%chk=000125074.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125074

0 1
 O    1.028000     -0.2044000      0.4580000    
 N   -3.428900      -1.419000     -0.5633000    
 N    2.158800      -2.149900      0.2325000    
 C    4.100000      0.5610000     -0.3269000    
 C    3.386100     -6.2700003E-02  0.8934000    
 C   -1.303700     -0.9717000     -0.1045000    
 C   -2.050000      0.2329000      2.5800001E-02
 C    5.342400       1.360400      6.6000000E-02
 C   0.1385000      -1.171500      9.7599998E-02
 C   -3.380100     -7.5300001E-02 -0.2675000    
 C    2.214500     -0.8687000      0.5179000    
 C   -2.178900      -1.969300     -0.4674000    
 C   -1.720500       1.559900      0.3659000    
 C   0.8294000      -2.350300     -3.8300000E-02
 C   -4.401300      0.8811000     -0.2374000    
 C    6.048100       1.929500      -1.154600    
 C   -2.731600       2.527200      0.4001000    
 C   -4.050800       2.190700      0.1027000    
 H    3.398200       1.211500     -0.8646000    
 H    4.384300     -0.2371000      -1.024800    
 H    3.084700      0.7340000       1.584200    
 H    4.094800     -0.6976000       1.438800    
 H    5.058800       2.180200      0.7360000    
 H    6.038700      0.7173000      0.6163000    
 H   -2.037000      -3.022400     -0.6688000    
 H   -4.266700      -1.925100     -0.8149000    
 H  -0.6995000       1.845200      0.6013000    
 H   0.4601000      -3.328100     -0.3119000    
 H   -5.428500      0.6200000     -0.4688000    
 H    5.387300       2.600900      -1.712000    
 H    6.373700       1.130100      -1.827800    
 H    6.932200       2.498400     -0.8501000    
 H   -2.483300       3.552400      0.6618000    
 H   -4.820200       2.957900      0.1353000    


%chk=000125074-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000125074

0 1
O 1.039172 -0.511361 0.437947
N -3.517418 -1.349801 -0.490133
N 2.174868 -2.496957 0.456960
C 3.886349 0.598172 -0.272767
C 3.487968 -0.344353 0.897251
C -1.281362 -1.170797 -0.058449
C -1.865687 0.166865 -0.037053
C 5.120827 1.460657 0.071376
C 0.099206 -1.545235 0.161128
C -3.270518 0.018845 -0.311195
C 2.287292 -1.182416 0.607085
C -2.327277 -2.062529 -0.339260
C -1.344935 1.469442 0.185266
C 0.810510 -2.740421 0.178765
C -4.156119 1.116964 -0.367910
C 5.529706 2.400507 -1.082900
C -2.222881 2.569208 0.129858
C -3.612385 2.397297 -0.143294
H 3.029757 1.254408 -0.522712
H 4.095001 -0.010839 -1.174318
H 3.306954 0.265516 1.804759
H 4.317892 -1.036584 1.123777
H 4.905820 2.059715 0.980052
H 5.970984 0.796678 0.329110
H -2.302907 -3.145845 -0.439991
H -4.424062 -1.762318 -0.698006
H -0.281359 1.606442 0.395839
H 0.448305 -3.751369 0.013741
H -5.223523 0.985718 -0.577619
H 4.705780 3.091802 -1.342125
H 5.782582 1.824718 -1.992899
H 6.411085 3.011068 -0.813690
H -1.834573 3.579467 0.300145
H -4.267451 3.274838 -0.178740


