%chk=000101396.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101396

0 1
 O    3.707200      0.2777000     -8.5199997E-02
 O   0.1975000      4.1999999E-03 -0.3601000    
 O  -0.5078000       2.043800      0.4473000    
 O    2.364000      -1.585400     -3.4899998E-02
 N    1.500200      0.5308000     -0.3528000    
 C   -2.081100      0.2964000      5.1800001E-02
 C   -3.172000       1.114200     -0.1610000    
 C   -2.208500      -1.064800      0.2391000    
 C   -4.445700      0.5462000     -0.1878000    
 C   -3.482200      -1.632900      0.2123000    
 C   -4.600800     -0.8275000     -1.1000000E-03
 C    4.855100     -0.5512000      0.1293000    
 C  -0.7247000      0.8997000      7.8599997E-02
 C    6.091800      0.3208000      0.1726000    
 C    2.507300     -0.3721000     -0.1481000    
 H   -3.063700       2.184300     -0.3112000    
 H   -1.356100      -1.712400      0.4211000    
 H   -5.316800       1.173100     -0.3547000    
 H   -3.603600      -2.701900      0.3609000    
 H    4.746100      -1.086600       1.079000    
 H    4.940800      -1.274700     -0.6891000    
 H   -5.592500      -1.269700     -2.1299999E-02
 H    6.989700     -0.2817000      0.3356000    
 H    6.204200      0.8770000     -0.7639000    
 H    6.012800       1.062000      0.9749000    
 H    1.612400       1.537100     -0.4017000    


%chk=000101396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101396

0 1
O 3.775509 0.257121 0.037923
O 0.227004 -0.171575 0.009284
O -0.451689 2.051891 -0.184540
O 2.523606 -1.749029 0.188453
N 1.545058 0.386767 -0.026692
C -2.126708 0.254806 -0.048469
C -3.230931 1.143717 -0.135937
C -2.342059 -1.144808 0.071551
C -4.544362 0.634420 -0.103376
C -3.659533 -1.644990 0.103328
C -4.760874 -0.759422 0.016258
C 5.033960 -0.541205 0.127625
C -0.769977 0.842544 -0.085716
C 6.185020 0.458539 0.097885
C 2.593294 -0.504775 0.079126
H -3.039804 2.217941 -0.227680
H -1.485651 -1.821840 0.138574
H -5.396594 1.318672 -0.170663
H -3.828805 -2.722813 0.195810
H 5.008955 -1.130616 1.061948
H 5.063015 -1.244505 -0.724335
H -5.782756 -1.153763 0.041379
H 7.147401 -0.081410 0.160780
H 6.175612 1.044170 -0.837174
H 6.122608 1.157947 0.948949
H 1.592299 1.408617 -0.104691


