%chk=000229300.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229300

0 1
O -3.731046 1.387130 0.218845
O -1.829162 2.376345 0.836893
O 0.398672 -1.808085 -0.569213
N -0.265720 0.283769 0.102666
C -1.726203 0.019997 0.082442
C -2.235234 -0.508336 -1.278958
C -2.162364 -1.042801 1.124085
C -3.512898 -1.294821 -0.946315
C -3.389604 -1.750418 0.522890
C -2.380199 1.378333 0.423592
C 0.698378 -0.676886 -0.232016
C 2.110185 -0.182355 -0.123438
C 3.020903 -0.929376 0.635909
C 2.526552 0.974401 -0.794635
C 4.348723 -0.505134 0.736768
C 3.857151 1.390385 -0.693562
C 4.766028 0.654009 0.074033
H -1.473688 -1.184855 -1.724985
H -2.412242 0.296170 -2.007399
H -2.372660 -0.605533 2.111370
H -1.338300 -1.771458 1.271446
H -3.639836 -2.152783 -1.626084
H -4.402687 -0.649617 -1.071764
H -4.305261 -1.498412 1.084605
H -3.271863 -2.846076 0.586396
H 0.027335 1.202626 0.459636
H -4.138959 2.268174 0.455757
H 2.692640 -1.842256 1.135923
H 1.822160 1.543853 -1.401141
H 5.059086 -1.081440 1.328070
H 4.185972 2.288357 -1.214858
H 5.802141 0.982195 0.152743


%chk=000229300-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229300

0 1
O -3.784936 1.361500 0.129452
O -1.773586 2.498714 0.168564
O 0.449033 -1.910582 -0.081475
N -0.294680 0.298205 0.050527
C -1.744708 0.024229 0.013862
C -2.205696 -0.733688 -1.282178
C -2.242618 -0.918013 1.169000
C -3.538364 -1.431440 -0.915536
C -3.507124 -1.649575 0.634918
C -2.395856 1.408166 0.108791
C 0.697741 -0.659661 -0.018931
C 2.119320 -0.145652 -0.002463
C 3.142988 -1.094119 0.250960
C 2.475590 1.207874 -0.244787
C 4.495707 -0.698065 0.281138
C 3.830996 1.603399 -0.218060
C 4.844195 0.653791 0.049833
H -1.420903 -1.480065 -1.491320
H -2.287095 -0.058683 -2.152336
H -2.427393 -0.360176 2.103447
H -1.427196 -1.637449 1.349802
H -3.642610 -2.384118 -1.464388
H -4.395735 -0.792801 -1.185800
H -4.423471 -1.240910 1.093007
H -3.457489 -2.722939 0.889842
H -0.049020 1.287626 0.158736
H -4.139785 2.289927 0.193074
H 2.846785 -2.135528 0.413917
H 1.715690 1.962087 -0.482845
H 5.277150 -1.439016 0.482391
H 4.096068 2.648448 -0.412396
H 5.895001 0.963615 0.070956


