%chk=000294901.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294901

0 1
O 1.900872 1.125934 0.637836
O -2.264257 0.454176 0.533514
O 3.122882 -0.525438 -0.337637
O -0.851824 -4.243922 0.752385
O -0.965020 0.094954 -1.336756
O -0.395646 -4.134729 -1.437947
N -1.029419 -1.409118 0.442132
C 2.271684 2.197340 -0.339163
C 1.223216 -2.323262 1.095735
C 0.138498 -2.193644 0.008820
C -3.002701 1.630040 -0.036935
C 1.716503 -0.974468 1.612898
C 2.347239 -0.152539 0.511985
C 3.777807 2.402522 -0.265831
C 1.481454 3.368558 0.240220
C 1.786529 1.767562 -1.712027
C -1.995062 2.658406 -0.521989
C -3.767775 2.074893 1.205019
C -3.903197 1.105307 -1.144433
C -1.370779 -0.233267 -0.239133
C -0.376382 -3.592326 -0.364826
H 0.840902 -2.927578 1.946763
H 2.080405 -2.896277 0.674044
H 0.578125 -1.731215 -0.930667
H 0.893241 -0.399694 2.092490
H 2.473669 -1.127240 2.413149
H -1.398033 -1.584878 1.376336
H 4.098727 3.240616 -0.893056
H 4.316643 1.506908 -0.615737
H 4.113571 2.600266 0.757778
H 1.599235 4.267398 -0.372543
H 0.404665 3.129239 0.294508
H 1.805463 3.604935 1.260615
H 1.832821 2.583388 -2.438304
H 0.744372 1.404036 -1.682785
H 2.385800 0.934116 -2.110671
H -1.171350 2.802055 0.198970
H -1.520279 2.339297 -1.465741
H -2.462874 3.631695 -0.698130
H -3.086993 2.412477 1.996714
H -4.356642 1.249254 1.626785
H -4.455254 2.895590 0.975048
H -3.313335 0.707151 -1.985604
H -4.547342 0.290229 -0.793018
H -4.549789 1.892598 -1.546437
H -1.221270 -5.143743 0.543027


%chk=000294901-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294901

0 1
O 2.230788 1.385111 0.479039
O -2.785609 0.055357 0.541744
O 2.726285 -0.621846 -0.633523
O -1.423029 -4.165383 0.595884
O -0.793268 0.335231 -0.725080
O 0.569250 -4.531222 -0.542100
N -1.190306 -1.544326 0.616887
C 2.744154 2.302638 -0.635959
C 1.185835 -2.108283 1.299181
C 0.038526 -2.249015 0.242922
C -3.393903 1.388214 0.123347
C 1.578875 -0.641359 1.550850
C 2.236646 0.009174 0.335089
C 4.262868 2.093505 -0.795015
C 2.416421 3.695081 -0.070490
C 1.959030 2.018348 -1.932343
C -2.487939 2.538794 0.607057
C -4.735209 1.372517 0.876913
C -3.603316 1.398199 -1.404056
C -1.523832 -0.321909 0.067210
C -0.211353 -3.738342 0.019136
H 0.861359 -2.568065 2.252322
H 2.058374 -2.670283 0.921196
H 0.410672 -1.821831 -0.706493
H 0.709993 -0.032383 1.853175
H 2.299825 -0.592388 2.390642
H -1.887291 -2.030865 1.183170
H 4.656142 2.812853 -1.536868
H 4.483491 1.072905 -1.145812
H 4.783639 2.266922 0.163658
H 2.774079 4.476633 -0.764648
H 1.326554 3.812142 0.061041
H 2.903888 3.843306 0.908774
H 2.139110 2.839204 -2.650917
H 0.877912 1.956574 -1.720925
H 2.274722 1.067898 -2.389081
H -2.318564 2.464389 1.696065
H -1.514945 2.518889 0.091132
H -2.980579 3.506476 0.400137
H -4.569073 1.307376 1.966075
H -5.345964 0.507873 0.564819
H -5.298097 2.298166 0.660903
H -2.638417 1.370336 -1.934048
H -4.209206 0.528795 -1.715326
H -4.143427 2.317418 -1.696210
H -1.526012 -5.145220 0.457929


