%chk=000162822.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162822

0 1
 O    7.092100      -1.009500     -0.5746000    
 O    8.801500      0.5061000      0.8060000    
 C   -2.029700      -1.459400      0.1106000    
 C  -0.6834000      -1.589100     -0.6045000    
 C   -3.148300      -2.278200     -0.5409000    
 C   0.3995000     -0.7680000      0.1009000    
 C   -4.499700      -2.255500      0.1802000    
 C    1.738200     -0.8713000     -0.6324000    
 C   -5.129800     -0.8622000      0.2519000    
 C    2.881500     -0.1412000      7.8699999E-02
 C   -6.430500     -0.8865000       1.059300    
 C    4.261100     -0.2546000     -0.5797000    
 C   -7.089200      0.4894000       1.193900    
 C    5.365900      0.4760000      0.1953000    
 C   -7.394200       1.152100     -0.1511000    
 C    6.747300      0.3610000     -0.4549000    
 C   -8.061200       2.514800      4.1999999E-02
 C    7.834400       1.095100      0.3222000    
 C   -8.332600       3.195900      -1.290100    
 C    7.677100       2.585100      0.4870000    
 H   -2.311700     -0.4007000      0.1294000    
 H   -1.917700      -1.778100       1.154300    
 H  -0.3846000      -2.643700     -0.6358000    
 H  -0.7875000      -1.250600      -1.642400    
 H   -2.821300      -3.323400     -0.6097000    
 H   -3.289800      -1.931300      -1.572300    
 H   0.5163000      -1.125400       1.131100    
 H   9.4300002E-02  0.2838000      0.1555000    
 H   -4.365400      -2.651100       1.194500    
 H   -5.186500      -2.936800     -0.3369000    
 H    2.010400      -1.928600     -0.7401000    
 H    1.631200     -0.4677000      -1.646800    
 H   -4.441300     -0.1527000      0.7222000    
 H   -5.311800     -0.5183000     -0.7714000    
 H    2.619000      0.9210000      0.1645000    
 H    2.954700     -0.5241000       1.104700    
 H   -6.232200      -1.278000       2.064500    
 H   -7.138900      -1.577000      0.5850000    
 H    4.205900      0.1501000      -1.597600    
 H    4.516700      -1.316800     -0.6735000    
 H   -6.431900       1.143300       1.780500    
 H   -8.017600      0.3786000       1.767100    
 H    5.412400      5.8800001E-02   1.209700    
 H    5.088300       1.531200      0.3010000    
 H   -8.044400      0.4999000     -0.7461000    
 H   -6.471100       1.303300     -0.7204000    
 H    6.718400      0.7827000      -1.466300    
 H   -7.418800       3.161800      0.6507000    
 H   -9.006100       2.392900      0.5840000    
 H   -7.402200       3.364800      -1.841700    
 H   -8.996300       2.588000      -1.913100    
 H   -8.812400       4.166300      -1.128600    
 H    7.909000      -1.061200      -1.099800    
 H    6.918500       2.796500       1.243700    
 H    7.395500       3.035700     -0.4681000    
 H    8.629300       3.019800      0.8040000    


%chk=000162822-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162822

0 1
O 7.185135 -1.099214 -0.614579
O 8.948750 0.440068 0.632832
C -2.006454 -1.475141 0.157104
C -0.642647 -1.568471 -0.563800
C -3.125341 -2.262858 -0.564149
C 0.487461 -0.797307 0.154732
C -4.485421 -2.264899 0.175227
C 1.848943 -0.893304 -0.569897
C -5.160134 -0.876178 0.275486
C 2.985527 -0.140148 0.157917
C -6.568163 -0.941073 0.911819
C 4.343241 -0.247347 -0.570831
C -7.236237 0.439190 1.127647
C 5.475573 0.502151 0.163278
C -7.539366 1.213160 -0.176734
C 6.844274 0.313586 -0.545909
C -8.300923 2.535700 0.070666
C 7.969032 1.087951 0.163433
C -8.602939 3.313216 -1.228697
C 7.855524 2.593388 0.292916
H -2.294197 -0.408309 0.249277
H -1.901066 -1.860893 1.193295
H -0.352611 -2.635964 -0.659894
H -0.749142 -1.182758 -1.599652
H -2.786601 -3.310915 -0.700685
H -3.265156 -1.846154 -1.584147
H 0.594759 -1.186407 1.189056
H 0.198093 0.270208 0.253470
H -4.346835 -2.678532 1.196484
H -5.179071 -2.956085 -0.347603
H 2.131632 -1.961015 -0.678804
H 1.744821 -0.493722 -1.600476
H -4.527821 -0.189278 0.874377
H -5.224200 -0.437998 -0.741120
H 2.703755 0.928555 0.269453
H 3.089069 -0.543845 1.186877
H -6.490985 -1.461665 1.889303
H -7.226239 -1.570778 0.276307
H 4.243203 0.157186 -1.600221
H 4.636102 -1.308743 -0.675913
H -6.586401 1.062115 1.778177
H -8.186730 0.297555 1.683230
H 5.563500 0.124310 1.201254
H 5.232425 1.582838 0.218172
H -8.138173 0.567364 -0.853542
H -6.595232 1.436223 -0.713441
H 6.762866 0.707825 -1.583496
H -7.706599 3.174428 0.756065
H -9.250298 2.313580 0.600160
H -7.668277 3.578236 -1.758435
H -9.217735 2.705637 -1.919571
H -9.152038 4.250715 -1.023082
H 8.047648 -1.204641 -0.117487
H 7.219454 2.840970 1.165258
H 7.382408 3.045279 -0.596310
H 8.850236 3.035208 0.460802


