%chk=000258246.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258246

0 1
O 2.748937 3.817646 -0.845625
O 1.706598 -3.124771 -0.868316
O 0.046112 -2.997246 0.671373
N 1.903786 1.110850 -0.525123
N 1.664704 -0.611136 2.944262
C 0.995224 -0.078883 -0.510427
C 1.951610 1.747915 -1.883922
C 1.569938 2.148490 0.504018
C 1.681373 -1.161477 0.393648
C 3.035741 2.839618 -1.863358
C 2.662956 3.228640 0.469033
C -0.423177 0.197096 -0.078819
C 1.011409 -2.510655 0.142585
C -1.372439 0.580048 -0.939876
C 1.659153 -0.856023 1.815471
C -2.763498 0.854475 -0.539590
C 1.271388 -4.458997 -1.295943
C -3.439837 0.002113 0.348299
C -3.424909 1.978245 -1.064537
C -4.761887 0.275504 0.709098
C -4.744158 2.248232 -0.694615
C 1.709252 -5.492226 -0.281753
C -5.415100 1.398034 0.191217
H 0.986383 -0.523941 -1.548522
H 0.977581 2.192312 -2.183270
H 2.214882 0.974662 -2.636048
H 1.541833 1.675710 1.507835
H 0.573957 2.615471 0.335786
H 2.767172 -1.220106 0.062738
H 3.033027 3.445878 -2.786069
H 4.039465 2.415041 -1.683692
H 3.651709 2.824017 0.748076
H 2.409783 4.097082 1.102478
H -0.634132 0.070423 0.985661
H -1.167691 0.718759 -2.004879
H 0.176782 -4.438134 -1.440879
H 1.798739 -4.542620 -2.264153
H -2.935744 -0.876869 0.750944
H -2.907645 2.643681 -1.752877
H -5.283017 -0.388802 1.397319
H -5.251953 3.123200 -1.097499
H 1.158868 -5.382937 0.665755
H 2.778062 -5.403984 -0.046475
H 1.532126 -6.511959 -0.645336
H -6.443760 1.610222 0.476206


%chk=000258246-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258246

0 1
O 2.987573 3.943370 -0.621862
O 1.269785 -2.878535 -0.990384
O 0.359916 -3.076285 1.153955
N 2.024597 1.215099 -0.356773
N 1.944928 -0.552442 3.137343
C 1.133571 0.015435 -0.335156
C 2.054843 1.896509 -1.680588
C 1.803334 2.223821 0.722233
C 1.797613 -1.130654 0.540991
C 3.178169 2.949928 -1.688557
C 2.936994 3.260987 0.683393
C -0.304806 0.277232 0.075063
C 1.057225 -2.462624 0.322692
C -1.335617 0.330145 -0.816499
C 1.870346 -0.814786 1.976684
C -2.757016 0.609133 -0.527038
C 0.607505 -4.162866 -1.396909
C -3.261059 0.798243 0.792433
C -3.673336 0.688830 -1.613518
C -4.627411 1.062651 1.009930
C -5.042071 0.954469 -1.396892
C 1.471012 -5.364075 -1.006031
C -5.525962 1.143662 -0.082286
H 1.141864 -0.395425 -1.361685
H 1.083276 2.397478 -1.910390
H 2.255949 1.147556 -2.470241
H 1.800358 1.727813 1.707169
H 0.830166 2.751397 0.589969
H 2.826474 -1.233303 0.148622
H 3.176940 3.522153 -2.631263
H 4.158911 2.442613 -1.559179
H 3.909012 2.761764 0.884740
H 2.767977 4.058614 1.425207
H -0.483755 0.447921 1.145880
H -1.104107 0.148080 -1.878446
H -0.386616 -4.205716 -0.918740
H 0.503107 -4.061073 -2.488705
H -2.585962 0.730052 1.652591
H -3.303001 0.543453 -2.636375
H -4.997218 1.203130 2.031782
H -5.728773 1.013384 -2.248602
H 1.558049 -5.445854 0.090125
H 2.481190 -5.285252 -1.443250
H 1.003507 -6.292484 -1.383125
H -6.587878 1.349048 0.091890


