%chk=000061582.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061582

0 1
 O    3.767200       1.898200      0.2594000    
 O    1.658300      -4.183900      0.2678000    
 O    3.595300       4.155200     -0.1003000    
 O   -3.012800      0.5199000     -0.5956000    
 O   -6.360900     -0.2008000      0.1111000    
 O   -5.340500      0.2934000      -1.768600    
 N    2.474100      -1.523400     -0.3304000    
 N    1.784400       2.721800     -0.3786000    
 N   0.3897000      0.9674000      0.4104000    
 N   -5.302300      9.4200000E-02 -0.5185000    
 C    2.822500      0.8106000      0.3623000    
 C    3.432400     -0.4209000     -0.2857000    
 C    1.583400       1.308800     -0.3632000    
 C    2.066000      -1.915400       1.025900    
 C    3.041000      -2.679000      -1.039300    
 C    1.076500      -3.074900      0.9544000    
 C    2.027800      -3.819800      -1.062700    
 C    3.088300       3.042700     -7.5700000E-02
 C  -0.6751000      0.8946000     -0.3129000    
 C   -1.971600      0.5677000      0.2550000    
 C   -2.329800      0.2929000       1.533700    
 C   -3.723200      5.0200000E-02   1.484200    
 C   -4.090700      0.2005000      0.1672000    
 H    2.659700      0.6699000       1.436900    
 H    4.349600     -0.7008000      0.2502000    
 H    3.754700     -0.1626000      -1.303700    
 H    1.545900      0.9664000      -1.405300    
 H    1.565200      -1.110500       1.568300    
 H    2.942700      -2.222900       1.611100    
 H    3.959700      -3.017200     -0.5424000    
 H    3.292700      -2.406900      -2.070600    
 H   0.8191000      -3.408700       1.964700    
 H   0.1450000      -2.781700      0.4546000    
 H    1.129400      -3.551400      -1.631800    
 H    2.469800      -4.701300      -1.538200    
 H    1.090300       3.396300     -0.6842000    
 H  -0.6580000       1.081600      -1.402300    
 H   -1.690800      0.2640000       2.404800    
 H   -4.372900     -0.2029000       2.310100    


%chk=000061582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000061582

0 1
O 3.478095 1.882627 1.038286
O 1.711921 -4.322150 -0.516143
O 3.894442 4.043494 0.205649
O -2.947066 -0.213170 -0.129669
O -6.380746 -0.473852 0.850943
O -5.139472 -1.739939 -0.616960
N 2.532771 -1.547569 -0.240587
N 2.219995 2.622216 -0.706072
N 0.234582 1.524705 0.170939
N -5.283292 -0.771434 0.224483
C 2.573124 0.765448 0.670099
C 3.408030 -0.410416 0.127270
C 1.589883 1.345461 -0.407978
C 2.096616 -2.349641 0.938009
C 3.140772 -2.438695 -1.269601
C 1.108919 -3.441461 0.495207
C 2.132967 -3.524964 -1.679027
C 3.247669 2.986510 0.162721
C -0.684554 0.667780 -0.198825
C -2.029903 0.756062 0.340523
C -2.670647 1.603904 1.253942
C -4.027810 1.164231 1.365355
C -4.150610 0.066673 0.515206
H 2.017719 0.492987 1.582361
H 4.175531 -0.681455 0.888550
H 3.949168 -0.067198 -0.774293
H 1.568340 0.667029 -1.287336
H 1.600051 -1.690897 1.674316
H 2.973057 -2.826677 1.441162
H 4.068732 -2.928679 -0.886537
H 3.412441 -1.832930 -2.154551
H 0.841068 -4.098818 1.338256
H 0.188460 -2.971436 0.084186
H 1.244101 -3.052175 -2.151213
H 2.586614 -4.242470 -2.381914
H 1.845798 3.291669 -1.375080
H -0.507886 -0.159348 -0.916387
H -2.194555 2.435504 1.767765
H -4.822225 1.580375 1.979045


