%chk=000299327.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299327

0 1
O 2.363486 1.191049 -0.769936
N 1.156575 0.223350 0.969670
N 2.954193 -0.952605 -0.137201
C -1.121774 -0.691255 1.043534
C -1.213814 0.865692 0.862105
C -1.740645 -1.237034 -0.279461
C -1.879167 1.018542 -0.539474
C -1.277529 -0.181969 -1.323621
C -3.271544 -0.960742 -0.221242
C -3.365989 0.580565 -0.398112
C 0.370127 -1.026367 1.227887
C 0.224396 1.400363 0.938976
C 2.164509 0.222174 -0.048959
C 4.208233 -0.855376 -0.921849
H -1.700891 -1.033625 1.920871
H -1.838271 1.330634 1.647333
H -1.482132 -2.277068 -0.502078
H -1.742207 2.004498 -0.995946
H -0.189702 -0.124829 -1.455343
H -1.716060 -0.323022 -2.318261
H -3.720906 -1.296972 0.722877
H -3.796742 -1.490545 -1.029710
H -3.940900 0.847506 -1.297207
H -3.864495 1.065021 0.452318
H 0.579198 -1.328855 2.276835
H 0.679555 -1.863689 0.571403
H 0.469880 2.086239 0.096435
H 0.396246 1.966346 1.879066
H 3.026138 -1.548218 0.685659
H 5.071254 -0.541566 -0.314043
H 4.091296 -0.116152 -1.740505
H 4.419783 -1.836490 -1.377118


%chk=000299327-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299327

0 1
O 3.009290 1.471769 -0.216004
N 1.129770 0.190188 0.296382
N 3.234291 -0.851550 0.024140
C -1.049159 -0.712947 0.821902
C -1.163146 0.860948 0.651572
C -1.984065 -1.253881 -0.305385
C -2.156011 1.008436 -0.543113
C -1.764800 -0.205802 -1.436316
C -3.457903 -0.966239 0.111980
C -3.576877 0.596020 -0.054355
C 0.450355 -1.071018 0.645194
C 0.266056 1.389405 0.365524
C 2.485730 0.332638 0.020681
C 4.669491 -0.834019 -0.265718
H -1.405322 -1.046826 1.812576
H -1.574078 1.341049 1.557518
H -1.792043 -2.308083 -0.568211
H -2.116857 2.000357 -1.022817
H -0.723879 -0.162582 -1.802839
H -2.443872 -0.348143 -2.295779
H -3.664565 -1.300455 1.145151
H -4.163015 -1.493976 -0.555264
H -4.340706 0.859466 -0.808193
H -3.851318 1.103530 0.888315
H 0.867174 -1.505783 1.579174
H 0.574353 -1.825843 -0.161695
H 0.321120 1.948088 -0.587886
H 0.625169 2.076036 1.155622
H 2.777897 -1.745792 0.197580
H 5.253777 -1.290166 0.555877
H 4.966575 0.222141 -0.370771
H 4.908669 -1.361366 -1.209940


