%chk=000230337.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230337

0 1
O 1.125351 2.899362 -0.833717
N 0.424759 -0.487050 1.390246
N -0.869819 1.182654 0.098535
N 0.757898 1.804629 1.795963
N 2.051182 -0.342873 -0.354990
N -2.270585 -0.702676 0.539492
C 0.120037 0.902606 1.126294
C 0.596712 3.241087 1.537785
C 1.374433 -1.119306 0.559455
C -1.978490 0.395279 -0.237275
C 1.452377 3.675317 0.327916
C 1.642307 -2.503024 0.733194
C -2.791844 0.778612 -1.341301
C 2.650000 -3.075827 -0.033582
C -3.919618 0.019323 -1.623444
C 3.362909 -2.294870 -0.954869
C -4.233470 -1.096185 -0.832214
C 3.031897 -0.940453 -1.081355
C -3.383887 -1.418967 0.231196
H -0.362974 -1.056254 1.737860
H -0.642957 1.985250 -0.524626
H -0.462985 3.549688 1.398586
H 0.959543 3.762518 2.456958
H 2.531628 3.580032 0.542076
H 1.215182 4.711428 0.023556
H 1.083957 -3.088644 1.457073
H -2.533740 1.642174 -1.946767
H 2.886859 -4.134648 0.080516
H -4.563195 0.289021 -2.462324
H 4.152780 -2.730501 -1.557664
H -5.113064 -1.695518 -1.041642
H 3.554461 -0.289112 -1.792615
H -3.579494 -2.282354 0.879236
H 1.620248 2.032983 -0.812452


%chk=000230337-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230337

0 1
O 1.330180 2.398949 -0.923414
N 0.226048 -0.550981 1.122547
N -1.099260 1.225663 0.154336
N 0.723314 1.667038 1.713125
N 2.125328 -0.175283 -0.266503
N -2.431200 -0.709179 0.513542
C -0.045641 0.847227 1.058606
C 0.705757 3.098461 1.381654
C 1.386650 -1.034858 0.516119
C -2.214799 0.460268 -0.176929
C 1.684221 3.289070 0.177464
C 1.770056 -2.399329 0.681971
C -3.110146 0.910887 -1.195084
C 2.929806 -2.864718 0.042115
C -4.248319 0.142582 -1.483081
C 3.704714 -1.974120 -0.745909
C -4.486361 -1.058840 -0.764563
C 3.258527 -0.644478 -0.864859
C -3.547573 -1.436335 0.214460
H -0.623305 -1.141953 1.184953
H -0.850513 2.019890 -0.448503
H -0.299621 3.490448 1.109199
H 1.077835 3.670179 2.250523
H 2.719989 3.097361 0.523953
H 1.614925 4.324404 -0.200765
H 1.169814 -3.054059 1.320863
H -2.904897 1.842278 -1.733084
H 3.238844 -3.908266 0.165483
H -4.947006 0.472739 -2.259052
H 4.618691 -2.299301 -1.249592
H -5.364933 -1.679274 -0.959611
H 3.808030 0.084575 -1.470693
H -3.678033 -2.357295 0.793755
H 1.647277 1.439954 -0.697926


