%chk=000076862.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076862

0 1
 O   -4.223300      -2.142500      1.9999999E-04
 C  -0.8611000      -1.019000     -3.0000001E-04
 C   -1.614700      0.1346000     -3.0000001E-04
 C   -2.965500     -0.1148000     -1.9999999E-04
 C   -1.772200      -2.222200     -1.9999999E-04
 C   0.5346000     -0.9428000     -9.9999997E-05
 C   -1.081500       1.414900     -1.9999999E-04
 C    1.167700      0.3396000     -9.9999997E-05
 C   -3.151400      -1.568000     -3.0000001E-04
 C   0.3260000       1.498700       0.000000    
 C   -3.888300      0.9113000       0.000000    
 C    2.606400      0.4018000      9.9999997E-05
 C   -2.007500       2.480200       0.000000    
 C    1.310900      -2.106600      9.9999997E-05
 C   -3.394900       2.222800       0.000000    
 C    3.356100     -0.8044000      1.9999999E-04
 C    2.699300      -2.036900      1.9999999E-04
 C   -5.355600      0.6649000      7.9999998E-04
 C    3.350900       1.608700     -9.9999997E-05
 C    4.761300     -0.7751000      9.9999997E-05
 C    4.748700       1.623800       0.000000    
 C    5.454200      0.4311000      9.9999997E-05
 H   -1.645600      -2.815400     -0.9093000    
 H   -1.645600      -2.815300      0.9091000    
 H   0.7608000       2.495900      9.9999997E-05
 H   -1.658300       3.509900      9.9999997E-05
 H   0.8464000      -3.090500      1.9999999E-04
 H   -4.078900       3.068500      3.0000001E-04
 H    3.264200      -2.967400      3.0000001E-04
 H   -5.650000      0.1033000     -0.8917000    
 H   -5.924700       1.600900      3.9999999E-04
 H   -5.649100      0.1044000      0.8943000    
 H    2.855300       2.575900     -1.9999999E-04
 H    5.333900      -1.701000      1.9999999E-04
 H    5.279900       2.571100     -9.9999997E-05
 H    6.539800      0.4372000      1.9999999E-04


%chk=000076862-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076862

0 1
O -4.325442 -2.247458 0.000424
C -0.863515 -1.078339 -0.000076
C -1.630128 0.108242 -0.000059
C -3.039995 -0.132323 -0.000016
C -1.814853 -2.265426 0.000136
C 0.545764 -0.997257 -0.000052
C -1.051007 1.415300 0.000047
C 1.175161 0.330526 -0.000077
C -3.236474 -1.609902 -0.000440
C 0.369364 1.496265 -0.000003
C -3.948164 0.941703 0.000263
C 2.648504 0.405399 -0.000052
C -1.988646 2.505715 0.000221
C 1.374706 -2.184691 -0.000001
C -3.371963 2.265215 0.000338
C 3.422058 -0.812435 -0.000007
C 2.749849 -2.097076 0.000019
C -5.448186 0.742208 0.000394
C 3.359600 1.642484 -0.000070
C 4.847905 -0.750146 0.000012
C 4.762837 1.685283 -0.000039
C 5.518290 0.480511 0.000004
H -1.711406 -2.917902 -0.887845
H -1.711699 -2.917393 0.888531
H 0.834278 2.487185 0.000063
H -1.620531 3.538911 0.000319
H 0.881255 -3.162888 0.000012
H -4.057835 3.121201 0.000486
H 3.365202 -3.004777 0.000064
H -5.770185 0.155581 -0.879313
H -5.983025 1.707133 -0.000088
H -5.770151 0.156564 0.880783
H 2.811712 2.589586 -0.000107
H 5.415248 -1.688567 0.000051
H 5.276681 2.652878 -0.000050
H 6.612989 0.516291 0.000030


