%chk=000200011.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200011

0 1
O -0.376652 0.523496 -1.446294
N 0.665115 -1.863001 0.672591
C 1.169940 -0.517443 1.121933
C 2.370452 -0.094343 0.229660
C -0.024461 0.453315 0.958573
C -0.826990 -0.115277 -0.235673
C 2.939214 1.259373 0.701268
C 3.474624 -1.167472 0.241156
C -0.437222 -1.624620 -0.309073
C 4.127161 1.689423 -0.169967
C 4.668575 -0.742324 -0.623279
C 5.226218 0.617721 -0.181046
C -2.315578 0.133881 -0.157380
C -2.960756 0.901772 -1.135856
C -3.058762 -0.407351 0.903416
C -4.338112 1.127068 -1.054432
C -4.434581 -0.179256 0.981121
C -5.076593 0.588015 0.002844
H 1.501955 -0.574586 2.183509
H 1.997971 0.020558 -0.824429
H -0.633420 0.499438 1.874998
H 0.289130 1.493121 0.757831
H 3.260554 1.185897 1.757428
H 2.152089 2.037131 0.672333
H 3.062410 -2.128867 -0.126924
H 3.806290 -1.358761 1.278073
H -1.299063 -2.294061 -0.140860
H -0.053735 -1.863230 -1.325849
H 0.303265 -2.380215 1.479680
H 4.537424 2.646772 0.201840
H 3.784407 1.884776 -1.204101
H 4.363883 -0.694891 -1.686247
H 5.461817 -1.510973 -0.568302
H 6.048210 0.926354 -0.852751
H 5.671075 0.528152 0.828412
H 0.612343 0.442981 -1.516276
H -2.377811 1.320175 -1.961467
H -2.567158 -1.005794 1.667776
H -4.834352 1.723968 -1.817834
H -5.008438 -0.599952 1.804657
H -6.148639 0.763931 0.065442


%chk=000200011-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200011

0 1
O -0.509715 0.784702 -1.575890
N 0.571951 -1.754639 0.611914
C 1.147356 -0.437112 1.035894
C 2.419953 -0.084660 0.211189
C -0.051795 0.553376 0.876676
C -0.867787 0.032860 -0.351877
C 3.017962 1.294327 0.596281
C 3.497633 -1.187885 0.367945
C -0.398577 -1.479961 -0.479012
C 4.292897 1.616636 -0.220737
C 4.767481 -0.877012 -0.456163
C 5.358162 0.503647 -0.082507
C -2.380813 0.182515 -0.187686
C -3.153090 0.938727 -1.102458
C -3.040232 -0.459021 0.894067
C -4.552591 1.053913 -0.935772
C -4.437185 -0.346923 1.059905
C -5.201748 0.413660 0.143829
H 1.458496 -0.509010 2.097540
H 2.150906 -0.052573 -0.872025
H -0.674715 0.504063 1.787436
H 0.225632 1.610161 0.725677
H 3.270608 1.280556 1.678365
H 2.275943 2.103891 0.455502
H 3.059357 -2.159939 0.079530
H 3.770214 -1.263970 1.443300
H -1.243881 -2.186062 -0.435917
H 0.078935 -1.594499 -1.471089
H 0.129757 -2.242312 1.402408
H 4.710346 2.590161 0.102547
H 4.019877 1.727046 -1.291289
H 4.513271 -0.884656 -1.536998
H 5.523017 -1.672060 -0.302560
H 6.236603 0.733958 -0.716337
H 5.718089 0.472831 0.967106
H 0.475682 0.764695 -1.672151
H -2.643344 1.428554 -1.935489
H -2.461954 -1.052606 1.614997
H -5.135678 1.644893 -1.651608
H -4.928773 -0.849551 1.900829
H -6.286452 0.504177 0.271127


