%chk=000028943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028943

0 1
 O   -2.231900       2.187100     -0.9248000    
 O    3.027400      -1.867400     -0.3998000    
 N   -2.990100     -0.2928000     -3.5999998E-02
 N    2.831200      0.3798000      0.1882000    
 C   -1.665900      6.1299998E-02 -4.2800002E-02
 C   -3.353300      -1.681800      0.1602000    
 C    1.463500      0.4419000      0.2756000    
 C  -0.6824000     -0.8368000      0.1265000    
 C   -1.429100       1.518600     -0.2740000    
 C   0.7462000     -0.6666000      4.3200001E-02
 C   0.9195000       1.726300      0.6488000    
 C  -0.3015000       2.207800      0.3959000    
 C   -4.862300      -1.858600      0.1694000    
 C    3.519200     -0.7680000     -0.1558000    
 C    5.009700     -0.5509000     -0.1745000    
 H   -2.946500      -2.305000     -0.6455000    
 H   -2.974200      -2.049900       1.121500    
 H   -3.695700      0.4201000     -0.1824000    
 H  -0.9257000      -1.885000      0.2928000    
 H    1.116000      -1.638900     -0.2262000    
 H    1.613100       2.403900       1.146400    
 H  -0.5092000       3.240300      0.6699000    
 H   -5.320300      -1.271800      0.9728000    
 H   -5.300700      -1.526900     -0.7778000    
 H   -5.124700      -2.910300      0.3196000    
 H    3.358000       1.228900      0.3780000    
 H    5.499700      -1.402800     -0.6539000    
 H    5.376800     -0.4542000      0.8508000    
 H    5.255300      0.3546000     -0.7370000    


%chk=000028943-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028943

0 1
O -2.716763 2.162964 0.179538
O 3.386206 -1.984584 0.000146
N -3.032833 -0.380603 0.121702
N 2.934526 0.325807 0.062877
C -1.717782 -0.000313 0.114286
C -3.546970 -1.751912 0.095262
C 1.501131 0.389270 0.083041
C -0.669592 -0.949954 0.078084
C -1.603840 1.494886 0.149203
C 0.734813 -0.796884 0.063889
C 0.981035 1.721836 0.122118
C -0.333800 2.183242 0.149828
C -5.084680 -1.750930 0.113846
C 3.785454 -0.780327 0.024293
C 5.273776 -0.434051 0.011019
H -3.180616 -2.275047 -0.813179
H -3.159235 -2.317571 0.968711
H -3.674076 0.432001 0.150141
H -0.994941 -1.998145 0.056789
H 1.316691 -1.723901 0.033845
H 1.739210 2.521795 0.132072
H -0.466021 3.272967 0.177971
H -5.470175 -1.261313 1.026227
H -5.491911 -1.219336 -0.764966
H -5.467527 -2.785662 0.094253
H 3.401041 1.235263 0.079082
H 5.730342 -0.852098 -0.902838
H 5.761831 -0.923165 0.871546
H 5.486806 0.648666 0.050316


