%chk=000284725.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284725

0 1
O 2.032250 -1.443841 -1.773314
O 5.438128 -1.286386 -0.327322
O 4.123262 -0.341473 1.257366
N 0.301774 -0.214016 -1.003695
N -2.721788 1.256402 0.390899
N 3.440898 2.785834 -0.962910
N 2.306990 2.023730 -0.940615
C -0.657253 -1.356258 -1.190435
C -0.349335 0.981690 -0.388899
C -1.945813 -0.839248 -0.627443
C -1.770074 0.528214 -0.156502
C 4.094641 0.474476 -1.068449
C 2.587291 0.748469 -1.081235
C 1.640069 -0.377039 -1.311935
C 4.674816 1.907059 -0.943827
C -3.164377 -1.434493 -0.508050
C -4.236225 -0.678411 0.083755
C -3.982669 0.654386 0.519259
C 4.490960 -0.394365 0.109745
C -5.545040 -1.218238 0.249588
C -5.033028 1.423159 1.109912
C -6.541354 -0.461090 0.820502
C -6.282630 0.869922 1.253819
C 5.919361 -2.263778 0.635867
H -0.281425 -2.261582 -0.660822
H -0.729696 -1.613495 -2.271760
H -0.299208 1.857434 -1.079106
H 0.158389 1.274886 0.558552
H 4.401232 -0.023343 -2.025815
H 5.285889 2.052079 -0.033713
H 5.297503 2.175620 -1.822558
H -3.351644 -2.453492 -0.842442
H 3.428033 3.575926 -0.310399
H -5.738939 -2.237304 -0.083214
H -4.811062 2.441370 1.434687
H -7.543609 -0.868111 0.949987
H -7.094448 1.442661 1.702265
H 6.116142 -1.787822 1.601976
H 6.834425 -2.636948 0.164340
H 5.162366 -3.049083 0.733042


%chk=000284725-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284725

0 1
O 2.224445 -1.528495 -0.843876
O 5.382133 -1.393550 -0.975777
O 4.830089 -0.443500 1.081612
N 0.364869 -0.200292 -0.467428
N -2.871299 1.356061 0.125195
N 3.394221 2.876094 -0.670035
N 2.273989 2.085134 -0.522677
C -0.483727 -1.427476 -0.435964
C -0.395629 1.056480 -0.239581
C -1.868143 -0.875011 -0.197741
C -1.818684 0.557438 -0.086621
C 4.120795 0.646156 -1.016711
C 2.620332 0.813196 -0.705502
C 1.720379 -0.356635 -0.676720
C 4.656380 2.073663 -0.680182
C -3.095075 -1.516265 -0.078990
C -4.266195 -0.715317 0.149501
C -4.110183 0.726367 0.245404
C 4.781275 -0.437107 -0.169663
C -5.574446 -1.281506 0.285608
C -5.264189 1.539929 0.471742
C -6.684767 -0.462548 0.506662
C -6.528166 0.957130 0.600057
C 5.929682 -2.573271 -0.265831
H -0.137919 -2.112185 0.362902
H -0.386455 -1.983873 -1.388215
H -0.286673 1.761614 -1.083612
H -0.043317 1.589885 0.662460
H 4.259028 0.384729 -2.080104
H 5.136053 2.080735 0.319560
H 5.360453 2.456052 -1.435592
H -3.189152 -2.606123 -0.154499
H 3.335335 3.813793 -0.273816
H -5.692988 -2.369669 0.213919
H -5.115819 2.622072 0.539044
H -7.681906 -0.904202 0.609799
H -7.407538 1.587003 0.773426
H 6.638017 -2.259580 0.519475
H 6.430066 -3.164695 -1.045065
H 5.099531 -3.138732 0.188936


