%chk=000085904.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085904

0 1
 O    4.259500     -0.8457000     -4.9400002E-02
 C   0.3173000      0.5289000      0.3094000    
 C    1.508200       1.491000     -5.6200001E-02
 C  -0.9412000      0.8766000     -0.5454000    
 C   0.7026000     -0.9443000      0.1101000    
 C  -0.4279000      -1.958100      0.1221000    
 C    2.830000      0.9858000      0.5377000    
 C   -2.044400     -0.1423000     -0.4095000    
 C  -3.2099999E-02  0.7294000       1.808700    
 C   -1.617600      -1.545000     -0.7437000    
 C    1.703600       1.737400      -1.564200    
 C    1.970000      -1.369100     -1.9500000E-02
 C    3.112200     -0.4354000      0.1152000    
 C   -3.288600      0.1726000     -2.4100000E-02
 C   -3.685800       1.582100      0.3032000    
 C   -4.365900     -0.8638000      0.1059000    
 H    1.306400       2.476600      0.3859000    
 H  -0.6854000      0.8723000      -1.612600    
 H   -1.253100       1.902600     -0.3296000    
 H  -7.5999998E-02  -2.941100     -0.2153000    
 H  -0.7632000      -2.091400       1.159000    
 H    2.817000       1.019100       1.632100    
 H    3.661300       1.619000      0.2060000    
 H  -0.2753000       1.778100       2.015000    
 H  -0.8964000      0.1319000       2.118500    
 H   0.7975000      0.4454000       2.465000    
 H   -2.402900      -2.293400     -0.6121000    
 H   -1.332900      -1.582500      -1.803300    
 H    2.623900       2.301700      -1.751800    
 H    1.761900      0.8033000      -2.131500    
 H   0.8862000       2.339500      -1.973500    
 H    2.211200      -2.417200     -0.1620000    
 H   -3.843900       2.160400     -0.6126000    
 H   -4.620800       1.604500      0.8742000    
 H   -2.947500       2.086100      0.9344000    
 H   -4.247200      -1.427500       1.036500    
 H   -5.358100     -0.3990000      0.1245000    
 H   -4.384100      -1.553700     -0.7434000    


%chk=000085904-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085904

0 1
O 4.388034 -0.830713 0.073924
C 0.335436 0.518688 0.283022
C 1.525916 1.488869 -0.068005
C -0.920369 0.858652 -0.603329
C 0.733955 -0.949478 0.064059
C -0.387269 -1.973933 0.011228
C 2.839180 0.996819 0.597053
C -2.066679 -0.129772 -0.435862
C -0.063609 0.703191 1.782759
C -1.611901 -1.526232 -0.842220
C 1.767600 1.698133 -1.585352
C 2.044720 -1.348762 -0.015730
C 3.186394 -0.434575 0.184741
C -3.322535 0.187364 0.014806
C -3.748594 1.587794 0.436372
C -4.463066 -0.814371 0.142070
H 1.270955 2.477351 0.368728
H -0.612553 0.827857 -1.667003
H -1.213129 1.901197 -0.388269
H 0.005103 -2.941012 -0.354522
H -0.746579 -2.149163 1.047574
H 2.746748 1.011438 1.702075
H 3.690036 1.652601 0.340501
H -0.306797 1.764804 1.978303
H -0.957004 0.103932 2.030064
H 0.750721 0.403803 2.465348
H -2.406622 -2.283430 -0.744999
H -1.307558 -1.512079 -1.909725
H 2.680948 2.302887 -1.734750
H 1.915474 0.738843 -2.114404
H 0.936107 2.236399 -2.071484
H 2.300420 -2.400940 -0.197210
H -4.579853 1.948437 -0.202265
H -4.135295 1.576263 1.475245
H -2.940153 2.333061 0.389025
H -4.809925 -0.876149 1.193257
H -5.335496 -0.480540 -0.454621
H -4.204261 -1.832435 -0.186705


