%chk=000106479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106479

0 1
 O   -3.013800     -0.1278000     -7.4900001E-02
 O   -1.882700       1.881700     -2.1299999E-02
 O   -10.14780      -1.020400      6.6500001E-02
 N   -6.683900      0.2238000      1.4000000E-02
 C    3.164200      0.4573000     -7.0000002E-03
 C    4.393900     -0.4539000     -1.2000001E-03
 C    1.869300     -0.3551000     -7.6200001E-02
 C    5.685500      0.3604000      0.1003000    
 C   0.6396000      0.5579000     -4.8400000E-02
 C    6.949000     -0.5045000      0.1413000    
 C  -0.6715000     -0.2272000     -8.2900003E-02
 C    8.238700      0.3103000      0.2680000    
 C   -1.897200      0.6593000     -6.4700000E-02
 C    9.442100     -0.5854000      0.3163000    
 C   -4.261400      0.5720000     -2.9899999E-02
 C   -5.392300     -0.4440000     -4.8099998E-02
 C   -7.771900     -0.7452000      3.9000001E-02
 C    10.45850     -0.5194000     -0.5506000    
 C   -9.118500     -3.9900001E-02  5.9900001E-02
 H    3.216200       1.141100     -0.8629000    
 H    3.161200       1.074000      0.9001000    
 H    4.411600      -1.058200     -0.9160000    
 H    4.333500      -1.148700      0.8452000    
 H    1.859100     -0.9577000     -0.9924000    
 H    1.826000      -1.051000      0.7704000    
 H    5.650600      0.9814000       1.004200    
 H    5.748800       1.047000     -0.7530000    
 H   0.6756000       1.246400     -0.9021000    
 H   0.6650000       1.180700      0.8548000    
 H    6.991000      -1.116200     -0.7693000    
 H    6.873800      -1.203100      0.9848000    
 H  -0.7086000     -0.8355000     -0.9937000    
 H  -0.7209000     -0.8909000      0.7879000    
 H    8.209400      0.9044000       1.189000    
 H    8.310500       1.017300     -0.5673000    
 H    9.489100      -1.317700       1.118200    
 H   -4.332200       1.237100     -0.8992000    
 H   -4.303800       1.172000      0.8873000    
 H   -5.267600      -1.125700      0.8026000    
 H   -5.311100      -1.057400     -0.9544000    
 H   -6.790300      0.8433000     -0.7888000    
 H   -7.728000      -1.404900     -0.8369000    
 H   -7.693700      -1.391600      0.9221000    
 H    11.30510      -1.190800     -0.4565000    
 H    10.46550      0.1981000      -1.363600    
 H   -9.248800      0.5901000     -0.8264000    
 H   -9.224500      0.5811000      0.9557000    
 H   -10.99530     -0.5439000      8.0600001E-02


%chk=000106479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106479

0 1
O -3.071601 -0.164882 0.014227
O -1.973921 1.886962 0.127913
O -10.326938 -0.979234 -0.029525
N -6.782280 0.142587 -0.205108
C 3.204273 0.495433 0.081232
C 4.462934 -0.400799 0.102295
C 1.884516 -0.308316 0.085701
C 5.784350 0.400293 0.098953
C 0.630368 0.592534 0.067000
C 7.039928 -0.499772 0.126730
C -0.674076 -0.227142 0.072959
C 8.364495 0.310237 0.118890
C -1.924486 0.637100 0.075968
C 9.591213 -0.571397 0.220836
C -4.377534 0.552844 0.034733
C -5.456994 -0.510947 -0.185434
C -7.937407 -0.781501 -0.183832
C 10.603384 -0.623644 -0.681732
C -9.234554 0.004695 0.035969
H 3.232931 1.147884 -0.816285
H 3.222348 1.174521 0.959009
H 4.444548 -1.080060 -0.775592
H 4.433196 -1.053341 1.000122
H 1.868291 -0.987067 -0.793023
H 1.859020 -0.961427 0.983503
H 5.802549 1.082259 0.974990
H 5.817607 1.049884 -0.800589
H 0.650285 1.246080 -0.826357
H 0.640848 1.271539 0.940921
H 7.029388 -1.184330 -0.744916
H 7.010778 -1.143711 1.030397
H -0.723791 -0.902527 -0.803429
H -0.717218 -0.890154 0.959984
H 8.345113 1.015583 0.977409
H 8.419299 0.926972 -0.799461
H 9.636407 -1.222575 1.109357
H -4.375350 1.321549 -0.761596
H -4.503839 1.060048 1.006649
H -5.435326 -1.227442 0.656240
H -5.219943 -1.088494 -1.111051
H -6.856394 0.820837 -0.976863
H -8.044344 -1.392319 -1.111454
H -7.804491 -1.488084 0.655930
H 11.461859 -1.291690 -0.547352
H 10.600922 0.002800 -1.582886
H -9.351682 0.778583 -0.756188
H -9.195167 0.514129 1.020203
H -11.186516 -0.533898 0.175051


