%chk=000170044.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170044

0 1
 O   -6.056300      0.2399000      -1.143800    
 C    2.298700      0.2291000      0.1931000    
 C    1.438200     -0.9686000     -0.2630000    
 C   2.9400000E-02 -0.9551000      0.3395000    
 C  -0.6915000      0.3593000     -9.5600002E-02
 C    3.620700     -0.1266000     -0.5300000    
 C    1.616900       1.510700     -0.3052000    
 C    2.339600      -2.174100     -1.3600000E-02
 C   -2.171500      0.4524000      0.4427000    
 C   0.1682000       1.618400      0.2040000    
 C    3.757200      -1.651700     -0.3121000    
 C  -0.7843000      -2.174700     -0.1113000    
 C    2.506600      0.3114000       1.726400    
 C    4.860600      0.6458000     -0.1029000    
 C   -2.913100     -0.8537000      0.1299000    
 C   -2.194000      -2.139200      0.4647000    
 C   -2.875100       1.646500     -0.2659000    
 C   -2.217800      0.6794000       1.970700    
 C   -4.389600       1.628500     -0.1316000    
 C   -4.149600     -0.9085000     -0.3930000    
 C    6.090800      0.1637000     -0.8717000    
 C    4.660200       2.147800     -0.3061000    
 C   -4.944400      0.3191000     -0.6253000    
 H    1.311600     -0.9078000      -1.357200    
 H   0.1036000     -0.9938000       1.431500    
 H  -0.7642000      0.3104000      -1.194500    
 H    3.476000      3.1399999E-02  -1.610200    
 H    1.605000       1.531800      -1.402500    
 H    2.128700       2.417000      2.0099999E-02
 H    2.083600      -3.018200     -0.6622000    
 H    2.269900      -2.520000       1.023700    
 H   0.1834000       1.819700       1.279800    
 H  -0.2833000       2.498600     -0.2670000    
 H    4.418900      -1.895200      0.5270000    
 H    4.167200      -2.133900      -1.206500    
 H  -0.2941000      -3.098600      0.2169000    
 H  -0.8336000      -2.212800      -1.207300    
 H    3.056400     -0.5493000       2.119900    
 H    3.067400       1.208500       2.007000    
 H    1.563100      0.3575000       2.276900    
 H    5.073300      0.4737000      0.9593000    
 H   -2.147200      -2.246300       1.555600    
 H   -2.745600      -3.012300      9.4700001E-02
 H   -2.630200       1.631500      -1.337300    
 H   -2.504100       2.602000      0.1235000    
 H   -1.619600     -5.5500001E-02   2.518000    
 H   -1.846100       1.672900       2.242500    
 H   -3.241000      0.6059000       2.357500    
 H   -4.813100       2.436400     -0.7385000    
 H   -4.708800       1.778100      0.9046000    
 H   -4.637500      -1.852300     -0.6127000    
 H    5.954800      0.2807000      -1.952400    
 H    6.978100      0.7380000     -0.5830000    
 H    6.312100     -0.8885000     -0.6680000    
 H    4.186100       2.376300      -1.265900    
 H    5.627000       2.665400     -0.2965000    
 H    4.089400       2.595400      0.5095000    


%chk=000170044-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170044

0 1
O -6.186594 0.247823 -1.207301
C 2.308325 0.273962 0.207836
C 1.434929 -0.957035 -0.210958
C 0.008039 -0.960674 0.379628
C -0.727118 0.340641 -0.071880
C 3.656293 -0.090010 -0.520823
C 1.566716 1.537353 -0.303956
C 2.350486 -2.176591 0.044365
C -2.220266 0.441597 0.452343
C 0.112242 1.612173 0.235060
C 3.780397 -1.645278 -0.301604
C -0.788171 -2.203889 -0.075238
C 2.531702 0.350720 1.742530
C 4.960967 0.663265 -0.132614
C -2.954031 -0.866471 0.103848
C -2.246771 -2.165201 0.442701
C -2.914869 1.645382 -0.258845
C -2.278997 0.633978 2.002001
C -4.454139 1.630979 -0.160870
C -4.209803 -0.887624 -0.450755
C 6.156198 0.129481 -0.965401
C 4.869458 2.199522 -0.306534
C -5.036578 0.314703 -0.672296
H 1.313040 -0.873981 -1.317106
H 0.077251 -0.983170 1.488462
H -0.806370 0.267799 -1.182409
H 3.487307 0.095315 -1.606231
H 1.544163 1.513145 -1.414358
H 2.096304 2.464336 -0.016988
H 2.070975 -3.050143 -0.571260
H 2.288710 -2.494745 1.103294
H 0.142194 1.788588 1.327360
H -0.377658 2.498582 -0.209441
H 4.490309 -1.858697 0.520849
H 4.185053 -2.139606 -1.202649
H -0.295981 -3.126906 0.284888
H -0.790688 -2.248735 -1.184104
H 3.079489 -0.530855 2.121049
H 3.124195 1.246657 2.004078
H 1.582123 0.413572 2.301424
H 5.175742 0.449404 0.936360
H -2.222212 -2.277434 1.548140
H -2.824574 -3.022969 0.052388
H -2.630493 1.628580 -1.330891
H -2.531652 2.594025 0.160174
H -1.737167 -0.164392 2.538758
H -1.834098 1.601444 2.294853
H -3.324548 0.622014 2.358035
H -4.904941 2.462811 -0.730552
H -4.778992 1.757295 0.892376
H -4.683468 -1.842733 -0.713860
H 5.984365 0.301812 -2.046142
H 7.091301 0.650515 -0.686626
H 6.316539 -0.952870 -0.816764
H 4.545896 2.461848 -1.332410
H 5.857874 2.666599 -0.136376
H 4.158699 2.660589 0.400644


