%chk=000095545.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095545

0 1
 O   0.3951000      -1.442800      -1.085600    
 O   -3.517300     -0.1321000      0.4957000    
 O    2.013400      -3.951600      0.8279000    
 O    3.564800      -4.478500     -0.7296000    
 O    1.445100       4.014100     -0.9808000    
 O   -2.421700     -0.2335000       2.511800    
 O    1.770500       3.734800       1.248300    
 N    2.155900      -1.369700      0.4267000    
 N   -1.272800     -0.2262000      0.4959000    
 C   6.9700003E-02 -0.2968000       1.019600    
 C    3.104000      -2.134300     -0.3509000    
 C   0.6431000       1.109500       1.230300    
 C    4.545600      -1.720100     -2.8000001E-02
 C   0.8703000      -1.085500     -9.1000004E-03
 C   0.7272000       1.953600     -4.3699998E-02
 C    4.806700     -0.2538000     -0.2753000    
 C    2.927600      -3.627600     -0.1175000    
 C    5.253000      0.1738000      -1.525800    
 C    4.601100      0.6734000      0.7464000    
 C   -2.404300     -0.2005000       1.285700    
 C    1.357700       3.310200      0.1781000    
 C    5.494100       1.528500      -1.754600    
 C    4.842100       2.028100      0.5175000    
 C    5.288600       2.455600     -0.7331000    
 C   -4.771600     -9.8499998E-02   1.185800    
 C   -5.882300     -2.4300000E-02  0.1797000    
 C   -6.347600       1.216800     -0.2552000    
 C   -6.449300      -1.196200     -0.3213000    
 C   -7.380000       1.286000      -1.190600    
 C   -7.481600      -1.126900      -1.256800    
 C   -7.947000      0.1143000      -1.691500    
 H   5.8499999E-02 -0.8469000       1.967500    
 H    2.882800      -1.955000      -1.410600    
 H   2.4000000E-02   1.643200       1.963800    
 H    1.640700       1.037200       1.679800    
 H    5.252100      -2.317600     -0.6195000    
 H    4.780800      -1.955100       1.019500    
 H    2.409500      -1.131500       1.381100    
 H  -0.2761000       2.120100     -0.4505000    
 H    1.333300       1.438600     -0.7971000    
 H   -1.403700     -0.1739000     -0.5106000    
 H    5.414400     -0.5390000      -2.330200    
 H    4.260500      0.3552000       1.727900    
 H    5.840600       1.861600      -2.728400    
 H    4.683700       2.749800       1.313300    
 H    5.475100       3.510600     -0.9112000    
 H   -4.879200     -0.9996000       1.802400    
 H   -4.804900      0.7733000       1.851000    
 H    1.936000      -4.922400      0.9460000    
 H    1.867800       4.889000     -0.8456000    
 H   -5.912400       2.136800      0.1259000    
 H   -6.094000      -2.169000      8.1000002E-03
 H   -7.741900       2.252300      -1.529600    
 H   -7.922800      -2.039200      -1.647400    
 H   -8.750500      0.1681000      -2.420200    


%chk=000095545-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095545

0 1
O 0.831954 -0.341067 -1.655322
O -3.318145 1.369703 -0.550433
O 1.924220 -4.247270 0.427453
O 3.067484 -4.571271 -1.572934
O 1.961258 4.402478 1.077134
O -2.737634 0.625852 1.620755
O 2.326021 2.882372 2.789274
N 1.717844 -1.611248 0.087798
N -1.250154 0.502277 -0.183939
C -0.150014 -0.079480 0.587336
C 2.728585 -2.272557 -0.738670
C 0.551831 0.960880 1.513553
C 4.198341 -1.911982 -0.316905
C 0.834108 -0.689249 -0.432615
C 1.117802 2.169775 0.745169
C 4.482461 -0.421189 -0.408962
C 2.591087 -3.795013 -0.721724
C 4.545622 0.224417 -1.671240
C 4.688022 0.351133 0.761351
C -2.450258 0.806903 0.403146
C 1.846211 3.130355 1.659693
C 4.808843 1.608178 -1.760272
C 4.954087 1.737644 0.677316
C 5.014225 2.370183 -0.585121
C -4.699989 1.685720 -0.053757
C -5.650223 0.526975 -0.267040
C -6.424697 0.442116 -1.451556
C -5.778890 -0.487413 0.717508
C -7.311432 -0.638690 -1.654957
C -6.664701 -1.568679 0.515235
C -7.433269 -1.646869 -0.670441
H -0.554189 -0.878421 1.240836
H 2.560909 -1.932288 -1.775928
H -0.197212 1.296944 2.252660
H 1.363459 0.466983 2.078826
H 4.872406 -2.482866 -0.983342
H 4.370164 -2.272695 0.714906
H 1.605154 -1.932279 1.051547
H 0.321891 2.717388 0.211255
H 1.844384 1.849277 -0.028815
H -1.102291 0.626852 -1.191260
H 4.388487 -0.355470 -2.589259
H 4.644088 -0.131634 1.745331
H 4.852028 2.092416 -2.742002
H 5.109369 2.315624 1.594724
H 5.217249 3.444389 -0.655188
H -4.620858 1.955431 1.013580
H -4.983140 2.563926 -0.655364
H 1.885963 -5.241640 0.424262
H 2.466648 4.996385 1.697101
H -6.329826 1.222959 -2.216360
H -5.172787 -0.424098 1.628521
H -7.906358 -0.693974 -2.573521
H -6.759133 -2.346964 1.280933
H -8.122607 -2.484827 -0.824874


