%chk=000089707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089707

0 1
 O  -0.7412000      0.4397000      0.6745000    
 O    5.386300      0.9940000     -0.5513000    
 O    5.258100      -1.175700     -0.2426000    
 N    4.725700     -4.0500000E-02 -0.2907000    
 C   0.6023000      0.3079000      0.4402000    
 C    1.208000     -0.9433000      0.4891000    
 C   -1.524300      0.9888000     -0.3781000    
 C   -2.916400      0.4614000     -0.2869000    
 C    2.577000      -1.058900      0.2474000    
 C    1.350600       1.444900      0.1524000    
 C    3.332700      7.7299997E-02 -4.1700002E-02
 C    2.719500       1.329100     -8.9299999E-02
 C   0.4148000      -2.169900      0.7984000    
 C   -3.262300     -0.7134000     -0.9547000    
 C   -3.872400       1.142500      0.4667000    
 C   -4.564100      -1.207000     -0.8693000    
 C   -5.174300      0.6489000      0.5522000    
 C   -5.520100     -0.5259000     -0.1159000    
 H   -1.099600      0.7421000      -1.361100    
 H   -1.526700       2.082600     -0.2932000    
 H    3.036700      -2.043700      0.2880000    
 H   0.8880000       2.427300      0.1212000    
 H    3.276700       2.236000     -0.3099000    
 H    1.047700      -3.060700      0.8727000    
 H  -0.1039000      -2.057700       1.756300    
 H  -0.3232000      -2.351600      1.0300000E-02
 H   -2.525700      -1.254500      -1.542700    
 H   -3.615000       2.057600      0.9935000    
 H   -4.833100      -2.122100      -1.388600    
 H   -5.918600       1.178800       1.139300    
 H   -6.533600     -0.9104000     -4.8999999E-02


%chk=000089707-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089707

0 1
O -0.744385 -0.181213 0.045437
O 5.470502 1.267528 -0.386461
O 5.552664 -0.794906 0.588111
N 4.900440 0.206724 0.090237
C 0.639747 -0.014031 0.022010
C 1.383973 -1.110776 0.567945
C -1.594667 0.916076 -0.511167
C -3.036471 0.494799 -0.373954
C 2.785266 -1.015816 0.579501
C 1.294104 1.136572 -0.492855
C 3.430587 0.135386 0.064322
C 2.697910 1.213694 -0.472282
C 0.655664 -2.321726 1.108528
C -3.646350 -0.307215 -1.371181
C -3.795359 0.887526 0.756494
C -4.992053 -0.714075 -1.239077
C -5.142428 0.483748 0.890911
C -5.742921 -0.318253 -0.107284
H -1.313408 1.068154 -1.571761
H -1.386741 1.843479 0.057149
H 3.396725 -1.826442 0.985383
H 0.722930 1.971043 -0.907425
H 3.230478 2.085520 -0.860498
H 1.366308 -3.076131 1.484065
H -0.028414 -2.039321 1.929428
H 0.024776 -2.785705 0.328701
H -3.064686 -0.616732 -2.247865
H -3.329958 1.506021 1.533554
H -5.454960 -1.333543 -2.014887
H -5.721442 0.793568 1.767642
H -6.788231 -0.630352 -0.005523


