%chk=000138883.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138883

0 1
 O   -2.497800      0.2923000      -1.338800    
 C   -1.139800     -0.7566000      0.3678000    
 C   -1.405600      -2.129900     -0.2812000    
 C   0.2929000     -0.2885000      0.2017000    
 C   -2.115200      0.2974000     -0.1686000    
 C   -2.562800       1.364900      0.8206000    
 C  -0.5914000      -3.253300      0.3482000    
 C    1.064100     -6.8499997E-02   1.328000    
 C   0.7928000     -9.3300000E-02  -1.072600    
 C    2.905200      0.5651000     -0.1020000    
 C    2.381800      0.3622000       1.174800    
 C    2.110800      0.3373000      -1.225700    
 C   -3.549500       2.346300      0.2134000    
 C    4.314400       1.024600     -0.2657000    
 H   -1.368600     -0.8672000       1.437000    
 H   -1.208200      -2.107000      -1.359700    
 H   -2.470900      -2.372500     -0.1749000    
 H   -1.676800       1.905100       1.169300    
 H   -3.029200      0.8646000       1.675600    
 H  -0.7693000      -3.310500       1.426800    
 H  -0.8767000      -4.214200     -9.2100002E-02
 H   0.4812000      -3.117400      0.1807000    
 H   0.6673000     -0.2227000       2.327100    
 H   0.1891000     -0.2626000      -1.958700    
 H    2.990200      0.5379000       2.058000    
 H    2.506600      0.4939000      -2.225800    
 H   -3.106700       2.872400     -0.6388000    
 H   -3.851300       3.091600      0.9558000    
 H   -4.448900       1.831700     -0.1405000    
 H    4.946100      0.6614000      0.5521000    
 H    4.748000      0.6456000      -1.197500    
 H    4.353500       2.118300     -0.2801000    


%chk=000138883-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138883

0 1
O -2.614519 0.140996 -1.331812
C -1.226377 -0.852659 0.428000
C -1.449760 -2.242503 -0.230047
C 0.206993 -0.329898 0.242836
C -2.201169 0.203765 -0.143275
C -2.611973 1.330225 0.805170
C -0.563197 -3.346436 0.380657
C 1.065726 -0.139569 1.353199
C 0.708078 -0.037339 -1.052439
C 2.895459 0.613974 -0.116296
C 2.389584 0.321334 1.175686
C 2.030289 0.423187 -1.225527
C -3.345941 2.494022 0.117639
C 4.308428 1.139320 -0.305603
H -1.414687 -0.934907 1.518010
H -1.264626 -2.154844 -1.316049
H -2.518196 -2.515261 -0.123763
H -1.703203 1.680361 1.335384
H -3.252272 0.874872 1.591951
H -0.762237 -3.470443 1.462601
H -0.755202 -4.318262 -0.109520
H 0.509370 -3.110305 0.260439
H 0.701659 -0.367231 2.363023
H 0.056057 -0.166347 -1.924628
H 3.039126 0.451752 2.050243
H 2.397855 0.640863 -2.236084
H -2.696338 2.977610 -0.632537
H -3.653051 3.254838 0.857055
H -4.242928 2.132664 -0.413155
H 4.985754 0.776646 0.487659
H 4.727416 0.831678 -1.279932
H 4.329184 2.246296 -0.274685


