%chk=000025149.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025149

0 1
 O   -1.459100      -1.718600     -0.7298000    
 O   -3.835200     -0.4296000      0.2718000    
 O   0.9039000     -0.4072000     -0.6086000    
 N    3.926000      -2.004800      0.7618000    
 C  -0.2166000      0.1890000     -0.1095000    
 C   -1.445300     -0.4691000     -0.1668000    
 C  -0.1342000       1.455000      0.4708000    
 C   -2.595100      0.1509000      0.3285000    
 C   -2.664700      -2.426400     -0.4277000    
 C   -3.868100      -1.529300     -0.6421000    
 C   -1.277800       2.062800      0.9899000    
 C    1.171800       2.175000      0.5498000    
 C   -2.509400       1.411100      0.9207000    
 C    1.655500      -1.223000      0.2866000    
 C    3.115400      -1.196700     -0.1371000    
 C    1.437800       3.043800     -0.6512000    
 C    5.332900      -1.951000      0.3866000    
 C    2.462000       2.868200      -1.493700    
 H   -2.608800      -2.787700      0.6067000    
 H   -2.715300      -3.295500      -1.091000    
 H   -3.900400      -1.133900      -1.664900    
 H   -4.793500      -2.084900     -0.4612000    
 H   -1.226000       3.047900       1.446400    
 H    1.175300       2.822300       1.437600    
 H    1.999400       1.481200      0.7256000    
 H   -3.396600       1.895500       1.319200    
 H    1.554300     -0.8690000       1.321100    
 H    1.259300      -2.244300      0.2373000    
 H    3.197600      -1.558700      -1.169800    
 H    3.469900     -0.1596000     -0.1429000    
 H   0.7570000       3.872800     -0.8294000    
 H    3.605200      -2.972300      0.7373000    
 H    5.719200     -0.9280000      0.4416000    
 H    5.494400      -2.341700     -0.6234000    
 H    5.918500      -2.561100       1.081300    
 H    2.599700       3.535800      -2.337200    
 H    3.175100       2.062800      -1.360400    


%chk=000025149-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025149

0 1
O -1.123635 -1.694346 -0.425886
O -3.717193 -0.576915 0.315814
O 1.178011 0.019823 -0.301342
N 3.712630 -2.642385 0.264517
C -0.096897 0.464911 0.084153
C -1.260013 -0.353276 0.022456
C -0.204319 1.825915 0.486349
C -2.524956 0.189507 0.375408
C -2.289668 -2.538481 -0.089008
C -3.580250 -1.814101 -0.478223
C -1.478157 2.330683 0.844713
C 1.025202 2.727720 0.495683
C -2.634503 1.527612 0.797841
C 1.646474 -1.324571 0.122052
C 3.176028 -1.287396 0.024411
C 1.210839 3.454701 -0.830137
C 5.178114 -2.709508 0.414101
C 2.309765 3.365471 -1.619020
H -2.283233 -2.758930 0.996275
H -2.153553 -3.469001 -0.662995
H -3.567815 -1.560923 -1.556314
H -4.472797 -2.416816 -0.245078
H -1.560067 3.372834 1.173666
H 0.907082 3.477787 1.303783
H 1.929978 2.134242 0.710833
H -3.620340 1.914905 1.070049
H 1.323917 -1.534751 1.158647
H 1.215959 -2.091829 -0.546419
H 3.462087 -0.855443 -0.965738
H 3.578810 -0.609944 0.800692
H 0.365571 4.084720 -1.148404
H 3.365036 -3.314493 -0.432283
H 5.483292 -2.142541 1.313085
H 5.750583 -2.297419 -0.452913
H 5.488038 -3.759181 0.562480
H 2.384606 3.914631 -2.564795
H 3.159474 2.728489 -1.344554


