%chk=000240671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240671

0 1
O -3.514764 1.083190 -0.247166
O 0.266010 1.860389 -1.207653
O -3.144085 -1.149830 -0.172348
O -0.518287 1.258606 0.839454
O 3.607403 0.498897 -0.408903
N 3.522895 -1.578878 0.591755
C -0.783045 -0.843495 -1.829307
C -1.520136 0.372673 -1.237034
C 0.045477 -1.591320 -0.814777
C 1.382109 -1.221072 -0.612644
C -2.770914 -0.045968 -0.482105
C -0.572859 1.185302 -0.360934
C -0.514960 -2.647028 -0.084883
C 2.152561 -1.916334 0.329747
C 0.268882 -3.345904 0.837606
C 1.602215 -2.996583 1.051550
C -4.764106 0.946648 0.505295
C 1.393694 2.601953 -0.629379
C 4.166778 -0.382330 0.216167
C -5.849321 0.390636 -0.391777
C 0.902267 3.860328 0.050620
C 5.602608 -0.300570 0.657364
H -0.133211 -0.488320 -2.660449
H -1.524026 -1.528760 -2.295797
H -1.847285 1.038762 -2.088302
H 1.812871 -0.382956 -1.170616
H -1.570096 -2.899241 -0.214402
H -0.169202 -4.168710 1.403063
H 2.194658 -3.544827 1.777681
H 4.039645 -2.254358 1.157985
H -4.935829 1.997176 0.804612
H -4.570980 0.312287 1.388675
H 1.992232 2.792039 -1.539295
H 1.940187 1.918542 0.050304
H -5.640508 -0.654795 -0.666061
H -5.934894 0.961070 -1.325213
H -6.827387 0.411011 0.103381
H 1.738807 4.488826 0.377040
H 0.301863 3.619006 0.942131
H 0.268542 4.460653 -0.613360
H 6.215164 -1.122334 0.264048
H 5.705159 -0.291120 1.750728
H 6.052567 0.637038 0.288300


%chk=000240671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240671

0 1
O -3.609124 0.885970 0.160687
O 0.020863 2.120616 -0.855337
O -3.241749 -1.337688 -0.433651
O -0.709261 1.079267 1.103240
O 3.591294 0.716093 -0.082083
N 3.506788 -1.537987 0.575360
C -0.808578 -0.658844 -1.872750
C -1.640419 0.433732 -1.117604
C 0.062719 -1.550455 -0.994748
C 1.365189 -1.116839 -0.644508
C -2.882172 -0.138481 -0.431087
C -0.763823 1.224528 -0.135354
C -0.402803 -2.808679 -0.538518
C 2.190454 -1.926029 0.174797
C 0.432149 -3.624130 0.257514
C 1.722860 -3.190802 0.618502
C -4.845458 0.495907 0.907990
C 1.044134 2.895494 -0.072136
C 4.131576 -0.300196 0.453216
C -6.056400 0.466838 -0.028574
C 1.617337 3.942972 -1.019825
C 5.548401 -0.239644 1.022183
H -0.171212 -0.123093 -2.598408
H -1.527329 -1.275935 -2.440425
H -1.998768 1.159118 -1.873552
H 1.744741 -0.154914 -0.995177
H -1.418149 -3.129458 -0.789656
H 0.072581 -4.598463 0.605924
H 2.361315 -3.824911 1.247836
H 4.040866 -2.263688 1.058311
H -4.934599 1.275565 1.680806
H -4.672901 -0.488241 1.377182
H 1.813741 2.181606 0.267299
H 0.538534 3.337589 0.804696
H -5.947943 -0.328070 -0.785483
H -6.181558 1.436295 -0.541173
H -6.973604 0.264459 0.555332
H 2.385147 4.536050 -0.490191
H 0.832844 4.629566 -1.382646
H 2.098149 3.462072 -1.888537
H 5.897521 -1.188973 1.464531
H 5.590332 0.548697 1.793379
H 6.245016 0.053385 0.217740


