%chk=000070388.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070388

0 1
 O    5.881700       2.081400     -0.2059000    
 O   -2.096600      -2.022100       1.080000    
 O    5.737600      0.3019000       1.197700    
 N  -0.9891000      -1.287700     -0.8212000    
 C    1.968800     -0.8307000     -0.6348000    
 C    1.224700      -2.065900     -0.1219000    
 C    3.262900     -0.5412000      0.1283000    
 C  -4.8999999E-02  -2.373000     -0.9015000    
 C    3.971700      0.6920000     -0.4320000    
 C   -1.950300      -1.200800      0.1786000    
 C    5.271700      0.9715000      0.2863000    
 C   -2.864000     -3.1500001E-02  0.1068000    
 C   -4.125800     -0.1378000      0.6540000    
 C   -2.421200       1.123200     -0.5042000    
 C   -4.983600      0.9601000      0.5869000    
 C   -3.279200       2.221100     -0.5713000    
 C   -4.560400       2.139400     -2.5699999E-02
 H    2.200500     -0.9695000      -1.698200    
 H    1.317000      4.8700001E-02 -0.5650000    
 H   0.9810000      -1.922000      0.9382000    
 H    1.889200      -2.936400     -0.1798000    
 H    3.927700      -1.411600      6.6100001E-02
 H    3.039400     -0.3898000       1.191600    
 H  -0.5132000      -3.285300     -0.5116000    
 H   0.1783000      -2.534800      -1.960500    
 H    4.197600      0.5412000      -1.493400    
 H    3.326500       1.570900     -0.3250000    
 H  -0.9636000     -0.6113000      -1.576300    
 H   -4.472500      -1.050200       1.129900    
 H   -1.421200       1.239900     -0.9086000    
 H   -5.981500      0.8965000       1.011000    
 H   -2.947300       3.142600      -1.040800    
 H   -5.227700       2.994800     -7.6399997E-02
 H    6.726400       2.269500      0.2563000    


%chk=000070388-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070388

0 1
O 6.099460 2.032243 -0.137215
O -2.088257 -2.064128 0.998741
O 5.961376 0.166088 1.236808
N -1.023171 -1.241137 -0.894173
C 2.068099 -0.822375 -0.662290
C 1.251287 -2.009764 -0.107271
C 3.357181 -0.562732 0.147153
C -0.026790 -2.327778 -0.918360
C 4.156540 0.634430 -0.401741
C -1.992711 -1.171976 0.095524
C 5.461102 0.870479 0.333722
C -2.942195 0.000545 0.032360
C -4.168656 -0.116606 0.734977
C -2.656437 1.205055 -0.663300
C -5.104542 0.938051 0.721429
C -3.591780 2.263302 -0.673179
C -4.821043 2.130130 0.013244
H 2.332572 -1.019931 -1.723612
H 1.437995 0.091557 -0.655702
H 0.959882 -1.813591 0.942156
H 1.884448 -2.920385 -0.096646
H 3.996632 -1.465931 0.138428
H 3.101806 -0.380358 1.208502
H -0.512809 -3.223531 -0.492914
H 0.231133 -2.537361 -1.974100
H 4.400381 0.489297 -1.473578
H 3.564659 1.569159 -0.356141
H -1.028523 -0.557908 -1.650769
H -4.356720 -1.042728 1.287948
H -1.693809 1.348055 -1.170309
H -6.051226 0.834459 1.262863
H -3.359081 3.192116 -1.205612
H -5.546190 2.951452 0.004576
H 6.955888 2.154899 0.356082


