%chk=000094162.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094162

0 1
 O   0.4585000       3.080700     -0.4030000    
 O    3.248800      -2.563400      0.1148000    
 C   -2.034700      0.4868000      0.2643000    
 C   -1.314900     -0.7093000     -0.4565000    
 C   -3.595600      0.3866000      0.4330000    
 C   -1.834600      -2.041500      0.1508000    
 C   -3.973700      -1.011600      0.9735000    
 C   -3.354800      -2.154400      0.1853000    
 C   -1.567900       1.826400     -0.3217000    
 C   0.2034000     -0.5285000     -0.2328000    
 C   -1.500400     -0.7539000      -1.991200    
 C   -4.074600       1.416900       1.490100    
 C   -4.393200      0.6852000     -0.8515000    
 C   0.7740000      0.7580000     -0.1603000    
 C  -6.5600000E-02   1.975000     -0.2898000    
 C    1.074300      -1.632000     -0.1475000    
 C    2.155800      0.9251000      1.8800000E-02
 C    2.988900     -0.1854000      0.1191000    
 C    2.449400      -1.462600      3.2099999E-02
 C    4.455800      1.4100000E-02  0.3111000    
 C    4.787900      0.7349000       1.631900    
 C    5.113200      0.7532000     -0.8705000    
 H   -1.648800      0.4653000       1.298900    
 H   -1.458000      -2.151200       1.177400    
 H   -1.452700      -2.902200     -0.4123000    
 H   -5.064300      -1.133900      0.9865000    
 H   -3.646200      -1.100400       2.018500    
 H   -3.764100      -2.190400     -0.8293000    
 H   -3.630300      -3.104500      0.6589000    
 H   -1.968800       2.654800      0.2711000    
 H   -1.897800       1.962800      -1.355800    
 H   -1.167800      0.1658000      -2.483200    
 H  -0.9077000      -1.567400      -2.430100    
 H   -2.531100     -0.9375000      -2.291900    
 H   -5.134500       1.269800       1.730200    
 H   -3.511200       1.320800       2.425000    
 H   -3.967900       2.447200       1.136500    
 H   -4.228100     -4.8200000E-02  -1.639300    
 H   -5.470900      0.6756000     -0.6465000    
 H   -4.159300       1.675100      -1.255500    
 H   0.6885000      -2.644100     -0.2310000    
 H    2.579300       1.924500      7.9400003E-02
 H    4.959400     -0.9589000      0.3699000    
 H    2.701200      -3.363000      3.4400001E-02
 H    4.409500       1.762600       1.644500    
 H    5.871900      0.7778000       1.783900    
 H    4.349400      0.2049000       2.484700    
 H    4.908300      0.2363000      -1.814600    
 H    6.200000      0.7963000     -0.7395000    
 H    4.748800       1.781700     -0.9647000    


%chk=000094162-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094162

0 1
O 0.449832 3.165143 -0.191711
O 3.307862 -2.576905 0.142373
C -2.075414 0.477420 0.289863
C -1.337876 -0.715493 -0.437526
C -3.646402 0.390842 0.413673
C -1.847309 -2.062714 0.161281
C -4.025971 -1.021178 0.955665
C -3.386582 -2.178348 0.163592
C -1.583633 1.833732 -0.262995
C 0.178508 -0.531913 -0.188808
C -1.515797 -0.744167 -1.990668
C -4.123777 1.434332 1.466158
C -4.413907 0.680882 -0.905893
C 0.761694 0.771745 -0.113603
C -0.068405 2.005189 -0.189086
C 1.050484 -1.639269 -0.104798
C 2.167177 0.917400 0.039857
C 3.043960 -0.177614 0.125303
C 2.446651 -1.467348 0.051684
C 4.554068 0.001543 0.289144
C 4.890452 0.743636 1.610360
C 5.164752 0.740944 -0.931342
H -1.716724 0.413984 1.343068
H -1.481003 -2.154421 1.204738
H -1.422986 -2.913354 -0.407628
H -5.129895 -1.120861 0.960252
H -3.695960 -1.093597 2.013891
H -3.772965 -2.196168 -0.874027
H -3.678325 -3.145886 0.616420
H -2.029037 2.685808 0.279038
H -1.880617 1.958816 -1.323548
H -1.218347 0.208773 -2.461318
H -0.869509 -1.532873 -2.417735
H -2.553582 -0.963053 -2.289338
H -5.191050 1.267375 1.705803
H -3.548994 1.348723 2.407905
H -4.028485 2.472571 1.100430
H -4.264444 -0.096419 -1.672750
H -5.499113 0.734544 -0.696504
H -4.115628 1.650489 -1.343598
H 0.647741 -2.658205 -0.157620
H 2.551628 1.942583 0.089564
H 5.007167 -1.004519 0.338954
H 2.797548 -3.422373 0.081762
H 4.466403 1.764909 1.615240
H 5.985887 0.831522 1.733558
H 4.486723 0.203774 2.485734
H 4.959655 0.197632 -1.871301
H 6.260910 0.831285 -0.816696
H 4.749436 1.760980 -1.030719


