%chk=000114238.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114238

0 1
 N  -0.6388000      0.1143000      0.6727000    
 C   0.1340000       1.150700     -5.2299999E-02
 C   0.9780000      0.5348000      -1.170100    
 C    1.021200       1.912200      0.9384000    
 C   -1.677200      0.5686000       1.589800    
 C  -0.3161000      -1.227800      0.5588000    
 C   0.5531000      -1.718900     -0.3373000    
 C    1.163700     -0.7958000      -1.273000    
 C    1.570900       1.480600      -2.176100    
 C    2.072300      0.9949000       1.549200    
 C   -3.053000      1.7600000E-02   1.230000    
 C   0.8936000      -3.169500     -0.4560000    
 C   -3.493800      0.4122000     -0.1814000    
 C   0.6244000       1.729100      -3.332600    
 C    2.936300       1.744700       2.550500    
 C    2.071700      -3.547300      0.4234000    
 C   -4.840300     -0.2004000     -0.5342000    
 H  -0.5820000       1.846800     -0.5073000    
 H   0.4146000       2.351500       1.739200    
 H    1.513700       2.756900      0.4427000    
 H   -1.417000      0.2663000       2.611700    
 H   -1.740200       1.663500       1.599100    
 H  -0.8293000      -1.872400       1.263800    
 H    1.762000      -1.208900      -2.079400    
 H    1.844500       2.432900      -1.711700    
 H    2.507600       1.066100      -2.570500    
 H    2.738200      0.5813000      0.7849000    
 H    1.609400      0.1553000       2.077400    
 H   -3.783900      0.3937000       1.956500    
 H   -3.059700      -1.075000       1.322100    
 H   2.8400000E-02  -3.777800     -0.1621000    
 H    1.104200      -3.438100      -1.498300    
 H   -2.761000      7.9599999E-02 -0.9246000    
 H   -3.559900       1.503700     -0.2572000    
 H    1.085100       2.407400      -4.058300    
 H  -0.3106000       2.187600      -2.993500    
 H   0.3767000      0.7988000      -3.855200    
 H    3.461300       2.577100       2.070900    
 H    2.330900       2.145800       3.369700    
 H    3.686700       1.074200       2.981300    
 H    2.288400      -4.616100      0.3258000    
 H    1.864500      -3.341800       1.479200    
 H    2.973700      -2.994400      0.1398000    
 H   -5.616300      0.1303000      0.1635000    
 H   -5.140500      9.9500000E-02  -1.543000    
 H   -4.794000      -1.293800     -0.5046000    


%chk=000114238-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114238

0 1
N -0.648192 -0.024565 0.845939
C 0.139161 1.012746 0.114061
C 0.824330 0.389374 -1.109819
C 1.134223 1.774337 1.055293
C -1.852847 0.377700 1.597304
C -0.260804 -1.361737 0.827364
C 0.650448 -1.868787 -0.078248
C 1.107832 -0.954379 -1.123463
C 1.150278 1.312462 -2.270965
C 2.233070 0.907568 1.706177
C -3.188466 0.012111 0.897951
C 1.122081 -3.310298 -0.037754
C -3.402007 0.722672 -0.456706
C -0.097648 1.721591 -3.103901
C 3.200497 1.743996 2.572231
C 2.608011 -3.461527 0.386577
C -4.738634 0.336252 -1.125694
H -0.585654 1.777085 -0.241365
H 0.543630 2.274961 1.852851
H 1.608957 2.587331 0.465421
H -1.829911 -0.095754 2.601024
H -1.808738 1.471393 1.761003
H -0.749037 -2.002701 1.573156
H 1.645220 -1.377753 -1.984871
H 1.645675 2.236533 -1.906506
H 1.875252 0.812095 -2.941479
H 2.797309 0.379905 0.913466
H 1.758662 0.123013 2.326331
H -4.023093 0.266137 1.585215
H -3.224205 -1.085445 0.744897
H 0.486951 -3.890772 0.660710
H 0.994001 -3.776914 -1.037567
H -2.563239 0.469112 -1.134211
H -3.369227 1.821683 -0.302671
H 0.182099 2.414887 -3.918976
H -0.854810 2.229603 -2.477439
H -0.573456 0.830956 -3.552079
H 3.714212 2.513512 1.964594
H 2.660278 2.266838 3.384958
H 3.976718 1.108570 3.037677
H 2.923623 -4.522241 0.375539
H 2.764871 -3.061333 1.405077
H 3.271226 -2.900602 -0.297611
H -5.598860 0.595110 -0.479240
H -4.872703 0.857190 -2.091596
H -4.781581 -0.751917 -1.320953


