%chk=000228629.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228629

0 1
N 0.033755 0.561753 -0.241535
N 3.705045 -0.331609 -0.011807
N -3.573407 -0.506514 0.065561
N -0.027004 1.713212 -1.097035
C 1.282133 -0.257134 -0.443828
C -1.191731 -0.278937 -0.496765
C 2.451605 0.438276 0.284672
C -2.409784 0.439056 0.123031
C 3.807572 -1.544528 0.853787
C 4.908215 0.534219 0.174214
C -4.253446 -0.436940 -1.262721
C -4.547918 -0.209922 1.158075
H 1.541089 -0.422942 -1.512012
H 1.122434 -1.266925 -0.007185
H -1.056737 -1.264359 0.000208
H -1.366300 -0.475447 -1.574728
H 2.223651 0.522970 1.368785
H 2.567321 1.477050 -0.089196
H -2.591177 1.403153 -0.397733
H -2.179298 0.694451 1.179805
H 0.303754 2.511018 -0.546159
H 0.583320 1.645212 -1.916595
H 2.926284 -2.184498 0.687063
H 3.883502 -1.339755 1.931680
H 4.691704 -2.126622 0.548034
H 5.809808 -0.047362 -0.078175
H 5.035376 0.941910 1.187436
H 4.859967 1.373460 -0.537722
H -5.035412 -1.211221 -1.304171
H -3.522864 -0.668220 -2.054125
H -4.713362 0.534286 -1.496678
H -4.047778 -0.353577 2.129414
H -5.373404 -0.937709 1.110284
H -4.978114 0.801595 1.134023


%chk=000228629-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228629

0 1
N 0.020805 0.405947 -0.146259
N 3.784198 -0.247321 -0.045002
N -3.696008 -0.427060 0.032832
N -0.044395 1.515565 -1.069887
C 1.280428 -0.381790 -0.271212
C -1.209254 -0.424518 -0.274662
C 2.492364 0.418181 0.247105
C -2.434699 0.316438 0.291879
C 3.974292 -1.507056 0.703792
C 4.929345 0.668472 0.135520
C -4.199249 -0.236112 -1.343381
C -4.743125 -0.137714 1.032867
H 1.483103 -0.683684 -1.329942
H 1.153385 -1.304851 0.322711
H -1.059047 -1.356331 0.299550
H -1.389957 -0.715142 -1.337066
H 2.350100 0.615604 1.340606
H 2.506979 1.401508 -0.262292
H -2.452344 1.347626 -0.133628
H -2.301617 0.412565 1.384991
H 0.368190 2.363567 -0.670426
H 0.324014 1.294498 -2.013406
H 3.179242 -2.229712 0.453278
H 3.974488 -1.361713 1.815131
H 4.939962 -1.961124 0.418124
H 5.862428 0.161558 -0.170078
H 5.059412 1.019032 1.191858
H 4.799338 1.558863 -0.505472
H -5.070747 -0.893849 -1.515549
H -3.420860 -0.506421 -2.077116
H -4.512431 0.819639 -1.551032
H -4.366559 -0.367052 2.045581
H -5.624010 -0.778609 0.843291
H -5.088971 0.928399 1.025196


