%chk=000178557.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178557

0 1
 O   -4.374800      -2.377700      9.4899997E-02
 O    6.037900      0.4122000      0.1454000    
 O   0.2714000      -2.130900      0.1322000    
 O   -2.541600       3.575800      0.3722000    
 O  -0.6841000       2.809100     -0.6899000    
 N  -0.2979000      0.1406000     -1.5400000E-02
 C   -1.714000      0.1095000     -3.0099999E-02
 C   -2.438000       1.287600     -0.1130000    
 C   -2.346100      -1.121800      3.8800001E-02
 C    2.009300     -0.5854000      8.4600002E-02
 C   -3.739700      -1.175900      2.4499999E-02
 C   0.5976000     -0.9351000      6.1900001E-02
 C   -3.831700       1.233700     -0.1273000    
 C   -4.482500      1.8000000E-03 -5.8600001E-02
 C    2.958400      -1.488000     -0.3950000    
 C    2.414000      0.6521000      0.5853000    
 C    4.717100      8.4500000E-02  0.1265000    
 C    4.312300      -1.153000     -0.3740000    
 C    3.767900      0.9870000      0.6061000    
 C   -1.788500       2.590500     -0.1860000    
 C   -5.801400      -2.360100      7.9000004E-02
 C    6.954500     -0.5563000     -0.3621000    
 H   -1.845500      -2.075500      0.1055000    
 H   9.6699998E-02   1.070300     -0.1116000    
 H   -4.438500       2.132100     -0.2049000    
 H   -5.566600      3.1700000E-02 -7.7000000E-02
 H    2.663000      -2.455000     -0.7940000    
 H    1.717500       1.371400       1.005500    
 H    4.996000      -1.899900     -0.7630000    
 H    4.078400       1.949000       1.004700    
 H   -6.207300      -1.838100      0.9522000    
 H   -6.138100      -3.400000      0.1434000    
 H   -6.188300      -1.956600     -0.8629000    
 H    6.785700     -0.7512000      -1.426600    
 H    6.941600      -1.474400      0.2352000    
 H    7.958800     -0.1298000     -0.2707000    
 H   -2.098300       4.449300      0.3185000    


%chk=000178557-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178557

0 1
O -4.456322 -2.411004 -0.102352
O 6.145407 0.449357 -0.075560
O 0.222002 -2.137585 -0.171638
O -2.659401 3.712993 0.296860
O -0.542203 2.798521 0.205691
N -0.347854 0.136561 0.009961
C -1.751915 0.074700 0.028247
C -2.491733 1.318751 0.128451
C -2.462709 -1.145258 -0.046603
C 2.017811 -0.510962 -0.077521
C -3.874987 -1.146192 -0.022992
C 0.570873 -0.916947 -0.084365
C -3.911462 1.273262 0.148315
C -4.616735 0.065405 0.074747
C 2.973790 -1.551559 -0.189143
C 2.486325 0.831143 0.032630
C 4.803589 0.055845 -0.083252
C 4.355982 -1.286009 -0.193942
C 3.861676 1.111150 0.030029
C -1.803693 2.609247 0.208989
C -5.921017 -2.503653 -0.082670
C 7.166081 -0.597978 -0.189074
H -1.915851 -2.085825 -0.123309
H 0.011001 1.105141 0.073931
H -4.453243 2.219702 0.224146
H -5.709285 0.069460 0.093110
H 2.599399 -2.577195 -0.272524
H 1.798936 1.680011 0.123002
H 5.064318 -2.114709 -0.283282
H 4.232399 2.136876 0.114413
H -6.335126 -2.102140 0.861825
H -6.137212 -3.578995 -0.156095
H -6.367950 -1.972263 -0.944405
H 7.072823 -1.146397 -1.146108
H 7.106089 -1.310146 0.656251
H 8.127049 -0.064520 -0.158265
H -2.101652 4.534711 0.346801


