%chk=000030843.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030843

0 1
 O    1.707600      -1.286700       2.296200    
 O    3.838700      -3.845200     -0.8714000    
 N   -2.271700       1.085500     -0.2336000    
 N    2.747100      -2.530700      0.6730000    
 C   0.4926000      0.3776000      0.4389000    
 C    1.805000     -0.3091000      7.1199998E-02
 C  -0.6565000     -0.6335000      0.5125000    
 C   0.1475000       1.481100     -0.5668000    
 C    1.626200      -1.002800      -1.298200    
 C   -1.993000      6.1200000E-02  0.7817000    
 C   -1.215400       2.106000     -0.2613000    
 C    2.921000      0.7503000      4.3699998E-02
 C    2.052100      -1.407000       1.118800    
 C    2.854500      -1.818300      -1.671700    
 C   -3.575000       1.704200      8.0000004E-03
 C    3.185000      -2.835600     -0.6103000    
 C    3.622900       1.042400       1.208300    
 C    3.218600       1.407000      -1.145500    
 C   -4.692100      0.6960000     -3.9600000E-02
 C    4.634300       2.002500       1.183400    
 C    4.230100       2.367200      -1.170400    
 C    4.938000       2.664900     -6.0000001E-03
 C   -5.325600      0.4347000      -1.246400    
 C   -5.072400      4.2300001E-02   1.123900    
 C   -6.360500     -0.4994000      -1.290600    
 C   -6.107400     -0.8918000       1.079800    
 C   -6.751400      -1.162600     -0.1275000    
 H   0.5809000      0.8529000       1.427600    
 H  -0.5071000      -1.381800       1.296400    
 H  -0.7987000      -1.179300     -0.4238000    
 H   0.1071000       1.117800      -1.597500    
 H   0.8707000       2.300900     -0.5297000    
 H    1.390000     -0.3401000      -2.132900    
 H   0.8171000      -1.739300      -1.273000    
 H   -2.727900     -0.7475000      0.7581000    
 H   -1.988900      0.4907000       1.792100    
 H   -1.167800       2.644900      0.6944000    
 H   -1.434400       2.846600      -1.040500    
 H    3.739800      -1.197700      -1.835900    
 H    2.656400      -2.358800      -2.604900    
 H   -3.770200       2.472700     -0.7523000    
 H   -3.595700       2.231200      0.9724000    
 H    2.953700      -3.227500       1.383700    
 H    3.405900      0.5609000       2.155400    
 H    2.692600       1.229500      -2.075600    
 H    5.183200       2.237500       2.090700    
 H    4.464400       2.886300      -2.095200    
 H    5.724400       3.413800     -2.5100000E-02
 H   -5.027800      0.9438000      -2.158700    
 H   -4.591900      0.2538000       2.075000    
 H   -6.861700     -0.7106000      -2.230700    
 H   -6.414300      -1.405700       1.986100    
 H   -7.557800      -1.889500     -0.1617000    


%chk=000030843-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000030843

0 1
O 2.014202 -1.372754 2.156598
O 4.134422 -3.909159 -1.059425
N -2.324368 1.042023 0.080072
N 3.026303 -2.568877 0.471423
C 0.506569 0.244709 0.329691
C 1.882930 -0.393588 -0.124915
C -0.657298 -0.773196 0.452676
C 0.052603 1.415679 -0.575377
C 1.768437 -1.091005 -1.510150
C -1.928201 -0.072844 0.974761
C -1.243453 2.049935 -0.029997
C 2.976310 0.717622 -0.093239
C 2.287480 -1.456410 0.927288
C 3.040045 -1.870003 -1.903926
C -3.623581 1.643040 0.465537
C 3.454840 -2.872909 -0.841549
C 3.474823 1.183939 1.153197
C 3.441484 1.350321 -1.275689
C -4.808439 0.712003 0.221621
C 4.414084 2.235906 1.212928
C 4.381099 2.404248 -1.217625
C 4.875411 2.851862 0.027265
C -4.865473 -0.084512 -0.950460
C -5.888736 0.660234 1.135918
C -5.982258 -0.909941 -1.204878
C -7.010810 -0.163090 0.882693
C -7.061635 -0.950777 -0.289934
H 0.690576 0.649106 1.346477
H -0.389042 -1.589334 1.148242
H -0.896356 -1.217743 -0.532386
H -0.146813 1.051677 -1.602263
H 0.837262 2.191782 -0.635124
H 1.526989 -0.352250 -2.292869
H 0.917087 -1.794656 -1.480481
H -2.762707 -0.794458 1.024625
H -1.743184 0.297137 2.017862
H -1.023359 2.524217 0.963802
H -1.582511 2.854379 -0.710041
H 3.893949 -1.182655 -2.059244
H 2.902181 -2.426310 -2.846621
H -3.751186 2.558497 -0.147691
H -3.632437 1.975452 1.535664
H 3.304548 -3.239454 1.199843
H 3.127112 0.719668 2.082680
H 3.066656 1.040681 -2.257001
H 4.785578 2.573176 2.187051
H 4.722761 2.875322 -2.146241
H 5.605747 3.667134 0.073051
H -4.015707 -0.053819 -1.641749
H -5.851497 1.263321 2.052255
H -6.013442 -1.521675 -2.114122
H -7.838298 -0.194071 1.600829
H -7.928498 -1.591878 -0.486551


