%chk=000245761.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245761

0 1
O 0.553237 -0.946957 0.019309
O 0.876129 -0.246173 -2.122998
N 0.064190 1.941890 0.250840
N 6.666765 0.246322 0.761451
C -1.615675 0.188096 -0.250426
C -3.042806 0.054309 -0.096068
C -1.019167 1.500230 -0.691295
C -3.600209 -1.197036 0.281011
C -0.841773 -0.932222 -0.013190
C -2.741961 -2.321764 0.508237
C -1.388091 -2.198234 0.365059
C -3.936275 1.154092 -0.307272
C -5.017191 -1.324246 0.431961
C -5.291923 1.008698 -0.154986
C -0.503219 2.312933 1.580591
C 0.814258 3.091214 -0.339091
C -5.843762 -0.249610 0.219479
C 1.335133 -0.439012 -1.023404
C 2.716202 -0.293426 -0.542227
C 3.781903 -0.450300 -1.447404
C 2.972668 0.034920 0.801533
C 5.350301 0.022642 0.338028
C 5.093363 -0.303229 -1.017642
C 4.279100 0.190006 1.248206
H -0.562229 1.350715 -1.705615
H -1.811871 2.273251 -0.825480
H -3.188938 -3.273694 0.793341
H -0.701021 -3.027205 0.529567
H -3.509186 2.118413 -0.595439
H -5.424952 -2.292933 0.718270
H -5.965105 1.848821 -0.318294
H -1.206267 3.157827 1.565417
H 0.322307 2.559298 2.265751
H -1.027913 1.437454 2.000232
H 1.277616 2.767326 -1.286598
H 1.635743 3.367535 0.341082
H 0.212501 3.989668 -0.535524
H -6.922316 -0.339590 0.331479
H 3.567483 -0.690655 -2.492582
H 2.125152 0.171915 1.483625
H 5.913882 -0.423000 -1.718701
H 4.472751 0.449676 2.284453
H 6.862464 0.243290 1.749126
H 7.422103 -0.094357 0.189487


%chk=000245761-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245761

0 1
O 0.439910 -0.989627 0.264037
O 0.799121 -0.279752 -1.957951
N 0.225424 1.781779 0.018862
N 6.686168 0.393069 0.763396
C -1.725640 0.184413 -0.152457
C -3.172909 0.071221 -0.108264
C -1.070409 1.477307 -0.628713
C -3.793952 -1.158234 0.353722
C -0.973914 -0.949346 0.211440
C -2.965810 -2.257900 0.750849
C -1.583752 -2.156132 0.672812
C -4.050556 1.135696 -0.518015
C -5.221936 -1.265490 0.404181
C -5.440787 1.001892 -0.462408
C 0.150351 1.998157 1.473893
C 0.969619 2.833390 -0.695025
C -6.039645 -0.207133 0.006555
C 1.226833 -0.394233 -0.781718
C 2.626891 -0.205456 -0.342249
C 3.596611 0.167938 -1.311670
C 3.044146 -0.380537 1.004667
C 5.356474 0.197000 0.400510
C 4.937895 0.369694 -0.953828
C 4.383759 -0.183359 1.374432
H -0.867552 1.375446 -1.713960
H -1.771693 2.332763 -0.497559
H -3.436593 -3.183059 1.102126
H -0.924123 -2.984272 0.948240
H -3.633921 2.073230 -0.896630
H -5.662628 -2.204630 0.760169
H -6.079092 1.832070 -0.785362
H -0.402302 2.930776 1.745283
H 1.172986 2.067960 1.885995
H -0.358167 1.145397 1.953621
H 1.139082 2.514522 -1.739051
H 1.953396 2.978893 -0.215791
H 0.436562 3.815907 -0.706714
H -7.130361 -0.298909 0.046742
H 3.272665 0.289369 -2.350956
H 2.304504 -0.678745 1.753025
H 5.673465 0.654591 -1.715982
H 4.691360 -0.326079 2.417716
H 6.989837 0.261638 1.723931
H 7.382086 0.655676 0.071397


