%chk=000253205.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253205

0 1
O -4.493718 0.845329 1.829916
O -5.081885 -0.327014 0.009351
O -0.468479 -2.231218 -0.505766
O 3.120539 -0.455958 0.080252
O -0.232246 -0.627502 1.116090
O 3.382234 1.670373 0.902642
N -2.209862 -0.853569 -0.110413
N 1.923929 1.207159 -0.877998
C -1.221857 1.761066 -1.323710
C -2.651541 1.533962 -0.819438
C -0.270042 2.274178 -0.237719
C -2.742791 0.465458 0.286665
C 1.156773 2.477030 -0.765573
C -4.219788 0.242141 0.630380
C -0.896441 -1.170021 0.254962
C 2.835879 0.902953 0.139614
C 0.852604 -2.786259 -0.137310
C 4.233182 -0.920693 0.911878
C 1.169957 -3.715693 -1.285820
C 5.550763 -0.539834 0.271306
H -0.825706 0.825261 -1.765266
H -1.255813 2.488374 -2.161843
H -3.298373 1.252777 -1.677097
H -3.067827 2.486640 -0.429060
H -0.645244 3.231152 0.174985
H -0.250455 1.572126 0.628386
H -2.191069 0.820375 1.211712
H 1.149782 2.940305 -1.778854
H 1.714052 3.180768 -0.098910
H -2.630370 -1.306738 -0.924865
H 1.424832 0.425295 -1.305030
H -5.441521 0.732417 2.117067
H 0.721188 -3.300925 0.828917
H 1.566008 -1.943033 -0.030794
H 4.112222 -0.494842 1.925073
H 4.044980 -2.008998 0.914984
H 0.365661 -4.448588 -1.444043
H 1.289959 -3.168022 -2.230441
H 2.098680 -4.269587 -1.099756
H 5.590759 -0.840659 -0.783135
H 5.702415 0.551012 0.300627
H 6.399128 -1.002601 0.788034


%chk=000253205-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253205

0 1
O -4.688747 1.153489 1.383012
O -4.856460 -0.829058 0.181795
O -0.560468 -2.486638 -0.497974
O 3.261902 -0.221899 -0.401223
O -0.144977 -0.704768 0.989097
O 3.131218 1.518367 1.195301
N -2.118520 -0.842931 -0.277570
N 1.938697 1.579648 -0.831560
C -1.165476 1.923295 -1.188150
C -2.612175 1.592218 -0.757180
C -0.279255 2.512614 -0.067411
C -2.702597 0.391069 0.246453
C 1.170644 2.798300 -0.532828
C -4.167877 0.133792 0.586003
C -0.885056 -1.288087 0.151758
C 2.791974 1.019993 0.091403
C 0.782580 -3.044278 -0.152698
C 4.247627 -0.909908 0.477048
C 0.969263 -4.288181 -1.015268
C 5.667477 -0.388804 0.235672
H -0.699168 1.003221 -1.593906
H -1.216023 2.646821 -2.028092
H -3.216217 1.343829 -1.652677
H -3.079942 2.472441 -0.276461
H -0.723287 3.463384 0.292182
H -0.228718 1.818685 0.791015
H -2.157606 0.655457 1.170011
H 1.163695 3.444571 -1.433062
H 1.718765 3.329532 0.263879
H -2.692736 -1.453888 -0.862819
H 1.735363 1.034157 -1.669112
H -5.652777 0.980307 1.561996
H 0.795664 -3.276590 0.927826
H 1.542490 -2.266725 -0.351855
H 3.941494 -0.763909 1.527858
H 4.148067 -1.972933 0.199090
H 0.180056 -5.032478 -0.812820
H 0.940934 -4.032396 -2.088352
H 1.948373 -4.751715 -0.794652
H 5.945956 -0.480486 -0.828807
H 5.746122 0.668910 0.538047
H 6.390217 -0.974032 0.835033


