%chk=000296022.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296022

0 1
S 4.761707 1.550163 -0.253685
N 1.226292 -0.403374 -0.051971
C 0.301255 0.197908 -1.070458
C 2.657384 -0.119460 -0.406375
C 0.968618 -1.874141 0.106616
C -1.120955 0.222116 -0.560654
C 3.017032 1.244723 0.184553
C 1.622676 -2.385445 1.390232
C -2.174495 -0.107971 -1.426102
C -1.401282 0.606309 0.759511
C -3.495949 -0.049048 -0.973510
C -2.722971 0.659573 1.207424
C -3.773134 0.334279 0.341995
H 0.358518 -0.314958 -2.056441
H 0.620731 1.252716 -1.251061
H 2.847239 -0.143732 -1.501999
H 3.310229 -0.906170 0.039957
H -0.134371 -2.021410 0.177198
H 1.314099 -2.468637 -0.765935
H 2.878255 1.240803 1.282440
H 2.372580 2.047241 -0.217446
H 2.717251 -2.352081 1.338571
H 1.323986 -1.773068 2.252104
H 1.326872 -3.419494 1.595245
H -1.970013 -0.409500 -2.450861
H -0.577686 0.848839 1.432830
H -4.310737 -0.303759 -1.648770
H -2.936008 0.955505 2.233086
H -4.801826 0.378901 0.692132
H 4.963199 2.692773 0.435372


%chk=000296022-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296022

0 1
S 4.762805 1.742876 -0.326385
N 1.261531 -0.488999 -0.131603
C 0.303496 0.071565 -1.115482
C 2.665525 -0.111072 -0.423233
C 1.054989 -1.941780 0.116456
C -1.127211 0.165059 -0.588853
C 2.994795 1.258047 0.198846
C 1.616993 -2.404564 1.473112
C -2.226313 -0.032320 -1.460844
C -1.379740 0.497365 0.766116
C -3.553504 0.110132 -0.993962
C -2.704116 0.636430 1.236567
C -3.796901 0.446331 0.357557
H 0.304743 -0.507163 -2.073948
H 0.653274 1.090910 -1.373826
H 2.872776 -0.085859 -1.520305
H 3.341762 -0.868203 0.010486
H -0.035578 -2.120735 0.106242
H 1.490284 -2.560545 -0.708098
H 2.946294 1.194770 1.296978
H 2.299525 2.036111 -0.157096
H 2.709208 -2.251560 1.547259
H 1.137114 -1.843899 2.294213
H 1.421411 -3.482853 1.620782
H -2.043693 -0.300877 -2.509459
H -0.523293 0.627090 1.437213
H -4.393668 -0.046648 -1.680218
H -2.886096 0.892263 2.286957
H -4.824701 0.553573 0.722576
H 4.826785 2.904154 0.425948


