%chk=000097235.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097235

0 1
 O    1.772900     -0.4852000     -0.9449000    
 O   0.7502000       2.261500       1.136100    
 O    2.911200       2.310200     -0.5111000    
 O    3.773600      -2.363400     -0.3688000    
 N  -0.4381000     -0.4252000     -8.5699998E-02
 N   -2.114600       1.254000     -0.5183000    
 N   -4.384700      0.4519000     -0.1563000    
 C   0.7532000      0.3655000     -0.3866000    
 C    1.377500       1.033100      0.8291000    
 C    2.815500       1.197200      0.3779000    
 C    3.056800     -8.5299999E-02 -0.4121000    
 C    3.593800      -1.220200      0.4487000    
 C   -1.735800      1.6000001E-02 -0.1559000    
 C  -0.4298000      -1.738500      0.3187000    
 C   -2.569800      -1.033500      0.2097000    
 C   -1.734900      -2.140500      0.5086000    
 C   -3.939800     -0.7755000      0.1995000    
 C   -3.457100       1.377800     -0.4886000    
 H   0.4693000       1.090600      -1.159200    
 H    1.326700      0.3834000       1.710500    
 H    3.513400       1.366300       1.202800    
 H    3.716700      7.3600002E-02  -1.272500    
 H    2.901900      -1.491300       1.252100    
 H    4.559500     -0.9568000      0.8899000    
 H   0.4956000      -2.283300      0.4467000    
 H   0.8459000       2.848500      0.3669000    
 H    3.833000       2.358200     -0.8171000    
 H   -2.046900      -3.124800      0.8295000    
 H    2.910000      -2.584800     -0.7575000    
 H   -4.692000      -1.508300      0.4633000    
 H   -3.846000       2.350900     -0.7687000    


%chk=000097235-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097235

0 1
O 1.619720 -0.473218 -0.849633
O 1.011379 2.107817 1.733776
O 2.846043 2.440801 -0.145764
O 3.646091 -2.368842 -1.030334
N -0.504146 -0.336790 0.237062
N -2.124028 1.018217 -1.019251
N -4.437141 0.217070 -0.862108
C 0.686572 0.410763 -0.098742
C 1.528154 0.914510 1.111968
C 2.929168 1.105672 0.471214
C 3.025132 -0.029536 -0.570965
C 3.786677 -1.271400 -0.078962
C -1.787515 -0.024453 -0.221620
C -0.596696 -1.498076 1.031402
C -2.701066 -1.003713 0.308940
C -1.917482 -1.930099 1.097299
C -4.057375 -0.820176 -0.057750
C -3.458347 1.076883 -1.301290
H 0.365916 1.259128 -0.732054
H 1.563803 0.141884 1.898675
H 3.744637 1.070154 1.219406
H 3.453259 0.327173 -1.526676
H 3.418420 -1.566498 0.929413
H 4.869864 -1.066658 -0.016034
H 0.296126 -1.940893 1.468763
H 1.287701 2.873738 1.159795
H 3.725403 2.728019 -0.490831
H -2.273569 -2.803316 1.640120
H 2.680636 -2.440547 -1.255045
H -4.853366 -1.492332 0.281579
H -3.786773 1.896817 -1.945655


