%chk=000220227.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220227

0 1
N 4.967034 -0.653616 0.016451
N -4.968745 -0.658671 -0.012851
C 7.255151 0.296432 -0.007349
C -7.257990 0.288631 0.007403
C 5.759237 0.601467 0.160733
C -5.762349 0.595118 -0.160443
C 8.098505 1.561053 0.204149
C -8.102745 1.551751 -0.207402
C 0.736416 -0.562328 -0.006426
C -0.738246 -0.563045 0.009734
C 3.552897 -0.561550 -0.037583
C -3.554733 -0.565037 0.040909
C 1.455074 0.502187 0.558610
C -1.457973 0.499663 -0.557308
C 1.441391 -1.630323 -0.588642
C -1.442152 -1.630647 0.593990
C 2.848956 0.512522 0.546262
C -2.851874 0.508632 -0.544964
C 2.831873 -1.635340 -0.614009
C -2.832615 -1.637020 0.619375
C 9.588630 1.275427 0.035674
C -9.592622 1.264682 -0.039212
H 7.562750 -0.487072 0.715057
H 7.455505 -0.124025 -1.011614
H -7.564190 -0.496842 -0.713457
H -7.458445 -0.129850 1.012472
H 5.566041 1.010586 1.179719
H 5.437816 1.379124 -0.567779
H -5.442325 1.374784 0.566541
H -5.569036 1.002221 -1.180216
H 7.910555 1.975016 1.214913
H 7.786394 2.348732 -0.509856
H -7.914674 1.963711 -1.218961
H -7.792031 2.341381 0.505055
H 5.373750 -1.307981 -0.653760
H -5.374848 -1.311904 0.658806
H 0.916088 1.330271 1.019240
H -0.919833 1.327421 -1.019513
H 0.889748 -2.459115 -1.033092
H -0.889661 -2.458032 1.040006
H 3.380994 1.340972 1.003211
H -3.384721 1.335707 -1.003452
H 3.360133 -2.469788 -1.066046
H -3.360046 -2.471138 1.072983
H 9.819475 0.901941 -0.968563
H 10.185152 2.181573 0.192687
H 9.940454 0.524646 0.752990
H -9.823627 0.893116 0.965700
H -10.190148 2.169756 -0.198574
H -9.943092 0.511903 -0.755096


%chk=000220227-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220227

0 1
N 5.027672 -0.512172 -0.164617
N -5.029623 -0.517059 0.167430
C 7.368810 0.284021 -0.046981
C -7.371608 0.276150 0.046983
C 5.878669 0.648653 0.102534
C -5.881825 0.642226 -0.102553
C 8.303594 1.482850 0.228220
C -8.307680 1.473370 -0.230858
C 0.742232 -0.489861 -0.021132
C -0.744200 -0.490574 0.024237
C 3.632878 -0.489881 -0.113722
C -3.634847 -0.493409 0.116645
C 1.500048 0.678231 0.266947
C -1.503212 0.676114 -0.266384
C 1.479569 -1.662752 -0.357618
C -1.480334 -1.663495 0.363239
C 2.907873 0.691402 0.222954
C -2.911053 0.687909 -0.222505
C 2.883065 -1.669993 -0.402904
C -2.883824 -1.672105 0.408449
C 9.796855 1.120308 0.081359
C -9.800582 1.109283 -0.084173
H 7.616025 -0.541654 0.652189
H 7.551847 -0.096021 -1.073513
H -7.617521 -0.551119 -0.650758
H -7.554680 -0.102185 1.074141
H 5.697059 1.034015 1.130540
H 5.631469 1.478185 -0.596639
H -5.635948 1.473531 0.594980
H -5.700160 1.025618 -1.131283
H 8.114388 1.866158 1.251312
H 8.052257 2.309031 -0.467170
H -8.118366 1.855096 -1.254521
H -8.057732 2.301080 0.463214
H 5.485208 -1.390900 -0.404068
H -5.486264 -1.395724 0.408818
H 0.978561 1.595889 0.563960
H -0.982656 1.593678 -0.565322
H 0.940910 -2.580770 -0.620284
H -0.940732 -2.580376 0.627936
H 3.442751 1.615514 0.464009
H -3.446882 1.610951 -0.465546
H 3.413416 -2.591619 -0.677267
H -3.413234 -2.593686 0.684774
H 10.020772 0.764493 -0.941937
H 10.444490 1.992522 0.284440
H 10.081551 0.316714 0.786418
H -10.024617 0.754971 0.939619
H -10.449158 1.980365 -0.289104
H -10.083933 0.304127 -0.787988


