%chk=000148024.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148024

0 1
 O   1.2600000E-02  -2.069000     -0.5975000    
 O    5.737500     -0.1771000      0.7260000    
 O   2.8300000E-02   2.508400       1.079000    
 O    5.246900       2.407500      -1.408100    
 C    2.238400      -1.141500     -0.1574000    
 C    1.646400      8.3200000E-02  0.5821000    
 C    1.301600      -2.365100     -1.9500000E-02
 C    3.682200      -1.351200      0.3134000    
 C    4.551600     -0.1427000     -6.5300003E-02
 C   0.1999000      0.2589000      0.1589000    
 C    2.551600       1.284700      0.3997000    
 C    3.862600       1.192300      0.1063000    
 C  -0.5103000     -0.8200000     -0.3911000    
 C    1.829800      -3.549900     -0.8482000    
 C    1.088400      -2.851300       1.422800    
 C  -0.4986000       1.457400      0.3859000    
 C   -1.848600     -0.6739000     -0.7774000    
 C    4.708200       2.418500     -0.1007000    
 C   -2.509100      0.5352000     -0.5819000    
 C   -1.836700       1.598000      9.4999997E-03
 C   -3.936800      0.6820000     -0.9845000    
 C   -4.949800      0.2955000      0.1092000    
 C   -6.402900      0.3970000     -0.3646000    
 C   -7.375400     -1.9099999E-02  0.7398000    
 C   -8.818000      4.2300001E-02  0.2635000    
 H    2.273400     -0.8973000      -1.232700    
 H    1.621500     -0.1130000       1.663200    
 H    4.129900      -2.244800     -0.1347000    
 H    3.713400      -1.516100       1.398400    
 H    4.854600     -0.2492000      -1.113600    
 H    2.162600       2.286800      0.5221000    
 H    1.086800      -4.355500     -0.8917000    
 H    2.013600      -3.248500      -1.885900    
 H    2.753300      -3.967900     -0.4370000    
 H   0.6041000      -2.094100       2.046900    
 H   0.4174000      -3.718700       1.439300    
 H    2.030000      -3.142500       1.898000    
 H   -2.376100      -1.517700      -1.217300    
 H    5.524600       2.467300      0.6275000    
 H    4.123800       3.338100      7.1000000E-03
 H   -2.366300       2.529500      0.1969000    
 H    5.482000     -5.7700001E-02   1.656900    
 H   -4.123600       1.717300      -1.299400    
 H   -4.122600      7.3799998E-02  -1.879900    
 H   -4.803600      0.9412000      0.9844000    
 H   -4.748700     -0.7310000      0.4417000    
 H  -0.6208000       3.229800       1.137000    
 H    5.982200       1.771500      -1.422400    
 H   -6.616000       1.426100     -0.6776000    
 H   -6.545800     -0.2450000      -1.242200    
 H   -7.253800      0.6370000       1.609400    
 H   -7.150600      -1.040200       1.069400    
 H   -8.980100     -0.6300000     -0.5852000    
 H   -9.496100     -0.2575000       1.068600    
 H   -9.085700       1.057600     -4.6000000E-02


%chk=000148024-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148024

0 1
O 0.063718 -2.022936 -0.725221
O 5.921706 -0.128744 0.500181
O 0.086318 2.458887 1.254038
O 5.938812 2.141000 -1.111107
C 2.268874 -1.133951 -0.141659
C 1.671452 0.105214 0.581503
C 1.351070 -2.374843 -0.017325
C 3.726243 -1.327128 0.330827
C 4.581391 -0.148668 -0.170957
C 0.198947 0.281961 0.203381
C 2.569476 1.309720 0.290681
C 3.888412 1.199773 -0.023972
C -0.508726 -0.768547 -0.448165
C 1.864816 -3.578920 -0.819601
C 1.010356 -2.769189 1.434700
C -0.558282 1.444573 0.504508
C -1.851784 -0.624476 -0.870093
C 4.772863 2.428837 -0.271296
C -2.558829 0.567729 -0.612070
C -1.900593 1.602493 0.097932
C -4.016646 0.716312 -1.021443
C -5.004249 0.217756 0.070764
C -6.483822 0.383275 -0.340636
C -7.474553 -0.123905 0.732313
C -8.951679 0.056303 0.320074
H 2.292588 -0.895938 -1.226601
H 1.715954 -0.077134 1.680538
H 4.162383 -2.270350 -0.041725
H 3.759092 -1.358499 1.440071
H 4.863179 -0.301652 -1.228149
H 2.106105 2.298549 0.372875
H 1.053172 -4.319091 -0.925507
H 2.184832 -3.272448 -1.830879
H 2.712784 -4.067884 -0.309507
H 0.465547 -1.964320 1.957092
H 0.372562 -3.669903 1.438728
H 1.930419 -2.994756 2.004576
H -2.326379 -1.464245 -1.387411
H 5.098869 2.858838 0.702887
H 4.204784 3.208456 -0.805518
H -2.439758 2.530511 0.333678
H 5.779971 -0.004432 1.474023
H -4.241318 1.778564 -1.243348
H -4.204931 0.148466 -1.953407
H -4.814462 0.771109 1.012890
H -4.793522 -0.848512 0.288802
H -0.545006 3.199532 1.431364
H 6.454148 1.428121 -0.638683
H -6.690025 1.453838 -0.552094
H -6.664875 -0.160570 -1.291695
H -7.286527 0.412910 1.684666
H -7.273623 -1.195528 0.935511
H -9.172556 -0.494734 -0.613675
H -9.639371 -0.314982 1.102056
H -9.186124 1.122958 0.142185


