%chk=000294388.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294388

0 1
O -0.000216 1.681500 0.000023
O 0.000648 -3.698731 0.000205
O -5.144453 1.775472 1.650109
O 5.144286 1.775877 -1.649467
N -2.576432 1.761898 -0.238751
N 2.575983 1.762733 0.239004
C -1.271154 -0.292957 -0.088296
C 1.271346 -0.292541 0.088762
C -1.284078 -1.709538 -0.078603
C 1.284709 -1.709122 0.079342
C -0.000016 0.436918 0.000131
C -2.525721 0.386168 -0.180260
C 2.525696 0.386985 0.180710
C 0.000444 -2.483876 0.000330
C -2.459380 -2.435641 -0.139449
C 2.460223 -2.434846 0.140513
C -3.737540 -0.382855 -0.228637
C 3.737741 -0.381649 0.229393
C -3.697744 -1.756096 -0.213527
C 3.698368 -1.754903 0.214606
C -3.828513 2.540060 -0.259577
C 3.827823 2.541284 0.259578
C -4.345365 2.854204 1.157859
C 4.344952 2.854739 -1.157916
H -2.432145 -3.527732 -0.130388
H 2.433329 -3.526947 0.131684
H -4.696073 0.137661 -0.287720
H 4.696112 0.139174 0.288449
H -1.694640 2.304537 -0.156915
H 1.694018 2.305082 0.157044
H -4.621044 -2.337886 -0.256880
H 4.621840 -2.336398 0.258237
H -4.626091 1.999907 -0.825904
H -3.638696 3.487056 -0.815285
H 4.625396 2.001750 0.826486
H 3.637549 3.488598 0.814601
H -5.058840 3.701621 1.144423
H -3.527598 3.070819 1.867403
H 5.058329 3.702249 -1.144733
H 3.527306 3.070920 -1.867727
H -4.579562 1.000280 1.864463
H 4.579504 1.000628 -1.863920


%chk=000294388-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294388

0 1
O -0.000424 1.683805 -0.001390
O 0.000526 -3.846553 0.001556
O -4.981985 1.877870 1.775947
O 4.982297 1.878900 -1.775347
N -2.575396 1.718002 -0.114792
N 2.574998 1.718823 0.114495
C -1.273802 -0.366407 -0.047294
C 1.273848 -0.365954 0.046798
C -1.278685 -1.800664 -0.050174
C 1.279156 -1.800223 0.050278
C -0.000106 0.363976 -0.000686
C -2.547594 0.335738 -0.101687
C 2.547449 0.336555 0.101693
C 0.000389 -2.571659 -0.000536
C -2.482054 -2.529290 -0.108114
C 2.482686 -2.528489 0.109368
C -3.756620 -0.438217 -0.147965
C 3.756652 -0.437063 0.149022
C -3.715952 -1.838891 -0.155698
C 3.716365 -1.837739 0.157403
C -3.761449 2.558424 -0.306793
C 3.760844 2.559454 0.306859
C -4.424093 3.002896 1.018179
C 4.423936 3.003905 -1.017891
H -2.428656 -3.621353 -0.109220
H 2.429591 -3.620567 0.110790
H -4.723049 0.072245 -0.152616
H 4.722936 0.073672 0.154116
H -1.623349 2.140208 -0.077132
H 1.622862 2.140835 0.076576
H -4.655651 -2.400863 -0.188451
H 4.656196 -2.399441 0.190992
H -4.508563 2.035769 -0.931328
H -3.451047 3.464941 -0.862256
H 4.507802 2.036983 0.931737
H 3.450084 3.465985 0.862103
H -5.287427 3.654668 0.799682
H -3.692714 3.572628 1.629656
H 5.287083 3.655828 -0.799110
H 3.692708 3.573471 -1.629705
H -4.241186 1.291639 2.076321
H 4.241696 1.292556 -2.075989


