%chk=000094708.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094708

0 1
 O    1.241100     -0.1791000     -0.1702000    
 O   -3.743400      -1.041300     -0.1632000    
 O   -3.703500       1.252500      3.7599999E-02
 O    4.701000     -0.6340000      1.6700000E-02
 O    3.048400      -2.062400     -0.2401000    
 N    3.463300     -0.8757000     -9.1700003E-02
 C   0.5311000      0.9690000     -0.1006000    
 C  -0.8935000      0.9753000     -0.1960000    
 C   -1.675800     -3.7000000E-02  0.2259000    
 C    1.346700       2.053700      6.4999998E-02
 C    2.546700      0.1763000     -4.6200000E-02
 C    2.664500       1.538900      0.1010000    
 C   -1.224100      -1.298600      0.9062000    
 C   -3.143900      0.1653000      3.0300001E-02
 C   -5.158700      -1.002800     -0.3747000    
 H   -1.339400       1.870000     -0.6245000    
 H    1.047400       3.089100      0.1508000    
 H    3.582000       2.097700      0.2198000    
 H   -1.060100      -2.091600      0.1700000    
 H   -1.977500      -1.645500       1.622300    
 H  -0.3083000      -1.156900       1.487200    
 H   -5.391600     -0.4254000      -1.274500    
 H   -5.660600     -0.5768000      0.4994000    
 H   -5.509300      -2.028700     -0.5153000    


%chk=000094708-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094708

0 1
O 1.369291 -0.177846 0.204366
O -3.939973 -1.043348 0.049545
O -3.653986 1.244898 -0.277849
O 4.944432 -0.247831 0.403812
O 3.392250 -1.941011 0.576988
N 3.726661 -0.703050 0.407809
C 0.567623 0.970403 -0.012016
C -0.865520 0.881551 -0.074863
C -1.695212 -0.212768 0.048172
C 1.411918 2.090884 -0.137671
C 2.692648 0.269550 0.205904
C 2.761799 1.645336 0.000703
C -1.288862 -1.645658 0.289487
C -3.157583 0.105165 -0.079628
C -5.403050 -0.832617 -0.062771
H -1.359793 1.847258 -0.249162
H 1.075860 3.111376 -0.310313
H 3.674747 2.233147 -0.040623
H -1.664736 -2.290392 -0.526232
H -1.763922 -2.025516 1.212696
H -0.200902 -1.764837 0.369454
H -5.651596 -0.408667 -1.050145
H -5.749338 -0.141481 0.723869
H -5.840257 -1.832543 0.063669


