%chk=000092969.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092969

0 1
 O   -1.567100     -0.8206000     -0.8755000    
 O  -0.3646000      0.7401000      0.4431000    
 O   -4.620100       1.831900     -4.2700000E-02
 O   -4.588400     -0.7407000       1.234900    
 O   -1.951900       2.821400     -0.5685000    
 O   -1.543000      -3.435300     -9.1100000E-02
 O    5.500300      -1.340200     -0.3669000    
 O    5.906000      0.7431000      0.1935000    
 N    5.106100     -0.1962000     -3.4899998E-02
 C   -3.426900       1.092800      0.2282000    
 C   -3.753900     -0.3987000      0.1308000    
 C   -2.358900       1.476400     -0.7940000    
 C   -2.476200      -1.248900      0.1449000    
 C   -1.152100      0.5390000     -0.7291000    
 C   -2.767600      -2.725400     -0.1091000    
 C   0.9792000      0.5100000      0.3261000    
 C    1.433800     -0.7518000     -4.3400001E-02
 C    1.880000       1.540200      0.5763000    
 C    2.803600     -0.9860000     -0.1640000    
 C    3.249800       1.306100      0.4556000    
 C    3.711600      4.2900000E-02  8.5500002E-02
 H   -3.111100       1.366000       1.242700    
 H   -4.321900     -0.5916000     -0.7885000    
 H   -2.802000       1.434500      -1.796600    
 H   -1.972300      -1.170300       1.117500    
 H  -0.5296000      0.7754000      -1.603400    
 H   -3.231100      -2.880400      -1.089000    
 H   -3.422600      -3.143900      0.6605000    
 H   -5.237400       1.674900      0.6914000    
 H   -5.443800     -0.2972000       1.108400    
 H   -1.511000       2.856500      0.2976000    
 H  -0.9896000      -3.082800     -0.8088000    
 H   0.7488000      -1.572800     -0.2235000    
 H    1.523900       2.525400      0.8640000    
 H    3.127200      -1.983700     -0.4498000    
 H    3.927800       2.131300      0.6579000    


%chk=000092969-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000092969

0 1
O -1.629998 -0.892581 -0.955819
O -0.441400 1.012845 -0.011029
O -4.704147 1.730554 0.241348
O -4.422403 -0.821848 1.533334
O -2.268791 2.820500 -1.026694
O -1.349318 -3.498322 0.252224
O 5.537068 -1.220926 -0.521860
O 5.765587 0.283856 1.179565
N 5.060809 -0.335189 0.290165
C -3.412009 1.040596 0.258901
C -3.725397 -0.461517 0.300374
C -2.591008 1.390762 -0.995665
C -2.413987 -1.264904 0.274761
C -1.329400 0.507277 -1.091270
C -2.619151 -2.775518 0.175986
C 0.907196 0.616432 0.008720
C 1.457426 -0.363938 -0.857027
C 1.712844 1.270000 0.974564
C 2.827381 -0.671125 -0.763821
C 3.077557 0.959026 1.072127
C 3.622605 -0.007652 0.195147
H -2.836917 1.319051 1.168659
H -4.345451 -0.710709 -0.589309
H -3.208231 1.219123 -1.894054
H -1.802293 -1.024699 1.165031
H -0.818769 0.614517 -2.064426
H -3.167844 -3.014417 -0.759942
H -3.213368 -3.111773 1.039057
H -4.538832 2.694365 0.074445
H -5.182654 -0.192346 1.637237
H -1.517304 2.970386 -0.393289
H -0.772333 -3.181358 -0.488855
H 0.829102 -0.898376 -1.573012
H 1.254781 2.013689 1.632782
H 3.287693 -1.420942 -1.412561
H 3.725958 1.446563 1.804306


