%chk=000124368.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124368

0 1
 O   -1.012600       1.729300     -0.5242000    
 N   -1.243700      0.5354000     -0.1490000    
 C   -2.633200      2.3600001E-02 -1.1800000E-02
 C   -2.370600      -1.245100      0.8050000    
 C  -0.9620000      -1.673300      0.4130000    
 C  -0.3118000     -0.3554000      0.1017000    
 C   -3.160900     -0.2546000      -1.415600    
 C   -3.477200       1.041400      0.7428000    
 C    1.140300     -0.1569000      5.3100001E-02
 C    1.984600      -1.208200     -0.3208000    
 C    1.694400       1.085600      0.3801000    
 C    3.365800      -1.019100     -0.3673000    
 C    3.075600       1.274800      0.3333000    
 C    3.911300      0.2224000     -4.0399998E-02
 H   -3.108300      -2.033100      0.6223000    
 H   -2.386700      -1.025100       1.880600    
 H  -0.9704000      -2.296000     -0.4874000    
 H  -0.4525000      -2.200600       1.223400    
 H   -4.160200     -0.7010000      -1.372100    
 H   -3.231100      0.6676000      -2.003500    
 H   -2.511800     -0.9415000      -1.970000    
 H   -3.016700       1.317600       1.698300    
 H   -3.606200       1.964300      0.1662000    
 H   -4.473800      0.6385000      0.9529000    
 H    1.582100      -2.182200     -0.5859000    
 H    1.079700       1.917400      0.7103000    
 H    4.016700      -1.838000     -0.6592000    
 H    3.501400       2.238800      0.5958000    
 H    4.986800      0.3691000     -7.5099997E-02


%chk=000124368-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124368

0 1
O -1.089635 1.890933 -0.165558
N -1.238002 0.587007 0.021058
C -2.674333 0.008249 0.046364
C -2.424248 -1.419673 0.593200
C -0.932863 -1.732534 0.275914
C -0.285818 -0.367074 0.126287
C -3.187567 0.025094 -1.412232
C -3.542093 0.894986 0.951875
C 1.152292 -0.132318 0.056364
C 2.039031 -1.253383 0.117692
C 1.721886 1.174893 -0.073418
C 3.434575 -1.078394 0.056590
C 3.120953 1.337299 -0.131384
C 3.985931 0.219547 -0.066899
H -3.111225 -2.154675 0.141614
H -2.583640 -1.431853 1.686073
H -0.823324 -2.320369 -0.657975
H -0.465020 -2.324118 1.082955
H -4.239412 -0.310215 -1.446333
H -3.130328 1.050602 -1.816740
H -2.587989 -0.639792 -2.060061
H -3.165671 0.894780 1.990256
H -3.528324 1.934004 0.581445
H -4.583458 0.526333 0.954647
H 1.632370 -2.266319 0.209741
H 1.048726 2.033533 -0.127621
H 4.094372 -1.952113 0.105175
H 3.539600 2.345480 -0.229595
H 5.072213 0.355791 -0.112935


