%chk=000249310.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249310

0 1
O -0.636220 0.237883 1.405703
O -1.419648 -2.977907 -1.007407
N 3.083088 -1.535335 0.759860
N 0.018700 -1.825658 0.305699
C 1.446232 0.279898 0.089014
C 1.899712 1.468113 0.972804
C 0.770438 0.798806 -1.205584
C 0.483588 -0.596417 0.963774
C 2.663677 -0.601074 -0.337213
C 2.440481 2.634495 0.140393
C 0.231887 2.227467 -1.065849
C 1.356337 3.231961 -0.772652
C -1.826520 0.188818 0.736034
C -1.208606 -1.963628 -0.363077
C 4.118865 -0.922836 1.642809
C 3.597038 -2.819588 0.192746
C -2.152062 -0.848405 -0.157345
C -2.732511 1.225915 1.030562
C -3.407745 -0.828285 -0.786266
C -3.970084 1.215025 0.395339
C -4.307761 0.200047 -0.516860
H 2.665813 1.131869 1.703904
H 1.038759 1.823341 1.579367
H -0.046192 0.121689 -1.517445
H 1.495812 0.781915 -2.043509
H 0.955991 -0.847773 1.952673
H 3.484118 0.065606 -0.677228
H 2.368675 -1.197743 -1.229501
H 3.296740 2.291844 -0.471502
H 2.841069 3.417237 0.811121
H -0.522109 2.263588 -0.253846
H -0.303247 2.517177 -1.989263
H 0.924098 4.136641 -0.305603
H 1.817172 3.571033 -1.718900
H 0.693529 -2.595164 0.268658
H 3.732830 0.038063 2.040111
H 5.085937 -0.727916 1.157364
H 4.290971 -1.588578 2.503654
H 2.814209 -3.293338 -0.420942
H 3.818301 -3.510855 1.022817
H 4.503749 -2.723961 -0.422565
H -2.455127 2.000192 1.740657
H -3.662274 -1.635485 -1.479833
H -4.689860 2.008071 0.605976
H -5.279154 0.215852 -1.005449


%chk=000249310-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249310

0 1
O -0.690241 0.494583 1.406425
O -1.279418 -3.115372 -0.636289
N 2.954434 -1.720511 0.601439
N 0.083033 -1.665334 0.569734
C 1.490964 0.414070 0.144212
C 2.087559 1.620483 0.945815
C 0.806434 0.956716 -1.160511
C 0.483273 -0.347589 1.077775
C 2.587833 -0.608210 -0.326836
C 2.641628 2.718608 0.009689
C 0.310755 2.414671 -1.036073
C 1.504336 3.387817 -0.817373
C -1.903334 0.259547 0.739959
C -1.097874 -1.987051 -0.079675
C 3.753089 -1.309167 1.780288
C 3.638962 -2.810845 -0.141724
C -2.142774 -0.922566 -0.008547
C -2.909059 1.240417 0.885886
C -3.399785 -1.102704 -0.631111
C -4.156870 1.042829 0.257971
C -4.406870 -0.124741 -0.507626
H 2.884730 1.276803 1.629718
H 1.290093 2.056974 1.578034
H -0.015704 0.280527 -1.462553
H 1.548224 0.916017 -1.985216
H 0.974061 -0.494660 2.057339
H 3.491744 -0.024919 -0.635105
H 2.201501 -1.100021 -1.238886
H 3.392729 2.270879 -0.671787
H 3.181779 3.481040 0.602371
H -0.399805 2.490143 -0.194094
H -0.249863 2.698567 -1.946876
H 1.144975 4.298363 -0.300543
H 1.906175 3.718452 -1.794840
H 0.860999 -2.340697 0.596393
H 3.169036 -0.648866 2.441669
H 4.694485 -0.775981 1.499855
H 4.026620 -2.206723 2.362386
H 2.985940 -3.179236 -0.952534
H 3.843406 -3.652639 0.542958
H 4.607136 -2.486981 -0.594890
H -2.702769 2.133207 1.483876
H -3.556555 -2.029408 -1.193425
H -4.937538 1.804056 0.366450
H -5.378778 -0.267948 -0.990528


