%chk=000066746.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066746

0 1
 O    3.647500      0.7839000      1.6000000E-03
 O    3.953000      -1.497700      1.4100000E-02
 N   -2.442900     -0.7785000     -1.5400000E-02
 C   -4.769700     -8.5000005E-03  6.2000002E-03
 C   -3.298500      0.4021000     -2.4499999E-02
 C   -5.685100       1.216300      1.8700000E-02
 C   -1.066600     -0.7132000     -9.7000003E-03
 C   -7.151900      0.8161000      1.3400000E-02
 C  -0.2802000      -1.885200     -1.0000000E-03
 C  -0.3947000      0.5280000     -1.2700000E-02
 C    1.752500     -0.5797000      1.7000000E-03
 C    1.113100      -1.819200      4.8000002E-03
 C   0.9987000      0.5940000     -7.0000002E-03
 C    3.205100     -0.5109000      6.8999999E-03
 C    5.065300      0.9832000      4.6999999E-03
 C    5.354300       2.469200     -2.0999999E-03
 H   -4.964000     -0.6252000      0.8928000    
 H   -4.995400     -0.6327000     -0.8677000    
 H   -3.107900      0.9942000     -0.9275000    
 H   -3.084900       1.024400      0.8529000    
 H   -5.481800       1.842600     -0.8578000    
 H   -5.480600       1.825000      0.9072000    
 H   -2.877600      -1.694600     -1.7800000E-02
 H   -7.787900       1.706700      2.3800001E-02
 H   -7.396600      0.2341000     -0.8809000    
 H   -7.396900      0.2132000      0.8936000    
 H  -0.7616000      -2.861100      1.4000000E-03
 H  -0.9401000       1.468200     -2.0600000E-02
 H    1.681500      -2.745600      1.1500000E-02
 H    1.453700       1.580600     -1.0100000E-02
 H    5.494800      0.5251000      0.9023000    
 H    5.500000      0.5158000     -0.8857000    
 H    6.431300       2.658300      9.9999997E-05
 H    4.913500       2.943300     -0.8853000    
 H    4.908400       2.952300      0.8737000    


%chk=000066746-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066746

0 1
O 3.766521 0.835140 -0.000603
O 3.993820 -1.488469 0.004841
N -2.472007 -0.723453 -0.004411
C -4.851222 -0.026832 0.003497
C -3.379547 0.429566 -0.007956
C -5.836184 1.164546 0.004559
C -1.087304 -0.632487 -0.003812
C -7.312163 0.713683 0.011032
C -0.292801 -1.824406 -0.000654
C -0.418667 0.632191 -0.005732
C 1.768713 -0.490444 -0.000537
C 1.103915 -1.750037 0.000913
C 0.983931 0.693332 -0.003934
C 3.246008 -0.473061 0.001453
C 5.252511 0.933402 0.001562
C 5.596202 2.420216 -0.002828
H -5.035876 -0.654503 0.899495
H -5.047808 -0.662338 -0.884511
H -3.195809 1.059064 -0.905534
H -3.185647 1.070267 0.879199
H -5.644465 1.797095 -0.885457
H -5.637814 1.800748 0.890477
H -2.891873 -1.653105 -0.009595
H -7.997358 1.580470 0.013854
H -7.544742 0.102202 -0.880960
H -7.536934 0.102611 0.905317
H -0.790512 -2.802441 0.000880
H -0.999364 1.559246 -0.009138
H 1.714752 -2.659132 0.003470
H 1.492011 1.662127 -0.005453
H 5.638670 0.412982 0.897188
H 5.641746 0.407005 -0.889220
H 6.693896 2.551491 -0.001097
H 5.188383 2.915845 -0.900573
H 5.184818 2.921982 0.889867


