%chk=000028742.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028742

0 1
 O   -1.337200      4.6399999E-02  -1.982700    
 O   -6.427400      -1.685300      0.4511000    
 O   -5.071300       2.887000      1.3600000E-02
 O   -6.995200       1.014600      0.6942000    
 N    2.210800      -1.118600      0.2562000    
 N    4.884000     -0.1121000      0.2309000    
 C    2.787000     -0.5092000       1.461000    
 C    2.743700     -0.4574000     -0.9415000    
 C    4.311700     -0.6450000       1.471100    
 C    4.266500     -0.5926000      -1.011500    
 C   0.7513000      -1.030200      0.2844000    
 C   0.1411000      -2.046900     -0.6826000    
 C    6.231700      0.2625000      0.1933000    
 C   -1.389100      -1.992800     -0.6929000    
 C    6.647800       1.285900     -0.6582000    
 C    7.159200     -0.3883000       1.006900    
 C   -1.943500     -0.6626000      -1.182900    
 C    7.991600       1.658400     -0.6962000    
 C    8.502900     -1.5699999E-02  0.9690000    
 C   -3.278500     -0.2197000     -0.6886000    
 C    8.919000       1.007600      0.1174000    
 C   -3.560500       1.140800     -0.5663000    
 C   -4.244500      -1.165800     -0.3458000    
 C   -5.492600     -0.7513000      0.1192000    
 C   -4.808600       1.555300     -0.1013000    
 C   -5.774500      0.6092000      0.2415000    
 C   -6.058700      -3.054300      0.2969000    
 C   -4.029600       3.787500     -0.3577000    
 C   -7.136800       1.192500       2.101600    
 H    2.511000      0.5520000       1.527200    
 H    2.397700      -1.004500       2.358800    
 H    2.340500     -0.8993000      -1.857900    
 H    2.473300      0.6074000     -0.9493000    
 H    4.694900     -9.8600000E-02   2.342000    
 H    4.585200      -1.701900       1.584900    
 H    4.545500      -1.642400      -1.169900    
 H    4.618300     -3.0400001E-02  -1.884200    
 H   0.4118000     -8.8999998E-03  7.4699998E-02
 H   0.3827000      -1.280900       1.287900    
 H   0.4533000      -3.059200     -0.3961000    
 H   0.4928000      -1.886100      -1.707000    
 H   -1.773100      -2.777900      -1.354100    
 H   -1.749200      -2.190400      0.3231000    
 H    5.938600       1.815000      -1.289400    
 H    6.873700      -1.198800       1.671300    
 H    8.315400       2.457400      -1.356800    
 H    9.226000     -0.5243000       1.600000    
 H    9.965200       1.297700      8.7899998E-02
 H   -2.771900       1.833500     -0.8394000    
 H   -3.990800      -2.211000     -0.4752000    
 H   -5.864200      -3.304800     -0.7516000    
 H   -5.225600      -3.325700      0.9542000    
 H   -6.918200      -3.655800      0.6113000    
 H   -3.152300       3.679400      0.2892000    
 H   -3.779300       3.700200      -1.420600    
 H   -4.412200       4.802200     -0.2050000    
 H   -8.161700       1.515200       2.304600    
 H   -6.449400       1.963400       2.463800    
 H   -6.956000      0.2507000       2.629300    


%chk=000028742-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028742

0 1
O -1.150934 0.719313 -1.152780
O -6.511254 -1.584802 0.779998
O -5.730997 2.964558 -0.480635
O -7.390982 1.062288 0.346857
N 2.452865 -1.158571 0.232836
N 5.215302 -0.257591 0.197661
C 3.240498 -1.048384 1.483171
C 2.898171 -0.102683 -0.710827
C 4.746004 -1.222786 1.209943
C 4.390399 -0.272443 -1.034079
C 0.988113 -1.132068 0.478529
C 0.183238 -1.722697 -0.698985
C 6.592994 0.066462 0.124128
C -1.338994 -1.619698 -0.478383
C 7.065326 1.069133 -0.780177
C 7.558705 -0.558559 0.972998
C -1.896086 -0.202711 -0.697169
C 8.426309 1.427391 -0.822495
C 8.918437 -0.183178 0.927426
C -3.336356 0.066769 -0.389133
C 9.371348 0.810306 0.031717
C -3.823774 1.381126 -0.597905
C -4.211490 -0.941785 0.088102
C -5.564199 -0.635744 0.352758
C -5.168367 1.696504 -0.320832
C -6.062272 0.690642 0.170463
C -6.067544 -2.974276 0.911799
C -4.855645 4.019382 -1.003450
C -8.074658 0.706928 1.609729
H 3.081342 -0.058218 1.983735
H 2.914385 -1.840892 2.182653
H 2.318747 -0.177318 -1.646838
H 2.725181 0.917460 -0.283223
H 5.286279 -1.046796 2.156271
H 4.938252 -2.273068 0.887932
H 4.530396 -1.236198 -1.575123
H 4.703179 0.540638 -1.706511
H 0.628034 -0.095812 0.690292
H 0.790943 -1.740457 1.383998
H 0.478263 -2.780192 -0.830346
H 0.436679 -1.187485 -1.631374
H -1.870717 -2.297879 -1.177855
H -1.607573 -1.965709 0.540789
H 6.364328 1.595874 -1.435213
H 7.260996 -1.357821 1.657546
H 8.748937 2.206367 -1.523622
H 9.630482 -0.686444 1.592545
H 10.428017 1.094968 -0.003489
H -3.113763 2.126228 -0.967149
H -3.844868 -1.960272 0.233461
H -5.694862 -3.368883 -0.053094
H -5.282650 -3.077077 1.686337
H -6.964282 -3.532577 1.218169
H -4.001143 4.207270 -0.324938
H -4.477742 3.764667 -2.012131
H -5.493432 4.913434 -1.057868
H -9.053657 1.204086 1.540097
H -7.510379 1.106444 2.473422
H -8.191228 -0.384067 1.704064


