%chk=000203338.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203338

0 1
O -0.057599 -1.308060 -1.833028
N -1.737100 -3.982349 0.961578
C 0.008823 -0.854991 -0.462291
C -0.136811 -2.179006 0.353788
C -1.151321 0.106054 -0.202558
C 1.326852 -0.123271 -0.216052
C -1.461589 -2.888533 -0.017051
C 1.050072 -3.107831 0.092565
C -1.236595 0.819643 1.000654
C 1.933447 -0.114929 1.047927
C -2.156872 0.271729 -1.165508
C 1.936037 0.586505 -1.261302
C -2.302241 1.690787 1.234046
C 3.123420 0.583323 1.261378
C -3.222273 1.143691 -0.938295
C 3.125682 1.284999 -1.055366
C -3.302507 1.863581 0.264293
C 3.730377 1.290328 0.211713
C -4.448256 2.788745 0.516963
C 5.011950 2.024773 0.434816
H -0.163031 -1.907492 1.437337
H -2.289881 -2.150589 -0.080580
H -1.359101 -3.334557 -1.032998
H 1.986383 -2.715012 0.497486
H 0.870605 -4.094111 0.543727
H 1.194266 -3.261802 -0.985641
H 0.200395 -0.594076 -2.455427
H -0.465814 0.705500 1.762437
H 1.482548 -0.662004 1.876726
H -2.109105 -0.296874 -2.097015
H 1.475711 0.589456 -2.251758
H -2.546783 -4.518032 0.664829
H -1.955322 -3.596102 1.874579
H -2.353636 2.239478 2.172025
H 3.582297 0.575312 2.248072
H -3.993087 1.262583 -1.696628
H 3.584283 1.826222 -1.880349
H -4.846088 3.222879 -0.409964
H -5.276631 2.256314 1.007554
H -4.170760 3.627639 1.169070
H 5.109963 2.901632 -0.218975
H 5.113822 2.383189 1.467766
H 5.873673 1.370957 0.231956


%chk=000203338-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203338

0 1
O -0.049998 -1.214473 -1.955516
N -1.764368 -3.977390 1.000011
C 0.013356 -0.868547 -0.511901
C -0.156705 -2.191063 0.325573
C -1.156591 0.107490 -0.265751
C 1.347700 -0.135105 -0.230034
C -1.539555 -2.849342 0.066105
C 0.971070 -3.216230 0.067007
C -1.321020 0.713944 1.005346
C 2.026327 -0.203188 1.011008
C -2.088442 0.415441 -1.284090
C 1.892147 0.702580 -1.238993
C -2.395167 1.593347 1.252391
C 3.211647 0.534418 1.232651
C -3.159014 1.303653 -1.033332
C 3.074955 1.434689 -1.015762
C -3.334710 1.908679 0.235691
C 3.759669 1.366179 0.226306
C -4.471421 2.882628 0.496782
C 5.031384 2.163163 0.461472
H -0.132380 -1.904418 1.398513
H -2.331579 -2.072382 0.121667
H -1.551419 -3.243223 -0.966830
H 1.970089 -2.827436 0.327714
H 0.762161 -4.119898 0.664316
H 0.988177 -3.534747 -0.995239
H 0.737848 -1.780397 -2.156994
H -0.597969 0.515020 1.804993
H 1.644413 -0.838683 1.817638
H -1.965748 -0.047322 -2.266480
H 1.368200 0.777083 -2.197662
H -2.439463 -4.670120 0.663659
H -1.980025 -3.678093 1.957228
H -2.501538 2.049903 2.244683
H 3.718580 0.458681 2.202572
H -3.870698 1.528213 -1.837772
H 3.472237 2.075104 -1.813703
H -5.255069 2.805129 -0.276979
H -4.943692 2.701762 1.479729
H -4.108910 3.929072 0.497497
H 4.845355 3.250479 0.374219
H 5.447740 1.973511 1.465802
H 5.810629 1.907586 -0.281036


