%chk=000178691.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178691

0 1
 O    2.566900      -2.201800     -0.7451000    
 O    5.408500     -0.1896000     -6.4900003E-02
 O    3.774800       2.144600     -0.3559000    
 O   -5.308500      -1.279000     -0.1129000    
 C    3.469000      -1.535600      0.1455000    
 C    1.994500      -1.626200      0.4394000    
 C    4.013400     -0.2397000     -0.3648000    
 C    1.147400     -0.3842000      0.2685000    
 C    3.309900      0.9597000      0.2952000    
 C    1.790700      0.8801000      0.2110000    
 C  -0.2745000     -0.4523000      0.1760000    
 C   -1.030300      0.7491000      6.9499999E-02
 C    1.023000       2.047600      0.1322000    
 C   -2.427300      0.6643000     -1.6100001E-02
 C  -0.3649000       1.982900      5.8200002E-02
 C  -0.9748000      -1.689900      0.1867000    
 C   -3.054200     -0.5750000      1.0000000E-03
 C   -3.417800       1.787800     -0.1312000    
 C   -2.365400      -1.762400      9.9699996E-02
 C   -4.789500       1.096800     -0.1904000    
 C   -4.490800     -0.3770000     -0.1013000    
 H    4.152200      -2.134600      0.7310000    
 H    1.721000      -2.307500       1.239800    
 H    3.919100     -0.1772000      -1.456400    
 H    3.591400       1.038500       1.352900    
 H    1.495100       3.026700      0.1256000    
 H  -0.9187000       2.916700     -1.0800000E-02
 H    5.838100     -0.9145000     -0.5509000    
 H  -0.4321000      -2.630600      0.2600000    
 H   -3.360900       2.450800      0.7385000    
 H   -3.244200       2.371800      -1.041200    
 H    4.742500       2.167600     -0.2616000    
 H   -5.299000       1.316000      -1.133400    
 H   -5.418600       1.400200      0.6515000    
 H   -2.871800      -2.720800      0.1096000    


%chk=000178691-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178691

0 1
O 2.534433 -2.312081 -0.779261
O 5.446038 -0.081661 -0.134968
O 3.815357 2.211536 -0.125053
O -5.425373 -1.312215 -0.073415
C 3.454992 -1.564518 0.148205
C 1.998855 -1.619680 0.494773
C 4.002468 -0.239125 -0.384219
C 1.171872 -0.390864 0.307358
C 3.339485 0.925960 0.377857
C 1.823209 0.858717 0.245496
C -0.261684 -0.469459 0.204375
C -1.018077 0.762483 0.063967
C 1.071991 2.059719 0.082459
C -2.445002 0.675317 -0.021438
C -0.320361 2.011496 0.002869
C -0.959468 -1.731947 0.226776
C -3.083155 -0.571449 0.022731
C -3.446273 1.815412 -0.169114
C -2.348128 -1.790770 0.140995
C -4.834531 1.113801 -0.205935
C -4.555185 -0.400529 -0.080866
H 4.168241 -2.187832 0.703312
H 1.666555 -2.353575 1.238478
H 3.772967 -0.151587 -1.465149
H 3.625412 0.815183 1.449652
H 1.618386 3.003924 0.019422
H -0.893096 2.938056 -0.112680
H 5.961553 -0.625418 -0.780679
H -0.380839 -2.658690 0.289199
H -3.367623 2.528725 0.673090
H -3.254510 2.396363 -1.091150
H 4.806534 2.156051 -0.143154
H -5.386027 1.304464 -1.144111
H -5.496005 1.430096 0.620543
H -2.888812 -2.742601 0.154535


