%chk=000224091.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224091

0 1
O -0.285252 4.083616 0.998637
O -4.068104 0.302170 -0.803682
N 0.811198 1.851973 -0.401907
N -3.571411 -1.682951 0.265480
C 0.906052 0.460025 -0.918999
C -0.070977 -0.577614 -0.355169
C 2.259952 -0.160186 -0.578814
C 0.644494 -1.685127 0.191010
C 2.083556 -1.430204 0.050219
C 0.840752 1.909605 1.096373
C -0.409712 2.555849 -0.917788
C 0.864140 3.385265 1.521407
C -0.361980 4.016029 -0.439736
C -1.450101 -0.543570 -0.350645
C 3.525172 0.341919 -0.820899
C -0.041240 -2.759672 0.739224
C 3.182745 -2.191002 0.419751
C -2.141887 -1.640983 0.213943
C -1.443544 -2.738837 0.752107
C 4.637696 -0.433792 -0.440355
C 4.468479 -1.677668 0.165906
C -4.456341 -0.703371 -0.245740
C -5.907292 -1.032809 -0.030452
H 0.792705 0.500065 -2.036729
H 1.759874 1.394599 1.451325
H -0.026513 1.392646 1.562412
H -1.360788 2.079771 -0.582292
H -0.399516 2.522211 -2.027395
H 0.739823 3.507451 2.611239
H 1.780320 3.896889 1.177877
H 0.498110 4.559078 -0.869331
H -1.303656 4.552244 -0.651817
H -1.998350 0.310159 -0.767045
H 3.657493 1.317563 -1.286039
H 0.494772 -3.610634 1.155644
H 3.061004 -3.160351 0.894644
H -1.978813 -3.581237 1.182096
H 5.640117 -0.051453 -0.624688
H 5.340288 -2.264614 0.450463
H -3.970652 -2.508245 0.717387
H -6.208534 -1.964485 -0.527101
H -6.536556 -0.229745 -0.452930
H -6.169320 -1.111476 1.033108


%chk=000224091-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224091

0 1
O -0.081600 4.303621 0.971628
O -4.279168 0.254091 -0.805698
N 0.761468 1.871220 -0.341731
N -3.637095 -1.755998 0.229629
C 0.868960 0.489826 -0.875657
C -0.113983 -0.582680 -0.344023
C 2.227158 -0.150385 -0.562979
C 0.611753 -1.688944 0.190020
C 2.057570 -1.426807 0.047848
C 0.798400 1.982487 1.137609
C -0.335851 2.696394 -0.904558
C 0.990902 3.458006 1.526309
C -0.118485 4.164023 -0.494558
C -1.516829 -0.567823 -0.362881
C 3.508007 0.370715 -0.801059
C -0.081866 -2.794520 0.726202
C 3.182465 -2.200663 0.409209
C -2.214189 -1.681295 0.189709
C -1.491386 -2.782733 0.729266
C 4.639192 -0.403964 -0.436534
C 4.474606 -1.679491 0.160135
C -4.581184 -0.837834 -0.240054
C -6.029441 -1.269962 -0.003531
H 0.742636 0.578655 -1.975488
H 1.645012 1.385735 1.523789
H -0.139500 1.598602 1.604979
H -1.341050 2.375479 -0.542820
H -0.324456 2.611731 -2.008326
H 0.933932 3.594014 2.619181
H 1.976412 3.812785 1.153563
H 0.835381 4.533868 -0.929904
H -0.954923 4.799979 -0.829130
H -2.092742 0.253831 -0.789460
H 3.624351 1.362835 -1.250067
H 0.455791 -3.657214 1.134394
H 3.065536 -3.184903 0.876895
H -2.040395 -3.636594 1.147773
H 5.648339 -0.016252 -0.615558
H 5.359296 -2.265384 0.434629
H -4.014761 -2.601806 0.664157
H -6.251806 -2.230673 -0.504240
H -6.694346 -0.496481 -0.413077
H -6.243909 -1.386394 1.075111


