%chk=000154431.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154431

0 1
 O    5.297700       1.376100     -2.5500000E-02
 O    3.535100       2.683400      3.3700000E-02
 N    4.057800       1.546400     -1.3000000E-03
 C  -0.4007000     -0.5668000      1.8500000E-02
 C   -1.041000      0.7001000      4.9300000E-02
 C   -2.464500      0.7549000      5.7100002E-02
 C    1.018100     -0.6630000     -4.8000002E-03
 C   -1.168600      -1.754300      1.8800000E-02
 C   -3.214700       2.073800      0.1300000    
 C   -3.214700     -0.4398000      8.1799999E-02
 C    1.809500      0.5067000      1.0800000E-02
 C    1.650200      -1.929500     -4.0600002E-02
 C   -2.564400      -1.676700      6.0400002E-02
 C   -4.655100       2.013000     -0.3941000    
 C  -0.2147000       1.843700      7.8299999E-02
 C    1.178900       1.751000      5.6200001E-02
 C  -0.5261000      -2.999100     -1.4700000E-02
 C   -4.680300     -0.4086000      0.1477000    
 C   0.8647000      -3.086400     -4.6900000E-02
 C    3.208100      0.4011000     -1.4500000E-02
 C   -5.349300      0.7274000     -7.9700001E-02
 C    3.050400      -2.005900     -6.6399999E-02
 C    3.823500     -0.8476000     -5.4000001E-02
 H   -3.223600       2.392600       1.180300    
 H   -2.701400       2.849400     -0.4481000    
 H   -3.153100      -2.593700      7.3899999E-02
 H   -4.661000       2.144700      -1.483500    
 H   -5.220600       2.852100      2.7500000E-02
 H  -0.6449000       2.841700      0.1245000    
 H    1.600100       2.739800      8.6700000E-02
 H   -1.104700      -3.921000     -1.5600000E-02
 H   -5.215300      -1.329900      0.3522000    
 H    1.326600      -4.071100     -7.3100001E-02
 H   -6.434900      0.7215000     -6.5700002E-02
 H    3.551900      -2.971100     -9.4899997E-02
 H    4.903600     -0.9693000     -7.4800000E-02


%chk=000154431-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000154431

0 1
O 5.478045 1.285765 -0.066683
O 3.765412 2.772200 -0.006379
N 4.208895 1.553710 -0.035869
C -0.406201 -0.571471 0.030536
C -1.085742 0.704221 0.067877
C -2.513310 0.762127 0.099937
C 1.032850 -0.643283 -0.003764
C -1.186804 -1.784855 0.039404
C -3.286273 2.072221 0.222163
C -3.268260 -0.452704 0.107286
C 1.832364 0.570267 0.002868
C 1.669649 -1.940874 -0.041870
C -2.600036 -1.697455 0.084273
C -4.680123 2.026584 -0.452028
C -0.257583 1.886294 0.083533
C 1.125401 1.832807 0.052208
C -0.516539 -3.062078 0.004536
C -4.741080 -0.402941 0.139204
C 0.863472 -3.136585 -0.038085
C 3.261009 0.416276 -0.036225
C -5.424111 0.747825 -0.119546
C 3.089638 -2.021287 -0.079825
C 3.871055 -0.864205 -0.077962
H -3.423995 2.285394 1.304390
H -2.714243 2.919842 -0.191221
H -3.190632 -2.622229 0.093060
H -4.570327 2.100082 -1.555825
H -5.266586 2.911464 -0.142615
H -0.731638 2.871224 0.124491
H 1.708259 2.752053 0.062926
H -1.124999 -3.973787 0.010267
H -5.277149 -1.339968 0.334664
H 1.371121 -4.106945 -0.067920
H -6.520579 0.753454 -0.141945
H 3.570003 -3.005064 -0.109866
H 4.961635 -0.912476 -0.106498


