%chk=000140903.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140903

0 1
 O  -0.3283000       2.350000     -0.4119000    
 N   -2.125500     -0.5746000     -0.9555000    
 N   8.2099997E-02  0.2188000      0.4415000    
 C   -1.862700      -1.362000      0.2588000    
 C   -2.154700      0.7968000     -0.4297000    
 C   -2.735400     -0.7263000       1.345700    
 C   -2.907500      0.7231000      0.8983000    
 C  -0.3695000      -1.173000      0.5577000    
 C  -0.7058000       1.204100     -0.1630000    
 C   -3.376500     -0.9493000      -1.610000    
 C    1.458200      0.4971000      0.8200000    
 C    2.408300      0.1776000     -0.2965000    
 C    3.689200     -0.2307000     -0.2123000    
 C    4.588700     -0.5346000      -1.376700    
 C    4.339600     -0.4170000       1.133800    
 H   -2.074900      -2.431000      0.1442000    
 H   -2.590700       1.517300      -1.130400    
 H   -2.287600     -0.7922000       2.342600    
 H   -3.715800      -1.215300       1.389800    
 H   -3.972200      0.9421000      0.7576000    
 H   -2.515700       1.417300       1.649600    
 H  -0.1337000      -1.530200       1.566800    
 H   0.2221000      -1.760900     -0.1551000    
 H   -4.258400     -0.8543000     -0.9680000    
 H   -3.321300      -1.986300      -1.959200    
 H   -3.535900     -0.3270000      -2.497500    
 H    1.545300       1.565100       1.049400    
 H    1.668900     -6.3400000E-02   1.735000    
 H    2.007400      0.3147000      -1.301000    
 H    4.938800      -1.570700      -1.328000    
 H    4.068900     -0.4017000      -2.331300    
 H    5.458000      0.1307000      -1.373500    
 H    3.780900      1.7100001E-02   1.966100    
 H    4.482300      -1.483600       1.336300    
 H    5.323600      6.5600000E-02   1.142400    


%chk=000140903-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000140903

0 1
O -0.586816 2.627614 -0.235636
N -2.102759 -0.560050 -0.967259
N 0.096258 0.471528 0.361548
C -1.654886 -1.307890 0.248901
C -2.234875 0.816751 -0.403330
C -2.532970 -0.766337 1.442481
C -3.006906 0.641614 0.955777
C -0.157628 -0.987284 0.424458
C -0.836041 1.386800 -0.111168
C -3.340101 -1.079727 -1.592961
C 1.477930 0.929515 0.659622
C 2.479467 0.439501 -0.368139
C 3.602444 -0.305805 -0.155270
C 4.511937 -0.683451 -1.314376
C 4.070360 -0.807388 1.200890
H -1.768560 -2.395527 0.099580
H -2.728866 1.502078 -1.108157
H -1.944723 -0.703734 2.374427
H -3.389135 -1.436464 1.633473
H -4.096998 0.664902 0.779388
H -2.765178 1.446991 1.669137
H 0.202477 -1.368832 1.402355
H 0.423911 -1.491352 -0.371941
H -4.222677 -1.131169 -0.911524
H -3.147523 -2.095411 -1.981582
H -3.606421 -0.436223 -2.449734
H 1.431908 2.034567 0.648571
H 1.747001 0.604519 1.681931
H 2.248228 0.750881 -1.397619
H 4.607960 -1.784333 -1.401130
H 4.135479 -0.293421 -2.275483
H 5.536109 -0.288643 -1.160814
H 3.359761 -0.595486 2.016351
H 4.242340 -1.901540 1.171004
H 5.039696 -0.343896 1.472229


