%chk=000089841.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089841

0 1
 O    4.440200       1.452100      0.6242000    
 O    5.905200       3.008800     -0.2169000    
 O    5.537200      -2.507300      0.8997000    
 O    6.774400      -2.212400      -1.001100    
 C  -0.6897000      0.1208000      0.5990000    
 C   -1.940000     -0.3127000     -0.1712000    
 C   0.5846000     -0.3425000     -0.1123000    
 C   -3.248000      0.1144000      0.5011000    
 C    1.869100      3.7799999E-02  0.6300000    
 C   -4.498300     -0.3401000     -0.2554000    
 C    3.141000     -0.4466000     -6.6900000E-02
 C   -5.773800      0.1327000      0.4478000    
 C    4.388000      1.8300001E-02  0.6701000    
 C   -7.022900     -0.2888000     -0.3294000    
 C   -8.329600      0.1781000      0.3185000    
 C    5.656500     -0.3827000      2.4800001E-02
 C   -9.574500     -0.1791000     -0.4966000    
 C    6.370800      0.6647000     -0.3823000    
 C   -10.84160      0.3731000      0.1581000    
 C    5.583900       1.851600     -6.0000001E-03
 C    6.063000      -1.774900     -0.1083000    
 C    7.683200      0.7799000      -1.060700    
 C   -12.07880      5.4900002E-02 -0.6662000    
 H  -0.6788000       1.212500      0.7005000    
 H  -0.7187000     -0.2991000       1.611500    
 H   -1.905100      0.1069000      -1.184300    
 H   -1.935900      -1.404400     -0.2807000    
 H   0.5541000      -1.432500     -0.2338000    
 H   0.6127000      8.7800004E-02  -1.121100    
 H   -3.276100     -0.2918000       1.520000    
 H   -3.258700       1.207300      0.5961000    
 H    1.834000     -0.3790000       1.644300    
 H    1.894800       1.128900      0.7384000    
 H   -4.502900      -1.433800     -0.3344000    
 H   -4.470500      5.8600001E-02  -1.276700    
 H    3.143700     -5.6100000E-02  -1.093100    
 H    3.119100      -1.540600     -0.1356000    
 H   -5.757200       1.224800      0.5465000    
 H   -5.814100     -0.2839000       1.461400    
 H    4.362800     -0.2818000       1.724000    
 H   -6.965400      0.1165000      -1.347300    
 H   -7.041200      -1.381600     -0.4247000    
 H   -8.288600       1.266300      0.4528000    
 H   -8.411800     -0.2612000       1.320300    
 H   -9.649900      -1.268700     -0.5936000    
 H   -9.477200      0.2301000      -1.509500    
 H   -10.75890       1.460100      0.2735000    
 H   -10.95710     -5.2099999E-02   1.161900    
 H    7.551500       1.152500      -2.081300    
 H    8.216300     -0.1724000      -1.113200    
 H    8.329500       1.480600     -0.5217000    
 H   -12.20910      -1.026400     -0.7763000    
 H   -12.00870      0.4962000      -1.665600    
 H   -12.97260      0.4570000     -0.1792000    
 H    5.791800      -3.452700      0.8389000    


%chk=000089841-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089841

0 1
O 4.560470 1.526149 0.610628
O 6.092761 3.061754 -0.272056
O 5.300454 -2.667294 0.780213
O 7.211668 -2.338324 -0.503352
C -0.669987 0.149355 0.515061
C -1.942168 -0.250322 -0.265805
C 0.636917 -0.325822 -0.158723
C -3.249010 0.188932 0.432170
C 1.903967 0.099454 0.616017
C -4.523837 -0.196402 -0.351739
C 3.198046 -0.428482 -0.040160
C -5.829829 0.209757 0.367718
C 4.470234 0.033292 0.699194
C -7.106633 -0.163779 -0.418713
C -8.411552 0.218155 0.316165
C 5.785274 -0.441719 0.097510
C -9.689789 -0.146372 -0.472204
C 6.526488 0.621475 -0.352840
C -10.994182 0.223983 0.270452
C 5.769509 1.883493 -0.040147
C 6.197754 -1.857727 0.058719
C 7.860263 0.686303 -1.026659
C -12.266166 -0.139228 -0.526142
H -0.642390 1.252832 0.630651
H -0.724718 -0.269047 1.542035
H -1.902200 0.192150 -1.283192
H -1.955867 -1.351714 -0.406385
H 0.615378 -1.431682 -0.257710
H 0.685209 0.078888 -1.191140
H -3.291758 -0.264147 1.444971
H -3.231591 1.288394 0.585117
H 1.840669 -0.278515 1.658004
H 1.950297 1.203389 0.680221
H -4.529076 -1.292951 -0.526590
H -4.494626 0.277541 -1.355270
H 3.260122 -0.088662 -1.092603
H 3.193615 -1.534507 -0.044653
H -5.821186 1.304459 0.552978
H -5.861322 -0.273240 1.367003
H 4.398877 -0.214039 1.775072
H -7.085141 0.334225 -1.410720
H -7.106696 -1.255796 -0.619919
H -8.408790 1.308780 0.524662
H -8.435043 -0.286303 1.305002
H -9.690129 -1.235492 -0.688815
H -9.672759 0.365460 -1.457325
H -10.991604 1.311450 0.489699
H -11.011656 -0.290478 1.253045
H 7.737929 1.051564 -2.064906
H 8.351793 -0.296482 -1.052513
H 8.502711 1.428973 -0.519559
H -12.308730 -1.225961 -0.730396
H -12.285815 0.384907 -1.500439
H -13.183983 0.137248 0.024983
H 5.619529 -3.609775 0.751382


