%chk=000145848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145848

0 1
 O   -1.084200      -2.364100      0.3104000    
 O  -0.4414000      -2.488100      -1.785000    
 N  -0.2016000      0.2984000     -0.7232000    
 N   -6.261500      0.6294000      0.5638000    
 N    3.806000      0.2985000      0.5029000    
 N  -0.1907000      -2.353200     -0.5662000    
 C   -2.621400      0.3937000     -0.5352000    
 C   -3.818200      0.4890000      0.4171000    
 C   -1.283500      0.3825000      0.1993000    
 C    1.157100      0.2658000     -0.3067000    
 C   -5.135300      0.5301000     -0.3572000    
 C    1.813700     -0.9386000     -3.4800000E-02
 C    1.826200       1.486700     -0.1733000    
 C    3.156900     -0.8747000      0.3730000    
 C    3.168800       1.455800      0.2397000    
 C    1.165800      -2.179900     -0.1604000    
 C    1.190800       2.712000     -0.4399000    
 C    3.816100      -2.070400      0.6454000    
 C    3.840400       2.668000      0.3743000    
 C    1.847300      -3.360900      0.1180000    
 C   -6.598600     -0.6866000       1.109200    
 C   -7.424500       1.214700     -0.1054000    
 C    3.175200      -3.305600      0.5215000    
 C    1.884600       3.910000     -0.2976000    
 C    3.212100       3.887600      0.1104000    
 H   -2.715700     -0.5143000      -1.143700    
 H   -2.645500       1.238900      -1.235400    
 H   -3.721500       1.391400       1.034000    
 H   -3.787500     -0.3703000       1.096100    
 H   -1.208200       1.348500      0.7181000    
 H   -1.251400     -0.3344000       1.019700    
 H   -5.099400       1.418400      -1.002300    
 H   -5.228900     -0.3347000      -1.026900    
 H  -0.3370000      0.7589000      -1.619700    
 H   0.1564000       2.775700     -0.7662000    
 H    4.857000      -2.053600      0.9634000    
 H    4.881300       2.676800      0.6926000    
 H    1.363000      -4.330200      2.6600000E-02
 H   -6.881400      -1.400400      0.3267000    
 H   -5.769200      -1.112500       1.682000    
 H   -7.437600     -0.6031000       1.809700    
 H   -7.199300       2.227900     -0.4568000    
 H   -8.264100       1.307900      0.5926000    
 H   -7.752600      0.6151000     -0.9623000    
 H    3.716600      -4.221200      0.7412000    
 H    1.392300       4.855200     -0.5052000    
 H    3.762700       4.816700      0.2242000    


%chk=000145848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145848

0 1
O -1.585449 -2.499916 -0.486195
O -0.610973 -0.951543 -1.856247
N -0.218122 1.315374 -0.080773
N -6.393795 -0.094966 0.504417
N 3.815192 0.154019 0.568516
N -0.603277 -1.712064 -0.810214
C -2.689714 0.849850 -0.198448
C -3.890260 0.244103 0.562718
C -1.396761 0.786473 0.641335
C 1.072126 0.836976 -0.099087
C -5.202113 0.388613 -0.235373
C 1.443893 -0.535862 0.159772
C 2.157799 1.773507 -0.343541
C 2.817979 -0.778848 0.604667
C 3.507996 1.374275 0.013556
C 0.606859 -1.706401 0.043168
C 1.954940 3.088275 -0.878346
C 3.169430 -2.075488 1.128578
C 4.582998 2.310788 -0.168634
C 0.978534 -2.959933 0.537061
C -6.406748 -1.561847 0.688504
C -7.650824 0.380264 -0.110835
C 2.262885 -3.131346 1.134367
C 3.022454 3.970000 -1.061136
C 4.350648 3.578993 -0.695616
H -2.528150 0.312433 -1.150971
H -2.907955 1.909105 -0.453886
H -4.026317 0.742952 1.542943
H -3.676732 -0.823692 0.761396
H -1.534101 1.387595 1.566353
H -1.201496 -0.242647 0.975463
H -5.364030 1.462970 -0.454234
H -5.089375 -0.130117 -1.224803
H -0.329451 2.289942 -0.366854
H 0.959873 3.415831 -1.205937
H 4.194022 -2.187410 1.495484
H 5.584188 1.974909 0.117484
H 0.298135 -3.804517 0.398795
H -6.432607 -2.123485 -0.280622
H -5.514707 -1.889557 1.247501
H -7.296845 -1.849461 1.276246
H -7.648026 1.484057 -0.160464
H -8.509504 0.068769 0.510989
H -7.817590 -0.012502 -1.147111
H 2.548555 -4.111034 1.529225
H 2.845279 4.960618 -1.493006
H 5.181235 4.278744 -0.837704


