%chk=000298788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298788

0 1
O 5.851643 -2.145446 0.398559
O -5.823367 -1.646500 0.328861
O 6.978086 0.253705 -0.857148
O -7.324412 0.788749 0.423821
N 0.481241 1.763933 0.221436
N -0.460433 1.849797 -0.661476
N 0.163964 -0.625030 0.330278
N -0.777790 -0.539099 -0.555475
C 3.261081 0.351233 1.062989
C -3.568003 0.765223 -1.391636
C 1.920309 0.423416 1.751114
C -2.224282 0.807300 -2.076816
C 3.940534 -0.871237 0.987533
C -4.029594 -0.451398 -0.856595
C 3.819053 1.508570 0.497708
C -4.348092 1.918722 -1.294492
C 0.818825 0.523391 0.741615
C -1.118759 0.700284 -1.072402
C 5.193269 -0.923185 0.365981
C -5.273026 -0.507414 -0.232543
C 5.770148 0.249422 -0.171368
C -6.077082 0.665649 -0.142111
C 5.073009 1.462760 -0.112861
C -5.601646 1.869829 -0.675029
C 6.139081 -2.698541 -0.916508
C -5.013795 -2.848728 0.322427
C 8.123403 -0.110583 -0.036811
C -7.917266 -0.385720 1.032798
H 1.889723 1.304180 2.436102
H 1.758768 -0.467809 2.402046
H -2.109401 1.745717 -2.668679
H -2.147920 -0.024825 -2.816012
H 3.513986 -1.787500 1.395881
H -3.397813 -1.336338 -0.929744
H 3.268751 2.451015 0.534569
H -3.988990 2.866638 -1.693369
H 5.521556 2.355711 -0.548087
H -6.221935 2.762615 -0.595438
H 6.754773 -3.570100 -0.670688
H 6.685966 -1.975381 -1.532374
H 5.200029 -2.995490 -1.391679
H -4.081505 -2.686164 0.872183
H -4.827993 -3.174951 -0.704945
H -5.664896 -3.556734 0.849912
H 8.304996 0.679783 0.696429
H 8.929765 -0.161585 -0.775996
H 7.959539 -1.077545 0.452308
H -7.290720 -0.737625 1.858911
H -8.053529 -1.170410 0.280938
H -8.876449 0.006499 1.388784


%chk=000298788-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298788

0 1
O 5.926236 -2.115275 0.149550
O -5.912657 -1.738291 0.230938
O 6.930267 0.400088 -0.978046
O -7.585724 0.500255 -0.357063
N 0.433299 1.666269 0.752996
N -0.526458 1.755862 -0.221420
N 0.131737 -0.754825 0.834821
N -0.827136 -0.664400 -0.141376
C 3.311581 0.300507 1.263288
C -3.476731 0.606041 -1.437523
C 2.009754 0.285223 2.073009
C -2.007796 0.655460 -1.874910
C 4.040484 -0.893748 1.056193
C -3.982012 -0.541546 -0.776106
C 3.783899 1.506855 0.685276
C -4.341458 1.690417 -1.701062
C 0.809244 0.401793 1.167003
C -1.051532 0.574897 -0.710829
C 5.235275 -0.890757 0.304756
C -5.337593 -0.613695 -0.385826
C 5.733973 0.333877 -0.226904
C -6.209523 0.494084 -0.638188
C 4.989148 1.519945 -0.047673
C -5.694316 1.628036 -1.298726
C 6.054142 -2.579183 -1.252868
C -5.049986 -2.904201 0.449326
C 8.154005 0.025966 -0.229019
C -8.023231 0.124785 1.003711
H 1.994168 1.133885 2.779225
H 1.921973 -0.654519 2.642193
H -1.810977 1.598173 -2.411416
H -1.787998 -0.188431 -2.555212
H 3.690491 -1.849369 1.461223
H -3.300316 -1.373879 -0.574800
H 3.212709 2.432245 0.818725
H -3.964033 2.585594 -2.206829
H 5.382321 2.445256 -0.480711
H -6.383182 2.456666 -1.489592
H 6.646792 -3.505022 -1.201044
H 6.565702 -1.823456 -1.875634
H 5.053261 -2.795394 -1.671831
H -4.207656 -2.662736 1.125590
H -4.655688 -3.292934 -0.508927
H -5.700821 -3.657314 0.917326
H 8.328406 0.745750 0.592862
H 8.973715 0.086466 -0.960822
H 8.071912 -0.996830 0.180426
H -7.557014 0.790556 1.755897
H -7.774181 -0.925221 1.224951
H -9.113673 0.274883 0.997970


