%chk=000092183.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092183

0 1
 O    1.911700      0.4386000      2.1500001E-02
 O    2.065500      -1.719300     -0.8516000    
 O    5.712700       1.362400      -1.232000    
 O    4.875600      -1.449400     -0.9755000    
 O    4.431000       2.965200      0.8262000    
 O    1.911300       3.598800       1.551100    
 O   0.3740000       2.455700      0.3157000    
 O   0.2530000      -3.611100       1.548700    
 N   0.8930000      -2.092900     -0.1186000    
 C    4.732200      0.8680000     -0.3187000    
 C    4.002900     -0.3202000     -0.9464000    
 C    3.766400       2.009200      1.9000000E-03
 C    2.759600     -0.6958000     -0.1396000    
 C    2.542900       1.488400      0.7457000    
 C   -2.458200     -0.7798000      0.5583000    
 C   -3.584000     -0.5669000       1.548600    
 C    1.480600       2.536200      0.8282000    
 C   -2.801600     -0.2444000     -0.7035000    
 C   -4.610000      0.1537000      0.6994000    
 C   -4.126800      0.3304000     -0.6166000    
 C  -0.3475000      -1.478600     -0.2973000    
 C   -1.238700      -1.397500      0.7742000    
 C   -1.917300     -0.3253000      -1.766200    
 C  -0.6832000     -0.9476000      -1.554700    
 C   -5.861200      0.6084000       1.077300    
 C   -4.901100      0.9693000      -1.570500    
 C    1.110200      -3.139400      0.8001000    
 C   -6.641700       1.252300      0.1154000    
 C   -6.166500       1.431000      -1.195300    
 C    2.515000      -3.699300      0.8741000    
 H    5.275500      0.5488000      0.5797000    
 H    3.730700     -9.6699998E-02  -1.985400    
 H    3.469000       2.520800     -0.9227000    
 H    3.054600      -1.067100      0.8479000    
 H    2.771200       1.152500       1.764800    
 H   -3.255300      6.4999998E-02   2.378700    
 H   -3.976500      -1.525200       1.900900    
 H    6.243200       2.029200     -0.7645000    
 H    5.671500      -1.188400      -1.469600    
 H    5.140200       3.368500      0.2983000    
 H   -1.008100      -1.735100       1.776900    
 H   -2.162500      7.9300001E-02  -2.742500    
 H   1.3500000E-02  -1.016300      -2.387400    
 H   -6.229100      0.4714000       2.088000    
 H   -4.548100       1.114900      -2.585900    
 H   -7.628900       1.620700      0.3815000    
 H   -6.792700       1.935600      -1.926500    
 H    1.227700       4.299400       1.615600    
 H    3.120300      -3.108200       1.564000    
 H    2.462700      -4.722700       1.260700    
 H    2.992600      -3.754300     -0.1065000    


%chk=000092183-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092183

0 1
O 2.028382 0.741216 -0.286033
O 2.024759 -1.560144 -0.741749
O 6.192901 0.802626 -0.716969
O 4.872225 -1.667801 -0.115429
O 4.866988 3.147823 0.316828
O 0.519950 2.923559 0.500341
O 2.284020 4.235720 -0.239442
O 0.229023 -3.979260 1.237591
N 0.920113 -2.102564 0.057961
C 4.894310 0.784942 -0.043369
C 4.172064 -0.468925 -0.570012
C 4.095246 2.067524 -0.296089
C 2.738622 -0.528412 -0.013380
C 2.699556 1.885913 0.348855
C -2.571322 -0.904374 0.701911
C -3.792785 -0.873659 1.613506
C 1.835396 3.129248 0.155070
C -2.823580 -0.140467 -0.476738
C -4.773777 0.000580 0.839130
C -4.184030 0.420758 -0.394000
C -0.349558 -1.440024 -0.107487
C -1.343408 -1.551448 0.903436
C -1.826095 -0.032356 -1.470884
C -0.592531 -0.686700 -1.287194
C -6.078599 0.397925 1.177879
C -4.906719 1.239886 -1.290663
C 1.148460 -3.394063 0.596561
C -6.802989 1.220926 0.277860
C -6.220014 1.636486 -0.945573
C 2.515873 -4.003005 0.345655
H 5.040196 0.683105 1.055778
H 4.129390 -0.421239 -1.677727
H 3.964158 2.234212 -1.385174
H 2.728388 -0.743954 1.076107
H 2.817550 1.719279 1.444712
H -3.557770 -0.451848 2.610458
H -4.196397 -1.890198 1.789420
H 6.661233 1.633814 -0.445667
H 5.825756 -1.564965 -0.371354
H 4.412616 4.002242 0.084707
H -1.150123 -2.148919 1.795549
H -2.000062 0.547534 -2.384049
H 0.195904 -0.606693 -2.038504
H -6.536257 0.077850 2.121288
H -4.464290 1.562296 -2.240325
H -7.822114 1.536890 0.527723
H -6.795251 2.269677 -1.630720
H -0.016089 3.750186 0.350291
H 3.350738 -3.333346 0.611099
H 2.573066 -4.937193 0.924070
H 2.638177 -4.228458 -0.729355


