%chk=000269727.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269727

0 1
S 0.001250 0.000907 -1.676928
N 5.006362 -2.625703 0.695565
N -5.003803 2.624869 0.697862
N 4.026768 -2.334276 -0.201550
N -4.023912 2.334526 -0.199274
C 2.517146 -0.895917 -1.397979
C -2.514713 0.897443 -1.397775
C 3.745850 -1.101189 -0.544818
C -3.743770 1.101930 -0.544936
C 4.585696 0.050034 -0.150315
C -4.584770 -0.049436 -0.153323
C 5.747697 -0.219795 0.603853
C -5.747003 0.219752 0.600718
C 1.346946 -0.446481 -0.529861
C -1.345365 0.445467 -0.529834
C 6.082617 -1.629332 1.019123
C -6.081042 1.628689 1.018723
C 4.292305 1.372017 -0.511764
C -4.292221 -1.370900 -0.517344
C 6.606379 0.823946 0.968698
C -6.606734 -0.824059 0.962883
C 5.147262 2.411176 -0.135572
C -5.148228 -2.410156 -0.143820
C 6.304030 2.137945 0.600613
C -6.305215 -2.137531 0.592247
H 2.259195 -1.842218 -1.928606
H 2.740347 -0.160240 -2.200500
H -2.255785 1.844594 -1.926412
H -2.737930 0.163468 -2.201844
H 1.613800 0.419849 0.103076
H 1.025475 -1.258454 0.149705
H -1.612935 -0.422525 0.100511
H -1.024346 1.255553 0.152195
H 7.059827 -1.925137 0.574721
H 6.205081 -1.673064 2.130277
H -7.057757 1.926199 0.574369
H -6.204119 1.670208 2.129894
H 3.394660 1.596057 -1.090074
H -3.394414 -1.594450 -1.095590
H 5.389939 -3.564271 0.507184
H -5.386516 3.564136 0.511215
H 7.506633 0.617424 1.544401
H -7.507165 -0.618014 1.538482
H 4.910783 3.435889 -0.418285
H -4.912401 -3.434468 -0.428521
H 6.969920 2.949309 0.890677
H -6.971924 -2.948965 0.880230


%chk=000269727-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269727

0 1
S 0.001145 0.004232 -2.046724
N 4.982878 -2.543165 0.713210
N -4.985399 2.541733 0.713833
N 3.965126 -2.285677 -0.186004
N -3.966803 2.286830 -0.185174
C 2.661046 -0.798683 -1.578862
C -2.659940 0.803483 -1.579308
C 3.835935 -1.039142 -0.646227
C -3.835703 1.041106 -0.647051
C 4.680566 0.068080 -0.146990
C -4.679175 -0.067919 -0.149842
C 5.823579 -0.252900 0.649135
C -5.823070 0.250476 0.646056
C 1.386671 -0.379496 -0.808102
C -1.385511 0.384744 -0.808385
C 6.211954 -1.720927 0.755389
C -6.213427 1.717844 0.754103
C 4.366885 1.437946 -0.366079
C -4.363594 -1.437069 -0.370654
C 6.602035 0.770002 1.223586
C -6.600531 -0.774236 1.218624
C 5.162939 2.458947 0.195174
C -5.158653 -2.459884 0.188700
C 6.278478 2.129700 0.999392
C -6.275087 -2.133200 0.992724
H 2.450588 -1.732518 -2.128044
H 2.915382 -0.024448 -2.327271
H -2.450358 1.738424 -2.126948
H -2.912790 0.030040 -2.329041
H 1.556214 0.523013 -0.195385
H 1.053791 -1.202772 -0.153476
H -1.554324 -0.518866 -0.197077
H -1.054049 1.207458 -0.152348
H 6.897193 -1.988273 -0.086665
H 6.746614 -1.929810 1.699615
H -6.898480 1.985469 -0.088015
H -6.748959 1.924717 1.698279
H 3.498763 1.708022 -0.976302
H -3.494781 -1.705167 -0.980763
H 5.057924 -3.534420 0.939515
H -5.061888 3.532583 0.941433
H 7.473561 0.509020 1.836705
H -7.472753 -0.515233 1.831595
H 4.911849 3.509237 0.010100
H -4.906096 -3.509588 0.002306
H 6.893788 2.921174 1.440843
H -6.889632 -2.926079 1.432716


