%chk=000216710.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216710

0 1
O -3.535027 -2.853064 0.349945
N 1.871832 1.253888 0.688987
C -0.614980 1.019349 0.680395
C 0.614827 1.733381 0.031403
C -0.035459 0.469759 2.028299
C -1.745760 2.031256 0.982835
C 1.445724 0.892233 2.079690
C -1.150953 -0.151698 -0.134360
C -2.568491 2.638361 -0.176921
C 2.485953 0.098222 -0.045643
C 3.902768 -0.152632 0.495163
C -2.108580 -0.996940 0.445867
C -0.714833 -0.418993 -1.444973
C -1.713390 3.246180 -1.292635
C -3.587012 1.654106 -0.763357
C 4.621206 -1.281905 -0.271416
C -2.598677 -2.078997 -0.297274
C -1.218827 -1.504412 -2.164181
C 5.009294 -0.837918 -1.687883
C 5.866943 -1.732558 0.504753
C -2.171991 -2.357552 -1.603355
H 0.651958 1.612389 -1.067845
H 0.565536 2.828251 0.222161
H -0.120399 -0.629422 2.081920
H -0.587568 0.855575 2.898569
H -2.463693 1.550276 1.679599
H -1.297957 2.870717 1.554874
H 1.578914 1.801878 2.703054
H 2.087644 0.106013 2.518014
H -3.154180 3.479209 0.287088
H 2.547327 0.370311 -1.122320
H 1.875238 -0.827752 0.015525
H 3.854342 -0.403461 1.572373
H 4.490294 0.785009 0.440837
H -2.486646 -0.829497 1.451538
H 0.026622 0.231286 -1.910701
H -1.192079 2.473235 -1.868286
H -0.963415 3.938627 -0.897219
H -2.335515 3.805656 -2.000484
H -3.108393 0.895843 -1.394932
H -4.322972 2.172920 -1.385843
H -4.132810 1.117866 0.019983
H 3.927148 -2.155496 -0.353978
H -0.864466 -1.690895 -3.178457
H 5.500979 -1.646539 -2.238070
H 5.699771 0.012521 -1.667553
H 4.131371 -0.530078 -2.265404
H 5.605833 -2.114001 1.497090
H 6.574984 -0.908386 0.644170
H 6.396989 -2.531152 -0.024845
H -2.562997 -3.200260 -2.159431
H -3.849030 -3.602710 -0.210666


%chk=000216710-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216710

0 1
O -3.292319 -3.092145 0.237715
N 1.892619 1.308287 0.725563
C -0.587378 1.016034 0.655361
C 0.653207 1.827947 0.091475
C 0.007087 0.466725 2.023192
C -1.796601 1.966376 0.996299
C 1.449677 1.059413 2.126395
C -1.053464 -0.161922 -0.229210
C -2.638942 2.673973 -0.114357
C 2.492425 0.119324 0.056449
C 3.963626 -0.088899 0.472170
C -1.930956 -1.120938 0.339432
C -0.681286 -0.329794 -1.589907
C -1.814277 3.490115 -1.139391
C -3.637333 1.739259 -0.844798
C 4.599062 -1.392351 -0.081538
C -2.424040 -2.199476 -0.422162
C -1.176274 -1.413382 -2.349263
C 4.633930 -1.414181 -1.629678
C 6.022409 -1.583572 0.493934
C -2.054589 -2.359153 -1.779330
H 0.754896 1.828022 -1.004061
H 0.535925 2.882599 0.406643
H 0.047851 -0.635658 2.005400
H -0.617142 0.764524 2.885315
H -2.512637 1.387196 1.614830
H -1.383454 2.754921 1.661531
H 1.432243 2.025988 2.666776
H 2.151202 0.391526 2.654156
H -3.257172 3.406928 0.450429
H 2.441856 0.300687 -1.032910
H 1.919130 -0.821963 0.248808
H 4.028492 -0.106510 1.579491
H 4.553635 0.788837 0.140326
H -2.252524 -1.044572 1.383273
H -0.004636 0.379151 -2.074153
H -1.218674 2.828282 -1.793779
H -1.124095 4.197431 -0.643764
H -2.490484 4.076028 -1.790144
H -3.122825 1.028122 -1.512822
H -4.335893 2.338178 -1.460455
H -4.236758 1.150717 -0.125348
H 3.973196 -2.246644 0.257851
H -0.875457 -1.522547 -3.397344
H 5.134759 -2.328574 -1.999427
H 5.194938 -0.541169 -2.017081
H 3.619231 -1.388661 -2.066977
H 6.009902 -1.606032 1.599999
H 6.684106 -0.752616 0.181204
H 6.475547 -2.528024 0.138556
H -2.437644 -3.198731 -2.373821
H -3.586696 -3.811076 -0.374754


