%chk=000287222.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287222

0 1
O 0.551288 -1.527709 1.451264
O 1.074311 2.444448 0.039064
O 3.599242 -1.341347 -1.043321
N 2.708529 0.192019 0.394876
N -5.051017 -0.085225 -0.971955
C 1.350691 0.093405 -0.194164
C 0.335379 -0.192395 0.955293
C -1.090668 -0.176388 0.467195
C 1.013421 1.392043 -0.949738
C -1.854216 0.994706 0.580651
C -1.665531 -1.330849 -0.085923
C 3.786273 -0.509375 -0.173565
C -3.172677 1.026755 0.134362
C -2.983153 -1.319857 -0.535128
C -3.743495 -0.134557 -0.432289
C 5.129758 -0.192046 0.418431
H 1.326061 -0.771345 -0.920417
H 0.488858 0.516001 1.802298
H -0.000959 1.356617 -1.387945
H 1.756049 1.607411 -1.738932
H 2.864236 1.018815 0.972293
H -1.408174 1.890384 1.017672
H -1.068322 -2.245519 -0.145548
H 1.501863 -1.677649 1.635014
H -3.753872 1.939843 0.217578
H -3.416930 -2.216939 -0.967428
H 0.784977 3.288341 -0.356400
H 5.890338 -0.878697 0.009995
H 5.457370 0.828014 0.179007
H 5.148961 -0.304445 1.510420
H -5.525167 -0.970015 -1.081324
H -5.661723 0.630552 -0.606437


%chk=000287222-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287222

0 1
O 0.669195 -1.223963 1.699600
O 1.418753 2.644185 0.031759
O 3.367112 -1.647354 -0.917110
N 2.713164 0.226191 0.313001
N -5.113896 -0.359475 -0.916812
C 1.321330 0.247820 -0.179093
C 0.320598 0.026839 1.007632
C -1.114993 -0.081326 0.531259
C 1.067389 1.564963 -0.922446
C -2.012544 1.005266 0.663820
C -1.584392 -1.268401 -0.086214
C 3.661636 -0.688190 -0.142138
C -3.335628 0.926018 0.184272
C -2.903442 -1.366099 -0.564341
C -3.803305 -0.265883 -0.440945
C 5.080676 -0.463948 0.374763
H 1.223205 -0.600799 -0.880969
H 0.420657 0.890283 1.699299
H 0.003952 1.631781 -1.220613
H 1.714621 1.617406 -1.820915
H 3.017514 1.073668 0.801230
H -1.673481 1.926486 1.155098
H -0.910765 -2.129225 -0.156578
H 1.659381 -1.250839 1.779101
H -4.015153 1.779287 0.303440
H -3.249993 -2.298100 -1.028596
H 1.299696 3.524328 -0.401397
H 5.758051 -0.322322 -0.485188
H 5.171683 0.403077 1.051610
H 5.418364 -1.369765 0.907247
H -5.452755 -1.218703 -1.338704
H -5.764931 0.411793 -0.806172


