%chk=000111412.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111412

0 1
 O  -0.6215000      -2.922100       1.529600    
 O    1.928400      -2.691100      0.5819000    
 O    1.435000       2.066600      0.7653000    
 O   -2.225400     -0.7888000       1.756600    
 O    3.033000      0.2053000      -1.502200    
 C  -0.3115000      -1.805300      0.6984000    
 C    1.171400      -1.542100      0.7138000    
 C    1.692900     -0.3009000      0.8330000    
 C  -0.8102000      -2.118400     -0.7117000    
 C   -1.110700     -0.6290000       1.258100    
 C  -0.5294000      0.7419000       1.142200    
 C   0.7897000      0.8522000      0.9080000    
 C    3.170300     -3.1999999E-03  0.9006000    
 C   -1.514600       1.864900       1.296000    
 C    3.732900      0.2208000     -0.4889000    
 C   -2.261300      -2.492700     -0.6996000    
 C    5.228800      0.5336000     -0.5514000    
 C   -2.030300       2.334800     -2.8600000E-02
 C   -3.267800      -1.910600      -1.379000    
 C    5.854000     -1.7600000E-02  -1.830800    
 C    5.452400       2.037600     -0.4456000    
 C   -3.217500       2.913200     -0.2930000    
 C   -4.707900      -2.335300      -1.323400    
 C   -2.997300     -0.7455000      -2.293400    
 C   -3.677800       3.364200      -1.650300    
 C   -4.205500       3.167500      0.8145000    
 H  -0.5769000      -1.296600      -1.393400    
 H  -0.2750000      -2.993500      -1.105800    
 H    3.393500      0.8555000       1.541800    
 H    3.699100     -0.8618000       1.332600    
 H   -2.324800       1.567700       1.968500    
 H   -1.025700       2.710300       1.796100    
 H   -2.521400      -3.352400     -8.3099999E-02
 H    5.712200      3.4699999E-02  0.2972000    
 H  -0.2255000      -2.767700       2.404700    
 H    1.324900      -3.453400      0.5686000    
 H   -1.348800       2.221400     -0.8719000    
 H    5.437400      0.4652000      -2.721700    
 H    6.937400      0.1408000      -1.834300    
 H    5.667300      -1.093300      -1.920500    
 H    4.967600       2.569900      -1.271600    
 H    5.033900       2.431300      0.4867000    
 H    6.520500       2.277100     -0.4637000    
 H   0.7787000       2.781500      0.7788000    
 H   -5.331600      -1.522700     -0.9374000    
 H   -5.063800      -2.607900      -2.322100    
 H   -4.847300      -3.202700     -0.6700000    
 H   -2.116300     -0.1593000      -2.027300    
 H   -3.836900     -4.1200001E-02  -2.260500    
 H   -2.893400      -1.093700      -3.326100    
 H   -3.853500       4.444600      -1.656400    
 H   -2.934100       3.141100      -2.422300    
 H   -4.607200       2.855200      -1.925400    
 H   -5.037500       2.459300      0.7438000    
 H   -4.613600       4.180700      0.7253000    
 H   -3.780800       3.100800       1.818700    


%chk=000111412-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111412

0 1
O -0.665697 -3.294058 1.952971
O 1.886220 -2.652737 1.593316
O 0.664148 1.858066 0.472855
O -2.631615 -1.429525 1.795045
O 2.624755 -0.290398 -1.549411
C -0.446623 -2.150557 1.069469
C 0.970463 -1.673734 1.252620
C 1.325816 -0.375546 0.982640
C -0.581975 -2.631771 -0.449139
C -1.495720 -1.056264 1.324887
C -1.131118 0.291289 0.965961
C 0.236243 0.570343 0.771299
C 2.757897 0.077469 0.875347
C -2.192899 1.385366 0.990510
C 3.235022 0.235508 -0.583236
C -1.901612 -3.303381 -0.733149
C 4.493753 1.094732 -0.785334
C -2.097171 2.346180 -0.187117
C -2.951702 -2.795285 -1.442684
C 5.348967 0.592865 -1.967520
C 4.028337 2.566365 -1.005871
C -2.112937 3.717008 -0.165352
C -4.217107 -3.611493 -1.643284
C -2.984425 -1.411851 -2.066284
C -2.066357 4.512622 -1.460095
C -2.201286 4.558418 1.096327
H -0.386319 -1.767208 -1.104938
H 0.243100 -3.353961 -0.604377
H 2.927469 1.035060 1.400886
H 3.421978 -0.673477 1.348451
H -3.175834 0.874142 0.976975
H -2.156249 1.936273 1.950876
H -2.008758 -4.310927 -0.308306
H 5.086840 1.061895 0.151395
H -1.606061 -3.196142 2.284332
H 1.361883 -3.430618 1.942666
H -2.058980 1.853111 -1.171421
H 4.736265 0.541521 -2.884094
H 6.199565 1.275703 -2.145533
H 5.750306 -0.418528 -1.775441
H 3.467492 2.644871 -1.954410
H 3.370888 2.917497 -0.190525
H 4.907121 3.233841 -1.062039
H -0.127989 2.427904 0.216260
H -5.095017 -3.082323 -1.222054
H -4.425996 -3.767407 -2.720557
H -4.149522 -4.600436 -1.158349
H -2.024946 -0.875839 -1.986579
H -3.760483 -0.792805 -1.572435
H -3.258184 -1.472069 -3.137962
H -1.208148 5.212954 -1.469437
H -1.988935 3.857865 -2.344728
H -2.978798 5.131496 -1.570052
H -3.162407 5.109072 1.118579
H -1.400728 5.323227 1.114491
H -2.134432 3.966574 2.022956


