%chk=000138884.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138884

0 1
 O   -8.300700       1.058800     -0.6810000    
 O    8.300600       1.058900      0.6812000    
 O   -2.396100      -1.478000      0.9129000    
 O    2.396200      -1.478200     -0.9129000    
 N   -3.605200      0.3186000      9.4999997E-03
 N    3.605200      0.3185000     -9.7000003E-03
 C   -1.192300      0.3781000      0.1942000    
 C    1.192200      0.3780000     -0.1946000    
 C    0.000000     -0.3193000     -9.9999997E-05
 C   -2.435200     -0.3483000      0.3990000    
 C    2.435200     -0.3485000     -0.3992000    
 C   -1.192300       1.773000      0.1943000    
 C    1.192300       1.772900     -0.1943000    
 C   -4.947200     -0.1239000      0.1089000    
 C    4.947200     -0.1239000     -0.1089000    
 C    0.000000       2.470300       0.000000    
 C   -5.965700      0.6988000     -0.3407000    
 C    5.965600      0.6989000      0.3407000    
 C   -5.209500      -1.369700      0.6526000    
 C    5.209600      -1.369700     -0.6526000    
 C   -7.287000      0.2625000     -0.2436000    
 C    7.286900      0.2626000      0.2437000    
 C   -6.530900      -1.805800      0.7498000    
 C    6.531000      -1.805900     -0.7496000    
 C   -7.569600     -0.9898000      0.3018000    
 C    7.569600     -0.9898000     -0.3016000    
 C   -9.627400      0.5505000     -0.5518000    
 C    9.627400      0.5505000      0.5521000    
 H  -9.9999997E-05  -1.407100     -1.9999999E-04
 H   -2.087300       2.359900      0.3783000    
 H    2.087200       2.359700     -0.3782000    
 H   -3.513100       1.225200     -0.4404000    
 H    3.512900       1.225100      0.4401000    
 H   9.9999997E-05   3.556600      1.9999999E-04
 H   -5.750600       1.675500     -0.7662000    
 H    5.750500       1.675700      0.7662000    
 H   -4.463900      -2.058100       1.020700    
 H    4.464000      -2.058100      -1.020600    
 H   -6.751300      -2.781100       1.174500    
 H    6.751400      -2.781300      -1.174100    
 H   -8.571900      -1.390600      0.4072000    
 H    8.572000      -1.390700     -0.4068000    
 H   -9.773200     -0.3520000      -1.155200    
 H   -10.30580       1.312900     -0.9486000    
 H   -9.898900      0.3963000      0.4980000    
 H    10.30570       1.313100      0.9488000    
 H    9.773200     -0.3519000       1.155500    
 H    9.898900      0.3963000     -0.4977000    


%chk=000138884-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138884

0 1
O -8.290338 1.096940 -0.743735
O 8.290304 1.096973 0.743871
O -2.396259 -1.559283 0.945650
O 2.396271 -1.559303 -0.945585
N -3.648896 0.220361 0.051209
N 3.648892 0.220408 -0.051258
C -1.213244 0.424053 0.200659
C 1.213236 0.424073 -0.200739
C 0.000003 -0.273845 -0.000030
C -2.459232 -0.397228 0.441539
C 2.459237 -0.397196 -0.441592
C -1.204705 1.844545 0.214983
C 1.204666 1.844565 -0.215099
C -4.985642 -0.253490 0.188297
C 4.985639 -0.253464 -0.188263
C -0.000027 2.547671 -0.000068
C -6.013342 0.581806 -0.312611
C 6.013323 0.581843 0.312658
C -5.310455 -1.498343 0.796732
C 5.310469 -1.498345 -0.796631
C -7.364974 0.184798 -0.210218
C 7.364956 0.184818 0.210347
C -6.665931 -1.869450 0.888327
C 6.665946 -1.869469 -0.888145
C -7.707073 -1.049947 0.395414
C 7.707073 -1.049956 -0.395218
C -9.707904 0.736869 -0.673411
C 9.707872 0.736893 0.673613
H 0.000016 -1.368112 -0.000015
H -2.119424 2.410832 0.428214
H 2.119370 2.410870 -0.428344
H -3.554114 1.110459 -0.442636
H 3.554101 1.110533 0.442536
H -0.000038 3.642712 -0.000082
H -5.790714 1.545137 -0.786325
H 5.790683 1.545195 0.786322
H -4.513920 -2.141281 1.171649
H 4.513946 -2.141293 -1.171558
H -6.920346 -2.827343 1.355524
H 6.920374 -2.827385 -1.355290
H -8.747653 -1.373894 0.483779
H 8.747654 -1.373917 -0.483521
H -9.914634 -0.197459 -1.230747
H -10.240331 1.575520 -1.145501
H -10.044362 0.624751 0.375721
H 10.240285 1.575561 1.145689
H 9.914577 -0.197414 1.230993
H 10.044366 0.624733 -0.375503


