%chk=000164710.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164710

0 1
 O  -0.5317000       2.842700      0.1420000    
 O   -2.930600       2.810400      0.1445000    
 O    5.400600      1.8600000E-02 -1.9200001E-02
 N   -1.062300      -3.285300      0.2382000    
 C  -0.2597000      -2.130600     -0.1915000    
 C   -1.007600     -0.8088000     -9.3400002E-02
 C    1.019400      -2.076800      0.6585000    
 C  -0.2614000      0.4007000     -5.7799999E-02
 C   -2.427200     -0.8107000     -9.0400003E-02
 C   -3.190700      -2.111600     -8.3999999E-02
 C   -2.333900      -3.312100     -0.4823000    
 C    1.858400     -0.8772000      0.2788000    
 C    1.220700      0.3360000     -7.6700002E-02
 C   -1.012900       1.570000      2.9100001E-02
 C   -3.126500      0.3966000     -1.6300000E-02
 C   -2.394200       1.562100      4.4799998E-02
 C    3.257800     -0.9732000      0.3129000    
 C    2.042800       1.411300     -0.4549000    
 C   -1.742500       3.616800      0.1971000    
 C    4.044200      0.1170000     -4.3600000E-02
 C    3.437200       1.304200     -0.4355000    
 H   2.1100000E-02  -2.272500      -1.245000    
 H    1.593900      -3.000000      0.5093000    
 H   0.7852000      -2.001700       1.729100    
 H   -3.586600      -2.266400      0.9280000    
 H   -4.044100      -2.043700     -0.7692000    
 H   -1.238000      -3.230700       1.241500    
 H   -2.868200      -4.238700     -0.2457000    
 H   -2.154900      -3.321100      -1.564900    
 H   -4.211000      0.4179000      9.8000001E-03
 H    3.733600      -1.904800      0.6103000    
 H    1.623900       2.355200     -0.7906000    
 H   -1.752400       4.315600     -0.6472000    
 H   -1.748800       4.193100       1.129300    
 H    4.036500       2.161100     -0.7324000    
 H    5.783600      0.8682000     -0.2980000    


%chk=000164710-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164710

0 1
O -0.525102 2.917416 -0.072137
O -2.912594 2.907373 -0.037237
O 5.457642 -0.007576 -0.039857
N -1.048807 -3.357016 0.204309
C -0.253549 -2.166499 -0.175240
C -1.027697 -0.837761 -0.085792
C 1.032252 -2.092933 0.668513
C -0.256909 0.381512 -0.076311
C -2.446364 -0.832297 -0.065424
C -3.242224 -2.138069 -0.051669
C -2.376367 -3.358270 -0.455660
C 1.877112 -0.895579 0.269925
C 1.224368 0.328597 -0.086608
C -1.006182 1.571045 -0.049836
C -3.163056 0.401157 -0.034984
C -2.414655 1.574487 -0.025530
C 3.282158 -0.974456 0.274003
C 2.027549 1.450668 -0.425516
C -1.720981 3.750446 0.213196
C 4.060751 0.153588 -0.067622
C 3.434013 1.371986 -0.419480
H 0.047797 -2.305990 -1.236688
H 1.596695 -3.034761 0.554855
H 0.748887 -2.005512 1.741019
H -3.649856 -2.304697 0.967670
H -4.118490 -2.049682 -0.724052
H -1.143840 -3.416255 1.230787
H -2.899753 -4.301879 -0.216658
H -2.201144 -3.348909 -1.548652
H -4.256462 0.423475 -0.021913
H 3.791190 -1.905923 0.540931
H 1.547766 2.394099 -0.695886
H -1.732576 4.607423 -0.476428
H -1.704047 4.050340 1.279508
H 4.034208 2.251091 -0.687999
H 5.911967 0.830962 -0.302936


