%chk=000128864.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128864

0 1
 O   -3.026000      -1.540300       1.603200    
 O   -1.103800      -1.633600       2.816500    
 C    1.109200      -2.423400      -1.773800    
 C    1.884700      -1.137100      -1.471800    
 C   0.9698000      -3.410600     -0.6102000    
 C    3.352800      -1.381800      -1.109700    
 C   0.3162000      -2.862500      0.6639000    
 C    4.134000     -9.5200002E-02 -0.8173000    
 C    1.147200       3.375900      0.8610000    
 C    2.526400       2.819900       1.233000    
 C   -1.134700      -2.410200      0.5070000    
 C   0.1369000       2.270100      0.5269000    
 C    3.532800      0.7294000      0.2830000    
 C    3.135700       2.001100      0.1317000    
 C   -1.247900       2.803900      0.1462000    
 C   -1.707400      -1.816300       1.770000    
 C   -2.224700       1.715600     -0.1959000    
 C   -2.811800       1.591700      -1.395600    
 C   -3.778900      0.4986000      -1.740900    
 C   -5.210400      0.9048000      -1.427100    
 H    1.595500      -2.941900      -2.609800    
 H   0.1098000      -2.149100      -2.132400    
 H    1.843700     -0.4938000      -2.359800    
 H    1.373200     -0.5920000     -0.6727000    
 H   0.3857000      -4.271400     -0.9595000    
 H    1.958900      -3.806400     -0.3513000    
 H    3.412800      -2.030000     -0.2274000    
 H    3.847800      -1.917100      -1.929000    
 H   0.9213000      -2.039300       1.062400    
 H   0.3532000      -3.648400       1.429800    
 H    5.158300     -0.3614000     -0.5303000    
 H    4.211300      0.4914000      -1.741100    
 H   0.7685000       3.975000       1.697800    
 H    1.242800       4.052800      2.7999999E-03
 H    2.442700       2.233200       2.156000    
 H    3.197700       3.658700       1.452400    
 H   -1.206100      -1.643000     -0.2710000    
 H   -1.751800      -3.267700      0.2165000    
 H   0.5093000       1.668000     -0.3101000    
 H   4.4399999E-02   1.593700       1.386500    
 H    3.422200      0.2463000       1.250800    
 H    3.256400       2.488100     -0.8328000    
 H   -1.657000       3.379200      0.9856000    
 H   -1.145400       3.504900     -0.6915000    
 H   -2.455200       1.000800      0.5886000    
 H   -2.593900       2.315300      -2.177000    
 H   -3.532100     -0.4171000      -1.190600    
 H   -3.681800      0.2583000      -2.805700    
 H   -3.427200      -1.165500       2.416100    
 H   -5.899800      0.1008000      -1.704500    
 H   -5.341700       1.107600     -0.3588000    
 H   -5.498100       1.803400      -1.983200    


%chk=000128864-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128864

0 1
O -3.083310 -1.775168 1.660058
O -1.084131 -1.043227 2.578620
C 1.146379 -2.518607 -1.846081
C 1.944723 -1.206156 -1.643497
C 1.017792 -3.412245 -0.583498
C 3.412714 -1.415642 -1.207055
C 0.390091 -2.728704 0.655447
C 4.177326 -0.083106 -0.963436
C 1.155381 3.318923 0.993098
C 2.569566 2.756927 1.313870
C -1.067889 -2.271876 0.423920
C 0.106384 2.219029 0.718608
C 3.612131 0.704742 0.202171
C 3.169898 1.988403 0.153426
C -1.275284 2.799471 0.311331
C -1.681255 -1.640434 1.655183
C -2.309050 1.724001 0.050343
C -2.920113 1.492291 -1.142171
C -3.948082 0.410610 -1.410180
C -5.320157 0.992040 -1.841348
H 1.628781 -3.117216 -2.646151
H 0.135017 -2.265450 -2.225081
H 1.934261 -0.632330 -2.593445
H 1.435110 -0.563971 -0.898379
H 0.418932 -4.309163 -0.845389
H 2.020257 -3.788772 -0.299705
H 3.448216 -2.013337 -0.273664
H 3.945552 -2.007804 -1.979190
H 0.995110 -1.858080 0.969179
H 0.411659 -3.438679 1.505162
H 5.243275 -0.324725 -0.766788
H 4.153876 0.537063 -1.881759
H 0.817005 3.951783 1.839066
H 1.223770 3.987415 0.109083
H 2.516224 2.102823 2.206639
H 3.231282 3.608627 1.578826
H -1.112909 -1.508685 -0.379896
H -1.708761 -3.110024 0.096112
H 0.471664 1.556944 -0.091036
H -0.008665 1.578337 1.616875
H 3.546696 0.160501 1.159663
H 3.225329 2.532239 -0.804857
H -1.627503 3.469484 1.125007
H -1.156793 3.431100 -0.592058
H -2.557421 1.078073 0.908520
H -2.673587 2.145559 -1.996325
H -4.070646 -0.222872 -0.510970
H -3.580948 -0.255668 -2.219525
H -3.447107 -1.329361 2.473749
H -6.040742 0.184788 -2.069379
H -5.747169 1.622390 -1.040580
H -5.217385 1.621138 -2.745614


