%chk=000148874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148874

0 1
 O  -0.3777000       2.984100     -0.8076000    
 O    1.645500      0.7529000      -3.063800    
 O  -0.3356000       3.043600       1.464300    
 O   -1.441400      -3.517700      0.1083000    
 O   0.5063000      -2.509600      0.2020000    
 O  -0.2172000     -0.3934000      -2.445100    
 O   -5.484000       1.157300      0.2490000    
 O   -5.518400      -1.034900      0.1402000    
 O    5.533600     -0.1474000       1.630000    
 O    5.629400     -4.6200000E-02 -0.5608000    
 N  -0.7454000      -2.478600      0.1757000    
 N   -4.893500      5.0999999E-02  0.2073000    
 N    4.974000     -9.0400003E-02  0.5083000    
 C  -0.6811000     -2.0600000E-02  0.2978000    
 C   0.7684000     -3.9299998E-02  0.3285000    
 C   -1.363200       1.197800      0.3414000    
 C   -1.401800      -1.214900      0.2235000    
 C    1.517300      9.3999999E-03 -0.8473000    
 C    1.413300     -0.1066000       1.563600    
 C   -2.757400       1.221800      0.3109000    
 C   -2.796200      -1.191100      0.1932000    
 C   -3.473900      2.7300000E-02  0.2368000    
 C    2.910800     -8.9999996E-03 -0.7880000    
 C    3.555500     -7.6099999E-02  0.4470000    
 C    2.806700     -0.1250000       1.622800    
 C  -0.6569000       2.472300      0.4204000    
 C   0.8829000      8.3800003E-02  -2.158400    
 H   0.8458000     -0.1444000       2.490700    
 H   -3.264500       2.183700      0.3464000    
 H   -3.360600      -2.118900      0.1354000    
 H    3.492300      1.3200000E-02  -1.706700    
 H    3.274600     -0.1771000       2.602500    
 H   9.9699996E-02   3.838900     -0.7473000    
 H    1.212300      0.7996000      -3.942700    


%chk=000148874-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148874

0 1
O 0.486108 2.680584 0.010979
O 1.893149 0.261515 -3.337782
O -1.542678 3.661413 0.530518
O -1.396611 -3.520986 0.570886
O 0.325064 -2.572739 -0.583991
O -0.270076 0.198523 -2.501084
O -5.640663 1.117179 0.541856
O -5.626152 -1.164089 0.428161
O 5.572287 -0.150886 1.750271
O 5.771387 0.048090 -0.514647
N -0.796229 -2.508432 0.045985
N -5.038903 -0.017292 0.446559
N 5.073055 -0.048387 0.564808
C -0.712445 0.028712 0.148394
C 0.793156 -0.003889 0.197604
C -1.460556 1.244300 0.270395
C -1.466596 -1.181390 0.163259
C 1.615033 0.086516 -0.962528
C 1.402454 -0.115664 1.469954
C -2.872026 1.221426 0.362418
C -2.866954 -1.224157 0.265080
C -3.553043 -0.004161 0.352138
C 3.018730 0.070501 -0.843224
C 3.591531 -0.036418 0.437435
C 2.804303 -0.134628 1.601947
C -0.875372 2.628225 0.294815
C 0.969572 0.184197 -2.298361
H 0.776049 -0.185216 2.364887
H -3.421379 2.163763 0.445541
H -3.402049 -2.177098 0.278107
H 3.653799 0.133284 -1.729528
H 3.290491 -0.222725 2.577067
H 0.789702 3.628739 0.039370
H 1.415461 0.306689 -4.208988


