%chk=000164949.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164949

1 1
 O    4.645200      -1.285100      0.6213000    
 N   0.6096000      0.8454000     -0.4994000    
 N    3.034200      -2.506400     -0.4612000    
 C   -3.194700      0.1174000     -0.6204000    
 C   -1.775400      0.3157000     -7.9099998E-02
 C   -4.186600     -0.3680000      0.4389000    
 C  -0.7332000      0.7358000      -1.113400    
 C   -5.603300     -0.4556000     -0.1298000    
 C    1.383900     -0.2363000     -0.4904000    
 C   -6.602500     -0.8944000      0.9289000    
 C   0.9698000       2.020200      1.0100000E-02
 C    2.647600     -0.1621000      7.7799998E-02
 C    2.222700       2.153000      0.5914000    
 C    3.067400       1.047400      0.6234000    
 C    3.515400      -1.327200      0.1018000    
 H   -3.166500     -0.6049000      -1.445500    
 H   -3.544800       1.067300      -1.042900    
 H   -1.802800       1.062600      0.7244000    
 H   -1.447400     -0.6192000      0.3930000    
 H   -3.873800      -1.349800      0.8141000    
 H   -4.176100      0.3224000       1.291100    
 H  -0.9870000       1.705500      -1.557900    
 H  -0.6764000      1.3300000E-02  -1.936100    
 H   -5.907900      0.5204000     -0.5255000    
 H   -5.625700      -1.165600     -0.9646000    
 H   0.9482000      -1.117300     -0.9363000    
 H   -6.628500     -0.1848000       1.762000    
 H   -7.608000     -0.9522000      0.5004000    
 H   -6.344900      -1.881500       1.325700    
 H   0.2633000       2.839400     -4.2900000E-02
 H    2.537300       3.101100       1.014400    
 H    4.048400       1.151900       1.078900    
 H    2.128400      -2.623300     -0.8977000    
 H    3.616600      -3.337900     -0.4521000    


%chk=000164949-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000164949

1 1
O 4.330936 -1.459436 1.276023
N 0.588252 0.839261 -0.583439
N 3.423473 -2.478596 -0.613692
C -3.250622 0.160600 -0.606610
C -1.818945 0.283252 -0.031901
C -4.270046 -0.301963 0.460872
C -0.816543 0.715581 -1.124605
C -5.707014 -0.419821 -0.098648
C 1.382268 -0.284199 -0.506286
C -6.719994 -0.894122 0.964762
C 1.028439 2.046877 -0.099212
C 2.657729 -0.226281 0.078588
C 2.294792 2.156527 0.496717
C 3.110981 1.012143 0.604888
C 3.544470 -1.444757 0.288278
H -3.256635 -0.559132 -1.451095
H -3.573619 1.137699 -1.020463
H -1.812421 1.020311 0.795031
H -1.508296 -0.689824 0.397801
H -3.957178 -1.284087 0.871467
H -4.266878 0.410164 1.311630
H -1.096224 1.694788 -1.549906
H -0.793723 -0.018576 -1.948991
H -6.025348 0.562836 -0.501569
H -5.710593 -1.125273 -0.954264
H 0.943048 -1.207342 -0.892353
H -6.763306 -0.191593 1.817804
H -7.736882 -0.969292 0.540747
H -6.447116 -1.889804 1.361288
H 0.345819 2.893469 -0.198637
H 2.621446 3.126946 0.876737
H 4.085948 1.041634 1.101724
H 2.928205 -2.400959 -1.501057
H 3.998076 -3.309832 -0.459228


