%chk=000258341.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258341

0 1
O 6.873963 0.365713 0.264870
O 6.431454 -1.746605 0.389544
N -0.362303 -0.360444 0.007414
N 0.573896 0.637380 -0.000218
N 6.093251 -0.575446 0.297587
C -1.638963 -0.078158 -0.044043
C -2.582122 -1.225567 -0.050144
C -2.235486 1.284615 -0.098200
C 1.934504 0.284695 0.074818
C -3.776819 -1.142871 0.684746
C -2.207197 2.107704 1.037352
C -2.290617 -2.385608 -0.785289
C -2.825352 1.738897 -1.285630
C 2.877967 1.345143 0.038384
C 2.371586 -1.058249 0.186424
C -4.670425 -2.215691 0.680485
C -2.765564 3.387056 0.979035
C -3.191955 -3.453782 -0.785044
C -3.379177 3.021355 -1.336985
C 4.662069 -0.278508 0.221364
C 4.232513 1.057454 0.111618
C 3.726331 -1.333523 0.258825
C -4.380846 -3.370984 -0.054187
C -3.349003 3.845413 -0.207292
H -4.005654 -0.244484 1.257618
H -1.762197 1.745453 1.963947
H -1.359885 -2.454684 -1.349381
H -2.856118 1.090728 -2.161738
H 0.311165 1.627446 -0.071634
H 2.550700 2.378808 -0.047357
H 1.637376 -1.867185 0.217018
H -5.595392 -2.152404 1.251985
H -2.749122 4.027341 1.860536
H -2.964282 -4.353567 -1.355150
H -3.838452 3.377051 -2.258997
H 4.978520 1.861002 0.084764
H 4.086451 -2.365889 0.345928
H -5.080785 -4.205059 -0.055297
H -3.783433 4.843653 -0.249778


%chk=000258341-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258341

0 1
O 6.905234 0.557301 0.156715
O 6.501006 -1.681680 0.376286
N -0.403111 -0.453616 0.021681
N 0.523382 0.565130 -0.003151
N 6.099591 -0.456218 0.239785
C -1.700215 -0.151121 -0.018168
C -2.650030 -1.290532 -0.080973
C -2.215510 1.261241 -0.018348
C 1.889792 0.285266 0.055416
C -4.028477 -1.105247 0.221660
C -1.928964 2.140458 1.063362
C -2.199737 -2.595242 -0.437462
C -2.987032 1.745870 -1.108893
C 2.814238 1.369001 -0.033774
C 2.372165 -1.048109 0.208574
C -4.927571 -2.192320 0.174058
C -2.403467 3.471540 1.052205
C -3.099336 -3.676838 -0.482420
C -3.452693 3.078958 -1.122571
C 4.656377 -0.201512 0.176598
C 4.192879 1.128284 0.026604
C 3.751235 -1.287722 0.267544
C -4.469510 -3.482306 -0.177632
C -3.162624 3.945821 -0.042692
H -4.393318 -0.112877 0.507242
H -1.363960 1.770262 1.927208
H -1.142243 -2.736529 -0.679592
H -3.216943 1.074379 -1.943460
H 0.216450 1.544726 -0.090789
H 2.444325 2.394369 -0.153520
H 1.650744 -1.864213 0.281656
H -5.984341 -2.032923 0.415391
H -2.186879 4.132552 1.898470
H -2.737841 -4.672748 -0.761838
H -4.043355 3.439397 -1.971764
H 4.919853 1.941615 -0.040972
H 4.148141 -2.299554 0.385043
H -5.168739 -4.324779 -0.217454
H -3.528921 4.978114 -0.052131


