%chk=000096849.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096849

0 1
 O    1.519000     -0.5557000     -0.9432000    
 O    3.344100       2.015000     -0.3481000    
 O    3.963700      0.1917000       1.581600    
 O    2.489400      -3.204200     -0.8009000    
 O   -4.507100      0.5650000      0.6201000    
 N  -0.1352000       1.066900     -0.4284000    
 N   -2.064000       2.115600      5.2999999E-02
 N  -0.9652000      -1.213700     -0.2596000    
 N  -9.1499999E-02   3.422500     -0.4042000    
 N   -3.293900      -1.383900      0.3016000    
 N   -1.954100      -3.291800     -4.8999999E-02
 C    1.272400      0.8563000     -0.7705000    
 C    2.245300       1.369100      0.2927000    
 C    2.686700      9.4999999E-02  0.9881000    
 C    2.657100     -0.9172000     -0.1439000    
 C    2.516800      -2.352400      0.3310000    
 C   -1.076900      0.1163000     -0.2142000    
 C  -0.7868000       2.269700     -0.2532000    
 C   -2.243400      0.7611000      7.7100001E-02
 C   -3.448500      6.8000001E-03  0.3583000    
 C   -2.127900      -1.932100      1.1800000E-02
 H    1.421100       1.334600      -1.745800    
 H    1.827700       2.083100       1.008300    
 H    1.949900     -0.1668000       1.757900    
 H    3.546300     -0.8312000     -0.7819000    
 H    1.589600      -2.508000      0.8915000    
 H    3.360200      -2.647600      0.9615000    
 H    2.995800       2.798200     -0.8070000    
 H    4.179000     -0.6758000       1.963500    
 H  -0.1069000      -1.698600     -0.4951000    
 H    1.738700      -2.931600      -1.356000    
 H   0.8835000       3.459400     -0.6804000    
 H  -0.5399000       4.324000     -0.2756000    
 H   -1.052700      -3.700400     -0.2705000    
 H   -2.723800      -3.927700      0.1286000    


%chk=000096849-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096849

0 1
O 1.648622 -0.441280 -1.197788
O 3.516055 1.943096 -0.676563
O 4.092786 0.260711 1.348210
O 1.398295 -3.131660 -0.527446
O -4.462469 0.274350 0.958492
N -0.078974 1.080211 -0.508194
N -2.009932 2.060398 0.265917
N -0.906899 -1.301885 -0.525210
N -0.119029 3.524746 -0.197578
N -3.145847 -1.584476 0.358403
N -1.837499 -3.442310 -0.269640
C 1.321557 0.971760 -0.977989
C 2.342561 1.491358 0.060688
C 2.697534 0.217698 0.889387
C 2.551362 -0.941977 -0.123828
C 1.958091 -2.225495 0.491288
C -1.019608 0.058724 -0.298405
C -0.764336 2.284043 -0.163932
C -2.183924 0.657210 0.200901
C -3.359902 -0.172466 0.535213
C -2.013723 -2.076087 -0.126967
H 1.451459 1.494870 -1.942042
H 1.926159 2.308014 0.677670
H 1.996725 0.104473 1.738680
H 3.533396 -1.143887 -0.593325
H 1.097519 -1.992479 1.139276
H 2.737385 -2.733080 1.094134
H 4.316718 1.635720 -0.167048
H 4.144776 0.649244 2.256844
H -0.070827 -1.720847 -0.952116
H 2.094048 -3.380358 -1.186326
H 0.440285 3.775876 -1.014944
H -0.683790 4.280196 0.193845
H -0.917914 -3.841650 -0.456179
H -2.622161 -4.031162 -0.004327


