%chk=000152836.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152836

0 1
 O   0.7240000      -2.605100      -1.003900    
 O    4.200600     -0.4248000       1.186900    
 N   0.1121000      0.4265000     -7.1099997E-02
 C    1.136500     -0.4939000      1.0400000E-02
 C    2.331400      0.1706000     -0.1576000    
 C   0.6601000       1.673600     -0.2902000    
 C    2.029900       1.541800     -0.3480000    
 C   -1.237000      0.1468000      4.7200002E-02
 C   0.8813000      -1.933100      0.2441000    
 C    3.681300     -0.4275000     -0.1426000    
 C  -0.1717000       2.889000     -0.4271000    
 C   -1.984500     -0.1740000      -1.085800    
 C   -1.849900      0.1847000       1.299600    
 C   -3.345300     -0.4570000     -0.9665000    
 C   -3.210600     -9.8399997E-02   1.418900    
 C   -3.958200     -0.4191000      0.2858000    
 H    2.734500       2.346400     -0.5091000    
 H    1.715000      -2.401300      0.7785000    
 H  -1.3700000E-02  -2.116900      0.8448000    
 H    3.669200      -1.459300     -0.5082000    
 H    4.365700      0.1461000     -0.7768000    
 H   0.4538000       3.772300     -0.5952000    
 H  -0.8560000       2.804800      -1.277400    
 H  -0.7578000       3.069800      0.4797000    
 H   -1.520500     -0.2079000      -2.068700    
 H   -1.280200      0.4329000       2.191900    
 H   -3.927400     -0.7070000      -1.848700    
 H   -3.688000     -6.9100000E-02   2.393900    
 H   -5.017600     -0.6396000      0.3787000    
 H    1.566300      -2.534600      -1.485100    
 H    5.087700     -0.8212000       1.145800    


%chk=000152836-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152836

0 1
O 0.668755 -2.562500 -1.397831
O 3.985741 -1.131890 1.086811
N 0.127568 0.458748 -0.050200
C 1.182193 -0.487676 -0.093044
C 2.390732 0.230049 -0.139536
C 0.671572 1.762250 -0.093709
C 2.064263 1.627966 -0.148894
C -1.273893 0.141125 0.069302
C 0.990734 -1.969236 -0.056989
C 3.767408 -0.365443 -0.170085
C -0.157256 3.016832 -0.146285
C -1.867478 -0.813492 -0.794340
C -2.057318 0.780127 1.063652
C -3.241936 -1.111331 -0.664732
C -3.433149 0.485810 1.174636
C -4.032657 -0.458604 0.309086
H 2.770205 2.456841 -0.197559
H 1.908843 -2.430552 0.349657
H 0.132400 -2.270121 0.564695
H 3.892070 -1.049756 -1.038730
H 4.516026 0.447925 -0.265260
H 0.452335 3.833930 -0.567677
H -1.052593 2.895050 -0.782436
H -0.506554 3.349411 0.849944
H -1.246306 -1.332288 -1.532672
H -1.585080 1.482361 1.757248
H -3.693566 -1.854497 -1.330982
H -4.031386 0.982902 1.946214
H -5.099644 -0.689713 0.399541
H 1.387903 -2.292679 -2.024738
H 4.901069 -1.516048 1.069113


