%chk=000104245.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104245

0 1
 O   0.9388000     -0.5564000      -2.421700    
 O   0.9397000     -0.7429000       2.368400    
 O    3.455800       2.333100      8.8900000E-02
 N    2.155300      0.8953000      -1.139100    
 N    2.153500      0.8061000       1.202300    
 C   0.5865000     -0.6614000     -2.6900001E-02
 C   0.6605000      -2.193600     -8.6199999E-02
 C  -0.8582000     -0.2474000     -1.1100000E-02
 C    1.237600     -0.1263000      -1.305600    
 C    1.237500     -0.2267000       1.289100    
 C    2.096800      -2.671000     -7.1300000E-02
 C   -1.184900       1.102300     -3.3900000E-02
 C   -1.849600      -1.219700      2.5400000E-02
 C    2.637600       1.412100      5.3300001E-02
 C   -2.525900       1.486400     -1.9900000E-02
 C   -3.190400     -0.8355000      3.9400000E-02
 C   -3.528600      0.5175000      1.6799999E-02
 C   -4.962000      0.9282000      3.2099999E-02
 H   0.1962000      -2.599600     -0.9953000    
 H   0.1866000      -2.668400      0.7837000    
 H    2.669700      -2.300700     -0.9268000    
 H    2.626100      -2.389100      0.8439000    
 H    2.119000      -3.765400     -0.1246000    
 H  -0.4220000       1.874400     -5.9700001E-02
 H   -1.685100      -2.289400      4.1600000E-02
 H    2.543400       1.293500      -1.989900    
 H    2.540700       1.138000       2.081300    
 H   -2.776800       2.543600     -3.9000001E-02
 H   -3.964000      -1.598700      6.5499999E-02
 H   -5.341400       1.006100     -0.9916000    
 H   -5.574800      0.2038000      0.5795000    
 H   -5.090800       1.896000      0.5286000    


%chk=000104245-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104245

0 1
O 1.045005 -0.665583 -2.450042
O 1.046719 -0.812836 2.406078
O 3.256792 2.542468 0.076864
N 2.073501 0.945011 -1.153324
N 2.068980 0.877725 1.209777
C 0.627891 -0.784588 -0.023288
C 0.793424 -2.334529 -0.068747
C -0.863799 -0.324981 -0.007162
C 1.255189 -0.192893 -1.306209
C 1.254903 -0.270237 1.293332
C 2.264147 -2.798595 -0.094202
C -1.172059 1.060487 -0.000389
C -1.933459 -1.249876 0.010263
C 2.513591 1.530601 0.046881
C -2.509313 1.503805 0.020231
C -3.271255 -0.799323 0.031152
C -3.586975 0.582008 0.032405
C -5.027786 1.059697 0.023574
H 0.274216 -2.700540 -0.971703
H 0.292241 -2.750138 0.822825
H 2.794316 -2.429936 -0.991057
H 2.813728 -2.466652 0.805553
H 2.309698 -3.901589 -0.117049
H -0.371251 1.809604 -0.008139
H -1.739447 -2.325209 0.011560
H 2.429441 1.377042 -2.012717
H 2.420659 1.260383 2.093914
H -2.719998 2.579929 0.027839
H -4.083574 -1.535910 0.047911
H -5.399181 1.177571 -1.013049
H -5.696044 0.342534 0.531392
H -5.133502 2.038748 0.522725


