%chk=000133144.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133144

0 1
 O   -4.521900       1.192100     -0.1953000    
 N    2.270200     -3.4000000E-03  4.8900001E-02
 C   0.8416000      0.2584000     -0.1728000    
 C   0.6413000       1.779900     -0.1177000    
 C   2.1400001E-02 -0.5011000      0.8824000    
 C  -0.7705000       2.257400     -0.4611000    
 C   -1.835500       1.823100      0.5441000    
 C   -1.424400     -0.6882000      0.4858000    
 C   -2.297400      0.4037000      0.3307000    
 C    2.664500      0.4456000       1.381000    
 C    3.069600      0.6596000     -0.9775000    
 C    4.140600      0.1430000       1.626800    
 C    2.712000      0.1184000      -2.359400    
 C   -1.911300      -1.990100      0.2742000    
 C   -3.635300      0.1670000     -2.9400000E-02
 C   -3.240500      -2.208900     -8.5199997E-02
 C   -4.103100      -1.129900     -0.2367000    
 C    4.428200      -1.345600       1.506900    
 C    2.950600      -1.381100      -2.445700    
 H   0.5177000     -0.1261000      -1.144800    
 H    1.262200       2.315900     -0.8380000    
 H   0.8567000       2.197500      0.8706000    
 H   2.6799999E-02  3.0000000E-03   1.857100    
 H   0.4642000      -1.493100       1.048300    
 H   -1.039400       1.938400      -1.476000    
 H  -0.7513000       3.355200     -0.4753000    
 H   -2.676500       2.520800      0.4594000    
 H   -1.474000       1.935900       1.573800    
 H    2.556800       1.522300       1.541000    
 H    2.109100     -6.5300003E-02   2.173700    
 H    3.070800       1.753100     -0.9562000    
 H    4.126600      0.3953000     -0.8617000    
 H    4.374200      0.4454000       2.656600    
 H    4.820400      0.7305000       1.002400    
 H    3.379000      0.6015000      -3.086000    
 H    1.702900      0.3803000      -2.689500    
 H   -1.253600      -2.848800      0.3880000    
 H   -3.600300      -3.220900     -0.2457000    
 H   -5.136800      -1.313700     -0.5171000    
 H    3.766800      -1.930800       2.154300    
 H    4.316600      -1.708200      0.4812000    
 H    5.459200      -1.549800       1.814300    
 H    3.975600      -1.639700      -2.160800    
 H    2.261000      -1.944900      -1.810400    
 H    2.798000      -1.721600      -3.475300    
 H   -5.390400      0.8318000     -0.4434000    


%chk=000133144-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133144

0 1
O -4.621791 1.067897 -0.014099
N 2.302298 0.349717 -0.112424
C 0.831880 0.631589 -0.134842
C 0.483489 2.126623 0.132240
C 0.078892 -0.334708 0.835002
C -0.992340 2.517403 -0.118249
C -2.021294 1.810268 0.810537
C -1.351069 -0.642707 0.414715
C -2.342729 0.379937 0.404293
C 3.007152 0.748553 1.134680
C 3.005435 0.764698 -1.353958
C 4.207650 -0.168398 1.475906
C 2.798049 -0.205519 -2.542495
C -1.689318 -1.962235 0.018560
C -3.655303 0.034579 -0.013257
C -3.001119 -2.281181 -0.392788
C -3.994348 -1.280208 -0.411042
C 3.784905 -1.606065 1.840487
C 3.405385 -1.601936 -2.298177
H 0.494690 0.381704 -1.160302
H 1.129021 2.762756 -0.507635
H 0.740307 2.373073 1.183783
H 0.087500 0.096130 1.858051
H 0.661891 -1.271953 0.869946
H -1.263201 2.320799 -1.174800
H -1.087133 3.611621 0.032364
H -2.957163 2.392265 0.819653
H -1.622254 1.824805 1.846779
H 3.360890 1.808584 1.090440
H 2.286718 0.693305 1.972664
H 2.710935 1.796648 -1.671102
H 4.088458 0.808843 -1.130657
H 4.763216 0.289273 2.320043
H 4.909200 -0.194075 0.618477
H 3.252781 0.253396 -3.444356
H 1.715958 -0.305610 -2.758314
H -0.916991 -2.739192 0.033743
H -3.252293 -3.302990 -0.697378
H -5.018171 -1.517859 -0.729766
H 3.167994 -1.617841 2.759554
H 3.184298 -2.040817 1.022080
H 4.662993 -2.255347 2.012782
H 4.503317 -1.540741 -2.169697
H 2.981721 -2.042509 -1.378681
H 3.199626 -2.285555 -3.142344
H -5.497732 0.716879 -0.309917


