%chk=000125125.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125125

0 1
 O    4.004600       1.359200       1.407200    
 O    2.165700      -1.609000      -1.619200    
 N    2.932000      0.1602000     -0.2917000    
 C  -6.5300003E-02  0.6768000     -0.6261000    
 C   -1.427800       1.190000     -0.1549000    
 C    1.046000       1.729400     -0.5388000    
 C   -2.499200      0.1029000     -0.2706000    
 C    2.409200       1.266900      -1.044500    
 C   -3.869700      0.6228000      0.1696000    
 C   -4.932100     -0.4751000      8.3700001E-02
 C    4.054100      -1.049500       1.371600    
 C    3.451700      -2.024600      0.3741000    
 C    3.680100      0.3127000      0.8631000    
 C    2.762400      -1.166600     -0.6473000    
 C   -6.328700     -7.9999998E-04  0.4912000    
 C   -7.382900      -1.095400      0.4327000    
 H   0.2039000     -0.1927000     -1.5699999E-02
 H  -0.1477000      0.3290000      -1.663200    
 H   -1.718200       2.059400     -0.7569000    
 H   -1.353400       1.526700      0.8860000    
 H   0.7446000       2.610800      -1.118100    
 H    1.138700       2.057100      0.5044000    
 H   -2.557000     -0.2487000      -1.307900    
 H   -2.215600     -0.7576000      0.3475000    
 H    3.116100       2.101600     -0.9762000    
 H    2.330400      0.9761000      -2.098200    
 H   -3.811200      0.9943000       1.199700    
 H   -4.163800       1.468500     -0.4637000    
 H   -4.636900      -1.313800      0.7264000    
 H   -4.972100     -0.8619000     -0.9422000    
 H    3.639500      -1.196200       2.373300    
 H    5.143300      -1.142700       1.412800    
 H    4.225000      -2.627200     -0.1112000    
 H    2.723600      -2.686100      0.8525000    
 H   -6.637000      0.8237000     -0.1627000    
 H   -6.292400      0.3996000       1.511300    
 H   -8.358500     -0.7006000      0.7329000    
 H   -7.126700      -1.920100       1.105200    
 H   -7.473900      -1.495300     -0.5822000    


%chk=000125125-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125125

0 1
O 3.730590 1.439169 1.541888
O 2.584757 -1.598461 -1.839728
N 3.006592 0.144756 -0.296632
C -0.054175 0.632623 -0.678938
C -1.431281 1.145267 -0.200913
C 1.047832 1.708890 -0.570146
C -2.546066 0.079454 -0.295366
C 2.433106 1.254764 -1.084920
C -3.922577 0.593232 0.183903
C -5.041363 -0.468442 0.089154
C 4.090794 -1.038907 1.468820
C 3.705080 -2.041433 0.355282
C 3.613345 0.329852 0.967828
C 3.033220 -1.201086 -0.738309
C -6.417121 0.049077 0.568166
C -7.530819 -1.015834 0.469937
H 0.229310 -0.257217 -0.080321
H -0.129748 0.284313 -1.729062
H -1.721601 2.032128 -0.802721
H -1.348542 1.497136 0.848970
H 0.753822 2.597101 -1.165373
H 1.147438 2.051829 0.477630
H -2.630106 -0.271124 -1.345249
H -2.256855 -0.808570 0.305010
H 3.146024 2.097456 -1.035903
H 2.364117 0.894581 -2.127299
H -3.837772 0.942470 1.234580
H -4.210411 1.482373 -0.415713
H -4.756447 -1.358173 0.689266
H -5.128315 -0.818180 -0.961056
H 3.608371 -1.254764 2.437480
H 5.177463 -0.991567 1.654246
H 4.572801 -2.565978 -0.079627
H 2.997379 -2.817439 0.694058
H -6.699543 0.938339 -0.031906
H -6.329283 0.398265 1.617458
H -8.503435 -0.619739 0.815897
H -7.287669 -1.901468 1.087218
H -7.658109 -1.360896 -0.573708


