%chk=000079476.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079476

0 1
 O    1.370200      -2.005900     -5.0000002E-04
 C   -1.462500      -2.247000      1.3000000E-03
 C    2.758800      0.4752000     -2.7000001E-03
 C  -0.7414000     -0.8889000       0.000000    
 C    1.268300      0.3812000     -1.7000000E-03
 C   0.6310000     -0.8596000     -6.0000003E-04
 C  -0.8810000       1.484800     -2.0999999E-03
 C   -1.518300      0.2442000     -7.9999998E-04
 C   0.5122000       1.553500     -2.4999999E-03
 C   -1.689300       2.738200     -1.4000000E-03
 C   -2.990400      -2.023800      1.4000000E-03
 C   -1.065800      -3.044800       1.262400    
 C   -1.130700      -3.132100      -1.221500    
 C    3.242400       1.768100      0.7227000    
 C    3.320500      0.5117000      -1.457100    
 C    3.504300     -0.7043000      0.7037000    
 C   -2.562700       2.875000       1.260100    
 C   -2.565800       2.874400      -1.260900    
 H   -2.598600      0.2570000     -1.9000000E-03
 H   0.9700000       2.535700     -3.1099999E-02
 H   -1.009600       3.601300     -2.3000001E-03
 H   -3.345600      -1.512600     -0.9017000    
 H   -3.342400      -1.498000      0.8974000    
 H   -3.508700      -2.992300      1.4000000E-02
 H  -3.2200001E-02  -3.400400       1.256400    
 H   -1.695500      -3.936900       1.367500    
 H   -1.204200      -2.443000       2.168700    
 H  -8.7700002E-02  -3.459100      -1.248200    
 H   -1.325900      -2.591300      -2.155000    
 H   -1.744800      -4.040600      -1.229400    
 H    4.333200       1.770200      0.8408000    
 H    3.013200       2.679700      0.1604000    
 H    2.807100       1.852400       1.725400    
 H    2.915500       1.366100      -2.012000    
 H    4.413000      0.5981000      -1.460000    
 H    3.050800     -0.3942000      -2.011700    
 H    4.541700     -0.4246000      0.9297000    
 H    3.036400     -0.9629000       1.660600    
 H    3.600100      -1.600200      8.3300002E-02
 H   -3.336000       2.101000       1.311000    
 H   -3.065100       3.848300       1.274600    
 H   -1.951500       2.798700       2.166300    
 H   -1.956800       2.797600      -2.168500    
 H   -3.068000       3.847900      -1.274600    
 H   -3.339400       2.100700      -1.309500    
 H    1.816300      -2.045100     -0.8650000    


%chk=000079476-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079476

0 1
O 1.324354 -2.088095 -0.188708
C -1.540776 -2.323284 -0.155903
C 2.862434 0.487427 -0.034241
C -0.807251 -0.958022 -0.072645
C 1.308913 0.390353 -0.009225
C 0.619385 -0.859950 -0.087890
C -0.898992 1.516944 0.111747
C -1.529460 0.253676 0.025843
C 0.510409 1.557767 0.092569
C -1.716415 2.808346 0.215553
C -3.084457 -2.155943 -0.123706
C -1.145257 -3.217198 1.059996
C -1.179423 -3.048292 -1.489082
C 3.352362 1.959526 0.056336
C 3.433109 -0.074173 -1.378858
C 3.487858 -0.250761 1.195714
C -2.596703 2.836168 1.493681
C -2.583023 3.042163 -1.051107
H -2.622087 0.212860 0.037331
H 0.996622 2.535590 0.158690
H -0.998372 3.651025 0.287417
H -3.455349 -1.559741 -0.978304
H -3.431210 -1.682521 0.813808
H -3.554022 -3.154854 -0.185521
H -0.061101 -3.407127 1.078444
H -1.672127 -4.188781 0.997246
H -1.434826 -2.730645 2.010343
H -0.097510 -3.238932 -1.558022
H -1.486074 -2.438162 -2.359325
H -1.712681 -4.016633 -1.543255
H 4.457558 1.978003 0.028711
H 2.985288 2.566150 -0.790970
H 3.032364 2.441689 0.997572
H 3.051347 0.522185 -2.227037
H 4.537094 -0.007496 -1.377583
H 3.164024 -1.125946 -1.589494
H 4.590256 -0.164070 1.167977
H 3.127329 0.209236 2.133251
H 3.244144 -1.327825 1.261457
H -3.348694 2.025285 1.474969
H -3.139217 3.796983 1.574224
H -1.982970 2.705506 2.403227
H -1.958362 3.065971 -1.962308
H -3.131904 4.000095 -0.979330
H -3.328411 2.234259 -1.175010
H 2.296926 -1.925357 -0.173582


