%chk=000074301.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074301

0 1
 O   3.3000000E-03 -0.5345000     -1.5000000E-03
 N   -6.178500      0.9459000      3.3399999E-02
 N    6.176300      0.9472000     -3.2699998E-02
 N  -0.6868000      -2.662600      3.7000000E-03
 N   0.6956000      -2.661900     -3.1000001E-03
 C   -4.895900      0.3592000      2.6200000E-02
 C    4.894200      0.3595000     -2.6100000E-02
 C   -6.333600       2.368400      0.2651000    
 C   -7.359200      0.1320000     -0.1768000    
 C    6.330400       2.369600     -0.2653000    
 C    7.357400      0.1343000      0.1791000    
 C   -3.792100       1.101500     -0.3932000    
 C    3.789500       1.101200      0.3920000    
 C   -4.731300     -0.9631000      0.4385000    
 C    4.730900     -0.9632000     -0.4375000    
 C   -2.351200     -0.8045000      1.2000000E-02
 C    2.358100     -0.8025000     -1.2900000E-02
 C   -2.523500      0.5215000     -0.4004000    
 C    2.521300      0.5202000      0.3987000    
 C   -3.462800      -1.543200      0.4314000    
 C    3.462800      -1.544300     -0.4310000    
 C   -5.791300       2.737000       1.632700    
 C   -7.302700     -0.5273000      -1.541400    
 C    5.789100       2.736700      -1.633600    
 C    7.300400     -0.5241000       1.544200    
 C   -1.046900      -1.400300      4.6999999E-03
 C    1.046500      -1.402900     -6.0999999E-03
 H   -5.854100       2.961200     -0.5215000    
 H   -7.392100       2.653800      0.2342000    
 H   -7.484000     -0.6130000      0.6166000    
 H   -8.266500      0.7471000     -0.1383000    
 H    5.849800       2.962600      0.5205000    
 H    7.388700       2.655800     -0.2336000    
 H    7.483400     -0.6112000     -0.6137000    
 H    8.264300      0.7499000      0.1407000    
 H   -3.878500       2.126000     -0.7412000    
 H    3.874900       2.126000      0.7393000    
 H   -5.559200      -1.570200      0.7909000    
 H    5.559500      -1.570000     -0.7888000    
 H   -1.685600       1.124000     -0.7436000    
 H    1.682400       1.121400      0.7409000    
 H   -3.356200      -2.573800      0.7625000    
 H    3.355800      -2.574900     -0.7611000    
 H   -6.257700       2.131800       2.417900    
 H   -4.708100       2.610100       1.711100    
 H   -6.009100       3.788500       1.847800    
 H   -7.159500      0.2165000      -2.333000    
 H   -6.500800      -1.265800      -1.627200    
 H   -8.244400      -1.049800      -1.740700    
 H    6.256700       2.131400      -2.418000    
 H    4.705900       2.608900      -1.712800    
 H    6.006300       3.788300      -1.849200    
 H    7.156200      0.2202000       2.335100    
 H    6.499000      -1.263100       1.629900    
 H    8.242300      -1.045800       1.744500    


%chk=000074301-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000074301

0 1
O -0.000461 -0.365755 0.000450
N -6.458861 0.813420 0.042585
N 6.457619 0.815136 -0.042639
N -0.717748 -2.537260 0.007680
N 0.717359 -2.537089 -0.004055
C -5.152585 0.315335 0.035755
C 5.151479 0.316684 -0.035333
C -6.737462 2.259508 -0.069043
C -7.630123 -0.079425 0.157983
C 6.735849 2.261335 0.068396
C 7.629105 -0.077415 -0.158009
C -4.016513 1.191740 0.031146
C 4.015162 1.192766 -0.030843
C -4.888004 -1.096480 0.032771
C 4.887301 -1.095201 -0.031720
C -2.458846 -0.712274 0.019370
C 2.458026 -0.711686 -0.017941
C -2.708036 0.687081 0.019228
C 2.706830 0.687742 -0.018435
C -3.578238 -1.591252 0.028394
C 3.577676 -1.590341 -0.026852
C -6.717472 3.002259 1.288189
C -8.122165 -0.637349 -1.198574
C 6.715427 3.003585 -1.289103
C 8.121629 -0.634763 1.198612
C -1.114015 -1.254414 0.009958
C 1.113361 -1.254203 -0.007928
H -6.016808 2.721885 -0.768848
H -7.733781 2.375171 -0.536052
H -7.396302 -0.908973 0.850468
H -8.445712 0.495769 0.635654
H 6.015201 2.723781 0.768158
H 7.732220 2.377444 0.535183
H 7.395361 -0.907258 -0.850167
H 8.444425 0.497847 -0.636060
H -4.154016 2.276158 0.051356
H 4.152347 2.277216 -0.051513
H -5.712396 -1.814440 0.019226
H 5.711897 -1.812923 -0.018073
H -1.861762 1.381910 0.018099
H 1.860363 1.382335 -0.017409
H -3.398358 -2.671395 0.023318
H 3.398109 -2.670535 -0.021292
H -7.470157 2.579079 1.977757
H -5.730055 2.917185 1.774141
H -6.945299 4.075291 1.147020
H -8.411063 0.183363 -1.879988
H -7.332862 -1.226863 -1.696013
H -9.003782 -1.288944 -1.052589
H 7.468084 2.580331 -1.978657
H 5.727940 2.918115 -1.774847
H 6.943035 4.076719 -1.148362
H 8.410468 0.186245 1.879695
H 7.332615 -1.224339 1.696435
H 9.003393 -1.286157 1.052617


