%chk=000101645.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101645

0 1
 O    2.024400     -3.6699999E-02 -0.7059000    
 O    1.049000       1.702000      0.5245000    
 C   -1.541900       1.172300     -0.7801000    
 C  -0.2096000      0.5839000      -1.274200    
 C   0.8105000      0.4543000     -0.1395000    
 C   -2.497100      9.3300000E-02 -0.2950000    
 C   -1.283100       2.253600      0.2324000    
 C    3.032000     -0.1880000      0.2824000    
 C  -7.0799999E-02   2.451900      0.7643000    
 C    4.303300     -0.6933000     -0.3847000    
 C   -3.305800     -0.5780000      -1.208800    
 C   -2.558800     -0.2193000       1.060800    
 C    5.428600     -0.8946000      0.6263000    
 C   -4.182000      -1.568100     -0.7639000    
 C   -3.434900      -1.209400       1.505500    
 C    6.682800      -1.440100     -3.7300002E-02
 C   -4.246500      -1.883700      0.5931000    
 H   -2.023300       1.662800      -1.638300    
 H  -0.3440000     -0.3792000      -1.782000    
 H   0.2097000       1.263100      -2.030900    
 H   0.4551000     -0.2745000      0.6009000    
 H   -2.097500       2.922100      0.4971000    
 H    2.696000     -0.9035000       1.042200    
 H    3.243600      0.7711000      0.7683000    
 H    4.613600      1.5100000E-02  -1.162900    
 H    4.088300      -1.635000     -0.9055000    
 H   0.1516000       3.265400       1.440400    
 H   -3.262700     -0.3423000      -2.268600    
 H   -1.932000      0.2723000       1.798300    
 H    5.106400      -1.591100       1.409200    
 H    5.664200      5.7399999E-02   1.115900    
 H   -4.813300      -2.093800      -1.474300    
 H   -3.482800      -1.458400       2.561600    
 H    6.488400      -2.409600     -0.5070000    
 H    7.050100     -0.7530000     -0.8062000    
 H    7.476000      -1.575300      0.7046000    
 H   -4.927800      -2.655400      0.9394000    


%chk=000101645-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101645

0 1
O 2.022556 0.194489 -0.676921
O 0.970095 1.922416 0.552570
C -1.607500 1.281327 -0.827889
C -0.215588 0.777976 -1.328824
C 0.763202 0.610247 -0.166777
C -2.471478 0.129665 -0.284916
C -1.399048 2.421635 0.152148
C 3.016350 -0.164919 0.365626
C -0.192278 2.687551 0.721549
C 4.259863 -0.690645 -0.353272
C -3.183190 -0.695707 -1.194800
C -2.554234 -0.163334 1.099357
C 5.379441 -1.098900 0.632422
C -3.950252 -1.789267 -0.737278
C -3.322353 -1.256822 1.562419
C 6.638452 -1.623678 -0.090724
C -4.021030 -2.075823 0.646619
H -2.131644 1.686119 -1.717705
H -0.309625 -0.187208 -1.855026
H 0.220337 1.512543 -2.030357
H 0.383395 -0.089745 0.611338
H -2.243715 3.076367 0.389333
H 2.577427 -0.940499 1.031617
H 3.247309 0.732926 0.970013
H 4.630855 0.094613 -1.039792
H 3.975111 -1.556716 -0.981700
H -0.000721 3.542974 1.376606
H -3.138431 -0.476083 -2.269728
H -2.028231 0.481361 1.813095
H 4.998838 -1.878885 1.323287
H 5.651516 -0.228366 1.263460
H -4.495455 -2.413041 -1.454930
H -3.377927 -1.466827 2.636870
H 6.400510 -2.511423 -0.706191
H 7.058855 -0.852697 -0.763359
H 7.426518 -1.911503 0.628879
H -4.618227 -2.921822 1.005080


