%chk=000025221.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025221

0 1
 O    1.946100      5.0000002E-04 -0.9519000    
 O    2.353500      9.9999997E-05   1.337100    
 N   -3.511600      5.0000002E-04  0.1357000    
 N    4.107100      9.9999997E-05 -0.1817000    
 C   -2.124900      3.9999999E-04 -0.1409000    
 C   -1.440600       1.208200     -0.2770000    
 C   -1.441200      -1.207700     -0.2777000    
 C  -7.2700001E-02   1.208000     -0.5501000    
 C  -7.3200002E-02  -1.207900     -0.5508000    
 C   0.6109000     -9.9999997E-05 -0.6872000    
 C   -2.145800       2.518000     -0.1354000    
 C   -2.146900      -2.517200     -0.1361000    
 C   -4.034900     -1.4000000E-03   1.464600    
 C    2.777100     -6.9999998E-04  0.1851000    
 C    5.196800     -7.9999998E-04  0.7663000    
 H   0.4702000       2.144100     -0.6567000    
 H   0.4695000      -2.143900     -0.6585000    
 H   -4.059100     -0.5229000     -0.5424000    
 H   -2.413100       2.695900      0.9110000    
 H   -1.517400       3.353300     -0.4640000    
 H   -3.051300       2.543500     -0.7507000    
 H   -1.490300      -3.359300     -0.3815000    
 H   -2.488800      -2.660500      0.8935000    
 H   -3.002800      -2.575100     -0.8165000    
 H   -3.727500     -0.8958000       2.015100    
 H   -5.128700      1.5100000E-02   1.434400    
 H   -3.704500      0.8795000       2.023700    
 H    4.332200      1.6000000E-03  -1.171700    
 H    5.810300     -0.8855000      0.5797000    
 H    4.830500     -1.3600000E-02   1.795400    
 H    5.796500      0.8969000      0.5971000    


%chk=000025221-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025221

0 1
O 2.025371 0.574974 0.008923
O 2.931869 -1.626410 0.218765
N -3.592196 -0.256864 0.031032
N 4.256796 0.307115 0.067770
C -2.185801 -0.056644 0.030674
C -1.612199 1.253337 -0.054840
C -1.322858 -1.201726 0.064437
C -0.206369 1.385801 -0.040695
C 0.081807 -1.044034 0.048115
C 0.630919 0.254889 0.017678
C -2.466631 2.494066 -0.247520
C -1.907063 -2.604340 0.122642
C -4.512889 0.456484 0.936716
C 3.063938 -0.381630 0.110373
C 5.549662 -0.374171 0.147362
H 0.252331 2.378017 -0.106302
H 0.736247 -1.916260 0.081092
H -3.868270 -1.221936 -0.152485
H -2.965656 2.820601 0.684923
H -1.848973 3.337029 -0.601688
H -3.258495 2.306885 -0.996355
H -1.105063 -3.355895 0.204528
H -2.578294 -2.734874 0.995117
H -2.491954 -2.855492 -0.786517
H -4.104939 0.551388 1.965237
H -5.457241 -0.112832 0.996321
H -4.763760 1.469220 0.576193
H 4.206779 1.321880 -0.020992
H 6.155468 -0.195363 -0.760464
H 5.357700 -1.455297 0.235353
H 6.125160 -0.044617 1.032505