%chk=000012452.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012452

0 1
 O   -4.931700       1.039700      0.9429000    
 O    5.675200     -0.1323000      0.7236000    
 C   -2.027400     -0.7227000      0.2081000    
 C   0.1748000      0.4480000      0.1459000    
 C   -2.787800      0.5855000     -0.1138000    
 C  -0.6489000     -0.7372000     -0.4617000    
 C    1.663800      0.4341000     -0.3559000    
 C  -0.5688000       1.799500     -1.2000000E-02
 C   -2.020500       1.750500      0.5055000    
 C   -3.044500      -1.820400     -9.0800002E-02
 C   -4.116900      0.2276000      0.5259000    
 C   -4.329500      -1.276700      0.5525000    
 C   9.3800001E-02  -2.034900     -0.2953000    
 C    2.282700     -0.9318000     -2.0900000E-02
 C    2.467700       1.543200      0.3740000    
 C   -3.079900      0.8491000      -1.603700    
 C    1.752700      0.6619000      -1.883400    
 C    1.415900      -2.100700     -8.6700000E-02
 C    3.971700       1.445600      0.1513000    
 C    3.565200      -1.090100      0.3482000    
 C    4.492500      6.1999999E-02  0.4463000    
 H   -1.856000     -0.7730000       1.297800    
 H   0.2205000      0.2748000       1.235000    
 H  -0.7814000     -0.5962000      -1.539800    
 H  -0.5687000       2.109800      -1.061900    
 H  -4.6799999E-02   2.585000      0.5449000    
 H   -2.010500       1.656100       1.599200    
 H   -2.520200       2.703000      0.2910000    
 H   -2.768000      -2.783900      0.3483000    
 H   -3.175100      -1.970400      -1.167800    
 H   -4.417000      -1.602500       1.592900    
 H   -5.215900      -1.557900     -2.0000000E-02
 H  -0.4626000      -2.964400     -0.3739000    
 H    2.273500       1.483500       1.454200    
 H    2.138700       2.538100      5.1500000E-02
 H   -2.172200      0.9647000      -2.201400    
 H   -3.675500      5.2200001E-02  -2.061600    
 H   -3.662700       1.771400      -1.717100    
 H    2.782700      0.5771000      -2.247700    
 H    1.168600     -6.9499999E-02  -2.450400    
 H    1.394400       1.659000      -2.159400    
 H    1.872300      -3.079900      3.5300002E-02
 H    4.475600       2.152500      0.8201000    
 H    4.241200       1.704500     -0.8774000    
 H    3.981800      -2.064100      0.5864000    


%chk=000012452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012452

0 1
O -5.001997 1.097335 0.992174
O 5.780815 -0.082630 0.769208
C -2.041173 -0.748535 0.200119
C 0.180616 0.435153 0.164432
C -2.797766 0.589260 -0.066544
C -0.641602 -0.743937 -0.455055
C 1.670063 0.435901 -0.351069
C -0.556359 1.796447 0.018517
C -2.013195 1.758572 0.563666
C -3.083919 -1.849538 -0.130963
C -4.180104 0.268001 0.536321
C -4.394522 -1.262422 0.470036
C 0.100315 -2.051839 -0.299062
C 2.295955 -0.923955 0.013968
C 2.476271 1.572123 0.345850
C -3.081599 0.866323 -1.578921
C 1.738947 0.599582 -1.901607
C 1.446380 -2.114208 -0.063680
C 4.000997 1.471220 0.127562
C 3.626487 -1.048744 0.360909
C 4.560408 0.083775 0.450364
H -1.873560 -0.797417 1.300775
H 0.237812 0.219354 1.256200
H -0.781422 -0.559652 -1.543944
H -0.565963 2.114833 -1.041958
H -0.002427 2.577582 0.570631
H -1.991617 1.630141 1.664486
H -2.519621 2.721585 0.365967
H -2.829402 -2.826479 0.314571
H -3.176854 -1.998522 -1.223041
H -4.566952 -1.624872 1.502066
H -5.309463 -1.500241 -0.101516
H -0.479547 -2.981217 -0.378620
H 2.266233 1.534186 1.434333
H 2.123895 2.555332 -0.017270
H -2.151013 1.041639 -2.145102
H -3.619922 0.035255 -2.068476
H -3.707980 1.771904 -1.667636
H 2.787106 0.610876 -2.246785
H 1.236293 -0.233578 -2.422826
H 1.266220 1.546434 -2.219869
H 1.934390 -3.088030 0.075520
H 4.544127 2.212380 0.740869
H 4.261916 1.696322 -0.926610
H 4.049532 -2.035901 0.590211


