%chk=000113773.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113773

0 1
 O   -5.363900      0.3735000     -3.0999999E-02
 N    2.470800      0.4839000     -0.3740000    
 C    2.946300     -0.5986000      0.5120000    
 C    2.176400      -1.903100      0.2431000    
 C   0.2065000     -0.5420000     -0.5046000    
 C    1.027600      0.7258000     -0.2027000    
 C    4.450500     -0.8506000      0.3071000    
 C   0.6702000      -1.705900      0.3816000    
 C    3.216800       1.731700     -0.1476000    
 C    5.264400      0.4228000      0.5026000    
 C    4.715300       1.539400     -0.3746000    
 C   -1.286300     -0.2969000     -0.3775000    
 C   -2.111000     -0.4474000      -1.489800    
 C   -1.825500      7.7900000E-02  0.8510000    
 C   -3.482500     -0.2219000      -1.373100    
 C   -3.197100      0.3034000      0.9678000    
 C   -4.025700      0.1534000     -0.1443000    
 C   -5.852900      0.7546000       1.254100    
 H    2.783300     -0.3099000       1.560600    
 H    2.503600      -2.681800      0.9426000    
 H    2.399200      -2.271200     -0.7671000    
 H   0.4158000     -0.8241000      -1.547200    
 H   0.7077000       1.518300     -0.8923000    
 H   0.8258000       1.089100      0.8138000    
 H    4.632600      -1.241300     -0.7029000    
 H    4.801600      -1.615000       1.010600    
 H   0.1495000      -2.630000      0.1024000    
 H   0.4339000      -1.518100       1.436300    
 H    3.045900       2.107800      0.8698000    
 H    2.865600       2.504200     -0.8426000    
 H    6.316600      0.2373000      0.2607000    
 H    5.223700      0.7273000       1.555500    
 H    5.245500       2.473800     -0.1585000    
 H    4.901000       1.302700      -1.430000    
 H   -1.703200     -0.7392000      -2.453700    
 H   -1.198200      0.2007000       1.729400    
 H   -4.122900     -0.3401000      -2.242900    
 H   -3.552500      0.5925000       1.951000    
 H   -5.690300     -3.4000002E-02   1.996500    
 H   -6.935700      0.8879000       1.161400    
 H   -5.438500       1.716900       1.573100    


%chk=000113773-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000113773

0 1
O -5.465241 0.425411 -0.109906
N 2.513307 0.465496 -0.342299
C 3.031391 -0.630229 0.529178
C 2.233942 -1.929364 0.274282
C 0.222626 -0.567745 -0.455275
C 1.061915 0.698806 -0.144683
C 4.538390 -0.857598 0.274245
C 0.715280 -1.728454 0.449199
C 3.274039 1.731080 -0.171716
C 5.361274 0.438287 0.435649
C 4.772522 1.541766 -0.470161
C -1.272737 -0.298626 -0.324615
C -2.124889 -0.365292 -1.459839
C -1.864522 0.029418 0.920437
C -3.507536 -0.121063 -1.360929
C -3.250416 0.279704 1.043684
C -4.076372 0.202556 -0.104830
C -6.098034 0.754188 1.167924
H 2.897345 -0.342318 1.610910
H 2.602116 -2.715569 0.962137
H 2.445472 -2.267144 -0.760007
H 0.441056 -0.845081 -1.506173
H 0.748667 1.522148 -0.814155
H 0.841214 1.027869 0.906783
H 4.661057 -1.243309 -0.757675
H 4.901955 -1.641468 0.967269
H 0.165458 -2.657395 0.206170
H 0.490324 -1.490013 1.509204
H 3.160985 2.129884 0.873113
H 2.839686 2.484615 -0.856090
H 6.424737 0.255057 0.190278
H 5.325891 0.773389 1.493364
H 5.302278 2.501918 -0.317680
H 4.894183 1.254550 -1.532593
H -1.695120 -0.615944 -2.437527
H -1.240244 0.089041 1.820163
H -4.163051 -0.175898 -2.235586
H -3.667952 0.528217 2.024387
H -5.971139 -0.063880 1.904220
H -7.165952 0.880988 0.936389
H -5.694006 1.695804 1.589353


