%chk=000019487.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019487

0 1
 O    1.890500      -2.326900      -1.634800    
 O    2.762200      -1.964800       1.866600    
 C    1.629100      -2.055000     -0.2579000    
 C   0.6866000     -0.8759000     -0.1346000    
 C    2.962200      -1.813100      0.4613000    
 C    1.197600      0.4304000     -5.3399999E-02
 C    3.532100     -0.4422000      0.1663000    
 C    2.664300      0.6479000     -7.6600000E-02
 C   -1.647400     -5.6899998E-02 -3.1199999E-02
 C  -0.7030000      -1.103600     -0.1350000    
 C   -1.124600       1.252800      7.2999999E-02
 C   0.2672000       1.475500      6.2100001E-02
 C   -3.075000     -0.2513000     -2.3200000E-02
 C    4.925400     -0.2627000      0.1674000    
 C    3.250500       1.898000     -0.3475000    
 C   -3.926000      0.8783000      9.2100002E-02
 C   -1.995500       2.340600      0.1866000    
 C   -3.374300       2.156900      0.1960000    
 C    5.475200      0.9881000     -9.3099996E-02
 C    4.638500       2.066100     -0.3545000    
 C   -3.707900      -1.515900     -0.1240000    
 C   -5.322900      0.7242000      0.1035000    
 C   -5.098400      -1.655600     -0.1115000    
 C   -5.906200     -0.5350000      2.3000001E-03
 H    1.151800      -2.947100      0.1662000    
 H    3.684000      -2.576000      0.1428000    
 H   -1.036200      -2.135800     -0.2182000    
 H   0.6187000       2.502000      0.1584000    
 H    5.586900      -1.101200      0.3701000    
 H    2.642500       2.770700     -0.5710000    
 H   -1.608900       3.354900      0.2684000    
 H    1.061200      -2.223700      -2.131500    
 H    2.462000      -2.876200       2.024100    
 H   -4.013900       3.033100      0.2855000    
 H    6.552800       1.120400     -9.5399998E-02
 H    5.063100       3.043400     -0.5661000    
 H   -3.126300      -2.429600     -0.2157000    
 H   -5.974400       1.591800      0.1921000    
 H   -5.544400      -2.642800     -0.1911000    
 H   -6.986900     -0.6381000      1.2500000E-02


%chk=000019487-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019487

0 1
O 1.993148 -2.297086 -1.717055
O 2.782064 -1.973820 1.897214
C 1.615293 -2.068194 -0.297489
C 0.668669 -0.895664 -0.148015
C 2.955453 -1.851695 0.430359
C 1.201529 0.438291 -0.078240
C 3.533934 -0.476075 0.165315
C 2.674698 0.634960 -0.083194
C -1.654335 -0.046829 -0.032898
C -0.713460 -1.116553 -0.112029
C -1.123621 1.292599 0.035679
C 0.287058 1.500397 0.020457
C -3.103565 -0.250305 -0.007196
C 4.933471 -0.297726 0.180442
C 3.263783 1.904940 -0.325847
C -3.970712 0.900582 0.085854
C -2.029509 2.415886 0.132591
C -3.397408 2.226708 0.155307
C 5.506831 0.971896 -0.045359
C 4.662024 2.076513 -0.303844
C -3.709587 -1.543339 -0.073163
C -5.388097 0.719817 0.109645
C -5.102387 -1.698877 -0.047951
C -5.952681 -0.559406 0.044175
H 1.128945 -2.989730 0.091912
H 3.658247 -2.627489 0.061401
H -1.067272 -2.153466 -0.146502
H 0.648126 2.530541 0.115614
H 5.576884 -1.163689 0.375122
H 2.629257 2.767464 -0.555324
H -1.606040 3.425486 0.188222
H 1.215459 -2.072268 -2.288097
H 2.500597 -2.902950 2.105073
H -4.076944 3.084038 0.228019
H 6.594702 1.098086 -0.030547
H 5.092692 3.065128 -0.497793
H -3.083731 -2.438370 -0.145208
H -6.031138 1.605255 0.180621
H -5.539880 -2.701915 -0.099569
H -7.040297 -0.687443 0.063297


