%chk=000245222.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245222

0 1
S -3.454487 -0.262639 1.451466
S 3.732980 -1.549993 0.390810
N -1.062985 -0.178815 0.273690
N 0.472512 -1.895385 0.309002
N 0.548518 1.748817 0.299558
N 2.876439 0.998488 0.361689
C -2.342737 0.528396 0.216207
C -3.045493 0.394110 -1.139150
C -4.559178 0.275610 -0.913886
C -4.819887 -0.614098 0.294593
C 0.202677 0.421053 0.298415
C -0.830647 -1.594513 0.278690
C 1.156037 -0.669463 0.322875
C 2.520341 -0.303932 0.356793
C 1.885709 1.963029 0.333768
C 5.295301 -0.656728 0.431798
H -2.179718 1.604046 0.501029
H -2.672123 -0.489531 -1.696940
H -2.810532 1.264889 -1.783213
H -5.000769 1.281538 -0.756478
H -5.053562 -0.129968 -1.818369
H -5.781049 -0.388868 0.790076
H -4.824041 -1.687635 0.035756
H -1.649333 -2.305100 0.276476
H 2.231431 3.009822 0.339434
H 5.374479 -0.009730 1.316472
H 5.424290 -0.014655 -0.450357
H 6.106627 -1.394645 0.457097


%chk=000245222-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245222

0 1
S -3.505708 -0.252339 1.541780
S 3.865846 -1.591041 0.359978
N -1.023169 -0.318071 0.214144
N 0.541573 -2.004833 0.234875
N 0.493723 1.639906 0.316815
N 2.852382 0.974480 0.389795
C -2.310330 0.379170 0.170048
C -3.066175 0.203361 -1.169030
C -4.563959 0.447819 -0.898782
C -4.949712 -0.425097 0.313013
C 0.227461 0.306987 0.278936
C -0.767660 -1.700729 0.196553
C 1.186502 -0.754817 0.285606
C 2.547985 -0.355240 0.344715
C 1.833285 1.892348 0.374841
C 5.369640 -0.463135 0.458820
H -2.094133 1.439280 0.379417
H -2.914748 -0.828365 -1.539593
H -2.659500 0.896660 -1.926784
H -4.737092 1.513726 -0.659291
H -5.180285 0.194636 -1.780877
H -5.862268 -0.073927 0.818274
H -5.059055 -1.487453 0.039043
H -1.573566 -2.430024 0.189500
H 2.132895 2.943233 0.413499
H 5.319072 0.143303 1.373385
H 5.400300 0.194680 -0.420382
H 6.237496 -1.140417 0.479005


