%chk=000296165.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296165

0 1
O -1.057427 2.475790 0.791393
O 4.339092 1.966871 -0.358389
O 2.289254 1.970123 -1.245809
N 0.788567 -0.070215 0.539730
C -2.408503 0.619903 0.173374
C -4.881262 -0.694323 -0.069057
C -2.454267 -0.744429 -0.151365
C -3.610142 1.319639 0.387715
C -3.680494 -1.396875 -0.272156
C -4.836401 0.670545 0.263799
C 2.005284 -0.728420 0.200708
C 3.167671 -0.074780 -0.264674
C -1.133442 1.364629 0.321598
C -6.192551 -1.396520 -0.187209
C 2.059364 -2.108444 0.502662
C 4.374966 -0.793573 -0.367234
C 0.115134 0.696408 -0.239833
C 3.252804 -2.807596 0.360951
C 4.417413 -2.150624 -0.066680
C 3.153242 1.342639 -0.670015
H -1.531285 -1.306451 -0.302314
H -3.568035 2.380396 0.655358
H -3.706873 -2.455880 -0.521397
H -5.760152 1.221973 0.429912
H -6.997388 -0.729094 -0.525575
H -6.158194 -2.238589 -0.891980
H -6.502685 -1.804797 0.787746
H 1.161371 -2.610036 0.866291
H 5.278467 -0.267204 -0.689153
H 0.337211 0.985849 -1.285461
H 3.288272 -3.873509 0.593074
H 5.351388 -2.703050 -0.156662
H 4.338698 2.927345 -0.628950


%chk=000296165-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296165

0 1
O -1.624759 0.769067 -3.282129
O 2.774663 -0.306874 2.864515
O 0.878700 0.423632 1.755433
N 0.609004 -0.446123 -0.855556
C -2.405264 0.262315 -1.045401
C -4.535828 -0.058206 0.831628
C -2.127204 0.182105 0.347433
C -3.758128 0.187821 -1.488601
C -3.188308 0.026833 1.264546
C -4.802022 0.023886 -0.565916
C 1.986555 -0.739018 -0.760210
C 2.680853 -0.668009 0.494072
C -1.351726 0.472234 -2.071079
C -5.673721 -0.217282 1.821912
C 2.681453 -1.233130 -1.902271
C 4.034480 -1.090797 0.566988
C 0.121428 0.344836 -1.768033
C 4.024026 -1.645579 -1.807185
C 4.707958 -1.576872 -0.569537
C 2.004196 -0.132187 1.697960
H -1.098334 0.241853 0.711610
H -3.956196 0.263298 -2.563198
H -2.964015 -0.029355 2.336171
H -5.838191 -0.040921 -0.920149
H -6.324643 -1.069638 1.552254
H -5.301381 -0.381137 2.846964
H -6.315123 0.685064 1.836104
H 2.138996 -1.321418 -2.849621
H 4.544399 -1.022719 1.531382
H 0.757564 0.926635 -2.466331
H 4.536655 -2.023124 -2.698769
H 5.751332 -1.898667 -0.495210
H 2.271678 0.079176 3.630620


