 -0.093194 -1.295071
C -4.653728 0.472159 1.035242
C 3.386422 -2.866110 -0.950813
C 1.687131 -2.765847 0.808347
C -5.079454 0.025529 -0.239730
C 2.541570 -3.524261 -0.025158
H -0.341001 1.556311 -1.537382
H 0.193027 -0.054886 -1.010503
H 1.111912 3.503052 -1.172387
H 2.526345 3.295800 -0.085054
H 0.864324 3.361555 0.610723
H -2.082621 0.133501 -1.910849
H -2.945778 1.142412 2.228184
H 4.050374 -0.934123 -1.726665
H 1.020017 -0.769993 1.373217
H -4.473634 -0.442116 -2.279921
H -5.376581 0.563218 1.853033
H 4.061964 -3.448710 -1.586911
H 1.051933 -3.267814 1.546545
H -6.131583 -0.229169 -0.408933
H 2.560369 -4.616933 0.055598


