%chk=000258879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258879

0 1
O -4.200590 1.268986 1.783166
N -0.750620 0.522700 -0.339196
N 2.114185 0.294241 0.052185
C -3.156145 0.019891 0.072635
C -4.499660 0.644574 0.512093
C -3.363232 -0.796941 -1.214050
C -2.103378 1.134051 -0.122742
C -5.595424 -0.415688 0.700944
C -4.449496 -1.863374 -1.031816
C -5.777018 -1.238568 -0.579776
C -0.180445 0.005772 0.948352
C 0.195729 1.528038 -0.926504
C 1.167766 -0.686739 0.670210
C 1.546786 0.843831 -1.218467
C 3.500260 -0.024405 0.071828
C 4.024716 -0.891567 1.060397
C 4.399195 0.614401 -0.815797
C 5.399042 -1.098222 1.154087
C 5.770147 0.393552 -0.704425
C 6.281859 -0.463598 0.274648
H -2.809862 -0.662233 0.889657
H -4.829775 1.446133 -0.182812
H -2.400356 -1.269717 -1.496929
H -3.622937 -0.127844 -2.055168
H -2.137775 1.820618 0.755076
H -2.365800 1.743848 -1.012843
H -6.549327 0.061453 0.987571
H -5.321422 -1.079282 1.545272
H -4.116783 -2.615150 -0.290213
H -4.596071 -2.415399 -1.979001
H -6.183418 -0.597104 -1.385496
H -6.530021 -2.031416 -0.411715
H -0.894490 -0.735337 1.371812
H -0.045213 0.802815 1.712529
H 0.356401 2.409561 -0.267744
H -0.234391 1.899371 -1.881102
H 1.592840 -1.056049 1.631061
H 1.012641 -1.570183 0.011178
H 1.409008 0.043774 -1.980181
H 2.250518 1.594528 -1.644339
H -5.010550 1.596261 2.209515
H 3.358973 -1.388707 1.762697
H 4.026585 1.293370 -1.579573
H 5.788787 -1.765046 1.923005
H 6.450648 0.895590 -1.391899
H 7.350812 -0.632687 0.352370


%chk=000258879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258879

0 1
O -4.414066 1.206657 1.853395
N -0.757941 0.651097 -0.129680
N 2.121317 0.309568 0.102357
C -3.187896 0.040651 0.111075
C -4.574295 0.571804 0.524574
C -3.290197 -0.716330 -1.237581
C -2.139429 1.177505 0.038444
C -5.626118 -0.557723 0.576882
C -4.333965 -1.855178 -1.192656
C -5.720763 -1.312902 -0.771251
C -0.151548 0.203239 1.143285
C 0.167517 1.606522 -0.772960
C 1.178474 -0.522516 0.887995
C 1.516050 0.937158 -1.092166
C 3.494820 -0.040226 0.070747
C 4.108979 -0.754990 1.148241
C 4.338557 0.328818 -1.025227
C 5.485862 -1.052636 1.137221
C 5.716248 0.027083 -1.021294
C 6.311270 -0.663635 0.057183
H -2.881063 -0.681254 0.897194
H -4.906885 1.338344 -0.215204
H -2.286537 -1.098970 -1.497407
H -3.573969 0.004529 -2.034736
H -2.231834 1.823429 0.942108
H -2.369180 1.809817 -0.843258
H -6.615822 -0.135838 0.850823
H -5.336241 -1.261298 1.382903
H -4.006239 -2.627866 -0.467062
H -4.401706 -2.349793 -2.180797
H -6.096998 -0.624606 -1.556385
H -6.455592 -2.136379 -0.689128
H -0.837563 -0.492266 1.658125
H 0.027940 1.071977 1.828401
H 0.353571 2.500454 -0.122139
H -0.277207 1.963611 -1.720296
H 1.622608 -0.762835 1.866848
H 0.973180 -1.480462 0.358628
H 1.369922 0.188050 -1.904282
H 2.193407 1.723103 -1.468446
H -5.305324 1.497704 2.173445
H 3.521783 -1.075078 2.013148
H 3.928367 0.840745 -1.899231
H 5.915667 -1.595654 1.987401
H 6.325462 0.328994 -1.881693
H 7.380078 -0.900322 0.052957


