%chk=000173381.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173381

0 1
 O   -1.378500       1.070900      -1.192900    
 O    3.284000      0.4145000     -4.2199999E-02
 O    2.902600      -1.618800      0.9150000    
 O  -0.5719000       3.408500     -0.6233000    
 O   0.9809000       2.546500      0.8288000    
 N   0.9202000      -2.037200     -0.8913000    
 C  -0.8687000      -1.296300      0.3932000    
 C   0.1115000     -0.1177000      0.2978000    
 C    1.261600     -0.6508000     -0.5656000    
 C  -0.5382000      -2.120900     -0.8446000    
 C   -2.314400     -0.9489000      0.5202000    
 C  -0.4842000       1.094900     -0.3606000    
 C    2.550600     -0.7020000      0.1877000    
 C   -2.698000     -0.1448000       1.727000    
 C   -3.218800      -1.333200     -0.3927000    
 C   6.1299998E-02   2.435100      4.3600000E-02
 H  -0.5921000      -1.895800       1.274400    
 H   0.4254000      0.1490000       1.314600    
 H    1.401400     -9.3699999E-02  -1.499500    
 H  -0.8685000      -3.161800     -0.7638000    
 H  -0.9269000      -1.697800      -1.778000    
 H    1.289400      -2.661800     -0.1725000    
 H   -2.402500     -0.6714000       2.640600    
 H   -2.220300      0.8386000       1.727300    
 H   -3.779800      1.8900000E-02   1.780800    
 H   -4.263600      -1.060300     -0.2707000    
 H   -2.998300      -1.924600      -1.271300    
 H    4.134800      0.4010000      0.4458000    
 H  -0.2238000       4.298400     -0.4016000    


%chk=000173381-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173381

0 1
O -0.115486 1.040165 -2.041704
O 3.434644 0.261007 -0.097651
O 3.261665 -1.912169 0.710274
O -1.420985 3.120021 -0.839694
O -0.642802 2.386992 1.225547
N 0.919186 -2.345525 -0.791131
C -0.763728 -1.135869 0.452435
C 0.374201 -0.088375 0.089519
C 1.451496 -0.969964 -0.681873
C -0.547415 -2.237571 -0.634050
C -2.178448 -0.567228 0.602798
C -0.158472 1.037342 -0.790598
C 2.785128 -0.965916 0.043625
C -2.602786 -0.244719 2.023709
C -3.004690 -0.354349 -0.458693
C -0.760825 2.230293 -0.012890
H -0.460414 -1.570397 1.426289
H 0.767594 0.363117 1.016049
H 1.588147 -0.523105 -1.684159
H -0.986030 -3.205998 -0.341078
H -1.004412 -1.931983 -1.592541
H 1.360660 -2.963392 -0.092995
H -2.540598 -1.144290 2.667270
H -1.932914 0.518007 2.467579
H -3.636565 0.138490 2.066980
H -4.012351 0.052332 -0.315531
H -2.713366 -0.570817 -1.492018
H 4.296206 0.246120 0.400865
H -1.781439 3.876283 -0.300135


