%chk=000178230.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178230

0 1
 O    1.143200      -1.165900     -0.6370000    
 N    2.840600      -1.873500      0.7419000    
 N    4.674200     -0.3996000       1.257100    
 N    4.782200       1.745500      0.3920000    
 C   -4.716300       1.177700      0.5167000    
 C   -3.680800      0.2002000      7.4199997E-02
 C   -4.544500       1.540500       2.024500    
 C   -6.154500      0.6011000      0.3327000    
 C   -4.716600       2.545900     -0.2429000    
 C   -3.595600      -1.050400      0.6860000    
 C   -2.797500      0.5363000     -0.9517000    
 C   -1.756600      -1.616900     -0.7484000    
 C   -2.627200      -1.965000      0.2721000    
 C   -1.829100     -0.3783000      -1.365800    
 C  -0.7082000      -2.606300      -1.196000    
 C   0.5956000      -2.460600     -0.4191000    
 C    2.329300     -0.8848000     -1.0400000E-02
 C    2.936400      0.3586000     -0.1683000    
 C    4.146700      0.5709000      0.5023000    
 C    2.388800       1.380300     -0.9580000    
 C    3.051600       2.590100      -1.066300    
 C    4.000500      -1.566200       1.339600    
 C    4.237700       2.720400     -0.3753000    
 H   -5.287500       2.280600       2.343800    
 H   -4.662200      0.6646000       2.672000    
 H   -3.549100       1.959700       2.212900    
 H   -6.314600     -0.2993000      0.9359000    
 H   -6.917400       1.329500      0.6309000    
 H   -6.335500      0.3337000     -0.7151000    
 H   -5.503500       3.208600      0.1375000    
 H   -3.764500       3.074900     -0.1180000    
 H   -4.902800       2.410300      -1.314700    
 H   -4.270100      -1.338000       1.487500    
 H   -2.819000       1.493300      -1.461000    
 H   -2.566900      -2.935700      0.7557000    
 H   -1.146000     -0.1068000      -2.165600    
 H  -0.5182000      -2.460600      -2.267400    
 H   -1.092800      -3.628100      -1.088800    
 H    1.296500      -3.226700     -0.7737000    
 H   0.4049000      -2.612900      0.6512000    
 H    1.450700       1.244000      -1.489700    
 H    2.655500       3.399300      -1.667800    
 H    4.447400      -2.336400       1.956400    
 H    4.807500       3.642900     -0.4172000    


%chk=000178230-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178230

0 1
O 1.228196 -1.251210 -0.688347
N 2.909496 -1.937946 0.820011
N 4.741290 -0.422562 1.418003
N 4.850998 1.764674 0.514331
C -4.809639 1.257029 0.557426
C -3.736625 0.274770 0.030106
C -4.472053 1.648920 2.028073
C -6.206923 0.566694 0.517387
C -4.886246 2.555874 -0.285735
C -3.529400 -0.970789 0.685619
C -2.929137 0.550584 -1.101923
C -1.752605 -1.603987 -0.895914
C -2.562269 -1.890096 0.233454
C -1.956341 -0.370410 -1.555582
C -0.687294 -2.588203 -1.359841
C 0.579501 -2.582531 -0.492558
C 2.376508 -0.998716 0.020819
C 2.965680 0.310590 -0.144049
C 4.185746 0.555011 0.592334
C 2.423511 1.343084 -0.962475
C 3.104822 2.562211 -1.029196
C 4.077990 -1.587040 1.483179
C 4.311643 2.717619 -0.275895
H -5.241151 2.337190 2.426534
H -4.434204 0.764373 2.688818
H -3.490749 2.154719 2.084841
H -6.228035 -0.349815 1.133826
H -6.983422 1.253527 0.903820
H -6.476895 0.284796 -0.516847
H -5.662445 3.222954 0.131902
H -3.928601 3.108592 -0.274227
H -5.156157 2.346543 -1.337499
H -4.135317 -1.232721 1.561159
H -3.053345 1.492214 -1.645156
H -2.438488 -2.844690 0.761754
H -1.346899 -0.124587 -2.434174
H -0.398518 -2.382317 -2.406810
H -1.084897 -3.622194 -1.331689
H 1.297463 -3.365442 -0.796015
H 0.357080 -2.706961 0.581915
H 1.493806 1.163168 -1.510331
H 2.735472 3.391539 -1.639791
H 4.497866 -2.362550 2.131195
H 4.862887 3.664994 -0.317754


