%chk=000010153.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010153

0 1
 O   0.8560000       2.403600     -0.7757000    
 O   -1.378300       3.837700     -0.6276000    
 O    2.437100       1.269800      0.5979000    
 O    4.572000     -0.3082000      0.3541000    
 N   -3.006100      -2.343600     -3.6800001E-02
 C   -1.657500      -1.783300      0.2390000    
 C   -1.573900     -0.2744000     -1.5900001E-02
 C  -0.5680000      -2.490400     -0.5989000    
 C   -2.748200      0.5032000     -4.2900000E-02
 C   -4.030000      -1.549600      0.6609000    
 C  -0.3028000      0.3383000     -0.1593000    
 C   -4.099800     -0.1453000      6.8200000E-02
 C   0.7975000      -1.890300     -0.3485000    
 C   0.9176000     -0.5003000     -0.1337000    
 C  -0.2595000       1.730500     -0.3557000    
 C   -2.665000       1.884500     -0.2423000    
 C   -3.121400      -3.745000      0.3811000    
 C   -1.426200       2.494700     -0.3947000    
 C    2.204800      1.6600000E-02  9.8499998E-02
 C    1.934500      -2.712700     -0.3728000    
 C    3.331700     -0.8106000      9.0099998E-02
 C    3.197400      -2.172900     -0.1512000    
 C   -1.257800       4.687300      0.5106000    
 C    2.519700       1.391200       2.013500    
 C    5.326100      0.1691000     -0.7575000    
 H   -1.427100      -1.921000       1.306900    
 H  -0.7871000      -2.412100      -1.672100    
 H  -0.5273000      -3.555200     -0.3448000    
 H   -3.819100      -1.500900       1.738000    
 H   -5.020200      -2.008500      0.5469000    
 H   -4.758100      0.4688000      0.6945000    
 H   -4.541600     -0.1908000     -0.9355000    
 H   -3.572000       2.482600     -0.2906000    
 H   -2.864000      -3.884100       1.437100    
 H   -2.487100      -4.397400     -0.2258000    
 H   -4.144100      -4.109700      0.2287000    
 H    1.838500      -3.779500     -0.5578000    
 H    4.068800      -2.821700     -0.1574000    
 H   0.6393000       3.337900     -0.9348000    
 H   -2.134000       4.584100       1.158500    
 H   -1.200400       5.722000      0.1618000    
 H  -0.3469000       4.456400       1.072200    
 H    3.445400      0.9492000       2.393200    
 H    1.655900      0.9249000       2.498900    
 H    2.520500       2.455900       2.263300    
 H    4.800000      0.9895000      -1.255800    
 H    5.516900     -0.6415000      -1.467900    
 H    6.284500      0.5423000     -0.3868000    


%chk=000010153-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000010153

0 1
O 1.091322 2.312515 -0.846342
O -0.967265 3.928054 -0.531282
O 2.503923 0.952517 0.997779
O 4.706141 -0.796305 0.364751
N -2.969558 -2.226572 0.168588
C -1.568057 -1.732850 0.222381
C -1.482748 -0.204940 0.142086
C -0.699112 -2.290553 -0.940622
C -2.624793 0.616734 0.229746
C -3.863072 -1.422126 1.039134
C -0.183173 0.355581 -0.101700
C -3.991999 0.002179 0.481233
C 0.744358 -1.875146 -0.708460
C 0.981101 -0.561572 -0.193503
C -0.089471 1.740412 -0.373781
C -2.496191 2.021565 0.058345
C -3.068895 -3.667559 0.481767
C -1.245751 2.566954 -0.258648
C 2.291336 -0.232281 0.255176
C 1.818537 -2.770781 -0.891182
C 3.378501 -1.116378 -0.011110
C 3.140948 -2.380236 -0.585286
C -2.083874 4.869223 -0.483254
C 2.939874 0.703417 2.392829
C 5.237748 0.444110 -0.248923
H -1.084731 -2.063991 1.184065
H -1.106084 -1.887623 -1.889322
H -0.759194 -3.391033 -0.992679
H -3.486077 -1.384392 2.094420
H -4.854707 -1.910499 1.060770
H -4.573280 0.630111 1.185062
H -4.563888 -0.042200 -0.466887
H -3.384937 2.656008 0.143782
H -2.681114 -3.921588 1.501540
H -2.508448 -4.267977 -0.253803
H -4.126802 -3.979223 0.428250
H 1.622181 -3.776195 -1.280598
H 3.994256 -3.044312 -0.754728
H 0.936890 3.290491 -0.943473
H -2.862186 4.598733 -1.222684
H -1.654736 5.850302 -0.734901
H -2.529140 4.903908 0.529771
H 3.894703 0.147338 2.418578
H 2.160652 0.140591 2.941311
H 3.062950 1.702793 2.838149
H 4.593842 1.308652 -0.008803
H 5.307319 0.321345 -1.346395
H 6.243402 0.573901 0.179953


