%chk=000181309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181309

0 1
O -1.353402 -3.520512 -1.551871
O 2.880100 2.001288 0.133646
O 2.319775 2.279518 -2.481292
N -0.883832 -2.393837 0.381987
C -2.110557 1.587155 1.710697
C -3.635553 -1.181529 -0.586506
C -3.239900 -2.641936 -0.333776
C 0.578132 -2.444878 0.133121
C -2.409954 0.679329 0.541371
C -3.321955 -0.295394 0.583513
C 1.066248 -1.183852 -0.540266
C -1.764456 -2.881760 -0.596407
C -0.641378 1.428601 2.126648
C -2.421282 3.039512 1.324719
C 1.781528 -0.224330 0.199778
C 0.788374 -0.975941 -1.895448
C 2.203620 0.936593 -0.438793
C 1.213445 0.189437 -2.543289
C 1.922940 1.146571 -1.817171
C 3.461816 1.786179 1.441485
H -2.754586 1.312295 2.584648
H -4.726472 -1.131287 -0.795076
H -3.149127 -0.815928 -1.515982
H -3.513328 -2.956984 0.692550
H -3.816531 -3.309193 -1.012248
H 0.805979 -3.335430 -0.508667
H 1.089429 -2.619395 1.105511
H -1.821951 0.884759 -0.355371
H -3.908220 -0.501456 1.479206
H -1.193331 -1.652428 1.011066
H -0.399694 2.080090 2.972657
H 0.039849 1.690418 1.305972
H -0.419872 0.398471 2.421563
H -2.259131 3.718213 2.168401
H -3.463122 3.150232 1.003710
H -1.786798 3.385268 0.500330
H 1.993864 -0.393349 1.251028
H 0.230875 -1.734523 -2.454943
H 1.006571 0.359428 -3.599193
H 2.851994 2.873494 -1.881575
H 4.000950 2.728376 1.605274
H 2.670234 1.652128 2.184685
H 4.150508 0.936585 1.419510


%chk=000181309-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181309

0 1
O -1.400919 -4.142976 -0.988842
O 3.574185 1.778178 -0.125103
O 3.135218 2.054070 -2.753007
N -0.952033 -2.106797 0.050147
C -2.475907 1.638789 1.954290
C -3.733379 -1.240878 -0.496603
C -3.313863 -2.736163 -0.376762
C 0.514391 -2.265022 0.022254
C -2.740869 0.771255 0.736050
C -3.449789 -0.390783 0.729509
C 1.212613 -1.124775 -0.709969
C -1.812241 -3.055447 -0.473391
C -0.953282 1.713794 2.253117
C -3.060445 3.061226 1.744441
C 2.066855 -0.237123 -0.004405
C 1.015388 -0.933087 -2.099527
C 2.702415 0.817805 -0.687331
C 1.653195 0.124331 -2.785505
C 2.498411 1.003205 -2.083574
C 3.840909 1.694273 1.310505
H -2.980380 1.179018 2.828535
H -4.828025 -1.229118 -0.677672
H -3.261466 -0.787701 -1.389472
H -3.688629 -3.152789 0.580638
H -3.792325 -3.324931 -1.178556
H 0.697358 -3.236122 -0.473654
H 0.899984 -2.339205 1.058436
H -2.315922 1.143053 -0.212523
H -3.874316 -0.759764 1.678061
H -1.347302 -1.240820 0.432701
H -0.758833 2.370834 3.121546
H -0.402879 2.123032 1.384213
H -0.540007 0.712633 2.475872
H -2.879037 3.694361 2.632939
H -4.149082 3.021976 1.561940
H -2.586456 3.554508 0.874431
H 2.224916 -0.381233 1.070477
H 0.362069 -1.620322 -2.648375
H 1.513799 0.277537 -3.859698
H 3.690861 2.551380 -2.095516
H 4.525115 2.526309 1.532244
H 2.906771 1.810782 1.893909
H 4.324730 0.732707 1.568432


