%chk=000130135.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130135

0 1
 O    1.564200      -1.908300      0.1711000    
 O    4.598000       1.487600       1.646700    
 O   -5.072500     -0.8048000      0.3192000    
 O    6.364700       2.263100      3.0000001E-04
 N   -2.921500      -1.647500     -5.4600000E-02
 N   -1.210900     -0.1854000     -0.8303000    
 N   -5.597100       1.807400     -1.6000000E-03
 N   -3.865400       3.069800     -0.7331000    
 N   -5.898700       3.102400     -0.1715000    
 N   -4.902500       3.888000     -0.6036000    
 C    3.073500     -0.2070000      0.9314000    
 C    2.392200     -0.1711000       2.262000    
 C    2.630700      -1.074900     -5.9400000E-02
 C    1.242900      0.8438000       2.295100    
 C  -0.6388000      -2.521700     -0.5037000    
 C    4.158100      0.6327000      0.6783000    
 C   0.7661000      -2.255000     -0.9462000    
 C   -1.610100      -1.369500     -0.4741000    
 C    4.791700      0.5984000     -0.5638000    
 C    3.256300      -1.115800      -1.299800    
 C    4.340800     -0.2759000      -1.552800    
 C   -1.067800      -3.736700     -0.1336000    
 C   0.5338000      0.8510000       3.640000    
 C   -3.285900      -2.937900      0.3119000    
 C   -3.896200     -0.6398000     -4.1999999E-03
 C   -2.422100      -3.956600      0.2852000    
 C   -3.411000      0.7218000     -0.3999000    
 C    5.926300       1.465400     -0.8508000    
 C   -2.128100      0.8239000     -0.7785000    
 C   -4.316200       1.839800     -0.3660000    
 C    6.605800       1.412800      -2.213600    
 H    2.013000      -1.168700       2.518800    
 H    3.115100      5.9799999E-02   3.054900    
 H    1.623700       1.850500       2.084800    
 H   0.5134000      0.6120000       1.510200    
 H   0.7533000      -1.478300      -1.721600    
 H    1.184400      -3.161500      -1.403200    
 H    2.960700      -1.802900      -2.086500    
 H    4.806300     -0.3433000      -2.531000    
 H  -0.4021000      -4.593600     -0.1376000    
 H   0.1051000     -0.1315000       3.861700    
 H    1.225400       1.115100       4.446200    
 H  -0.2797000       1.583200       3.635800    
 H   -4.310700      -3.099700      0.6273000    
 H   -2.722100      -4.956900      0.5746000    
 H   -1.719600       1.784400      -1.080000    
 H    5.467600       1.852000       1.426000    
 H    5.900000       1.689500      -3.000900    
 H    7.028800      0.4202000      -2.388900    
 H    7.427800       2.135900      -2.230200    
 H   -6.826500       3.466800      1.6500000E-02


%chk=000130135-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130135

0 1
O 1.293877 -0.500565 0.511776
O 5.990467 -0.741403 1.324351
O -5.917226 -0.652788 0.415021
O 7.602119 0.276008 -0.312075
N -3.552557 -0.569060 0.389651
N -2.331880 0.407843 -1.466769
N -7.297218 0.479211 -1.890638
N -5.913324 1.348003 -3.523083
N -7.973460 1.004778 -2.959347
N -7.174006 1.537754 -3.963899
C 3.634661 -0.631780 0.902402
C 3.366412 -1.368887 2.198685
C 2.584886 -0.193048 0.058097
C 3.093012 -0.405335 3.389162
C -1.108484 -0.504622 0.410663
C 4.964763 -0.330973 0.504867
C 0.152438 -0.092942 -0.313882
C -2.349484 -0.207542 -0.253433
C 5.245736 0.385704 -0.721911
C 2.827481 0.510240 -1.160118
C 4.146650 0.788299 -1.531559
C -1.115099 -1.131773 1.655366
C 2.808345 -1.170224 4.698737
C -3.551711 -1.195518 1.631316
C -4.893937 -0.297693 -0.226169
C -2.358263 -1.481412 2.272008
C -4.794659 0.358236 -1.513618
C 6.637369 0.666722 -1.085100
C -3.529371 0.671871 -2.058591
C -5.993709 0.707747 -2.268473
C 6.986877 1.413585 -2.358726
H 2.494905 -2.038317 2.071628
H 4.244987 -1.991031 2.444367
H 3.973202 0.251913 3.523060
H 2.235921 0.249776 3.138548
H 0.154392 1.003145 -0.474929
H 0.196169 -0.573570 -1.310717
H 2.005229 0.832035 -1.803276
H 4.333408 1.328958 -2.464848
H -0.162793 -1.347422 2.144835
H 1.919788 -1.823266 4.596450
H 3.665050 -1.813022 4.974582
H 2.622530 -0.475501 5.538250
H -4.546863 -1.422371 2.020750
H -2.382019 -1.973259 3.247102
H -3.489937 1.167337 -3.033385
H 6.876826 -0.435997 0.866446
H 6.540601 2.424884 -2.364034
H 6.612160 0.879513 -3.250971
H 8.081218 1.503972 -2.427269
H -8.991277 1.004785 -3.014302


