%chk=000227512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227512

0 1
N 0.832451 -0.318050 1.288165
N -3.616969 -0.657826 -0.198921
N -0.047929 1.392564 -0.119031
N -3.342635 -1.777407 0.548279
N -2.357776 1.380673 -0.929989
C 3.084289 -0.377187 0.211023
C 4.512735 0.174968 0.283500
C 2.192989 0.273987 1.280398
C 5.413403 -0.464321 -0.783074
C -0.203751 0.191443 0.535228
C -1.460822 -0.484678 0.471291
C -2.502591 0.172309 -0.280553
C 6.837924 0.080918 -0.716640
C -2.056611 -1.694085 0.960790
C -4.941461 -0.441515 -0.795680
C -1.122373 1.917195 -0.800682
H 2.654361 -0.184485 -0.793916
H 3.095373 -1.476896 0.329647
H 4.940878 -0.001550 1.288960
H 4.499569 1.274856 0.148827
H 2.623998 0.138069 2.297341
H 2.121171 1.375304 1.101899
H 4.990341 -0.281654 -1.790871
H 5.427817 -1.564472 -0.656102
H 0.752590 -1.267589 1.639177
H 7.473312 -0.378643 -1.482404
H 6.863937 1.164809 -0.878639
H 7.302857 -0.116111 0.255939
H -1.595730 -2.453696 1.570152
H -5.195543 -1.264064 -1.489962
H -5.720458 -0.400227 -0.011561
H -4.947974 0.514227 -1.356069
H -0.938973 2.885134 -1.298323


%chk=000227512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227512

0 1
N 0.821817 -0.442889 1.270831
N -3.665295 -0.591000 -0.183228
N -0.007551 1.251829 -0.148817
N -3.492203 -1.720804 0.625950
N -2.320031 1.314061 -0.979339
C 3.120541 -0.467129 0.228583
C 4.524260 0.177300 0.264343
C 2.176663 0.138281 1.294264
C 5.487284 -0.415324 -0.789881
C -0.219869 0.088221 0.549624
C -1.518783 -0.526921 0.512701
C -2.502690 0.152369 -0.276066
C 6.882752 0.244755 -0.766336
C -2.194552 -1.674925 1.043005
C -4.953510 -0.310525 -0.812018
C -1.051284 1.790188 -0.856387
H 2.664198 -0.316269 -0.768625
H 3.209601 -1.562410 0.383224
H 4.968450 0.051891 1.274727
H 4.429380 1.270392 0.098188
H 2.600666 -0.008406 2.306712
H 2.068149 1.221107 1.115669
H 5.038328 -0.298358 -1.797046
H 5.588801 -1.506631 -0.619291
H 0.665501 -1.332330 1.745147
H 7.551581 -0.195282 -1.528636
H 6.810060 1.330395 -0.966590
H 7.366182 0.118046 0.220985
H -1.831009 -2.467339 1.695956
H -5.235080 -1.131058 -1.493082
H -5.736951 -0.194648 -0.044624
H -4.848380 0.626070 -1.381548
H -0.828626 2.719342 -1.390196


