%chk=000017087.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017087

0 1
 O    3.228400     -0.5741000     -0.6013000    
 N   0.4817000      -1.740000     -0.1534000    
 N   -4.984200      0.3625000     -0.2621000    
 C   -1.354100     -0.5907000      0.3317000    
 C  -0.2756000      0.3283000      0.2007000    
 C   0.8645000     -0.4186000     -0.1040000    
 C   -2.757800     -0.2589000      0.6500000    
 C  -0.8571000      -1.854100      0.1087000    
 C    2.119800      0.1669000     -0.3036000    
 C  -0.1595000       1.728100      0.3121000    
 C   -3.610600      9.1000004E-03 -0.6036000    
 C    2.210700       1.557000     -0.1879000    
 C    1.089900       2.327500      0.1150000    
 C    4.003800      -1.043100      0.4977000    
 H   -3.207500      -1.081100       1.222700    
 H   -2.789700      0.6182000       1.309200    
 H   -1.334300      -2.824200      0.1120000    
 H    1.100700      -2.513400     -0.3540000    
 H   -1.023100       2.344000      0.5462000    
 H   -3.622000     -0.8805000      -1.243800    
 H   -3.168000      0.8225000      -1.190700    
 H    3.168700       2.050000     -0.3365000    
 H    1.185200       3.406800      0.1992000    
 H   -5.496300      0.5901000      -1.113300    
 H   -4.988100       1.206800      0.3087000    
 H    4.397300     -0.2016000       1.076700    
 H    4.845200      -1.619300      0.1032000    
 H    3.405200      -1.695000       1.141700    


%chk=000017087-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017087

0 1
O 3.103249 -1.094997 0.038295
N 0.342242 -2.012190 0.154285
N -4.999032 0.642744 -0.586085
C -1.556392 -0.751499 0.394385
C -0.404361 0.139391 0.377160
C 0.759433 -0.684483 0.227823
C -3.006822 -0.353866 0.514779
C -1.056405 -2.049027 0.257608
C 2.068504 -0.149148 0.184274
C -0.238266 1.550602 0.485552
C -3.576104 0.291923 -0.776393
C 2.216241 1.247390 0.292277
C 1.062618 2.079878 0.442574
C 4.471897 -0.578215 -0.005177
H -3.637008 -1.228863 0.757330
H -3.131723 0.366651 1.350782
H -1.597676 -2.993326 0.230829
H 0.968571 -2.807728 0.057743
H -1.104096 2.210897 0.603510
H -3.508023 -0.443600 -1.599252
H -2.927309 1.154228 -1.063015
H 3.207671 1.709564 0.265255
H 1.211414 3.162472 0.526008
H -5.494792 0.887873 -1.448508
H -5.158747 1.334641 0.153952
H 4.615403 0.102437 -0.866895
H 5.114713 -1.463630 -0.119840
H 4.728001 -0.046921 0.932044


