%chk=000217855.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217855

0 1
O 3.899558 -0.397560 -0.000343
N -1.574675 0.582954 -0.000032
N -0.532052 -2.048793 -0.000302
N -3.738557 -0.154804 0.000180
C -0.168024 0.426091 -0.000150
C 0.325549 -0.920266 -0.000290
C -2.438391 -0.555472 -0.000052
C 0.725490 1.515446 -0.000088
C 1.711446 -1.139491 -0.000365
C -2.388311 1.712186 0.000249
C 2.574999 -0.036977 -0.000288
C -1.830276 -1.872309 -0.000189
C 2.093465 1.291557 -0.000150
C -3.712396 1.228758 0.000011
C 4.895688 0.654984 -0.000164
H 0.338323 2.535454 0.000036
H 2.108573 -2.157794 -0.000451
H -2.027033 2.721144 0.000350
H -2.497434 -2.748980 -0.000182
H 2.780847 2.133208 -0.000081
H -4.622194 1.807751 0.000083
H 5.828236 0.072926 -0.000158
H 4.812927 1.258657 0.907811
H 4.813041 1.258831 -0.908035


%chk=000217855-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217855

0 1
O 3.954175 -0.420595 -0.000238
N -1.590153 0.582375 -0.000079
N -0.548927 -2.070014 -0.000291
N -3.762268 -0.161983 -0.000342
C -0.188200 0.418081 -0.000101
C 0.298285 -0.939788 -0.000182
C -2.457748 -0.548911 -0.000156
C 0.718813 1.499185 -0.000093
C 1.696350 -1.160534 -0.000233
C -2.403945 1.712227 -0.000207
C 2.596222 -0.077548 -0.000186
C -1.865635 -1.855693 -0.000282
C 2.104713 1.260949 -0.000118
C -3.725325 1.228282 0.000615
C 4.936006 0.667328 -0.000149
H 0.353904 2.531299 -0.000055
H 2.066332 -2.188541 -0.000309
H -2.015994 2.726227 -0.000307
H -2.533069 -2.723618 -0.000436
H 2.790479 2.112576 -0.000101
H -4.641127 1.815819 0.001036
H 5.914459 0.165838 -0.000178
H 4.840718 1.297202 0.905972
H 4.840733 1.297337 -0.906178


