%chk=000277258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277258

0 1
O 4.079849 -1.134627 1.606532
N 1.729900 0.892018 0.440424
N -1.631825 0.458645 1.543293
N 2.878792 -2.006263 -0.113672
C 0.438272 1.641156 0.671303
C 0.332557 2.795718 -0.353820
C 1.524243 3.749757 -0.234447
C 2.908335 1.811857 0.612020
C 2.831626 2.966639 -0.396255
C -0.729806 0.713646 0.478932
C 1.851536 -0.267679 1.380633
C -1.132794 0.004967 -0.639632
C -2.625189 -0.422417 1.077396
C -2.326017 -0.723321 -0.295146
C 3.036830 -1.140959 0.959211
C -3.739411 -0.974315 1.738406
C -3.172105 -1.596380 -1.003082
C -4.546415 -1.829282 1.007045
C -4.266845 -2.137782 -0.349566
C 4.021530 -2.842608 -0.545071
C 1.718418 -1.939499 -1.027331
H 0.409290 2.081832 1.705459
H -0.620403 3.335248 -0.203488
H 0.291970 2.375201 -1.379576
H 1.507143 4.271703 0.740865
H 1.454428 4.541157 -1.004350
H 3.832228 1.215183 0.428900
H 2.993216 2.209876 1.646207
H 2.902053 2.563285 -1.426611
H 3.704172 3.632483 -0.263396
H 0.913672 -0.868155 1.361131
H 2.017536 0.029863 2.441518
H -1.591183 0.861198 2.458505
H -0.652504 -0.005062 -1.596955
H -3.950801 -0.736229 2.774895
H -2.959948 -1.831383 -2.043216
H -5.420309 -2.281516 1.474478
H -4.935652 -2.815242 -0.876717
H 3.708723 -3.894915 -0.635514
H 4.834640 -2.789879 0.208367
H 4.432046 -2.501456 -1.508474
H 1.845504 -2.615917 -1.884943
H 1.575784 -0.910751 -1.413421
H 0.793513 -2.230696 -0.497336


%chk=000277258-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277258

0 1
O 3.858867 -1.313295 1.981384
N 1.668255 0.832914 0.369356
N -1.631544 0.408486 1.528545
N 3.124176 -1.889638 -0.154976
C 0.391025 1.603687 0.564455
C 0.336525 2.791623 -0.433808
C 1.568983 3.709727 -0.301735
C 2.858818 1.713158 0.561411
C 2.862251 2.879029 -0.441672
C -0.825987 0.719913 0.415981
C 1.729800 -0.357361 1.264144
C -1.367500 0.092059 -0.708550
C -2.689215 -0.418636 1.133913
C -2.544581 -0.637054 -0.284824
C 2.989200 -1.218694 1.052756
C -3.741476 -0.985726 1.885365
C -3.497358 -1.453220 -0.951821
C -4.669473 -1.792567 1.195849
C -4.548259 -2.022685 -0.207359
C 4.287259 -2.769959 -0.358154
C 2.123129 -1.867930 -1.235054
H 0.378649 2.035356 1.605834
H -0.598646 3.355895 -0.260069
H 0.286425 2.379163 -1.459409
H 1.557408 4.207695 0.690094
H 1.529734 4.510556 -1.063940
H 3.766113 1.096974 0.438218
H 2.883253 2.119906 1.605855
H 2.936685 2.471741 -1.468484
H 3.754885 3.508837 -0.265342
H 0.822361 -0.964029 1.090430
H 1.754694 -0.068625 2.340893
H -1.456111 0.737992 2.476111
H -0.966294 0.152839 -1.718782
H -3.838835 -0.812108 2.962944
H -3.416296 -1.636656 -2.029041
H -5.498170 -2.251409 1.746496
H -5.289405 -2.654785 -0.709105
H 3.958811 -3.813552 -0.528980
H 4.914933 -2.728228 0.545057
H 4.876791 -2.439048 -1.234778
H 2.641268 -1.814830 -2.211022
H 1.485609 -0.977231 -1.139330
H 1.499843 -2.785187 -1.225353


