%chk=000085934.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085934

0 1
 O   -2.059000       1.045100     -0.4294000    
 O   -3.717500      -1.350700      -1.464600    
 O    5.848100     -0.5483000       1.676800    
 O    3.573000     -0.3405000      1.1900000E-02
 O  -0.4900000       2.455200      0.5128000    
 O    2.003900      -1.749100     -0.9322000    
 N   -4.752800      0.2222000     -4.3000001E-02
 N   -4.893600      -1.976900      0.4608000    
 C   -5.476800      0.1672000       1.214700    
 C   -5.666200      -1.318200       1.483000    
 C   -4.416000       1.465400     -0.6827000    
 C   -4.374400      -1.064700     -0.4723000    
 C   -3.089300       2.008000     -0.1835000    
 C    5.941400     -0.7718000      0.2701000    
 C    6.302200      0.5469000     -0.4163000    
 C    4.601900      -1.305500     -0.2308000    
 C    7.636000       1.103000      6.5099999E-02
 C  -0.8114000       1.408500     -2.7200000E-02
 C    2.325600     -0.7023000     -0.3928000    
 C   0.1077000      0.2975000     -0.3596000    
 C    1.407000      0.4091000     -6.0500000E-02
 H   -6.431000      0.6941000       1.121300    
 H   -4.870900      0.6423000       1.992600    
 H   -5.301500      -1.618400       2.469000    
 H   -6.711100      -1.623600       1.374700    
 H   -5.225900       2.183900     -0.5229000    
 H   -4.334600       1.266500      -1.757500    
 H   -4.776000      -2.982800      0.3914000    
 H   -3.142100       2.209700      0.8928000    
 H   -2.851000       2.938000     -0.7120000    
 H    6.724300      -1.518700      0.1008000    
 H    6.345600      0.4004000      -1.501800    
 H    5.537600       1.307200     -0.2170000    
 H    4.657400      -1.521200      -1.304100    
 H    4.349500      -2.223300      0.3134000    
 H    7.608800       1.339900       1.133200    
 H    8.444400      0.3857000     -0.1089000    
 H    7.877500       2.023400     -0.4761000    
 H    5.130000      8.9699998E-02   1.829400    
 H  -0.3053000     -0.5829000     -0.8403000    
 H    1.819800       1.289500      0.4203000    


%chk=000085934-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085934

0 1
O -2.137201 1.015305 -0.367816
O -4.760329 -1.125720 -2.070014
O 6.056783 -0.262571 1.829207
O 3.647845 -0.355049 0.271486
O -0.590486 2.459135 0.626861
O 2.111271 -1.836580 -0.681324
N -4.966513 0.250381 -0.131210
N -5.262691 -1.967410 0.105507
C -5.087106 0.041277 1.322174
C -5.656720 -1.410545 1.409745
C -4.498349 1.482122 -0.752751
C -4.970211 -0.971822 -0.836017
C -3.196054 2.040209 -0.166310
C 6.048888 -0.654792 0.407065
C 6.364611 0.539969 -0.521553
C 4.733390 -1.362482 0.063578
C 7.751493 1.150404 -0.235704
C -0.859074 1.362322 0.075489
C 2.365716 -0.730380 -0.148341
C 0.090580 0.256246 -0.206629
C 1.404755 0.365497 0.130576
H -5.765474 0.777050 1.790827
H -4.098051 0.106079 1.822836
H -5.215001 -1.969229 2.252502
H -6.759120 -1.395275 1.533890
H -5.264694 2.281346 -0.667940
H -4.363133 1.252391 -1.825429
H -5.482230 -2.911719 -0.201726
H -3.268499 2.262663 0.914737
H -2.902365 2.971238 -0.685017
H 6.861811 -1.401783 0.336354
H 6.313723 0.195306 -1.574436
H 5.573919 1.306170 -0.401529
H 4.699599 -1.717187 -0.982230
H 4.545073 -2.211199 0.744229
H 7.836511 1.430985 0.828640
H 8.559096 0.427603 -0.458016
H 7.924957 2.051678 -0.850709
H 5.273792 0.328710 1.978923
H -0.300180 -0.642140 -0.696286
H 1.784967 1.271296 0.614963


