%chk=000021501.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021501

0 1
 O    3.465200     -0.6736000       0.000000    
 O    2.975800       1.466400     -1.9999999E-04
 N   -2.805400     -0.6867000       0.000000    
 N   -3.349700      0.5415000     -9.9999997E-05
 N    2.628800      0.2611000      9.9999997E-05
 C   -1.063600      0.6456000      9.9999997E-05
 C   -1.436600     -0.6938000       0.000000    
 C   0.3009000      0.9801000      1.9999999E-04
 C    1.243500     -5.5700000E-02   0.000000    
 C  -0.5131000      -1.741500     -9.9999997E-05
 C   0.8414000      -1.392600       0.000000    
 C   -2.287000       1.349400       0.000000    
 H   0.5868000       2.027600      1.9999999E-04
 H  -0.8278000      -2.779100     -1.9999999E-04
 H    1.564300      -2.205800     -9.9999997E-05
 H   -2.446700       2.418400     -9.9999997E-05
 H   -3.427800      -1.485200     -9.9999997E-05


%chk=000021501-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021501

0 1
O 3.510379 -0.708872 -0.000524
O 3.012349 1.518224 -0.000583
N -2.848548 -0.723270 -0.000188
N -3.385413 0.569587 -0.000162
N 2.666677 0.271955 0.000463
C -1.073225 0.659848 0.000073
C -1.463907 -0.729775 -0.000062
C 0.296949 1.004890 0.000225
C 1.222476 -0.053053 0.000272
C -0.514597 -1.783184 -0.000041
C 0.840151 -1.429938 0.000119
C -2.313127 1.399238 -0.000002
H 0.650158 2.039301 0.000331
H -0.817586 -2.834366 -0.000139
H 1.626929 -2.188474 0.000160
H -2.469498 2.476156 0.000058
H -3.491166 -1.512166 -0.000300


