%chk=000235351.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235351

0 1
O 0.865552 -0.195041 0.558142
O -0.643456 1.924953 0.295593
O -0.327791 -2.866910 -0.110269
O 1.635383 0.119149 -1.607810
N 2.978524 0.516819 0.277767
C -0.442849 -0.390342 0.116457
C -1.292922 0.745841 0.032570
C -0.971992 -1.666105 -0.144283
C -2.648156 0.605591 -0.272169
C -2.349846 -1.805322 -0.446327
C -3.158730 -0.680859 -0.507540
C 1.809314 0.197137 -0.415889
C -1.404874 3.152672 0.159510
C 1.118138 -2.881734 0.026374
C 4.029879 1.263487 -0.449607
H -3.306689 1.463473 -0.332187
H -2.741488 -2.802734 -0.633539
H -4.218228 -0.793027 -0.746511
H -2.222107 3.173139 0.886063
H -1.765121 3.263369 -0.867663
H -0.646446 3.909965 0.395803
H 1.419665 -2.367708 0.945601
H 1.572982 -2.426349 -0.860344
H 1.324391 -3.957212 0.076130
H 2.904406 0.710971 1.277083
H 3.907853 2.356139 -0.370017
H 4.020179 0.997498 -1.525223
H 5.015027 0.979538 -0.040814


%chk=000235351-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235351

0 1
O 0.886742 -0.256128 0.606272
O -0.593929 1.941440 0.185227
O -0.330487 -2.933920 0.154996
O 1.662959 0.265558 -1.583485
N 2.897672 0.761490 0.361419
C -0.457220 -0.431668 0.178268
C -1.270527 0.726163 0.013773
C -1.017551 -1.723241 0.023986
C -2.646999 0.598325 -0.274253
C -2.407575 -1.846118 -0.242511
C -3.203603 -0.698431 -0.386538
C 1.819320 0.291289 -0.342631
C -1.361378 3.170087 -0.028292
C 1.104772 -3.004610 -0.184479
C 4.071101 1.336079 -0.299878
H -3.280819 1.479583 -0.402509
H -2.820498 -2.853148 -0.346624
H -4.271748 -0.807625 -0.602434
H -2.190780 3.256214 0.700387
H -1.762894 3.216569 -1.058622
H -0.642407 3.987487 0.128367
H 1.724736 -2.605980 0.635574
H 1.316967 -2.454350 -1.119359
H 1.301842 -4.079011 -0.323951
H 2.822498 0.760219 1.378887
H 4.192045 2.405641 -0.045999
H 3.924801 1.249869 -1.388250
H 4.993559 0.794613 -0.020442


