%chk=000093315.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093315

0 1
 O   -2.793600       2.259700      0.6067000    
 O   -2.566300      -2.031900      -1.492500    
 O   -5.160800       1.461800       1.595800    
 O   -3.879800       3.097400      -1.275100    
 C    3.822800      0.1891000     -0.6720000    
 C    5.015300     -0.2713000      0.1727000    
 C    2.469600     -0.1988000     -7.0000000E-02
 C    6.369600      9.3000002E-02 -0.4397000    
 C    1.277300      0.2514000     -0.9218000    
 C    7.523900     -0.4003000      0.4359000    
 C  -7.8199998E-02 -7.0600003E-02 -0.2831000    
 C    8.879200     -6.6000000E-02 -0.1896000    
 C   -1.263800      0.3730000      -1.143200    
 C    10.03260     -0.5298000      0.7014000    
 C   -2.583300      0.1257000     -0.4946000    
 C    11.38680     -0.2257000      6.1200000E-02
 C   -3.248900      0.9960000      0.2874000    
 C   -3.158400      -1.225600     -0.7823000    
 C   -4.460700      -1.578200     -0.1918000    
 C   -5.140300     -0.6700000      0.6146000    
 C    12.53550     -0.7155000      0.9285000    
 C   -4.566200      0.6561000      0.8878000    
 C   -5.017800      -2.838100     -0.4455000    
 C   -6.378200      -1.016800       1.170600    
 C   -6.250900      -3.181900      0.1093000    
 C   -6.930100      -2.272400      0.9164000    
 C   -3.189300       3.234200     -0.2733000    
 C   -2.646000       4.555400      0.1862000    
 H    3.905700     -0.2437000      -1.676500    
 H    3.866200       1.278600     -0.7917000    
 H    4.959800      -1.359000      0.3047000    
 H    4.938300      0.1732000       1.172700    
 H    2.384200      0.2427000      0.9306000    
 H    2.427900      -1.287300      5.8899999E-02
 H    6.449200     -0.3510000      -1.439300    
 H    6.436400       1.180700     -0.5619000    
 H    1.344700       1.333200      -1.091000    
 H    1.337500     -0.2285000      -1.906300    
 H    7.452600      6.0199998E-02   1.428800    
 H    7.443100      -1.485200      0.5758000    
 H  -0.1329000      0.4175000      0.6985000    
 H  -0.1400000      -1.150900     -0.1007000    
 H    8.953900       1.016300     -0.3511000    
 H    8.956600     -0.5458000      -1.172800    
 H   -1.211400     -0.1023000      -2.130600    
 H   -1.156400       1.445600      -1.351400    
 H    9.966900     -3.4299999E-02   1.677700    
 H    9.946100      -1.608600      0.8803000    
 H    11.48930      0.8540000     -9.7700000E-02
 H    11.45070     -0.7060000     -0.9221000    
 H    12.51950     -0.2317000       1.910300    
 H    12.48040      -1.798500       1.077800    
 H    13.49410     -0.4866000      0.4525000    
 H   -4.508000      -3.565700      -1.071700    
 H   -6.927100     -0.3243000       1.803300    
 H   -6.681300      -4.159300     -8.8399999E-02
 H   -7.890100      -2.540600       1.348000    
 H   -3.058200       4.804400       1.167100    
 H   -2.938100       5.334400     -0.5239000    
 H   -1.554500       4.513800      0.2253000    


%chk=000093315-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093315

0 1
O -2.698557 2.284632 0.209010
O -2.580452 -2.219939 -1.472812
O -5.098016 1.693274 1.426812
O -4.366785 3.404471 -1.009703
C 3.856379 0.010275 -0.797863
C 5.039929 -0.427957 0.093912
C 2.475598 -0.306344 -0.179833
C 6.419952 -0.052848 -0.491434
C 1.293301 0.125580 -1.076283
C 7.604000 -0.495455 0.397508
C -0.081435 -0.136694 -0.423562
C 8.981978 -0.080812 -0.165908
C -1.258390 0.300747 -1.347966
C 10.167087 -0.525205 0.720720
C -2.600104 0.054835 -0.705755
C 11.543435 -0.091496 0.166429
C -3.281146 1.018065 0.002199
C -3.193991 -1.314576 -0.820731
C -4.519340 -1.583979 -0.178809
C -5.191896 -0.566877 0.555272
C 12.722082 -0.539038 1.057869
C -4.578837 0.782609 0.709758
C -5.109057 -2.863772 -0.304086
C -6.445663 -0.836260 1.153489
C -6.360022 -3.128191 0.293014
C -7.029480 -2.113683 1.021564
C -3.452390 3.457497 -0.176573
C -2.904111 4.657890 0.546006
H 3.939171 -0.484799 -1.787987
H 3.928273 1.101626 -0.989487
H 4.993370 -1.525698 0.252495
H 4.931838 0.034952 1.097474
H 2.393106 0.199924 0.804780
H 2.403627 -1.395041 0.023054
H 6.528240 -0.506503 -1.499024
H 6.465955 1.046579 -0.640231
H 1.388115 1.206382 -1.311814
H 1.348874 -0.412983 -2.044768
H 7.479769 -0.063728 1.413010
H 7.575666 -1.598053 0.524272
H -0.148329 0.412575 0.536273
H -0.185206 -1.214854 -0.194360
H 9.009672 1.022634 -0.287042
H 9.106116 -0.507209 -1.183616
H -1.200173 -0.284865 -2.283291
H -1.148144 1.372796 -1.588163
H 10.037680 -0.109181 1.742102
H 10.149570 -1.629814 0.831826
H 11.559379 1.012275 0.056504
H 11.672067 -0.506439 -0.854367
H 12.633714 -0.112521 2.075071
H 12.746336 -1.640717 1.158444
H 13.693442 -0.216593 0.639480
H -4.572386 -3.630247 -0.871845
H -6.940060 -0.035295 1.712028
H -6.814934 -4.119260 0.192814
H -8.000739 -2.321821 1.482467
H -3.275633 4.641361 1.586548
H -3.243993 5.581204 0.055239
H -1.803353 4.621765 0.585071


