%chk=000001252.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001252

0 1
 O    2.586000      -1.842400      0.4010000    
 O    2.662100     -0.9476000      -1.801900    
 O    3.258000       3.203000       1.021900    
 C   -3.422200       1.031700      0.1680000    
 C   -2.113700      0.2636000      0.4129000    
 C   -1.013300      0.4179000     -0.3688000    
 C   -3.423800       1.736400      -1.215300    
 C   -2.076100     -0.7189000       1.572600    
 C  -0.9788000       1.361100      -1.551900    
 C   -2.093600       2.400000      -1.533000    
 C   0.2256000     -0.3709000     -0.1454000    
 C   -1.190600      -2.463500     -0.1436000    
 C   -2.051500      -2.186600       1.112100    
 C   0.1529000      -1.729900     -6.3299999E-02
 C   -3.595400       2.089700       1.278100    
 C   -4.649200      9.3500003E-02  0.1824000    
 C    1.562900      0.2461000     -3.8400002E-02
 C    1.392200      -2.582700      0.1355000    
 C    2.716400     -0.6614000     -0.3988000    
 C   -1.111400      -3.975100     -0.3949000    
 C    1.743300       1.486900      0.4462000    
 C    4.064000     -6.9100000E-02 -8.8299997E-02
 C    3.100000       2.048900      0.6379000    
 C    4.256200       1.169300      0.3750000    
 H   -4.225200       2.484600      -1.263300    
 H   -3.641200       1.005700      -2.007000    
 H   -1.190200     -0.5132000       2.189500    
 H   -2.915000     -0.5716000       2.260500    
 H  -2.8100001E-02   1.899300      -1.619600    
 H   -1.060100      0.7609000      -2.467900    
 H   -1.868600       3.180500     -0.7970000    
 H   -2.148200       2.895100      -2.509500    
 H   -1.727100      -2.069700      -1.019300    
 H   -1.701500      -2.802000       1.951200    
 H   -3.080100      -2.510200      0.9051000    
 H   -4.488200       2.701400       1.104200    
 H   -3.709400       1.627600       2.265100    
 H   -2.735100       2.765800       1.333500    
 H   -4.526900     -0.7301000     -0.5308000    
 H   -4.828600     -0.3444000       1.169600    
 H   -5.560900      0.6375000     -9.2299998E-02
 H    1.252800      -3.249500      0.9923000    
 H    1.572000      -3.201400     -0.7505000    
 H   -2.116100      -4.392000     -0.5281000    
 H  -0.5435000      -4.194800      -1.305000    
 H  -0.6452000      -4.505700      0.4417000    
 H   0.9172000       2.124900      0.7431000    
 H    4.937300     -0.6919000     -0.2695000    
 H    3.561200      -1.123400      -2.126300    
 H    5.250200       1.555000      0.5681000    


%chk=000001252-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001252

0 1
O 2.606116 -1.893954 0.487042
O 2.750768 -0.971273 -1.731707
O 3.198125 3.408399 0.719004
C -3.415432 1.046045 0.190854
C -2.103229 0.255902 0.376017
C -1.006059 0.422056 -0.435663
C -3.431603 1.800029 -1.173993
C -2.018579 -0.736930 1.537972
C -0.993771 1.373628 -1.630930
C -2.080866 2.458989 -1.513716
C 0.225007 -0.405979 -0.208997
C -1.204037 -2.491133 -0.191911
C -2.070263 -2.226173 1.084052
C 0.143556 -1.781773 -0.083451
C -3.559568 2.072250 1.357503
C -4.642006 0.086125 0.217313
C 1.536750 0.243030 -0.071544
C 1.359497 -2.630230 0.207665
C 2.744437 -0.658584 -0.285520
C -1.128307 -4.004287 -0.499050
C 1.717696 1.565367 0.258388
C 4.073783 -0.070565 0.118192
C 3.046083 2.166226 0.461104
C 4.220331 1.248466 0.409529
H -4.244777 2.552057 -1.154833
H -3.681713 1.078715 -1.979666
H -1.062670 -0.580899 2.074266
H -2.823517 -0.559656 2.273834
H 0.005219 1.829368 -1.749390
H -1.158725 0.782768 -2.557729
H -1.799969 3.186186 -0.726833
H -2.157762 3.025405 -2.461098
H -1.745374 -1.999483 -1.026449
H -1.723564 -2.869692 1.918648
H -3.110309 -2.530045 0.852000
H -4.537829 2.585904 1.295100
H -3.500052 1.579659 2.345255
H -2.763289 2.836375 1.315840
H -4.555312 -0.691041 -0.564802
H -4.760385 -0.417023 1.193844
H -5.568198 0.660455 0.024444
H 1.203384 -3.254327 1.107147
H 1.543882 -3.314941 -0.646291
H -2.149992 -4.416595 -0.590072
H -0.601979 -4.205781 -1.449842
H -0.620375 -4.571442 0.303528
H 0.858748 2.223895 0.427529
H 4.917346 -0.772980 0.126699
H 3.625870 -1.384688 -1.957957
H 5.194413 1.690569 0.646474


