%chk=000131282.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131282

0 1
 O   5.1000002E-03  -3.284700     -0.8492000    
 O   -4.875300       2.265100      -1.466600    
 O   -5.998600     -0.7607000       1.857600    
 O    4.450400       2.834100     -0.4971000    
 O    6.399400      -1.116200      0.9393000    
 N   -4.977600      0.5140000      0.1337000    
 N    4.970800      0.6115000      0.1569000    
 C   -3.715500     -0.1416000     -3.6499999E-02
 C    3.722300     -6.8300001E-02 -1.8400000E-02
 C   -1.292900      -1.400800     -0.3623000    
 C    1.291200      -1.393400     -0.3597000    
 C   2.4200000E-02  -2.084300     -0.5386000    
 C   -3.101200     -0.1589000      -1.288700    
 C    2.522000      0.6195000      0.1600000    
 C   -3.100700     -0.7631000       1.050500    
 C    3.707000      -1.418700     -0.3674000    
 C   -1.872200     -0.7977000      -1.454000    
 C    1.306300     -4.3099999E-02 -1.0600000E-02
 C   -1.871800      -1.401800      0.8853000    
 C    2.491500      -2.081200     -0.5381000    
 C   -5.412700       1.603800     -0.5933000    
 C   -5.944900      0.1523000       1.049800    
 C    5.185400       1.954700     -7.8299999E-02
 C    6.143300      2.3700001E-02  0.5872000    
 C   -6.753700       1.940700     -9.3699999E-02
 C   -7.062700       1.092400      0.8819000    
 C    6.596900       2.221400      0.2345000    
 C    7.164100       1.081300      0.6160000    
 H   -3.563700      0.2904000      -2.162000    
 H    2.496900       1.662900      0.4586000    
 H   -3.536300     -0.7454000       2.044700    
 H    4.621300      -1.977600     -0.5414000    
 H   -1.399800     -0.8145000      -2.431500    
 H   0.3962000      0.5285000      0.1439000    
 H   -1.393200      -1.879400       1.734800    
 H    2.506800      -3.131700     -0.8162000    
 H   -7.357600       2.751000     -0.4665000    
 H   -7.972000       1.068100       1.458700    
 H    7.068800       3.185900      0.1495000    
 H    8.189000      0.9319000      0.9113000    


%chk=000131282-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000131282

0 1
O 0.061238 -3.305164 0.667461
O -4.523870 2.765485 -0.340974
O -6.573243 -1.451770 0.244701
O 4.428407 2.849494 -0.718575
O 6.624700 -1.202813 0.321809
N -5.142541 0.463940 -0.017947
N 5.127872 0.619613 -0.151084
C -3.847315 -0.148077 0.088138
C 3.854967 -0.031203 -0.010753
C -1.278761 -1.343433 0.311914
C 1.330428 -1.309510 0.248012
C 0.038858 -2.056335 0.423076
C -2.748364 0.391963 -0.627210
C 2.733641 0.700405 0.456350
C -3.666913 -1.297691 0.902813
C 3.719559 -1.408218 -0.332381
C -1.475747 -0.197491 -0.503556
C 1.482390 0.065069 0.571176
C -2.397327 -1.891124 0.994507
C 2.471549 -2.035305 -0.185790
C -5.388711 1.866381 -0.225620
C -6.404326 -0.223006 0.071113
C 5.324401 2.004177 -0.490011
C 6.412863 -0.006075 0.019301
C -6.882272 2.035500 -0.266660
C -7.471426 0.823588 -0.094787
C 6.810923 2.227634 -0.524525
C 7.442370 1.061814 -0.228539
H -2.883514 1.267588 -1.264931
H 2.835092 1.755399 0.717856
H -4.513350 -1.729065 1.440510
H 4.583757 -1.980805 -0.674452
H -0.642348 0.216211 -1.079688
H 0.631269 0.636671 0.953873
H -2.247685 -2.791873 1.598196
H 2.356435 -3.101468 -0.405362
H -7.337582 3.014852 -0.413053
H -8.529295 0.562453 -0.070706
H 7.231673 3.204580 -0.761971
H 8.508698 0.847710 -0.158130


