%chk=000262781.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262781

0 1
S 0.312703 -0.240933 -1.688027
S -1.626202 -0.675379 -1.243007
C 1.361220 -0.139668 -0.163884
C 1.587792 -1.534915 0.387553
C 2.637015 0.435355 -0.756956
C 0.643291 0.765610 0.810169
C 1.838567 -1.705893 1.761601
C 3.888348 -0.108592 -0.422888
C -0.451277 0.261134 1.540454
C 1.612376 -2.658949 -0.450817
C 2.586292 1.514319 -1.658303
C 1.028455 2.098922 1.012629
C 2.068351 -2.977588 2.289028
C 5.059647 0.403244 -0.987000
C -1.155696 1.080926 2.423150
C 1.840505 -3.932316 0.082218
C 3.760203 2.017851 -2.226062
C 0.317530 2.919406 1.894896
C 2.063483 -4.097464 1.451039
C 4.999770 1.464005 -1.895068
C -0.779002 2.416790 2.598143
C -2.454842 0.934690 -1.073254
C -3.886879 0.574449 -0.853297
C -4.401621 0.490351 0.450797
C -4.726955 0.315672 -1.949055
C -5.742551 0.155202 0.653442
C -6.066683 -0.019804 -1.738925
C -6.577393 -0.099753 -0.439310
H 1.857268 -0.840780 2.425961
H 3.961113 -0.938963 0.281698
H -0.750658 -0.784980 1.431991
H 1.462142 -2.563891 -1.528278
H 1.636263 1.985104 -1.922058
H 1.894339 2.514245 0.495849
H 2.252587 -3.096213 3.355397
H 6.021831 -0.030025 -0.717918
H -1.995613 0.674316 2.984440
H 1.844567 -4.798062 -0.578594
H 3.705235 2.846455 -2.930568
H 0.627618 3.953761 2.035548
H 2.236144 -5.089617 1.862682
H 5.911874 1.856606 -2.339958
H -1.330866 3.056025 3.284152
H -2.308305 1.550045 -1.982069
H -2.024950 1.515068 -0.230933
H -3.753939 0.683883 1.304652
H -4.333856 0.370652 -2.963293
H -6.137867 0.091018 1.665850
H -6.714228 -0.221131 -2.590959
H -7.621246 -0.361187 -0.278857


%chk=000262781-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262781

0 1
S 0.348520 -0.128899 -1.836691
S -1.722950 -0.868434 -1.321778
C 1.446151 -0.085621 -0.139706
C 1.618829 -1.510120 0.420235
C 2.756198 0.458337 -0.745687
C 0.751939 0.845154 0.862184
C 1.973614 -1.674948 1.787328
C 3.992974 -0.213545 -0.559101
C -0.400798 0.373335 1.554784
C 1.547482 -2.666222 -0.396588
C 2.752248 1.649677 -1.529565
C 1.215143 2.154484 1.156653
C 2.232033 -2.955890 2.322259
C 5.184942 0.291580 -1.124105
C -1.084604 1.196365 2.473147
C 1.801768 -3.949211 0.137732
C 3.941674 2.147270 -2.102529
C 0.534305 2.976169 2.083822
C 2.143763 -4.102551 1.500307
C 5.167015 1.472208 -1.900036
C -0.624909 2.507491 2.740536
C -2.677896 0.807550 -1.184141
C -4.134292 0.490528 -0.955032
C -4.668118 0.456664 0.360406
C -4.992387 0.201344 -2.049577
C -6.030117 0.152113 0.576672
C -6.353942 -0.104247 -1.835223
C -6.877035 -0.129593 -0.520793
H 2.046774 -0.796379 2.437147
H 4.027654 -1.133632 0.030707
H -0.758295 -0.643531 1.369439
H 1.282530 -2.555482 -1.452521
H 1.808341 2.177014 -1.702952
H 2.123171 2.532825 0.679728
H 2.501502 -3.055969 3.379816
H 6.127083 -0.243718 -0.961003
H -1.965632 0.805589 2.996096
H 1.729263 -4.828351 -0.512487
H 3.909069 3.060054 -2.707770
H 0.917888 3.980314 2.297456
H 2.336586 -5.098164 1.915487
H 6.091776 1.857311 -2.343973
H -1.151174 3.145141 3.459677
H -2.498264 1.333485 -2.133738
H -2.225269 1.361331 -0.348868
H -4.011258 0.677052 1.210358
H -4.586535 0.215744 -3.068206
H -6.431104 0.135285 1.596374
H -7.005858 -0.321906 -2.688611
H -7.933898 -0.366000 -0.353669


