%chk=000241957.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241957

0 1
O 0.493005 -0.115026 -2.295023
N 2.877060 -1.967037 0.519684
C 0.075528 -0.097974 0.090675
C 0.912074 -0.655960 1.267882
C 2.429033 -0.624797 1.018951
C 0.554592 -0.718027 -1.247636
C 1.072070 -2.139671 -1.204640
C -1.401265 -0.488890 0.157660
C 0.201317 1.423846 0.139180
C 2.584428 -2.159157 -0.938399
C 4.338040 -2.157148 0.770498
C -2.277991 0.067882 -0.792239
C -0.547623 2.128640 1.099615
C -1.905587 -1.381907 1.110236
C 1.072040 2.133129 -0.697740
C -3.633727 -0.258370 -0.778754
C -0.424192 3.513415 1.217256
C -3.266920 -1.706827 1.121796
C 1.193211 3.522038 -0.576959
C -4.133469 -1.146779 0.181051
C 0.449991 4.215814 0.380041
H 0.607032 -1.700868 1.498450
H 0.680876 -0.075306 2.182937
H 2.706345 0.212199 0.343408
H 2.941077 -0.419747 1.985431
H 0.539217 -2.743748 -0.441372
H 0.864418 -2.628626 -2.179800
H 2.979116 -3.160335 -1.227379
H 3.093112 -1.415445 -1.591295
H 4.994263 -1.432889 0.266264
H 4.630512 -3.171316 0.453224
H 4.525152 -2.099841 1.855379
H -1.887621 0.758515 -1.545320
H -1.237318 1.592732 1.751669
H -1.246026 -1.835595 1.850382
H 1.644094 1.618633 -1.471464
H -4.303956 0.179155 -1.517464
H -1.011612 4.048534 1.961297
H -3.648576 -2.400615 1.869098
H 1.868928 4.061653 -1.238655
H -5.191619 -1.399774 0.191664
H 0.545575 5.295191 0.472112


%chk=000241957-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241957

0 1
O 0.363806 -0.135714 -2.380020
N 2.958297 -1.937746 0.473056
C 0.044463 -0.132985 0.068168
C 0.875796 -0.732170 1.251247
C 2.414357 -0.696698 1.089641
C 0.503925 -0.750645 -1.288426
C 1.121803 -2.144159 -1.277349
C -1.463498 -0.522053 0.161421
C 0.195029 1.410962 0.104636
C 2.645474 -2.098816 -0.963625
C 4.408613 -2.088202 0.720041
C -2.347173 -0.056794 -0.851138
C -0.596933 2.151011 1.021764
C -2.000556 -1.300915 1.217051
C 1.167788 2.110570 -0.654458
C -3.722128 -0.362764 -0.810008
C -0.425855 3.542864 1.179033
C -3.381695 -1.607067 1.260209
C 1.338454 3.505641 -0.502125
C -4.248525 -1.142549 0.247592
C 0.546073 4.229928 0.415827
H 0.608554 -1.789028 1.430410
H 0.595566 -0.169523 2.160955
H 2.732068 0.223457 0.538701
H 2.864357 -0.626888 2.097075
H 0.628126 -2.813105 -0.550984
H 0.993173 -2.557078 -2.293177
H 3.085131 -3.059473 -1.290909
H 3.113925 -1.296892 -1.593018
H 5.031025 -1.290828 0.240872
H 4.751819 -3.064212 0.331739
H 4.604403 -2.065858 1.806777
H -1.943862 0.545294 -1.673027
H -1.363465 1.633795 1.611064
H -1.358483 -1.667355 2.023130
H 1.776192 1.580894 -1.392663
H -4.383018 0.006001 -1.602450
H -1.053225 4.090012 1.892052
H -3.776271 -2.206814 2.088465
H 2.089801 4.025804 -1.107324
H -5.317330 -1.381893 0.281096
H 0.678604 5.311691 0.530381


