%chk=000010576.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010576

0 1
 O    4.522200       1.364900      0.7242000    
 O   -5.778500      0.1273000      0.9656000    
 C    2.587400      0.3886000     -0.4383000    
 C    1.784600     -0.9075000     -0.1838000    
 C   0.3041000     -0.8272000     -0.6074000    
 C  -0.4299000      0.4125000     -4.5000002E-02
 C    3.877900      0.1344000      0.4048000    
 C    1.806700       1.626200      8.2999997E-02
 C    2.034600      -1.223700       1.302100    
 C   0.3543000       1.690400     -0.3911000    
 C    3.345500     -0.5307000       1.685700    
 C   -1.906800      0.4800000     -0.5503000    
 C  -0.4563000      -2.110900     -0.2433000    
 C    2.888200      0.5864000      -1.935300    
 C   -1.874400      -2.078500     -0.7986000    
 C   -2.624100     -0.8484000     -0.3533000    
 C    4.927200     -0.7674000     -0.2610000    
 C   -2.655700       1.641900      0.1360000    
 C   -4.159600       1.566700     -6.0699999E-02
 C   -3.866700     -0.9645000      0.1416000    
 C   -4.680600      0.2395000      0.4251000    
 H    2.236900      -1.724600     -0.7642000    
 H   0.2940000     -0.7448000      -1.704300    
 H  -0.4593000      0.3273000       1.050400    
 H    2.318800       2.547400     -0.2231000    
 H    1.796200       1.642200       1.179800    
 H    2.105700      -2.306100       1.457600    
 H    1.230800     -0.8598000       1.949900    
 H  -0.1084000       2.561100      8.6400002E-02
 H   0.3158000       1.874400      -1.470900    
 H    3.160200      0.2128000       2.470700    
 H    4.057700      -1.247100       2.110800    
 H   -1.894900      0.6755000      -1.632100    
 H  -0.4961000      -2.241000      0.8452000    
 H   6.7299999E-02  -2.984000     -0.6512000    
 H    3.570500       1.430000      -2.087400    
 H    3.348400     -0.3024000      -2.379600    
 H    1.982200      0.7857000      -2.515100    
 H   -2.394700      -2.996000     -0.4982000    
 H   -1.836900      -2.084900      -1.895400    
 H    5.369700     -0.2790000      -1.136000    
 H    5.762000     -0.9550000      0.4251000    
 H    4.519800      -1.735700     -0.5651000    
 H   -2.302800       2.602600     -0.2551000    
 H   -2.439500       1.636200       1.213000    
 H    5.238900       1.173100       1.353000    
 H   -4.430600       1.684900      -1.115300    
 H   -4.642600       2.365900      0.5119000    
 H   -4.344800      -1.927500      0.2831000    


%chk=000010576-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010576

0 1
O 4.531426 1.463925 0.649805
O -5.964179 0.135085 0.828283
C 2.611763 0.379105 -0.450149
C 1.796193 -0.926465 -0.173447
C 0.306079 -0.850050 -0.604147
C -0.426932 0.391000 -0.026670
C 3.906206 0.139622 0.411147
C 1.830797 1.610106 0.108865
C 2.046348 -1.245463 1.338820
C 0.364541 1.676651 -0.374410
C 3.365144 -0.505160 1.726358
C -1.915207 0.477333 -0.517890
C -0.453129 -2.148942 -0.254450
C 2.925762 0.598023 -1.946600
C -1.902121 -2.102166 -0.794746
C -2.648318 -0.855204 -0.358838
C 4.949373 -0.778129 -0.262324
C -2.670488 1.633093 0.191196
C -4.194685 1.592824 -0.042704
C -3.937236 -0.935784 0.106187
C -4.788336 0.243721 0.361422
H 2.251147 -1.744329 -0.772724
H 0.290671 -0.747809 -1.713971
H -0.457860 0.290810 1.081331
H 2.370775 2.531839 -0.171951
H 1.832665 1.584407 1.215215
H 2.122952 -2.334761 1.504088
H 1.207719 -0.889591 1.964332
H -0.113506 2.560348 0.088033
H 0.321101 1.837090 -1.472228
H 3.166276 0.298843 2.457558
H 4.107472 -1.187479 2.180286
H -1.875426 0.696607 -1.611911
H -0.473519 -2.287850 0.844276
H 0.074095 -3.024767 -0.682020
H 3.678021 1.399757 -2.062551
H 3.316952 -0.318224 -2.425858
H 2.025034 0.902055 -2.508696
H -2.466070 -3.006773 -0.502065
H -1.852690 -2.102683 -1.906072
H 5.340087 -0.325617 -1.189346
H 5.802603 -0.945979 0.424330
H 4.527904 -1.770218 -0.506196
H -2.274286 2.606918 -0.147784
H -2.471146 1.565542 1.280133
H 5.392074 1.322443 1.119502
H -4.416803 1.747444 -1.119720
H -4.716793 2.392198 0.511665
H -4.418049 -1.912143 0.250536


