%chk=000069586.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069586

0 1
 O  -0.1249000       4.216100      0.9090000    
 C  -2.0000001E-03  0.3092000     -0.2074000    
 C   -1.309900       1.018300     -0.2663000    
 C    1.271600       1.080900     -0.2010000    
 C   2.6000001E-02  -1.026700     -3.2900002E-02
 C   -1.339700       2.382600      7.1099997E-02
 C    1.218100       2.444600      0.1357000    
 C  -8.5299999E-02   3.094000      0.4193000    
 C    1.348600      -1.698700      2.0700000E-02
 C   -1.268300      -1.742300      9.5399998E-02
 C   -2.513200      0.4088000     -0.6594000    
 C    2.521300      0.5307000     -0.5319000    
 C   -2.543400       3.101000      6.2600002E-02
 C    2.384400       3.220500      0.1870000    
 C   -3.711600       1.127400     -0.6743000    
 C    3.682800       1.306800     -0.4873000    
 C   -3.727900       2.468900     -0.3066000    
 C    3.615300       2.647200     -0.1212000    
 C    1.911700      -2.158500      -1.152600    
 C   -1.818700      -1.906400       1.350300    
 C    1.975000      -1.843300       1.242000    
 C   -1.881900      -2.221700      -1.044200    
 C    3.154300      -2.790200      -1.102300    
 C   -3.034600      -2.579000       1.471100    
 C    3.217600      -2.474900       1.292200    
 C   -3.098000      -2.894200     -0.9234000    
 C    3.807200      -2.948300      0.1199000    
 C   -3.674400      -3.072800      0.3343000    
 H   -2.550900     -0.3403000      -1.426500    
 H    2.674200     -0.2611000      -1.229700    
 H   -2.573300       4.156000      0.3211000    
 H    2.350200       4.275400      0.4460000    
 H   -4.613700      0.6708000      -1.073400    
 H    4.628200      0.8907000     -0.8256000    
 H   -4.656000       3.031600     -0.3425000    
 H    4.516200       3.253500     -0.1076000    
 H    1.406100      -2.055900      -2.109700    
 H   -1.329900      -1.525900       2.242900    
 H    1.525500      -1.479500       2.161900    
 H   -1.424900      -2.125200      -2.026800    
 H    3.611900      -3.161400      -2.014500    
 H   -3.483400      -2.718000       2.450300    
 H    3.726300      -2.597900       2.243800    
 H   -3.591900      -3.286300      -1.807500    
 H    4.774600      -3.440300      0.1590000    
 H   -4.620400      -3.597800      0.4285000    


%chk=000069586-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000069586

0 1
O -0.174413 4.718092 -0.296093
C -0.009916 0.461715 -0.102848
C -1.266254 1.172541 -0.474101
C 1.191787 1.296023 0.183696
C 0.036091 -0.955233 -0.019970
C -1.321031 2.606129 -0.511795
C 1.133956 2.727586 0.090429
C -0.124296 3.440224 -0.242184
C 1.225619 -1.740454 -0.450264
C -1.103896 -1.755124 0.508143
C -2.425018 0.480447 -0.953683
C 2.404259 0.743521 0.709943
C -2.508861 3.286117 -0.897049
C 2.265742 3.530319 0.401067
C -3.591245 1.159588 -1.336990
C 3.514791 1.543918 1.017165
C -3.652964 2.577264 -1.285641
C 3.463787 2.951659 0.839236
C 1.912750 -1.391231 -1.650943
C -1.818960 -1.299884 1.655790
C 1.658824 -2.896628 0.262526
C -1.458874 -3.017907 -0.050340
C 3.002665 -2.157266 -2.108104
C -2.861524 -2.068063 2.209074
C 2.756898 -3.656638 -0.190582
C -2.509625 -3.781664 0.498715
C 3.435220 -3.290925 -1.377454
C -3.217199 -3.310896 1.630324
H -2.411853 -0.606526 -1.040280
H 2.478511 -0.328399 0.895023
H -2.477794 4.380374 -0.897505
H 2.148231 4.614396 0.304366
H -4.455140 0.584953 -1.689427
H 4.423113 1.072655 1.409076
H -4.567346 3.105398 -1.575770
H 4.334453 3.573988 1.071276
H 1.571576 -0.520939 -2.221654
H -1.536125 -0.344374 2.110191
H 1.141106 -3.183499 1.184349
H -0.918230 -3.386143 -0.929047
H 3.511834 -1.876632 -3.036686
H -3.393241 -1.703827 3.094981
H 3.084783 -4.532363 0.380457
H -2.778108 -4.742120 0.044898
H 4.284482 -3.884755 -1.733248
H -4.029664 -3.907018 2.060432


