%chk=000023611.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023611

0 1
 O   -2.008400       1.321500       1.439800    
 O   -2.002400      -1.290900       1.480500    
 N  -0.7908000       2.464200     -0.1157000    
 N  -0.7780000      -2.476100     -3.7300002E-02
 C  -0.7371000     -7.7999998E-03 -0.1986000    
 C   -1.290600     -3.2600001E-02  -1.663100    
 C   0.8067000     -2.0999999E-03 -0.1040000    
 C   -1.250900       1.302000      0.4711000    
 C   -1.244200      -1.298300      0.5123000    
 C   -2.816100     -1.5000000E-03  -1.760100    
 C    1.373800      4.0600002E-02   1.140300    
 C    1.521800     -3.9700001E-02  -1.269700    
 C    2.766100      4.6200000E-02   1.225600    
 C    2.914000     -3.4200002E-02  -1.184400    
 C    3.536100      8.8000000E-03  6.3299999E-02
 H  -0.9545000     -0.9305000      -2.196800    
 H  -0.9208000      0.8266000      -2.236900    
 H   -3.231500      0.9115000      -1.323800    
 H   -3.269700     -0.8623000      -1.260100    
 H   -3.120800     -3.1900000E-02  -2.811600    
 H   0.7850000      6.8599999E-02   2.051100    
 H    1.091900     -7.6300003E-02  -2.261800    
 H    3.250600      7.9200000E-02   2.197100    
 H    3.514600     -6.3900001E-02  -2.089100    
 H   -1.069600       3.371100      0.2437000    
 H  -0.1580000       2.467900     -0.9085000    
 H  -0.1437000      -2.502300     -0.8286000    
 H   -1.052700      -3.372500      0.3507000    
 H    4.620100      1.2800000E-02  0.1298000    


%chk=000023611-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000023611

0 1
O -1.481036 0.332555 1.994583
O -1.025746 -2.377186 -1.261418
N -1.267691 2.116229 0.575854
N -1.343313 -2.129875 1.025236
C -0.667993 -0.118089 -0.338976
C -1.230416 0.379460 -1.715483
C 0.892270 -0.072855 -0.339491
C -1.188059 0.766668 0.829595
C -1.052865 -1.648362 -0.221175
C -2.771146 0.414207 -1.800804
C 1.634138 0.524576 0.712018
C 1.602583 -0.679254 -1.410340
C 3.047165 0.541491 0.680365
C 3.013242 -0.662993 -1.439197
C 3.744378 -0.046744 -0.397665
H -0.860915 -0.322257 -2.480848
H -0.791006 1.366661 -1.965539
H -3.223241 1.081769 -1.045010
H -3.185878 -0.599366 -1.660790
H -3.089139 0.768132 -2.798130
H 1.120397 0.973287 1.568782
H 1.051878 -1.200327 -2.199650
H 3.600251 1.009200 1.502806
H 3.540831 -1.141267 -2.272083
H -1.566288 2.729514 1.334582
H -1.034735 2.514946 -0.330799
H -1.421595 -1.462538 1.809608
H -1.544916 -3.124894 1.120499
H 4.839744 -0.034590 -0.421330


