%chk=000090248.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090248

0 1
 O    1.609900       2.149800      1.8600000E-02
 C   -2.437800     -0.7848000     -3.4000000E-03
 C  -0.9701000     -0.4248000      2.0500001E-02
 C   -2.368500      -2.268400      0.4485000    
 C   -1.013800      -2.816500     -2.5100000E-02
 C  -0.1737000      -1.579500      1.4800000E-02
 C  -0.3860000      0.8337000      2.0199999E-02
 C   -3.283200      4.1700002E-02  0.9688000    
 C   -2.995900     -0.6631000      -1.427600    
 C    1.209300      -1.498700      6.0000003E-04
 C   -1.198700       2.084000     -1.0400000E-02
 C    1.799800     -0.2341000      8.1000002E-03
 C    1.007900      0.9239000      1.8600000E-02
 C    3.290800     -0.1330000     -1.3000000E-03
 C  -0.9377000       2.925200      -1.274000    
 C  -0.9927000       2.951100       1.246100    
 C    3.911300     -0.7417000      -1.271800    
 C    3.928900     -0.7647000       1.249000    
 H   -3.204900      -2.870300      7.6600000E-02
 H   -2.397600      -2.326600       1.546500    
 H   -1.074000      -3.201100      -1.048300    
 H  -0.6434000      -3.595900      0.6467000    
 H   -2.721200      0.3652000       1.851400    
 H   -3.776000      0.9041000      0.5114000    
 H   -4.116800     -0.5704000       1.338700    
 H   -2.970000      0.3706000      -1.789100    
 H   -2.425500      -1.267100      -2.143000    
 H   -4.037300      -1.002300      -1.466000    
 H    1.801900      -2.407600     -1.6600000E-02
 H   -2.257200       1.879700     -7.9400003E-02
 H    3.618900      0.9109000      1.9400001E-02
 H   4.8000000E-02   3.397800      -1.288000    
 H   -1.674900       3.733600      -1.344900    
 H   -1.031400       2.312800      -2.178100    
 H   -1.149700       2.363000       2.157000    
 H   -1.716400       3.774200       1.255300    
 H   1.6000000E-03   3.401900       1.304400    
 H    3.742600      -1.822000      -1.335600    
 H    4.993800     -0.5741000      -1.288700    
 H    3.486400     -0.2812000      -2.170600    
 H    3.514700     -0.3235000       2.162400    
 H    5.011400     -0.5955000       1.255400    
 H    3.762800      -1.846400       1.293500    
 H    2.299100       2.153800     -0.6666000    


%chk=000090248-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090248

0 1
O 1.606182 2.248067 -0.014743
C -2.482829 -0.805175 0.063148
C -0.983990 -0.400915 0.034916
C -2.398803 -2.332332 0.436772
C -1.012654 -2.831637 -0.045069
C -0.169433 -1.568144 0.007684
C -0.391888 0.889672 -0.020454
C -3.353243 -0.090386 1.132101
C -3.115432 -0.635281 -1.350029
C 1.228772 -1.475791 -0.012239
C -1.224550 2.174938 -0.123219
C 1.867152 -0.211145 0.000069
C 1.038286 0.946723 -0.010373
C 3.400479 -0.137234 0.001869
C -0.928468 2.967014 -1.427294
C -1.089742 3.078706 1.132635
C 3.998732 -0.723958 -1.305749
C 4.007029 -0.826038 1.253871
H -3.243036 -2.900602 0.005482
H -2.456104 -2.430346 1.538031
H -1.065330 -3.218499 -1.083417
H -0.613012 -3.649776 0.581899
H -2.833935 -0.063649 2.107506
H -3.619240 0.944751 0.857557
H -4.300962 -0.647072 1.266602
H -3.092158 0.419626 -1.679342
H -2.569593 -1.233358 -2.103049
H -4.171005 -0.967862 -1.342541
H 1.835896 -2.389101 -0.030140
H -2.281991 1.868269 -0.184705
H 3.736845 0.924109 0.045976
H 0.107737 3.340619 -1.435112
H -1.614934 3.831724 -1.505620
H -1.075976 2.330006 -2.319565
H -1.378726 2.529911 2.048053
H -1.749591 3.962268 1.038637
H -0.051522 3.429447 1.250272
H 3.746312 -1.795505 -1.403819
H 5.101098 -0.632941 -1.308526
H 3.601594 -0.203383 -2.195519
H 3.608787 -0.384084 2.184536
H 5.108530 -0.725684 1.260307
H 3.765488 -1.904361 1.263551
H 2.593932 2.182112 -0.006948


