%chk=000103570.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103570

0 1
 O   7.4999998E-03   1.905200       1.030900    
 O   -3.423700       3.880300      0.6424000    
 N   0.4363000     -0.2328000      0.2223000    
 N   -2.564000       1.702400      0.6421000    
 C   -1.729600      0.8946000     -0.2017000    
 C   -1.784500       1.598100      -1.544400    
 C  -0.3627000      0.9089000      0.4042000    
 C    1.765300     -0.3259000      0.7617000    
 C  -3.7500001E-02  -1.402300     -0.5306000    
 C   -2.061400       3.059800      -1.193900    
 C    2.806800      0.1943000     -0.2218000    
 C  -0.7415000      -2.404600      0.3761000    
 C   -2.789600       2.973700      0.1252000    
 C    4.217400      9.9900000E-02  0.3597000    
 C   -1.238800      -3.615600     -0.4134000    
 C    5.257900      0.6569000     -0.6116000    
 C   -1.978200      -4.602800      0.4893000    
 C    6.665600      0.5342000     -5.0500002E-02
 C   -2.445300      -5.824400     -0.2860000    
 H   -2.186100     -9.3699999E-02 -0.2314000    
 H   -2.624400       1.206100      -2.131900    
 H  -0.8755000       1.483500      -2.143100    
 H    1.811900      0.2713000       1.680300    
 H    1.975300      -1.363500       1.045400    
 H  -0.6940000      -1.087200      -1.347000    
 H   0.8273000      -1.874900      -1.012500    
 H   -1.133100       3.621000      -1.049900    
 H   -2.679900       3.547600      -1.951200    
 H    2.756700     -0.3755000      -1.157800    
 H    2.582800       1.237100     -0.4795000    
 H  -5.2200001E-02  -2.740700       1.160700    
 H   -1.583000      -1.930100      0.8937000    
 H   -2.922000       1.397200       1.541900    
 H    4.449600     -0.9474000      0.5884000    
 H    4.265200      0.6553000       1.304400    
 H  -0.3876000      -4.117000     -0.8899000    
 H   -1.908500      -3.282600      -1.215600    
 H    5.044100       1.711300     -0.8222000    
 H    5.203800      0.1181000      -1.564800    
 H   -2.845600      -4.112200      0.9461000    
 H   -1.321100      -4.925800       1.305200    
 H    6.763000       1.087900      0.8888000    
 H    6.922600     -0.5128000      0.1391000    
 H    7.393300      0.9393000     -0.7607000    
 H   -3.129400      -5.539500      -1.091800    
 H   -1.596900      -6.357100     -0.7274000    
 H   -2.972300      -6.516300      0.3784000    


%chk=000103570-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103570

0 1
O 0.114087 1.881493 1.252688
O -3.200343 4.345034 0.422470
N 0.332729 -0.224408 0.286901
N -2.596372 2.076696 0.670854
C -1.824733 1.034951 -0.008363
C -1.826943 1.541395 -1.499123
C -0.382711 0.930459 0.569970
C 1.721631 -0.326165 0.802498
C -0.189280 -1.378424 -0.480992
C -1.999564 3.074292 -1.380468
C 2.766878 0.252681 -0.178022
C -0.817532 -2.482493 0.404127
C -2.675710 3.288180 -0.014423
C 4.210362 0.102622 0.351538
C -1.264023 -3.710546 -0.420758
C 5.269005 0.690777 -0.609342
C -1.910825 -4.817938 0.442439
C 6.711123 0.540121 -0.078972
C -2.349814 -6.043882 -0.387019
H -2.335016 0.058516 0.077438
H -2.689223 1.099095 -2.028799
H -0.906732 1.251178 -2.032795
H 1.770547 0.227337 1.756477
H 1.936292 -1.393371 1.005649
H -0.924082 -1.035867 -1.230795
H 0.654812 -1.809399 -1.054371
H -1.029694 3.603473 -1.358284
H -2.609644 3.517477 -2.183300
H 2.678069 -0.253761 -1.161696
H 2.537733 1.323137 -0.340251
H -0.082692 -2.795981 1.172447
H -1.685110 -2.064688 0.953960
H -2.784190 2.045279 1.673944
H 4.434963 -0.970881 0.528046
H 4.293911 0.605756 1.337078
H -0.389141 -4.132803 -0.958558
H -1.985165 -3.391690 -1.202850
H 5.046329 1.763316 -0.780614
H 5.182362 0.193048 -1.596974
H -2.787022 -4.398516 0.977276
H -1.192490 -5.136714 1.224842
H 6.831922 1.056679 0.891844
H 6.969066 -0.525062 0.073938
H 7.447969 0.968472 -0.782938
H -3.094563 -5.758826 -1.153931
H -1.487570 -6.499341 -0.909700
H -2.805606 -6.821413 0.252615


