%chk=000133971.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133971

0 1
 O   -2.704200      -3.298200      0.5817000    
 O    2.838000       2.033400       2.072600    
 O   -1.647900     -6.7599997E-02   1.578200    
 O    2.491500       1.772800      -1.438100    
 O    1.356700      -1.132500      -2.249000    
 O   -1.808500       3.096300      0.7011000    
 N   -2.783000      -2.000200       1.099000    
 N    3.168400       1.703800      0.7520000    
 N    2.064500      -2.717500     -0.7055000    
 N   -2.545900       2.180000      -1.301600    
 C   -4.405600     -0.1811000     -0.8025000    
 C    4.144800      -1.171900      0.8230000    
 C   -4.950800      -1.310400      7.9899997E-02
 C    4.967000      4.9100000E-02   1.252900    
 C   -4.509100       1.202100     -0.1511000    
 C    4.217800      -1.462900     -0.6782000    
 C   -4.152100      -1.576500       1.360200    
 C    4.575200       1.368100      0.5809000    
 C    3.469300      -2.737100      -1.073500    
 C   -3.970400       2.313700      -1.053100    
 C  -0.3519000      -1.887700      0.7451000    
 C   0.8548000       2.306900      0.2413000    
 C  -0.2748000      -2.084200     -0.7682000    
 C  -0.1786000       2.269000     -0.8809000    
 C   -1.652900      -1.232800       1.175800    
 C    2.241500       1.904300     -0.2389000    
 C    1.126900      -1.904300      -1.320100    
 C   -1.580600       2.565600     -0.3828000    
 H   -4.980000     -0.1712000      -1.737500    
 H   -3.368900     -0.3981000      -1.081100    
 H    3.102100      -1.028800       1.128900    
 H    4.512900      -2.045100       1.375900    
 H   -5.988500      -1.083500      0.3529000    
 H   -4.979800      -2.228400     -0.5203000    
 H    4.868200      0.1583000       2.340200    
 H    6.028700     -0.1427000       1.055400    
 H   -5.561000       1.413400      7.5400002E-02
 H   -3.968600       1.216900      0.8004000    
 H    3.808800     -0.6199000      -1.242900    
 H    5.267200      -1.566100     -0.9791000    
 H   -4.131400     -0.6822000       1.990400    
 H   -4.638300      -2.372400       1.935900    
 H    5.166400       2.187300       1.006400    
 H    4.806300       1.329400     -0.4886000    
 H    3.531800      -2.877600      -2.158200    
 H   -4.145800       3.286300     -0.5804000    
 H    3.919000      -3.610900     -0.5904000    
 H   -4.476600       2.308800      -2.023800    
 H    1.766300      -3.350400      3.0500000E-02
 H   -2.257900       1.761000      -2.181100    
 H   0.4644000      -1.243800       1.096100    
 H  -0.2382000      -2.844600       1.267700    
 H   0.5476000       1.625400       1.043100    
 H   0.9162000       3.316800      0.6635000    
 H  -0.9261000      -1.368300      -1.284100    
 H  -0.6178000      -3.088000      -1.043600    
 H  -0.1733000       1.279800      -1.354900    
 H   6.9300003E-02   3.006000      -1.654000    
 H   -2.663300      -3.814400       1.404800    
 H    3.211800       2.928900       2.135000    


%chk=000133971-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133971

0 1
O -3.048850 -3.444781 0.304362
O 3.001283 1.779292 2.045572
O -2.093242 -0.600036 2.306723
O 3.010630 2.162280 -1.548386
O 0.892834 -1.410559 -2.370545
O -1.470513 3.542979 0.040190
N -3.176438 -2.368439 1.285026
N 3.517874 1.984781 0.696878
N 1.837908 -2.319041 -0.448241
N -2.227077 1.831574 -1.346329
C -4.411555 -0.388389 -0.768596
C 4.270047 -0.942947 0.772864
C -5.192270 -1.428175 0.069616
C 5.257792 0.194069 1.124853
C -4.285058 1.009038 -0.118193
C 4.103573 -1.228018 -0.736970
C -4.542483 -1.818923 1.420825
C 4.922191 1.575323 0.506823
C 3.192729 -2.448939 -1.022320
C -3.653053 2.068389 -1.055286
C -0.696383 -2.156979 1.018184
C 1.131913 2.258681 0.053610
C -0.565238 -1.637667 -0.439070
C 0.208070 2.229627 -1.179842
C -2.017155 -1.650549 1.598514
C 2.595847 2.124139 -0.348257
C 0.782103 -1.785251 -1.160433
C -1.221444 2.594750 -0.769218
H -4.929819 -0.282413 -1.744375
H -3.405083 -0.790931 -0.997960
H 3.284490 -0.693757 1.212860
H 4.619066 -1.867085 1.281165
H -6.202573 -1.034633 0.302859
H -5.334762 -2.345521 -0.532222
H 5.299370 0.295081 2.225592
H 6.280065 -0.069586 0.785053
H -5.296202 1.370138 0.163474
H -3.686449 0.959151 0.810565
H 3.688365 -0.347983 -1.260443
H 5.094470 -1.433323 -1.192236
H -4.431323 -0.946347 2.086645
H -5.178366 -2.564464 1.936790
H 5.594053 2.343305 0.937671
H 5.064428 1.578193 -0.587560
H 3.069513 -2.571750 -2.112234
H -3.702553 3.062648 -0.578168
H 3.649990 -3.371137 -0.613730
H -4.214634 2.111644 -2.010006
H 1.702192 -2.567865 0.531817
H -1.964270 1.095167 -2.004234
H 0.090129 -1.726505 1.664453
H -0.634566 -3.258949 1.037895
H 0.869930 1.461924 0.774367
H 0.960547 3.212166 0.591517
H -0.802979 -0.556966 -0.455133
H -1.315944 -2.138936 -1.075999
H 0.264208 1.250714 -1.690585
H 0.568137 2.978124 -1.910553
H -3.203989 -4.282827 0.821834
H 2.952125 2.688595 2.451227


