%chk=000256638.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256638

0 1
O -1.396857 0.932653 -1.978829
O -2.606248 -1.981517 1.164268
O -0.329868 1.377301 3.075169
O 2.667116 1.966070 0.826140
O -3.308961 0.962947 -0.759935
O -1.912516 -2.433396 -0.943708
O 0.787678 2.819825 -0.111742
N -1.538258 0.327657 1.421446
C 0.198639 -0.227864 -0.166631
C -1.355664 -0.268323 0.091080
C 0.772750 0.625017 0.998843
C 0.852055 -1.611657 -0.233835
C -0.374236 0.859000 1.986761
C 2.346129 -1.516874 -0.574280
C -2.165007 0.613767 -0.904556
C -1.965049 -1.683517 -0.000393
C 1.339058 1.933307 0.493776
C 2.991816 -2.907980 -0.616864
C 4.485804 -2.821195 -0.959674
C 5.134873 -4.202567 -1.001326
C -1.901358 1.958891 -2.908805
C -3.343640 -3.252501 1.240739
C 3.447945 3.148953 0.449853
C -1.676747 3.319147 -2.291509
C -4.645688 -3.128995 0.483521
C 3.793373 3.089609 -1.022229
H 0.379612 0.292910 -1.146288
H 1.583897 0.061419 1.541505
H 0.711849 -2.160374 0.717650
H 0.346423 -2.224852 -1.015521
H -2.446056 0.290321 1.880920
H 2.872994 -0.880747 0.165450
H 2.478124 -1.011827 -1.551566
H 2.473483 -3.544268 -1.360688
H 2.860648 -3.418449 0.356713
H 4.619656 -2.316573 -1.936630
H 5.007080 -2.186055 -0.216646
H 4.666343 -4.847114 -1.753986
H 6.200254 -4.132194 -1.248287
H 5.055972 -4.716066 -0.036257
H -1.262550 1.757410 -3.787838
H -2.961062 1.742928 -3.128056
H -2.692854 -4.056469 0.855103
H -3.474526 -3.335686 2.335989
H 4.325062 3.031754 1.113093
H 2.868264 4.049878 0.719113
H -1.662491 4.114043 -3.044766
H -0.713794 3.358169 -1.747845
H -2.453106 3.569919 -1.554867
H -5.193624 -2.217880 0.763167
H -4.478567 -3.079998 -0.603501
H -5.305591 -3.984072 0.675278
H 4.249599 2.128906 -1.293392
H 2.896976 3.213909 -1.648225
H 4.498644 3.882800 -1.299604


%chk=000256638-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256638

0 1
O -1.756083 0.627304 -1.765068
O -2.808446 -1.806327 1.099458
O 0.472776 0.977242 3.326399
O 2.456697 2.552694 1.031899
O -2.522522 1.656712 0.188566
O -1.774535 -2.391479 -0.907700
O 0.618549 2.543904 -0.406387
N -0.977635 -0.032320 1.768729
C 0.468344 -0.397049 -0.097998
C -1.053537 -0.350923 0.345305
C 1.159108 0.544099 0.936440
C 1.105877 -1.808956 -0.064454
C 0.207928 0.548470 2.177644
C 2.546192 -1.830658 -0.629499
C -1.851835 0.784334 -0.398570
C -1.870240 -1.638127 0.081913
C 1.354537 1.965915 0.430886
C 3.160007 -3.248875 -0.612578
C 4.591510 -3.301544 -1.194042
C 5.195380 -4.722246 -1.173640
C -2.447793 1.650089 -2.620387
C -3.763085 -2.954046 0.951506
C 2.721273 3.991209 0.703201
C -1.460267 2.745758 -3.024170
C -4.966389 -2.541331 0.101207
C 3.595151 4.107416 -0.548143
H 0.540976 0.007873 -1.120357
H 2.135760 0.164162 1.274421
H 1.107307 -2.197417 0.975715
H 0.490593 -2.497755 -0.668421
H -1.805786 -0.068387 2.364263
H 3.207418 -1.148272 -0.056822
H 2.532501 -1.449874 -1.672118
H 2.506263 -3.938155 -1.186395
H 3.175010 -3.629969 0.429967
H 4.575593 -2.919729 -2.235287
H 5.244065 -2.612420 -0.619786
H 4.579542 -5.423103 -1.768418
H 6.218949 -4.733884 -1.591127
H 5.246921 -5.115803 -0.140798
H -2.807250 1.066221 -3.483076
H -3.299922 2.057467 -2.048476
H -3.217524 -3.801541 0.501361
H -4.044085 -3.187695 1.990353
H 3.230526 4.367176 1.604267
H 1.752084 4.502700 0.570473
H -1.976614 3.486164 -3.663547
H -0.613788 2.324166 -3.592868
H -1.058335 3.256069 -2.134827
H -5.462877 -1.652326 0.526097
H -4.659040 -2.320796 -0.934786
H -5.700215 -3.367962 0.074013
H 4.532796 3.537843 -0.428123
H 3.060065 3.735358 -1.437887
H 3.855905 5.168122 -0.721028


