%chk=000130513.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130513

0 1
 O  -9.6199997E-02   1.977700       1.400200    
 O   -2.359200       1.467300       1.406300    
 O   -3.131500     -0.6494000      0.2868000    
 O   0.3073000      -2.949700      0.3824000    
 O    5.603200     -0.3759000     -0.4535000    
 O   -4.049400      -2.090000      -1.256700    
 N  -0.5478000       1.484500      -1.890700    
 N    1.086300       1.823400      0.6605000    
 N   -5.384100     -0.7938000      9.4300002E-02
 C   -1.294600       1.896100     -0.7037000    
 C  -0.1373000       2.717400      -1.242200    
 C   -1.133300       1.277200      0.6784000    
 C    1.140300       2.774700     -0.4518000    
 C  -0.8212000     -0.2529000      0.7476000    
 C   0.6486000     -0.5548000      0.4696000    
 C    1.564000      0.5205000      0.4226000    
 C   -1.832700      -1.039900     -0.1046000    
 C    1.118000      -1.860400      0.2730000    
 C    2.911100      0.2754000      0.1264000    
 C    2.465100      -2.093000     -7.0000002E-03
 C    3.358300      -1.027300     -8.7300003E-02
 C    4.761100      -1.275100     -0.3803000    
 C   -4.176100      -1.251900     -0.3703000    
 H   -2.300400       2.248500     -0.8994000    
 H  -0.3410000       3.626600      -1.791500    
 H   -1.088500       1.690700      -2.729800    
 H    2.006400       2.616000      -1.104500    
 H    1.242700       3.782400     -3.2099999E-02
 H  -0.9682000     -0.5649000       1.793300    
 H   -1.756600      -2.114300      7.2200000E-02
 H   -1.684400     -0.8631000      -1.175200    
 H   -2.378000      0.8589000       2.162900    
 H    3.606200       1.111200      8.3499998E-02
 H    2.821900      -3.109700     -0.1578000    
 H   0.8213000      -3.758300      0.2169000    
 H    5.056200      -2.326300     -0.5389000    
 H   -5.437200     -9.7900003E-02  0.8305000    
 H   -6.260500      -1.136400     -0.2846000    


%chk=000130513-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000130513

0 1
O -0.074918 1.894370 1.400991
O -2.384671 1.482686 1.448198
O -3.115596 -1.228309 0.274749
O 0.357555 -2.954657 0.981059
O 5.629937 -0.434156 -0.843312
O -3.801185 0.002451 -1.628281
N -0.609758 1.230409 -1.836244
N 1.120485 1.836665 0.545996
N -5.302052 -0.679347 0.038033
C -1.424109 1.776058 -0.685009
C -0.338104 2.627356 -1.318021
C -1.209623 1.156165 0.697948
C 0.983220 2.805924 -0.573653
C -0.845624 -0.355826 0.778811
C 0.653279 -0.593461 0.560699
C 1.546394 0.492226 0.312883
C -1.703880 -1.218522 -0.185201
C 1.211096 -1.900039 0.586199
C 2.889871 0.268116 -0.058427
C 2.553346 -2.142955 0.233594
C 3.386003 -1.051783 -0.125955
C 4.792680 -1.316503 -0.514010
C -4.057181 -0.572468 -0.538279
H -2.468730 2.040729 -0.870690
H -0.664883 3.486570 -1.917738
H -1.166653 1.220081 -2.709812
H 1.841944 2.660692 -1.251979
H 1.033287 3.822595 -0.146679
H -1.091386 -0.693642 1.809796
H -1.381036 -2.265787 -0.133560
H -1.649279 -0.837643 -1.215797
H -2.319394 1.084427 2.353133
H 3.570963 1.102297 -0.253077
H 2.960563 -3.163439 0.238953
H 0.846431 -3.814182 0.989736
H 5.082865 -2.399198 -0.499429
H -5.417453 -1.155043 0.929262
H -6.094602 -0.249357 -0.429389


