%chk=000296154.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296154

0 1
O 1.952678 -1.034251 1.344661
O 4.539051 -1.477220 0.246539
O -6.124605 -0.900470 -1.119550
O -4.482478 -0.973693 -2.521794
N -0.563423 1.055233 -0.157981
N -4.958884 -0.709956 -1.428595
C 0.494808 1.203552 0.884451
C 1.853490 1.020329 0.260028
C 2.598310 -0.145655 0.515806
C -1.867588 0.693717 0.229475
C 2.387992 2.011482 -0.580558
C 3.886055 -0.298881 -0.073077
C 3.644484 1.850644 -1.154370
C 4.400300 0.696265 -0.902821
C -2.727969 0.127033 -0.742004
C -2.376645 0.981368 1.519838
C -4.057768 -0.118106 -0.402110
C -3.710437 0.718546 1.822011
C -4.571542 0.165800 0.867623
C 2.635539 -2.261133 1.708889
C 5.846359 -1.695387 -0.338635
H 0.353818 0.478928 1.725094
H 0.405781 2.227647 1.320214
H -0.222314 0.620876 -1.019561
H 1.802012 2.909408 -0.780395
H 4.051375 2.623553 -1.805040
H 5.380843 0.592784 -1.360245
H -2.368968 -0.110802 -1.746276
H -1.732262 1.421299 2.278182
H -4.093126 0.947564 2.818291
H -5.618006 -0.040462 1.100423
H 3.564313 -2.031392 2.241386
H 2.831556 -2.860552 0.813231
H 1.898073 -2.739550 2.363531
H 6.548501 -0.927954 -0.000475
H 5.774740 -1.734108 -1.429435
H 6.110238 -2.678358 0.072751


%chk=000296154-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296154

0 1
O 1.782223 -1.348792 0.500122
O 4.403607 -1.548526 -0.478002
O -6.156488 -1.251034 -0.880905
O -4.278074 -2.385493 -1.490321
N -0.432991 0.296046 0.314714
N -4.873111 -1.398003 -0.905254
C 0.517377 1.156568 1.031325
C 1.935699 1.061282 0.474575
C 2.563669 -0.194565 0.270344
C -1.811853 0.437442 0.383568
C 2.655735 2.244884 0.176845
C 3.892362 -0.260767 -0.249388
C 3.979513 2.182069 -0.301506
C 4.601875 0.933020 -0.517378
C -2.642299 -0.526529 -0.264998
C -2.450692 1.521178 1.068057
C -4.038359 -0.376501 -0.221813
C -3.856387 1.639308 1.080617
C -4.683116 0.696586 0.437250
C 2.327289 -2.403898 1.383289
C 5.729119 -1.651811 -1.097508
H 0.527667 0.915134 2.120581
H 0.190446 2.208645 0.942245
H -0.043563 -0.604921 0.020579
H 2.172109 3.216802 0.323576
H 4.528321 3.103639 -0.520975
H 5.622550 0.896549 -0.908823
H -2.212339 -1.376696 -0.803196
H -1.852002 2.266500 1.599935
H -4.313227 2.481694 1.611436
H -5.772293 0.766331 0.438787
H 2.590914 -1.978835 2.370186
H 3.209884 -2.873115 0.921736
H 1.509172 -3.131633 1.493881
H 6.514094 -1.223122 -0.445072
H 5.746890 -1.150787 -2.083969
H 5.900577 -2.730553 -1.225035


