%chk=000244383.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244383

0 1
O 2.762708 -2.539869 1.333996
O 1.072473 -1.285540 2.097443
O -1.011271 1.794754 1.390072
O -2.703066 1.383185 2.788284
N 0.421079 1.512352 -1.129239
N -0.574032 -2.042286 -0.200224
C 1.531232 -0.579140 -1.625026
C 0.114704 0.063893 -1.413160
C -0.704324 -0.549320 -0.235232
C 1.634334 -2.064617 -1.291616
C 0.825909 -2.496525 -0.059349
C 2.445771 0.349121 -0.860686
C 1.743010 1.562948 -0.589163
C -2.179275 -0.225521 -0.399396
C 3.767394 0.212485 -0.484995
C 1.504033 -2.002022 1.226075
C 2.362720 2.629769 0.054799
C -2.865655 0.627032 0.482456
C -2.888718 -0.808080 -1.464791
C 4.398991 1.288021 0.171482
C 3.708492 2.471811 0.428066
C -4.234487 0.895562 0.288154
C -4.241792 -0.533583 -1.658646
C -2.253948 1.259640 1.674387
C -4.918357 0.324492 -0.782390
H -0.472358 0.013599 -2.359396
H 1.785333 -0.463208 -2.714396
H -0.307295 -0.103383 0.728399
H 1.266989 -2.653697 -2.160275
H 2.699295 -2.349684 -1.152957
H 0.812021 -3.624020 -0.010438
H -0.300747 2.008995 -0.595760
H -1.152303 -2.413044 0.567576
H 4.318249 -0.703852 -0.684849
H 1.834941 3.556150 0.252781
H -2.367179 -1.494413 -2.137378
H 5.438084 1.189523 0.474314
H 4.216081 3.294991 0.930436
H -4.758810 1.550228 0.989577
H -4.775899 -0.990188 -2.492882
H 3.247824 -2.222626 2.144011
H -5.975746 0.538916 -0.933177
H -0.569407 2.187853 2.193414


%chk=000244383-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244383

0 1
O 2.829703 -2.689138 1.224154
O 0.948316 -1.709416 2.166733
O -0.844635 1.874415 1.388119
O -2.756285 1.827786 2.694044
N 0.461080 1.479616 -1.328626
N -0.527982 -2.031124 -0.301433
C 1.595003 -0.580064 -1.669774
C 0.159440 0.035767 -1.528191
C -0.633062 -0.540800 -0.295429
C 1.676651 -2.095953 -1.404238
C 0.841050 -2.552541 -0.182923
C 2.432229 0.364222 -0.805119
C 1.713024 1.588870 -0.686470
C -2.117558 -0.169374 -0.372842
C 3.721099 0.241277 -0.268283
C 1.504356 -2.233977 1.177160
C 2.276232 2.702317 -0.025807
C -2.796446 0.723698 0.514970
C -2.890210 -0.819919 -1.373421
C 4.298309 1.351148 0.407617
C 3.577809 2.564667 0.519324
C -4.202400 0.918817 0.390861
C -4.274289 -0.598579 -1.509734
C -2.171543 1.488988 1.638015
C -4.940143 0.274518 -0.617051
H -0.434435 -0.125467 -2.444454
H 1.906408 -0.411320 -2.723555
H -0.180568 -0.107551 0.615404
H 1.270013 -2.633365 -2.280327
H 2.726989 -2.410141 -1.277647
H 0.791657 -3.659617 -0.219955
H -0.300887 2.077529 -0.998042
H -1.161750 -2.442760 0.396487
H 4.277710 -0.698632 -0.361415
H 1.731238 3.649227 0.058139
H -2.379391 -1.534949 -2.026578
H 5.302399 1.270407 0.837816
H 4.032924 3.417013 1.037841
H -4.695523 1.583429 1.107471
H -4.834990 -1.112020 -2.298757
H 3.216363 -2.479117 2.117567
H -6.018394 0.444493 -0.703566
H -0.472515 2.328321 2.192217


