%chk=000062929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062929

0 1
 O    4.641200     -0.7029000      0.2642000    
 O   -6.175900     -0.1319000     -0.9210000    
 C    2.188000     -0.3559000      0.2756000    
 C    1.368500      0.9175000     -3.1500001E-02
 C  -5.8499999E-02  0.8540000      0.5211000    
 C  -0.7945000     -0.3629000     -0.1124000    
 C    3.578800      5.9000000E-02 -0.2931000    
 C    1.484300      -1.549000     -0.3962000    
 C    2.282200       2.050000      0.4301000    
 C   1.4800000E-02  -1.675000      4.6100002E-02
 C   -2.248100     -0.4890000      0.4390000    
 C    3.711400       1.537200      0.1568000    
 C  -0.8403000       2.142300      0.2339000    
 C    2.321600     -0.6597000       1.797200    
 C   -2.249100       2.058900      0.8107000    
 C   -2.992500      0.8359000      0.3339000    
 C   -3.000800      -1.627400     -0.2803000    
 C    3.159000      -1.892400       2.012600    
 C    3.671400     -2.5699999E-02  -1.764000    
 C   -4.497400      -1.590600     -2.6100000E-02
 C   -4.253700      0.9527000     -0.1111000    
 C   -5.057600     -0.2506000     -0.4255000    
 C    3.747100     -9.4400004E-02  -2.959900    
 H    1.272300       1.025100      -1.123700    
 H  -2.5900001E-02  0.7274000       1.610200    
 H  -0.8671000     -0.1707000      -1.194400    
 H    1.990300      -2.506800     -0.2606000    
 H    1.463500      -1.399900      -1.483600    
 H    2.152000       2.264800       1.496600    
 H    2.085200       2.977300     -0.1180000    
 H  -0.4407000      -2.464400     -0.5632000    
 H  -3.9099999E-02  -2.024100       1.083200    
 H   -2.192600     -0.7398000       1.507900    
 H    4.202800       2.160800     -0.5999000    
 H    4.313200       1.626500       1.069600    
 H  -0.8904000       2.323100     -0.8476000    
 H  -0.3298000       3.004300      0.6785000    
 H    1.343500     -0.8168000       2.261200    
 H    2.768400      0.1769000       2.345400    
 H   -2.789700       2.979300      0.5587000    
 H   -2.189900       2.021300       1.906000    
 H   -2.616100      -2.599900      4.7200002E-02
 H   -2.824600      -1.561200      -1.362600    
 H    3.349200      -2.539600       1.156600    
 H    4.128400      -1.625000       2.450300    
 H    2.675300      -2.523300       2.769000    
 H    5.481400     -0.2851000      7.8999996E-03
 H   -4.727600      -1.766200       1.030300    
 H   -4.987600      -2.369000     -0.6208000    
 H   -4.752600       1.912600     -0.1886000    
 H    3.813300     -0.1554000      -4.021000    


%chk=000062929-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062929

0 1
O 4.715117 -0.735434 0.180664
O -6.303430 -0.229824 -0.882446
C 2.239321 -0.340068 0.281073
C 1.401591 0.956926 0.010463
C -0.046766 0.880243 0.532269
C -0.759954 -0.347794 -0.114530
C 3.618160 0.118290 -0.337808
C 1.530924 -1.515435 -0.424995
C 2.317581 2.110694 0.496079
C 0.065981 -1.651984 0.066637
C -2.229903 -0.512658 0.406325
C 3.761760 1.613941 0.158124
C -0.843265 2.169556 0.235727
C 2.427168 -0.605954 1.816811
C -2.287126 2.057456 0.780818
C -3.003348 0.804536 0.311008
C -2.965897 -1.661844 -0.333724
C 2.891399 -2.025523 2.217797
C 3.640604 0.065622 -1.817186
C -4.487651 -1.669718 -0.078187
C -4.299299 0.867180 -0.136123
C -5.121622 -0.324001 -0.427920
C 3.745737 0.042528 -3.046083
H 1.325639 1.048595 -1.096870
H -0.036977 0.741685 1.636050
H -0.822721 -0.139152 -1.207513
H 2.074450 -2.463844 -0.265208
H 1.527193 -1.333036 -1.517918
H 2.197684 2.270898 1.584508
H 2.080698 3.064926 -0.005749
H -0.412730 -2.476991 -0.492529
H 0.048576 -1.945767 1.136906
H -2.158790 -0.774997 1.489013
H 4.245457 2.243665 -0.608233
H 4.409919 1.610209 1.052861
H -0.866910 2.345177 -0.859389
H -0.345908 3.044801 0.695121
H 1.472024 -0.394688 2.334253
H 3.158667 0.116973 2.221838
H -2.880168 2.953949 0.522929
H -2.228422 2.023546 1.891263
H -2.541335 -2.636444 -0.033385
H -2.783396 -1.551596 -1.422265
H 2.132082 -2.793809 1.982924
H 3.828364 -2.288054 1.702447
H 3.070997 -2.065729 3.308892
H 5.536243 -0.531865 -0.336484
H -4.689388 -1.865993 0.996060
H -4.996175 -2.463895 -0.652366
H -4.807134 1.835162 -0.239642
H 3.819978 0.011841 -4.117606


