%chk=000155467.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155467

0 1
 O    1.262100      7.6899998E-02  -1.134800    
 O  -0.6855000      0.5910000      0.8008000    
 O    5.788800      2.1800000E-02  0.4168000    
 O   0.7451000       1.733200      -2.660100    
 N    3.493500     -0.2548000      0.6697000    
 C    2.229800      0.3071000       1.065500    
 C    1.506600       1.010100     -8.1799999E-02
 C    3.457100      -1.638500      0.1781000    
 C   0.1758000       1.626600      0.3371000    
 C    4.293800      -2.541200       1.075500    
 C    3.931800      -1.704700      -1.268200    
 C    4.690600      0.4760000      0.7486000    
 C   -2.027900      0.7849000      0.6389000    
 C    4.605700       1.888900       1.269200    
 C   -2.905400     -0.2960000      0.4546000    
 C   -4.288300     -4.4199999E-02  0.2903000    
 C   0.6503000      0.5868000      -2.243200    
 C   -2.506800       2.095200      0.6605000    
 C   -2.440900      -1.621200      0.4300000    
 C   -4.753000       1.280900      0.3152000    
 C   -3.866800       2.342700      0.4993000    
 C   -5.166100      -1.124900      0.1061000    
 C   -3.327300      -2.682800      0.2457000    
 C  -0.1756000     -0.4788000      -2.897900    
 C   -4.687300      -2.435200      8.3999999E-02
 H    1.610800     -0.5007000       1.475700    
 H    2.369600       1.011800       1.890600    
 H    2.155000       1.800100     -0.4785000    
 H    2.422200      -2.000100      0.2072000    
 H   0.3492000       2.332900       1.158400    
 H  -0.2633000       2.178400     -0.5003000    
 H    4.167400      -3.589400      0.7825000    
 H    5.363900      -2.320000       1.027400    
 H    3.981200      -2.447400       2.121300    
 H    3.412300     -0.9840000      -1.905400    
 H    3.749700      -2.704000      -1.679000    
 H    5.004300      -1.510400      -1.366600    
 H    4.336400       1.884000       2.328500    
 H    3.895600       2.485700      0.6958000    
 H    5.587700       2.363900       1.175100    
 H   -1.866600       2.953900      0.8388000    
 H   -1.384000      -1.848700      0.5519000    
 H   -5.812200       1.497800      0.1930000    
 H   -4.241000       3.362100      0.5251000    
 H   -6.233000     -0.9549000     -2.2200000E-02
 H   -2.955100      -3.703000      0.2280000    
 H  -0.9793000     -0.7906000      -2.228000    
 H   0.4580000      -1.329500      -3.161100    
 H  -0.6192000     -8.0799997E-02  -3.815000    
 H   -5.376600      -3.262100     -5.9500001E-02


%chk=000155467-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000155467

0 1
O 1.340518 0.063910 -1.765000
O -0.937965 0.493752 0.115302
O 5.462184 -0.081541 1.184870
O 1.547744 1.976690 -3.084554
N 3.241799 -0.388811 0.537234
C 1.823937 0.011141 0.615545
C 1.360220 0.921255 -0.540429
C 3.561545 -1.650987 -0.220844
C -0.014069 1.552973 -0.302091
C 4.020638 -2.777327 0.735172
C 4.571354 -1.407255 -1.365328
C 4.251823 0.310261 1.196315
C -2.266205 0.862999 0.391445
C 3.860115 1.580477 1.961393
C -3.128205 -0.225509 0.784012
C -4.508250 0.072439 1.102613
C 1.455737 0.731301 -2.995848
C -2.748372 2.174680 0.309827
C -2.661502 -1.576640 0.865190
C -4.981306 1.425215 1.014847
C -4.116938 2.446474 0.624470
C -5.368151 -1.004845 1.498801
C -3.526879 -2.603469 1.253711
C 1.443388 -0.259947 -4.135277
C -4.890698 -2.315410 1.574676
H 1.189150 -0.891233 0.621618
H 1.627181 0.539571 1.563834
H 2.079193 1.743751 -0.717920
H 2.602017 -1.947774 -0.682363
H 0.070601 2.317600 0.499334
H -0.374091 2.045700 -1.225036
H 4.161581 -3.715402 0.167117
H 4.975144 -2.507671 1.214684
H 3.266131 -2.961656 1.522010
H 4.218417 -0.601195 -2.033648
H 4.680281 -2.332140 -1.962044
H 5.556302 -1.125559 -0.962011
H 3.288922 1.340468 2.878295
H 3.259936 2.284086 1.357019
H 4.794959 2.077031 2.260141
H -2.100071 3.001826 0.008171
H -1.618592 -1.787077 0.612201
H -6.027751 1.641283 1.257080
H -4.478050 3.478212 0.554703
H -6.413554 -0.780369 1.741979
H -3.162881 -3.635046 1.312666
H 0.469438 -0.779140 -4.170920
H 2.220047 -1.028816 -3.982555
H 1.615701 0.264744 -5.085674
H -5.559374 -3.128218 1.878868


