%chk=000026692.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026692

0 1
 O   -1.231400      -2.449100      -1.491500    
 N   -3.011200      5.0999999E-02  0.5852000    
 C  -0.2851000      -1.143800      0.2618000    
 C   0.7779000      -2.216300      0.5169000    
 C   0.2646000     -9.0099998E-02 -0.7113000    
 C   -1.568000      -1.765300     -0.2861000    
 C    2.009800      -1.602700       1.180800    
 C    1.648300      0.3935000     -0.3528000    
 C    2.484900     -0.3405000      0.5072000    
 C   -2.650200     -0.7288000     -0.5907000    
 C    2.129400       1.574300     -0.9390000    
 C    3.772100      0.1404000      0.7922000    
 C   -4.035100       1.035600      0.2632000    
 C    3.414400       2.036100     -0.6558000    
 C    4.234500       1.320700      0.2113000    
 C   -3.532100       1.987800     -0.8182000    
 C   -4.422600       1.797100       1.526800    
 H  -0.5034000     -0.6564000       1.222100    
 H    1.088400      -2.685000     -0.4257000    
 H   0.3811000      -3.012800       1.157400    
 H  -0.3997000      0.7818000     -0.7212000    
 H   0.3135000     -0.4852000      -1.733500    
 H   -1.964600      -2.505200      0.4206000    
 H    2.814200      -2.348100       1.185800    
 H    1.775600      -1.362600       2.225600    
 H   -3.532100      -1.263200     -0.9696000    
 H   -2.304600     -0.1173000      -1.429200    
 H   -3.343200     -0.5708000       1.321700    
 H    1.501600       2.141900      -1.621800    
 H    4.422500     -0.4059000       1.471100    
 H   -4.937300      0.5293000     -0.1038000    
 H  -0.8465000      -3.308200      -1.249300    
 H    3.774400       2.953400      -1.112200    
 H    5.234000       1.681100      0.4360000    
 H   -4.199800       2.853700     -0.9008000    
 H   -2.531900       2.373500     -0.5899000    
 H   -3.514300       1.526300      -1.810300    
 H   -4.801400       1.116300       2.297300    
 H   -5.212200       2.526000       1.313900    
 H   -3.568000       2.340700       1.945600    


%chk=000026692-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026692

0 1
O -1.349105 -2.560927 -1.545082
N -3.063439 0.046280 0.482944
C -0.279002 -1.114840 0.218359
C 0.786909 -2.169419 0.603029
C 0.317441 -0.097681 -0.779659
C -1.574811 -1.781853 -0.308714
C 1.973355 -1.498770 1.324833
C 1.731386 0.361957 -0.428085
C 2.523713 -0.305644 0.548245
C -2.698259 -0.795440 -0.677859
C 2.280939 1.480908 -1.106420
C 3.837757 0.158969 0.811589
C -4.119075 1.068500 0.235434
C 3.586942 1.939615 -0.836637
C 4.374066 1.272057 0.131488
C -3.578033 2.210848 -0.652059
C -4.600987 1.613191 1.595370
H -0.571130 -0.568193 1.138821
H 1.166685 -2.677087 -0.309673
H 0.340301 -2.946255 1.256875
H -0.344023 0.787667 -0.838643
H 0.321549 -0.555846 -1.791040
H -1.945603 -2.468115 0.491887
H 2.782613 -2.232563 1.504860
H 1.635622 -1.158060 2.326294
H -3.554214 -1.387496 -1.082492
H -2.342049 -0.150789 -1.500003
H -3.327136 -0.543538 1.287236
H 1.669082 1.996772 -1.857808
H 4.445915 -0.363868 1.561345
H -4.998098 0.612442 -0.289698
H -0.668230 -3.256347 -1.362466
H 3.988348 2.806143 -1.374255
H 5.392012 1.614327 0.349738
H -4.357776 2.979169 -0.806999
H -2.704750 2.682409 -0.165759
H -3.266572 1.848090 -1.648033
H -5.025464 0.807218 2.225324
H -5.384563 2.378821 1.455837
H -3.755818 2.070549 2.141677


