%chk=000132888.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132888

0 1
 O  -0.9641000       1.335300      -2.352800    
 N    2.951800      4.1400000E-02  3.5000001E-03
 N    5.449900      -1.091400     -0.8481000    
 N   -2.698300     -0.1196000      -2.629000    
 C    3.034200      -1.399400     -0.3319000    
 C    4.212200      0.7467000      0.3267000    
 C    4.182200      -1.644300      -1.320800    
 C    5.312400      0.3531000     -0.6815000    
 C   -1.969900      0.4700000     -0.2737000    
 C    1.736600      0.4331000      0.5828000    
 C  -0.6929000      0.6560000      0.4731000    
 C    3.189000      -2.252600      0.9353000    
 C    4.061300       2.274000      0.2516000    
 C   -3.102800       1.573000      1.5500000E-02
 C   0.5160000      0.2665000     -0.1036000    
 C   -2.562900     -0.9517000      6.7599997E-02
 C    1.696300       1.005800       1.870600    
 C  -0.7072000       1.220400       1.748700    
 C   -2.687600       3.020100     -0.3114000    
 C   -1.806200      0.5918000      -1.849400    
 C   0.4873000       1.395100       2.447400    
 C   -1.794400      -2.023800     -0.2372000    
 C   -3.791100     -0.9813000      0.6366000    
 C   -3.838300       3.988700     -7.4900001E-02
 C   -2.318900      -3.280700      6.4400002E-02
 C   -4.315400      -2.238100      0.9384000    
 C   -3.579300      -3.388000      0.6524000    
 H    2.121500      -1.731200     -0.8422000    
 H    4.544000      0.4638000       1.333800    
 H    4.306800      -2.719500      -1.494000    
 H    3.934900      -1.204600      -2.295800    
 H    5.116800      0.8069000      -1.662300    
 H    6.276000      0.7555000     -0.3466000    
 H    5.694900      -1.512600      4.6999998E-02
 H    2.302300      -2.170600       1.573200    
 H    3.309600      -3.310000      0.6771000    
 H    4.051100      -1.949500       1.537800    
 H    3.607700       2.579600     -0.6982000    
 H    3.453100       2.690700       1.056500    
 H    5.040600       2.760700      0.3269000    
 H   -3.404500       1.571400       1.069800    
 H   -3.995700       1.358700     -0.5896000    
 H   0.5473000     -0.1711000      -1.097700    
 H    2.598900       1.120300       2.465500    
 H   -1.626800       1.513900       2.243200    
 H   -2.388300       3.115600      -1.358800    
 H   -1.833900       3.329300      0.2993000    
 H   0.4747000       1.821000       3.446600    
 H  -0.8269000      -1.971900     -0.7176000    
 H   -4.425800     -0.1480000      0.8938000    
 H   -4.697600       3.740100     -0.7058000    
 H   -4.160500       3.966400      0.9710000    
 H   -3.527600       5.011000     -0.3124000    
 H   -2.649100     -6.8700001E-02  -3.641300    
 H   -3.449900     -0.6831000      -2.247500    
 H   -1.748700      -4.176400     -0.1642000    
 H   -5.296800      -2.323300       1.396500    
 H   -3.988100      -4.366700      0.8860000    


%chk=000132888-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132888

0 1
O -1.097084 0.383023 -2.604138
N 2.968142 0.357783 -0.100595
N 5.627857 -0.129286 -1.238204
N -2.796297 -1.149179 -2.382986
C 3.232511 -0.871529 -0.931636
C 4.152286 0.980266 0.564269
C 4.403961 -0.611113 -1.912494
C 5.332603 1.084368 -0.455794
C -2.099674 0.111984 -0.327700
C 1.714855 0.335219 0.597384
C -0.753774 0.184898 0.449563
C 3.483976 -2.128245 -0.053205
C 3.848252 2.417892 1.043551
C -2.779933 1.539644 -0.273435
C 0.514478 0.230130 -0.165830
C -3.001939 -0.961973 0.338722
C 1.617329 0.407868 2.013858
C -0.828910 0.282537 1.868627
C -1.908589 2.731316 -0.726657
C -1.925334 -0.216936 -1.850750
C 0.347740 0.396124 2.632948
C -2.451257 -2.243130 0.626161
C -4.372393 -0.747287 0.637821
C -2.694919 4.058446 -0.652741
C -3.235995 -3.266762 1.195121
C -5.163116 -1.771626 1.212654
C -4.600895 -3.035826 1.492936
H 2.322970 -1.049593 -1.533658
H 4.498429 0.366364 1.434382
H 4.631677 -1.536469 -2.472357
H 4.093995 0.163209 -2.639928
H 5.077762 1.888161 -1.175271
H 6.240994 1.398466 0.090713
H 6.082986 -0.863084 -0.677878
H 2.651460 -2.280411 0.656263
H 3.567389 -3.031679 -0.686067
H 4.416630 -2.037225 0.535265
H 3.495147 3.023085 0.188998
H 3.078641 2.464296 1.829034
H 4.772308 2.878265 1.440999
H -3.094198 1.712081 0.775949
H -3.702487 1.521916 -0.889645
H 0.578240 0.242353 -1.256651
H 2.519661 0.449717 2.632253
H -1.802801 0.248733 2.369461
H -1.545291 2.558368 -1.754881
H -1.010580 2.795460 -0.084388
H 0.280652 0.454885 3.725728
H -1.391532 -2.424512 0.413470
H -4.835104 0.221904 0.432113
H -3.582830 4.038488 -1.313845
H -3.046683 4.262721 0.377071
H -2.063467 4.909535 -0.966954
H -2.744983 -1.325336 -3.386381
H -3.448709 -1.673591 -1.802319
H -2.784790 -4.241976 1.410377
H -6.217348 -1.577271 1.440938
H -5.212117 -3.827666 1.940059


