%chk=000246962.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246962

0 1
O 2.224421 -3.577183 0.883130
O -2.227832 2.463046 2.287961
N 2.713007 -0.062326 -0.933343
N -1.686235 0.299987 1.844419
C 3.710161 0.103885 0.176609
C 3.346362 0.195931 -2.270201
C 4.268219 1.536380 0.167271
C 3.898525 1.630657 -2.314310
C 4.909102 1.869472 -1.185800
C 2.116352 -1.441317 -0.902860
C 1.168699 -1.554094 0.263205
C 0.186332 -0.591564 0.491542
C 1.240886 -2.650047 1.154420
C -0.683403 -0.710603 1.593166
C 0.371705 -2.788690 2.242540
C -0.596364 -1.805806 2.464363
C -3.053089 0.026076 1.315724
C -3.146349 0.305438 -0.166373
C -1.353504 1.612144 2.246034
C -3.245385 1.631013 -0.615712
C -3.135315 -0.746624 -1.091487
C 0.065884 1.855348 2.663013
C -3.341544 1.898860 -1.982597
C -3.233585 -0.473078 -2.459533
C -3.338019 0.847450 -2.906392
H 4.543602 -0.628715 0.117060
H 3.181324 -0.086295 1.135974
H 2.559169 0.079700 -3.046617
H 4.154440 -0.527690 -2.510653
H 3.448093 2.252216 0.375242
H 5.002908 1.654578 0.983831
H 4.363466 1.819703 -3.298491
H 3.059144 2.349020 -2.219809
H 5.251943 2.920437 -1.197278
H 5.811407 1.249256 -1.343582
H 2.881278 -2.251908 -0.861210
H 1.539405 -1.601212 -1.843929
H 0.104498 0.262427 -0.189681
H 0.445811 -3.642297 2.909573
H -1.277717 -1.890055 3.310892
H -3.774175 0.676280 1.874140
H -3.320108 -1.027648 1.549930
H 2.222908 -4.316014 1.539297
H -3.239361 2.448611 0.112246
H -3.047189 -1.775947 -0.750194
H 0.754944 1.814042 1.804963
H 0.420798 1.123036 3.400512
H 0.160997 2.856172 3.112200
H -3.419325 2.928001 -2.329072
H -3.227786 -1.291284 -3.176864
H -3.415607 1.058231 -3.970771


%chk=000246962-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246962

0 1
O 2.108103 -3.944938 0.994450
O -2.085207 2.440382 2.578604
N 2.737609 -0.216963 -0.927101
N -1.573819 0.283823 1.864131
C 3.556888 0.436825 0.126332
C 3.362560 -0.085437 -2.267410
C 3.750545 1.936520 -0.174121
C 3.554493 1.398174 -2.642838
C 4.388085 2.134057 -1.568619
C 2.406629 -1.619761 -0.588745
C 1.317512 -1.728601 0.473289
C 0.389982 -0.686392 0.687808
C 1.182908 -2.910806 1.248576
C -0.628557 -0.793134 1.663289
C 0.161364 -3.038937 2.219726
C -0.742592 -1.977123 2.429469
C -2.932240 0.144873 1.255197
C -2.957235 0.476677 -0.232889
C -1.250965 1.482060 2.508850
C -2.925839 1.831390 -0.657946
C -3.004788 -0.549385 -1.208678
C 0.140051 1.584096 3.128712
C -2.940110 2.148238 -2.033797
C -3.020172 -0.233326 -2.587155
C -2.988009 1.117256 -3.002930
H 4.562463 -0.055890 0.209122
H 3.048010 0.302186 1.098839
H 2.705675 -0.581328 -3.006765
H 4.358472 -0.602820 -2.303642
H 2.763826 2.438806 -0.144105
H 4.382671 2.391264 0.612808
H 4.045518 1.465609 -3.632801
H 2.558351 1.873857 -2.727748
H 4.467917 3.210623 -1.810814
H 5.420357 1.726127 -1.560481
H 3.298397 -2.201917 -0.253941
H 2.049338 -2.118736 -1.512142
H 0.484928 0.213283 0.070349
H 0.076135 -3.958220 2.814067
H -1.527400 -2.058665 3.189323
H -3.588211 0.836059 1.812571
H -3.269406 -0.893495 1.424528
H 1.951300 -4.712188 1.598886
H -2.889520 2.623196 0.099320
H -3.028707 -1.598952 -0.888878
H 0.897079 1.788428 2.349180
H 0.439104 0.657478 3.647102
H 0.132656 2.426914 3.836007
H -2.920195 3.197055 -2.351608
H -3.059186 -1.036206 -3.332305
H -3.002870 1.364965 -4.070577


