%chk=000088777.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088777

0 1
 O    2.977100       2.715100      0.4816000    
 O    2.798500      -3.288000      2.2600001E-02
 N    2.564400       1.400900      0.3014000    
 N    1.605400      -2.595800     -0.1817000    
 C   -2.875500      0.1505000     -0.9401000    
 C   -3.722100     -7.4800000E-02  0.3212000    
 C   -1.455800      0.4767000     -0.6163000    
 C   0.8171000     -0.2491000     -0.1855000    
 C   -5.164200     -0.4473000     -2.3000000E-02
 C  -0.5173000     -0.5485000     -0.4900000    
 C    1.213200       1.097600     -6.3000000E-03
 C   -1.073600       1.803000     -0.4407000    
 C   0.2517000       2.112700     -0.1376000    
 C    1.845100      -1.329400     -4.3099999E-02
 C   -5.986500     -0.7086000       1.228800    
 C    3.235000     -0.9089000      0.2817000    
 C    3.487800      0.3941000      0.4271000    
 H   -3.314400      0.9570000      -1.542000    
 H   -2.912100     -0.7433000      -1.576700    
 H   -3.714600      0.8316000      0.9400000    
 H   -3.274700     -0.8730000      0.9274000    
 H   -5.629100      0.3611000     -0.5991000    
 H   -5.176600      -1.344000     -0.6534000    
 H  -0.8284000      -1.581500     -0.6270000    
 H   -1.798600       2.607300     -0.5351000    
 H   0.5222000       3.157300     -5.4000001E-03
 H   -6.019600      0.1790000       1.868600    
 H   -5.565500      -1.535700       1.809400    
 H   -7.014200     -0.9715000      0.9591000    
 H    4.062300      -1.595200      0.4093000    
 H    4.487000      0.7439000      0.6640000    
 H    3.223400       2.974400     -0.4231000    
 H    2.514300      -4.209300     -0.1015000    


%chk=000088777-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088777

0 1
O 2.984364 2.780828 0.544316
O 2.604791 -3.483837 0.056176
N 2.623801 1.427307 0.182582
N 1.477717 -2.563008 -0.203894
C -2.888762 0.165820 -0.997951
C -3.700084 -0.125328 0.295912
C -1.434938 0.506950 -0.710635
C 0.881196 -0.228235 -0.226042
C -5.176534 -0.481224 0.010930
C -0.470983 -0.510625 -0.546998
C 1.265119 1.145006 -0.082554
C -1.022284 1.857705 -0.540801
C 0.310465 2.181433 -0.230446
C 1.885981 -1.300890 -0.025578
C -5.976349 -0.783115 1.296678
C 3.228514 -0.892384 0.371345
C 3.553104 0.439756 0.483079
H -3.374848 1.000063 -1.541600
H -2.946680 -0.723174 -1.656443
H -3.652252 0.758882 0.963786
H -3.216146 -0.956998 0.846542
H -5.655617 0.355435 -0.538080
H -5.215732 -1.359755 -0.665430
H -0.751136 -1.563226 -0.662082
H -1.757590 2.663745 -0.651876
H 0.612601 3.220754 -0.077336
H -5.975786 0.088590 1.978055
H -5.535329 -1.636601 1.845125
H -7.028776 -1.034294 1.069420
H 3.979422 -1.657181 0.570091
H 4.536918 0.804023 0.785550
H 3.214336 3.226462 -0.319639
H 2.183199 -4.364583 -0.107600


