%chk=000038863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038863

0 1
 O    2.990200       1.174100     -0.6602000    
 O    2.258000       3.715300     -0.3821000    
 O    3.445000     -0.7845000      0.6161000    
 O    4.006600      -3.363600      0.2422000    
 N   -3.035800      0.1153000      8.9800000E-02
 C   -1.649800     -0.3650000      0.3287000    
 C  -0.5945000      0.7257000      0.1154000    
 C   -1.305600      -1.573100     -0.5718000    
 C   -3.274800       1.352300      0.8504000    
 C  -0.9647000       2.084200      0.1575000    
 C   -2.407200       2.481600      0.3025000    
 C   0.7635000      0.3561000     -5.9799999E-02
 C   -4.042400     -0.8815000      0.4705000    
 C   0.1190000      -2.033400     -0.3578000    
 C    1.128100      -1.078600     -0.1070000    
 C   -5.472100     -0.4377000      0.1161000    
 C    1.712200       1.382700     -0.2166000    
 C   6.6999998E-03   3.076600     -4.1999999E-03
 C    1.338700       2.726800     -0.1871000    
 C    2.438900      -1.549000      8.9599997E-02
 C   0.4311000      -3.398500     -0.4510000    
 C   -5.569100     -0.1593000      -1.386300    
 C   -6.525100      -1.474200      0.5162000    
 C    2.740300      -2.911800      1.2500000E-02
 C    1.738600      -3.835100     -0.2634000    
 C    3.202300       1.251100      -2.065500    
 C    2.920500       4.219300      0.7750000    
 C    3.601500     -0.8158000       2.030300    
 H   -1.557300     -0.6718000       1.382200    
 H   -1.430300      -1.318400      -1.632800    
 H   -1.964800      -2.418700     -0.3533000    
 H   -3.069600       1.197700       1.918700    
 H   -4.297400       1.725500      0.7729000    
 H   -2.488700       3.345900      0.9728000    
 H   -2.779100       2.787500     -0.6839000    
 H   -3.982400      -1.102600       1.544600    
 H   -3.874300      -1.827100     -5.3599998E-02
 H   -5.758800      0.4675000      0.6582000    
 H  -0.2811000       4.125400      8.9999998E-04
 H  -0.3462000      -4.127900     -0.6636000    
 H   -5.283900      -1.038600      -1.974400    
 H   -6.595300      0.1067000      -1.663000    
 H   -4.930300      0.6765000      -1.688600    
 H   -6.362500      -2.424900     -2.9000000E-03
 H   -7.533700      -1.123100      0.2734000    
 H   -6.486400      -1.666300       1.593700    
 H    1.966500      -4.895600     -0.3234000    
 H    2.478800      0.6332000      -2.607600    
 H    4.205700      0.8715000      -2.278400    
 H    3.146000       2.285900      -2.415600    
 H    4.601600      -2.597100      0.3085000    
 H    2.198300       4.665200       1.466400    
 H    3.624800       4.993100      0.4574000    
 H    3.478700       3.422500       1.276800    
 H    3.903200      -1.806700       2.382300    
 H    2.674800     -0.5117000       2.528200    
 H    4.385400     -0.1027000       2.300500    


%chk=000038863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038863

0 1
O 3.022322 1.111365 -0.557711
O 2.252520 3.867684 -0.381254
O 3.339947 -1.174760 1.062273
O 3.751255 -3.596457 0.209328
N -3.056566 0.186823 0.359697
C -1.653613 -0.304176 0.362077
C -0.621398 0.823607 0.295830
C -1.349992 -1.213581 -0.861341
C -3.227827 1.410952 1.179260
C -0.990467 2.188201 0.334353
C -2.442958 2.573066 0.556329
C 0.740228 0.436959 0.068042
C -4.040635 -0.865005 0.731679
C 0.030760 -1.824593 -0.686433
C 1.055402 -1.015487 -0.077845
C -5.425069 -0.676239 0.057563
C 1.697762 1.456615 -0.189611
C -0.001299 3.185244 0.161564
C 1.331818 2.830167 -0.105374
C 2.271088 -1.660871 0.278300
C 0.292679 -3.158607 -1.051882
C -5.318719 -0.847987 -1.473673
C -6.451323 -1.657514 0.670221
C 2.527788 -3.007891 -0.127102
C 1.554613 -3.749996 -0.811734
C 3.290692 1.272972 -2.005191
C 3.448219 3.914734 0.488974
C 3.082153 -0.228218 2.152854
H -1.450982 -0.911053 1.285970
H -1.425866 -0.587908 -1.773652
H -2.100583 -2.017719 -0.956581
H -2.890259 1.247623 2.235686
H -4.303161 1.660020 1.215346
H -2.506741 3.468609 1.204068
H -2.910667 2.835942 -0.412736
H -4.173347 -0.907651 1.842540
H -3.644176 -1.851925 0.427740
H -5.771059 0.358185 0.264020
H -0.257799 4.249112 0.207451
H -0.499634 -3.750858 -1.523106
H -5.064786 -1.895621 -1.731250
H -6.273642 -0.600283 -1.973176
H -4.526880 -0.191578 -1.875446
H -6.134879 -2.706939 0.511008
H -7.445021 -1.534088 0.202026
H -6.565409 -1.500199 1.759737
H 1.774032 -4.784020 -1.091993
H 2.627032 0.610850 -2.591876
H 4.339760 0.971113 -2.145621
H 3.146535 2.326265 -2.309819
H 4.262800 -2.917230 0.730480
H 3.148046 4.100150 1.538657
H 4.043368 4.762978 0.117552
H 4.025304 2.975809 0.417743
H 2.089357 -0.410611 2.604036
H 3.145607 0.806875 1.782861
H 3.875472 -0.411956 2.895541


