%chk=000297759.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297759

0 1
O 3.079320 -1.245332 0.688917
N 1.421499 0.391339 0.790211
N 3.457141 0.644878 -0.591578
C -2.213732 0.424104 -0.183339
C -3.398999 -0.586149 -0.034759
C -1.635725 0.853711 1.180349
C -1.077517 -0.130961 -1.066413
C 0.606757 1.423915 0.071248
C -0.514985 1.887765 1.020497
C 0.032563 0.905922 -1.262406
C -3.972025 -0.912780 -1.430081
C -2.949459 -1.892223 0.644233
C -4.522371 0.059113 0.804129
C 2.635328 0.015934 0.215550
C 4.425176 -1.439373 0.138746
C 4.681910 -0.181516 -0.733160
H -2.622833 1.336281 -0.684774
H -1.261750 -0.031074 1.729486
H -2.436782 1.281058 1.814471
H -1.476348 -0.431884 -2.054666
H -0.662393 -1.053269 -0.618420
H 1.295941 2.288126 -0.141597
H -0.932692 2.835539 0.627339
H -0.087819 2.135048 2.013158
H 0.846682 0.482488 -1.883874
H -0.355828 1.768250 -1.839092
H -4.300140 -0.008982 -1.952496
H -4.837592 -1.579086 -1.356316
H -3.233476 -1.412529 -2.065529
H -2.553526 -1.709711 1.648237
H -2.168783 -2.398743 0.067792
H -3.784112 -2.593561 0.746661
H -4.195210 0.271095 1.827165
H -5.392412 -0.601824 0.874707
H -4.863837 1.000797 0.363653
H 0.877634 -0.389792 1.172750
H 4.376538 -2.380239 -0.425947
H 5.090810 -1.527836 1.008566
H 5.562515 0.399338 -0.391598
H 4.842729 -0.428040 -1.801622


%chk=000297759-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297759

0 1
O 3.218071 -1.084626 1.002643
N 1.416218 0.380708 0.716914
N 3.287452 0.422402 -0.804733
C -2.209676 0.409257 -0.177309
C -3.407395 -0.611847 -0.056114
C -1.608368 0.832137 1.192898
C -1.060352 -0.062400 -1.113337
C 0.630880 1.461192 0.078777
C -0.498585 1.902780 1.037180
C 0.032912 1.016568 -1.281551
C -4.013427 -0.875514 -1.463914
C -2.964359 -1.967360 0.559045
C -4.530566 -0.001814 0.831243
C 2.628043 -0.029500 0.235458
C 4.509958 -1.383388 0.310286
C 4.566481 -0.348399 -0.871845
H -2.643511 1.329729 -0.635093
H -1.206257 -0.063655 1.711387
H -2.395592 1.241000 1.852219
H -1.456674 -0.326838 -2.110845
H -0.594492 -0.979875 -0.700516
H 1.324504 2.305384 -0.102378
H -0.948728 2.825322 0.621412
H -0.074032 2.168991 2.025329
H 0.851873 0.652263 -1.927732
H -0.397490 1.912286 -1.774807
H -4.290515 0.073774 -1.961926
H -4.927870 -1.492470 -1.377734
H -3.311235 -1.415242 -2.123356
H -2.558024 -1.841240 1.579474
H -2.194009 -2.464585 -0.057911
H -3.829783 -2.653370 0.628810
H -4.222487 0.093081 1.888060
H -5.429599 -0.646190 0.807007
H -4.823665 1.002354 0.468115
H 1.044246 -0.110448 1.528094
H 4.471072 -2.432730 -0.028111
H 5.319402 -1.254768 1.047873
H 5.426134 0.339978 -0.771091
H 4.651639 -0.853153 -1.851723


