%chk=000181472.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181472

0 1
O 2.864045 -1.948784 -1.273515
N 2.212712 0.165675 -0.702444
N 4.966039 0.730072 1.818913
C -0.481633 -1.083759 -0.601914
C -1.221988 0.149875 -0.653406
C 0.549048 -1.401448 -1.645767
C -2.176364 0.417658 0.363313
C -0.708961 -1.981893 0.418093
C 1.971531 -1.122869 -1.179229
C -1.036017 1.120076 -1.690069
C -2.387674 -0.537930 1.407313
C -1.671392 -1.707289 1.429453
C -2.914781 1.644781 0.329801
C 3.544915 0.535087 -0.173167
C -1.755279 2.288163 -1.699944
C -2.707838 2.556323 -0.673850
C 3.651274 0.219064 1.335289
H 0.490437 -2.477735 -1.934334
H 0.359785 -0.853604 -2.595313
H -0.153189 -2.918816 0.468875
H -0.315073 0.908587 -2.481939
H -3.125616 -0.317767 2.177140
H -1.824437 -2.444156 2.217526
H -3.643031 1.835646 1.117222
H 3.717934 1.619755 -0.353512
H 4.330812 -0.021459 -0.737826
H 1.447766 0.803733 -0.499852
H -1.613975 3.025573 -2.489058
H -3.264599 3.491869 -0.706315
H 3.503898 -0.870758 1.500752
H 2.843764 0.740823 1.893895
H 5.726175 0.171024 1.440622
H 5.020413 0.656783 2.830450


%chk=000181472-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181472

0 1
O 2.721617 -0.410698 -1.995415
N 2.068066 -0.126216 0.220071
N 5.576846 0.661510 1.404642
C -0.592003 -1.089144 -0.431744
C -1.317105 0.138085 -0.687243
C 0.614665 -1.466596 -1.275217
C -2.468127 0.464406 0.133312
C -1.018249 -1.929220 0.607379
C 1.888228 -0.612482 -1.058702
C -0.940697 1.051872 -1.728840
C -2.863124 -0.428446 1.184690
C -2.150123 -1.603794 1.418883
C -3.192027 1.676160 -0.121793
C 3.246198 0.670882 0.595740
C -1.665096 2.225555 -1.952985
C -2.801416 2.542481 -1.144554
C 4.423721 -0.203090 1.094921
H 0.895661 -2.517823 -1.074095
H 0.395723 -1.404412 -2.355341
H -0.478816 -2.866055 0.794388
H -0.070869 0.831306 -2.356277
H -3.734917 -0.173291 1.798845
H -2.455206 -2.287647 2.218286
H -4.061668 1.911493 0.503621
H 2.972435 1.395924 1.381656
H 3.568511 1.231946 -0.300566
H 1.334990 -0.299855 0.911549
H -1.362164 2.910279 -2.752600
H -3.360700 3.465798 -1.331110
H 4.623549 -0.983216 0.324923
H 4.121826 -0.724901 2.022766
H 6.004702 1.096596 0.581636
H 6.274269 0.244894 2.026374


