%chk=000001768.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001768

0 1
 O    1.767200       4.640100       1.530200    
 O    4.768000      -1.241100      -1.520300    
 O    2.753600     -0.5251000      -2.307800    
 C   -1.148500      -3.210300      0.5586000    
 C   0.2438000      -2.602800      0.3681000    
 C   -2.262800      -2.391700     -9.9900000E-02
 C    1.307000      -3.420300       1.106300    
 C   -3.661300      -2.959000      0.1570000    
 C    2.724300      -2.870100      0.9331000    
 C   -4.737800      -2.111100     -0.5264000    
 C    3.791800      -3.719200       1.605400    
 C   -4.734000     -0.7078000      5.4000001E-03
 C    2.707000       2.670800      0.5528000    
 C    2.599400       1.570300     -0.5052000    
 C    1.536300       3.661700      0.5122000    
 C    3.794000      0.6252000     -0.4519000    
 C   -4.558000      0.3799000     -0.7601000    
 C   -4.525900       1.779300     -0.2190000    
 C   0.2080000       3.007300      0.7829000    
 C  -0.8918000       3.023600      1.3000000E-02
 C   -3.212500       2.443400     -0.5169000    
 C    3.685200     -0.4260000      -1.522300    
 C   -2.153300       2.382600      0.3049000    
 H   -1.358700      -3.295700       1.632100    
 H   -1.160900      -4.228800      0.1512000    
 H   0.2524000      -1.571700      0.7418000    
 H   0.4832000      -2.561400     -0.7011000    
 H   -2.193600      -1.366000      0.2805000    
 H   -2.080000      -2.343200      -1.180600    
 H    1.064400      -3.453300       2.175600    
 H    1.279300      -4.455600      0.7439000    
 H   -3.849600      -3.008600       1.236700    
 H   -3.718000      -3.985000     -0.2257000    
 H    2.768900      -1.852800       1.336300    
 H    2.951800      -2.810800     -0.1360000    
 H   -5.720800      -2.556100     -0.3334000    
 H   -4.587900      -2.125700      -1.612700    
 H    3.798100      -4.734500       1.196700    
 H    4.781800      -3.280800       1.446000    
 H    3.616200      -3.784000       2.683800    
 H   -4.878800     -0.5884000       1.076500    
 H    3.644200       3.226300      0.4164000    
 H    2.777600       2.220800       1.552400    
 H    2.529900       2.028800      -1.499800    
 H    1.679000      0.9924000     -0.3580000    
 H    1.528100       4.182200     -0.4524000    
 H    3.843900      0.1318000      0.5236000    
 H    4.720000       1.187200     -0.6163000    
 H   -4.425000      0.2604000      -1.832900    
 H   -5.332100       2.362800     -0.6784000    
 H   -4.717600       1.790500      0.8614000    
 H   0.1522000       2.467100       1.728400    
 H  -0.8387000       3.567200     -0.9288000    
 H   -3.141500       2.981100      -1.460000    
 H    1.050300       5.295300       1.476400    
 H   -2.227300       1.834700       1.240600    
 H    4.711400      -1.927100      -2.219200    


%chk=000001768-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001768

0 1
O 1.748335 5.713110 0.365790
O 4.859929 -0.942646 0.113403
O 3.212490 -0.549787 -1.474226
C -1.236362 -3.641202 0.605660
C 0.216162 -3.207719 0.303152
C -2.296181 -2.669601 0.039342
C 1.270449 -4.224024 0.797257
C -3.739108 -3.052342 0.437602
C 2.725849 -3.750642 0.578379
C -4.827036 -2.129458 -0.180338
C 3.772904 -4.801054 1.009404
C -4.713161 -0.687498 0.271945
C 2.689068 3.507863 0.247852
C 2.683934 2.101016 -0.385023
C 1.461651 4.348669 -0.154622
C 3.889792 1.262956 0.080011
C -4.608463 0.386255 -0.552512
C -4.467714 1.832113 -0.092600
C 0.163173 3.831929 0.414352
C -0.897411 3.423377 -0.346599
C -3.178760 2.447139 -0.602844
C 3.912425 -0.125876 -0.528510
C -2.151984 2.891987 0.181940
H -1.368709 -3.728434 1.705070
H -1.411207 -4.657002 0.191986
H 0.407448 -2.220177 0.772734
H 0.338982 -3.055332 -0.789025
H -2.079928 -1.639166 0.385935
H -2.215622 -2.643236 -1.067674
H 1.112670 -4.424760 1.878133
H 1.117943 -5.192675 0.276270
H -3.830443 -3.032718 1.543989
H -3.941321 -4.097993 0.127065
H 2.885197 -2.810892 1.146277
H 2.861174 -3.496335 -0.493877
H -5.824161 -2.526390 0.105459
H -4.769466 -2.177201 -1.285967
H 3.661008 -5.734457 0.426112
H 4.808961 -4.438073 0.866288
H 3.657066 -5.058950 2.079044
H -4.708652 -0.523901 1.362694
H 3.593096 4.067993 -0.062505
H 2.717711 3.437880 1.353373
H 2.696468 2.177178 -1.489072
H 1.747823 1.572223 -0.124761
H 1.388702 4.381822 -1.264929
H 3.907421 1.156399 1.181164
H 4.843665 1.762129 -0.186443
H -4.598991 0.223560 -1.642034
H -5.328940 2.420804 -0.477129
H -4.506451 1.883592 1.011590
H 0.106938 3.793564 1.513143
H -0.809315 3.472688 -1.444096
H -3.065019 2.493393 -1.698021
H 0.929470 6.261650 0.255390
H -2.250770 2.837378 1.276688
H 4.839173 -1.850329 -0.296588


