%chk=000094538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094538

0 1
 O   -1.325200      -1.573000      0.7121000    
 O    3.993500      0.9853000      0.2434000    
 N    2.010900       2.167700      2.5100000E-02
 C    2.022400     -0.2659000      2.6100000E-02
 C  -1.9500000E-02  -1.520700      0.3317000    
 C   0.6845000     -0.3194000      0.4172000    
 C    2.656200      -1.413500     -0.4505000    
 C   0.6145000      -2.668200     -0.1450000    
 C   -2.161000     -0.5541000      0.2868000    
 C    1.952300      -2.614600     -0.5360000    
 C    2.756500      0.9865000      0.1148000    
 C   -2.099800     -0.1383000      -1.030900    
 C   -3.035000      2.1600001E-02   1.191100    
 C   -2.941200      0.8886000      -1.459000    
 C   -3.876400       1.048400      0.7628000    
 C   -3.829500       1.481800     -0.5622000    
 C    2.596900       3.487900      7.2499998E-02
 H   0.1958000      0.5517000      0.8446000    
 H    3.696500      -1.392000     -0.7647000    
 H   7.0900001E-02  -3.606500     -0.2147000    
 H    2.445200      -3.507900     -0.9082000    
 H   -1.433900     -0.5998000      -1.754200    
 H   -3.072100     -0.3144000       2.222900    
 H   -2.908600       1.222700      -2.491900    
 H   -4.568200       1.510400       1.461100    
 H    1.016500       2.126900     -0.1711000    
 H   -4.485600       2.280400     -0.8958000    
 H    1.865900       4.176600      0.5022000    
 H    2.836400       3.794000     -0.9489000    
 H    3.507400       3.481400      0.6766000    


%chk=000094538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094538

0 1
O -1.385452 -1.557787 0.503995
O 4.199492 0.973688 0.266899
N 2.269320 2.210941 -0.138851
C 2.106618 -0.241970 0.029045
C -0.003480 -1.463440 0.203717
C 0.705528 -0.242305 0.249411
C 2.781801 -1.465576 -0.207311
C 0.660901 -2.684722 -0.041825
C -2.277496 -0.504244 0.171875
C 2.058799 -2.676677 -0.240464
C 2.943778 1.015783 0.069118
C -2.194237 0.208419 -1.047875
C -3.330436 -0.271769 1.082871
C -3.180293 1.176481 -1.343050
C -4.310873 0.696131 0.771832
C -4.238505 1.426938 -0.437583
C 2.956586 3.506499 -0.105963
H 0.166472 0.675166 0.509731
H 3.866596 -1.438563 -0.346361
H 0.079875 -3.611416 -0.058243
H 2.582310 -3.620857 -0.423705
H -1.389120 -0.004586 -1.758535
H -3.367380 -0.850476 2.010554
H -3.126755 1.725446 -2.289862
H -5.129867 0.879285 1.475855
H 1.280579 2.189109 -0.388721
H -5.000402 2.176635 -0.675285
H 2.513587 4.174855 0.655344
H 2.918250 4.008850 -1.090638
H 4.010103 3.313760 0.151927


