%chk=000017510.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017510

0 1
 O   0.8459000      0.6765000      -1.925800    
 O   -6.365800      0.1814000      0.3334000    
 N   -3.705700       1.159200      7.0400000E-02
 C    1.150900      0.3194000     -0.5557000    
 C   7.6300003E-02   1.046600      0.2794000    
 C   0.9185000      -1.196100     -0.4378000    
 C    2.541000      0.9165000     -0.2518000    
 C   -1.310600      0.7369000     -0.2552000    
 C   -2.369900       1.437900      0.5936000    
 C    1.302900      -1.945900      0.6888000    
 C    3.559300      0.3480000      0.5408000    
 C    2.109300      -1.341900       1.801100    
 C    3.484400     -0.9645000       1.281000    
 C   -3.994100     -0.2808000      0.1164000    
 C   -4.726300       1.901400      0.8235000    
 C   0.1926000      -1.878800      -1.444100    
 C    2.805000       2.201900     -0.8051000    
 C   0.9819000      -3.317000      0.7766000    
 C    4.798300       1.025800      0.6703000    
 C   -5.396800     -0.5452000     -0.4233000    
 C   -6.112100       1.585100      0.2682000    
 C  -0.1163000      -3.238000      -1.349700    
 C    4.022500       2.864000     -0.6454000    
 C   0.2787000      -3.959200     -0.2358000    
 C    5.029800       2.266600      8.6199999E-02
 H   0.1420000      0.7901000       1.341800    
 H   0.2177000       2.134200      0.2196000    
 H   -1.424900       1.046200      -1.300400    
 H   -1.466500     -0.3382000     -0.1913000    
 H   -2.282400       1.125800       1.642700    
 H   -2.185100       2.519200      0.5599000    
 H    1.590300     -0.4963000       2.261100    
 H    2.234600      -2.079500       2.604600    
 H    3.901900      -1.752600      0.6405000    
 H    4.137800     -0.9000000       2.162200    
 H   -3.917800     -0.6572000       1.144600    
 H   -3.324100     -0.8646000     -0.5194000    
 H   -4.549700       2.980100      0.7435000    
 H   -4.688600       1.628100       1.886100    
 H  -0.1656000      -1.361300      -2.331300    
 H    2.041700       2.715000      -1.388800    
 H    1.613900      0.4494000      -2.478600    
 H    1.290800      -3.898300       1.642800    
 H    5.602500      0.5801000       1.254200    
 H   -5.481700     -0.2739000      -1.482800    
 H   -5.636700      -1.609700     -0.3342000    
 H   -6.877400       2.089700      0.8666000    
 H   -6.221100       1.929100     -0.7677000    
 H  -0.6731000      -3.724000      -2.145400    
 H    4.176000       3.839000      -1.097600    
 H   4.1400000E-02  -5.015100     -0.1529000    
 H    5.986600       2.762600      0.2142000    


%chk=000017510-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017510

0 1
O 0.883354 0.642044 -2.027769
O -6.654653 0.555606 0.368485
N -3.801023 1.107185 0.163304
C 1.199224 0.232054 -0.628582
C 0.065636 0.922299 0.202237
C 1.075994 -1.311779 -0.537216
C 2.569359 0.892660 -0.265769
C -1.369006 0.509393 -0.189047
C -2.408463 1.287899 0.643408
C 1.420894 -2.053746 0.630662
C 3.589476 0.392604 0.602067
C 2.148480 -1.417171 1.799994
C 3.550644 -0.925162 1.372584
C -4.310334 -0.278691 0.331353
C -4.734771 2.068581 0.805100
C 0.470110 -2.002681 -1.619125
C 2.769496 2.177559 -0.857088
C 1.161749 -3.447160 0.670927
C 4.763583 1.175006 0.796109
C -5.723612 -0.395839 -0.262291
C -6.139788 1.925285 0.199136
C 0.228524 -3.392999 -1.573080
C 3.934728 2.937373 -0.648735
C 0.571662 -4.125240 -0.417165
C 4.955289 2.425590 0.182016
H 0.241101 0.722370 1.276251
H 0.187009 2.012875 0.057248
H -1.534088 0.722108 -1.259790
H -1.492385 -0.579586 -0.042971
H -2.307730 1.005664 1.726115
H -2.180081 2.370494 0.573674
H 1.584077 -0.571977 2.236893
H 2.263208 -2.168329 2.602841
H 4.029659 -1.725427 0.772232
H 4.176977 -0.802227 2.276621
H -4.339721 -0.572809 1.412559
H -3.642218 -0.983401 -0.195142
H -4.363693 3.097237 0.632813
H -4.798312 1.905991 1.911939
H 0.162395 -1.428189 -2.496620
H 1.980819 2.572343 -1.504648
H 1.655930 0.392275 -2.598564
H 1.436596 -4.006436 1.573864
H 5.543008 0.780031 1.459986
H -5.680060 -0.204960 -1.356435
H -6.152365 -1.394454 -0.075240
H -6.865266 2.578808 0.711757
H -6.103848 2.179914 -0.882232
H -0.235724 -3.893383 -2.430370
H 4.042484 3.916794 -1.127816
H 0.383037 -5.203158 -0.361136
H 5.874838 2.994463 0.358655


