%chk=000207613.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207613

0 1
O -2.952388 -1.129557 0.912695
N 0.991159 0.327099 -0.823267
N 3.779216 0.178365 -0.093477
N -2.745124 -0.123685 -1.114916
N 6.007982 0.864669 -0.569130
N -4.869600 0.146979 2.451977
C 1.445816 -0.537972 0.314913
C 1.873319 1.537051 -0.913224
C 2.886833 -1.012571 0.044001
C 3.325972 1.097266 -1.182732
C -0.445748 0.716784 -0.659558
C -1.303709 -0.448462 -1.203358
C 5.163549 -0.006326 0.091688
C 5.666497 -0.972231 1.007864
C -3.492925 -0.503996 0.001290
C 7.033631 -1.011569 1.254370
C 7.333747 0.799888 -0.297172
C -4.924825 -0.114481 0.012228
C 7.893124 -0.119178 0.601482
C -5.572033 0.159969 1.247912
C -5.676854 -0.054740 -1.175049
C -6.946802 0.531409 1.251266
C -7.018748 0.300860 -1.162730
C -7.647394 0.602321 0.060204
H 0.773735 -1.422410 0.377429
H 1.396028 -0.021366 1.298905
H 1.835625 2.169082 0.000977
H 1.526312 2.162399 -1.764053
H 3.231111 -1.647657 0.890466
H 2.913528 -1.637460 -0.877937
H 3.404694 0.606223 -2.177938
H 3.986993 1.995592 -1.207220
H -0.730845 0.940826 0.391482
H -0.652474 1.638548 -1.243086
H -1.039776 -0.663812 -2.261881
H -1.100810 -1.379634 -0.620000
H -3.119417 0.502699 -1.817197
H 4.990251 -1.651262 1.518348
H 7.438245 -1.739769 1.958190
H 7.959961 1.518425 -0.840419
H 8.961208 -0.138151 0.783206
H -5.201323 -0.307900 -2.124831
H -7.439469 0.760065 2.192374
H -7.587197 0.341981 -2.087250
H -8.700895 0.887133 0.064304
H -3.977118 -0.351293 2.484493
H -5.392362 0.116653 3.312259


%chk=000207613-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207613

0 1
O -2.715804 -0.877615 0.937776
N 1.009179 0.214797 -1.078401
N 3.786856 -0.114928 -0.385495
N -2.773416 -0.133919 -1.246849
N 5.881049 0.961981 -0.352804
N -4.748912 -0.367822 2.537311
C 1.402371 -0.515095 0.151670
C 1.988553 1.296794 -1.355848
C 2.801865 -1.143101 -0.010444
C 3.392960 0.701248 -1.553285
C -0.399092 0.671620 -1.046140
C -1.358482 -0.476983 -1.454171
C 5.080808 -0.050157 0.131878
C 5.574887 -0.966788 1.120029
C -3.398143 -0.366277 -0.031453
C 6.881149 -0.799709 1.610512
C 7.141383 1.095026 0.138948
C -4.838348 -0.002706 0.102969
C 7.697389 0.252729 1.125188
C -5.454335 0.003906 1.411685
C -5.639004 0.341087 -1.023994
C -6.823005 0.412362 1.523174
C -6.985231 0.722879 -0.901133
C -7.570372 0.766639 0.392776
H 0.668850 -1.314287 0.357925
H 1.414196 0.169142 1.037810
H 2.021280 2.047418 -0.526336
H 1.687735 1.820797 -2.281989
H 3.082609 -1.615248 0.943878
H 2.753785 -1.933528 -0.790367
H 3.382844 0.062699 -2.462807
H 4.150614 1.489362 -1.679875
H -0.702015 1.046703 -0.040061
H -0.510856 1.511842 -1.758060
H -1.193391 -0.737400 -2.514470
H -1.144268 -1.368206 -0.841844
H -3.266571 0.372590 -1.980481
H 4.966678 -1.796226 1.488871
H 7.265162 -1.495783 2.364938
H 7.725355 1.920104 -0.287594
H 8.718023 0.406375 1.485833
H -5.215298 0.280524 -2.034194
H -7.285785 0.432690 2.517564
H -7.575036 0.973513 -1.788005
H -8.617650 1.067881 0.510211
H -3.789642 -0.716222 2.390321
H -5.190227 -0.343906 3.452732


