%chk=000034388.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034388

0 1
 O    1.199100      0.2839000     -0.6880000    
 O   -7.475400     -0.2022000     -0.7067000    
 O    2.962800       3.841100      0.1160000    
 O    1.171900       2.706400     -0.4538000    
 O   0.6661000      6.0100000E-02   1.578800    
 N    2.625300      -2.042000     -0.5569000    
 N    2.384400       2.758600     -0.1393000    
 C    4.602600     -0.8149000      6.9300003E-02
 C    3.238300     -0.8745000     -0.2843000    
 C    2.525100      0.3195000     -0.3468000    
 C    3.128900       1.548600     -7.0200004E-02
 C    5.210100      0.4213000      0.3474000    
 C    4.473100       1.599900      0.2773000    
 C    5.320900      -2.016500      0.1323000    
 C    4.692000      -3.221000     -0.1481000    
 C    3.354300      -3.179200     -0.4847000    
 C   -3.489300     -6.4400002E-02  0.3712000    
 C   -3.877200      0.4402000     -0.8591000    
 C   -4.410300     -0.6145000       1.248100    
 C   -2.067800     -1.6000001E-02  0.7564000    
 C   0.3404000      0.1463000      0.4049000    
 C   -6.162600     -0.1569000     -0.3512000    
 C   -1.050500      0.1222000     -0.1057000    
 C   -5.223000      0.3938000      -1.222900    
 C   -5.756300     -0.6611000      0.8844000    
 C   -8.382900     -0.7786000      0.2315000    
 H    6.261900      0.4719000      0.6204000    
 H    4.982500       2.533500      0.5004000    
 H    6.374900      -2.020300      0.4005000    
 H    5.232200      -4.159300     -0.1041000    
 H    2.809900      -4.089300     -0.7141000    
 H   -3.184900      0.8968000      -1.559300    
 H   -4.108000      -1.012300       2.213300    
 H   -1.871000     -0.1130000       1.821800    
 H   -5.534900      0.7922000      -2.184500    
 H   -6.432600      -1.102300       1.608400    
 H   -1.179000      0.1967000      -1.179000    
 H   -8.160700      -1.836300      0.4086000    
 H   -9.381800     -0.7321000     -0.2146000    
 H   -8.420900     -0.2011000       1.161400    


%chk=000034388-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034388

0 1
O 1.255022 0.650435 -0.413588
O -7.592450 -0.337930 -0.810613
O 3.536478 4.060428 -0.364587
O 1.602806 3.209800 0.496656
O 0.691866 -0.205623 1.711953
N 2.475151 -1.838261 -0.351603
N 2.798229 3.075447 0.039736
C 4.703881 -0.788630 -0.000842
C 3.269088 -0.718391 -0.168258
C 2.620202 0.570481 -0.154298
C 3.406147 1.724699 -0.004583
C 5.463850 0.418278 0.136011
C 4.828407 1.654061 0.118647
C 5.300539 -2.091517 0.005211
C 4.492407 -3.217302 -0.158587
C 3.082140 -3.038648 -0.342416
C -3.509251 -0.231515 0.340398
C -3.954736 0.163316 -0.960306
C -4.491452 -0.671519 1.271374
C -2.107903 -0.204478 0.752209
C 0.317946 0.147147 0.577792
C -6.271823 -0.329384 -0.357609
C -1.026269 0.186260 0.003579
C -5.309479 0.116120 -1.306120
C -5.859661 -0.724744 0.940670
C -8.634544 -0.786725 0.120450
H 6.551280 0.358921 0.253664
H 5.383173 2.591742 0.204031
H 6.384262 -2.186798 0.136008
H 4.914086 -4.226941 -0.157409
H 2.431772 -3.909053 -0.487385
H -3.229829 0.510563 -1.703814
H -4.172533 -0.977074 2.275313
H -1.894121 -0.535464 1.779584
H -5.658105 0.416799 -2.298563
H -6.583105 -1.067975 1.685741
H -1.103534 0.539426 -1.028005
H -8.466179 -1.835040 0.433015
H -9.573718 -0.713193 -0.446200
H -8.682442 -0.132518 1.011845


