%chk=000032257.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032257

0 1
 O    1.175200      -3.332600       2.026600    
 N   0.4203000      -2.430400     -3.5999999E-03
 N  -0.6128000      -2.506400     -0.9196000    
 C    3.227000     -0.1795000      0.6805000    
 C    4.097900      0.5220000       1.701600    
 C    3.641800      0.1459000     -0.6306000    
 C   -2.921500      8.1100002E-02  0.3081000    
 C   -3.235400       1.142000       1.342200    
 C    5.058500       1.286600      0.8149000    
 C   -3.954200      6.5000001E-03 -0.6533000    
 C    4.769700       1.048800     -0.5477000    
 C   -4.571200       1.662700      0.8546000    
 C   -4.970300      0.9804000     -0.3168000    
 C    2.161200      -1.031500      0.9111000    
 C    1.531800      -1.541000     -0.2014000    
 C   -1.809300     -0.7396000      0.2398000    
 C   -1.733000      -1.652100     -0.8139000    
 C    2.985400     -0.3850000      -1.728200    
 C   -3.878300     -0.8990000      -1.698400    
 C    1.907700      -1.246700      -1.502100    
 C    6.095700       2.117700       1.199900    
 C    5.525100       1.648000      -1.541800    
 C   -2.757100      -1.731000      -1.773200    
 C   -5.353300       2.658100       1.413400    
 C   -6.166100       1.294200     -0.9407000    
 C    6.857100       2.721400      0.1975000    
 C    6.574800       2.489000      -1.159500    
 C   -6.558700       2.974200      0.7842000    
 C   -6.961100       2.299100     -0.3811000    
 C   0.3387000      -3.256000       1.124800    
 C  -0.8855000      -4.146800       1.212800    
 H    4.634400     -0.2051000       2.318000    
 H    3.503500       1.208600       2.311400    
 H   -2.481200       1.934100       1.325800    
 H   -3.332500      0.6969000       2.336700    
 H    1.845200      -1.190300       1.933100    
 H   -1.046400     -0.6460000       1.004100    
 H    3.290100     -0.1491000      -2.742300    
 H   -4.660600     -0.9715000      -2.446500    
 H    1.398100      -1.672500      -2.361800    
 H    6.314800       2.297900       2.246400    
 H    5.319400       1.478100      -2.593300    
 H   -2.686300      -2.446100      -2.590000    
 H   -5.044100       3.179900       2.312200    
 H   -6.490100      0.7821000      -1.840600    
 H  -0.5336000      -3.173800      -1.675700    
 H    7.678700       3.379500      0.4680000    
 H    7.181900       2.970600      -1.921700    
 H   -7.195000       3.751500       1.198900    
 H   -7.904000       2.563100     -0.8528000    
 H  -0.7617000      -4.846400       2.045800    
 H   -1.007200      -4.736100      0.3001000    
 H   -1.779300      -3.548500       1.404300    


%chk=000032257-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000032257

0 1
O 1.060029 -3.160045 2.484092
N 0.418534 -2.346380 0.371563
N -0.568962 -2.444044 -0.622099
C 3.682133 -0.463351 0.689987
C 4.987967 -0.228328 1.441563
C 3.612406 0.400299 -0.443038
C -3.134028 0.096387 0.345556
C -3.636580 1.141204 1.335524
C 5.664290 0.862082 0.617198
C -4.039960 -0.005956 -0.753634
C 4.835783 1.221000 -0.491576
C -4.931279 1.627740 0.691602
C -5.151473 0.938557 -0.541836
C 2.653944 -1.366630 0.995868
C 1.512254 -1.416349 0.143046
C -1.973580 -0.688605 0.412791
C -1.705653 -1.601610 -0.644698
C 2.478859 0.350823 -1.281432
C -3.767096 -0.914239 -1.801152
C 1.437093 -0.552921 -0.988349
C 6.903793 1.494078 0.815620
C 5.251659 2.216945 -1.403652
C -2.605201 -1.710125 -1.744743
C -5.844124 2.595369 1.143169
C -6.293372 1.222845 -1.324325
C 7.320490 2.493723 -0.100089
C 6.499754 2.850427 -1.199475
C -6.990278 2.880038 0.357137
C -7.210083 2.197930 -0.865507
C 0.253953 -3.183808 1.511827
C -0.957312 -4.107658 1.491347
H 5.602932 -1.147925 1.497660
H 4.807944 0.092601 2.486331
H -2.906763 1.963621 1.470215
H -3.810579 0.707609 2.339934
H 2.705013 -2.014414 1.870707
H -1.273282 -0.595497 1.249003
H 2.391413 1.005903 -2.155119
H -4.446405 -1.010134 -2.655437
H 0.555815 -0.573844 -1.633694
H 7.543290 1.223371 1.663919
H 4.623027 2.498327 -2.256287
H -2.390367 -2.423328 -2.550512
H -5.678727 3.126571 2.087864
H -6.472234 0.701057 -2.271521
H -0.304610 -2.953025 -1.468106
H 8.284270 2.995524 0.041980
H 6.837403 3.625187 -1.897165
H -7.711383 3.632204 0.696207
H -8.100621 2.429516 -1.460940
H -0.931959 -4.698742 2.418970
H -0.940292 -4.786052 0.620759
H -1.903647 -3.540927 1.443143


