%chk=000207439.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207439

0 1
O -0.232696 -0.084268 0.171347
O -5.583776 0.148339 0.478292
O -1.834111 -1.958055 -1.034692
N -1.545685 0.240265 -0.237426
N -3.707047 -0.899121 -0.253984
C -2.081736 1.121827 0.849868
C -3.544950 1.445707 0.554896
C 1.999059 -0.373624 -0.392852
C 2.710503 0.736505 0.102804
C 0.641647 -0.227517 -1.015618
C 2.133086 2.127591 0.071408
C -4.390765 0.223594 0.289675
C -2.301661 -0.975521 -0.505537
C 2.564129 -1.656942 -0.312003
C 3.993047 0.542392 0.642481
C 2.550653 2.871579 -1.196059
C 3.837278 -1.838171 0.229406
C 4.553793 -0.733946 0.703466
H -1.463022 2.049830 0.852439
H -1.962709 0.658393 1.856063
H -3.625110 2.119030 -0.331651
H -3.988122 2.023173 1.396853
H 0.541616 0.664870 -1.655559
H 0.308295 -1.125842 -1.570693
H 1.025438 2.087324 0.146789
H 2.460995 2.695941 0.966461
H 2.001233 -2.519001 -0.673216
H -4.267029 -1.727658 -0.507300
H 4.554128 1.396859 1.017109
H 3.641726 2.963186 -1.265249
H 2.130641 3.883044 -1.219439
H 2.213656 2.350503 -2.100107
H 4.269420 -2.835199 0.285003
H 5.549078 -0.871186 1.123828


%chk=000207439-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207439

0 1
O -0.242910 -0.198800 0.446492
O -5.751823 0.288386 0.027308
O -1.849795 -2.138181 -0.766755
N -1.637120 0.052351 0.092262
N -3.774033 -0.894443 -0.281246
C -2.251471 1.063983 0.977293
C -3.619608 1.470246 0.398069
C 2.041975 -0.349323 -0.332369
C 2.816819 0.760090 0.122561
C 0.618039 -0.184713 -0.802494
C 2.273877 2.184316 0.124084
C -4.494103 0.264713 0.056826
C -2.356056 -1.072590 -0.328885
C 2.606164 -1.650621 -0.330864
C 4.146864 0.523908 0.552981
C 2.543740 2.923960 -1.215215
C 3.931325 -1.869686 0.100947
C 4.706005 -0.773056 0.542990
H -1.571571 1.930185 1.015546
H -2.357763 0.665149 2.007213
H -3.482417 2.056976 -0.530599
H -4.173158 2.102159 1.111043
H 0.433381 0.770911 -1.325439
H 0.295203 -1.029550 -1.433972
H 1.188630 2.183031 0.334507
H 2.749660 2.752709 0.945623
H 1.991011 -2.494622 -0.664570
H -4.313740 -1.709838 -0.590690
H 4.748714 1.370899 0.905344
H 3.627509 2.973471 -1.423940
H 2.152019 3.957234 -1.181619
H 2.066131 2.403327 -2.065588
H 4.353395 -2.880354 0.096541
H 5.736108 -0.928328 0.883417


