%chk=000076151.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076151

0 1
 O    3.544100       1.325500      2.5300000E-02
 O   -3.367400       2.602000      9.3300000E-02
 O   -2.320500       1.357100      -1.490500    
 N  -0.4905000      -2.383800     -0.1135000    
 C   -1.133700     -0.3368000      0.4549000    
 C   0.2694000     -0.3129000      0.2195000    
 C   0.6475000      -1.609400     -0.1358000    
 C   -1.572100      -1.623500      0.2423000    
 C   -1.971600      0.8124000      0.8570000    
 C    1.257200      0.6905000      0.2746000    
 C    1.969300      -1.954000     -0.4401000    
 C   -2.919600      -2.217000      0.3402000    
 C    2.583400      0.3604000     -2.7100001E-02
 C    2.931700     -0.9422000     -0.3788000    
 C   -2.551400       1.593600     -0.3127000    
 C    3.124200       2.638200      0.3914000    
 H  -0.5180000      -3.370900     -0.3293000    
 H   -1.386900       1.511500       1.465800    
 H   -2.810700      0.4651000       1.471700    
 H   0.9315000       1.685600      0.5516000    
 H    2.241400      -2.967800     -0.7139000    
 H   -3.234200      -2.277300       1.387100    
 H   -3.650200      -1.608100     -0.2022000    
 H   -2.952400      -3.227400     -8.0700003E-02
 H    3.966700      -1.183100     -0.6103000    
 H    4.014300       3.275900      0.3822000    
 H    2.724700       2.664300       1.410900    
 H    2.425400       3.057100     -0.3407000    
 H   -3.736600       3.101100     -0.6661000    


%chk=000076151-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076151

0 1
O 3.522411 1.433901 -0.011221
O -2.001151 2.624371 -0.433553
O -3.735434 1.116436 -0.776068
N -0.508665 -2.430943 -0.190647
C -1.213593 -0.399487 0.550915
C 0.203045 -0.307633 0.255637
C 0.623931 -1.602833 -0.200003
C -1.624107 -1.708195 0.257092
C -2.106929 0.715456 1.051972
C 1.146553 0.753891 0.333206
C 1.962132 -1.867880 -0.565004
C -2.989742 -2.332131 0.344514
C 2.480502 0.481955 -0.033895
C 2.887705 -0.814707 -0.475655
C -2.728716 1.464521 -0.119393
C 3.177393 2.785570 0.423783
H -0.527509 -3.410651 -0.465721
H -1.532576 1.422926 1.672601
H -2.935599 0.307762 1.656900
H 0.825856 1.750703 0.648684
H 2.282239 -2.857348 -0.909555
H -3.401593 -2.260076 1.368811
H -3.701570 -1.821154 -0.328896
H -2.966153 -3.401991 0.071194
H 3.937970 -0.957740 -0.746115
H 4.115093 3.358199 0.365293
H 2.801127 2.791388 1.466363
H 2.417913 3.243210 -0.241000
H -2.395534 3.048578 -1.244137


