%chk=000216793.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216793

0 1
S 3.675521 1.397994 -0.605544
N -0.856637 -0.364927 0.964754
N -3.577826 0.169016 0.029470
N 0.336590 -1.560658 -0.713523
N 2.532355 -0.916132 -1.529355
C -1.523030 0.955064 1.169661
C -1.892718 -1.443793 0.882595
C -2.543098 1.255889 0.052058
C -2.932107 -1.163291 -0.219823
C 0.244750 -0.441455 0.091896
C -4.604168 0.452547 -1.016965
C 1.327686 0.491978 0.097735
C 2.431864 0.178515 -0.740336
C 1.557093 1.714397 0.839195
C 1.458763 -1.755098 -1.465566
C 2.744845 2.305178 0.571491
H -0.776695 1.775154 1.246302
H -2.044366 0.904053 2.156052
H -2.385723 -1.488060 1.880886
H -1.408477 -2.431408 0.711039
H -3.059115 2.215140 0.274432
H -2.019358 1.385934 -0.919262
H -2.449401 -1.240680 -1.218994
H -3.725618 -1.940468 -0.182214
H -4.219764 0.501761 -2.046461
H -5.100642 1.408565 -0.784609
H -5.381095 -0.328605 -0.974943
H 0.817317 2.089007 1.542067
H 1.488278 -2.667383 -2.083611
H 3.146876 3.213166 0.988574


%chk=000216793-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216793

0 1
S 4.014389 1.325628 -0.246989
N -0.894732 -0.252868 0.439334
N -3.729980 0.173163 0.076811
N 0.617112 -1.637815 -0.706626
N 2.905099 -1.012338 -1.263690
C -1.491193 1.067591 0.725259
C -1.855351 -1.377405 0.538896
C -2.768410 1.278074 -0.121996
C -3.111963 -1.119197 -0.309975
C 0.389798 -0.453861 -0.037968
C -5.015964 0.415525 -0.605844
C 1.488370 0.474616 0.145983
C 2.693948 0.115397 -0.538050
C 1.652770 1.675413 0.947053
C 1.834612 -1.856731 -1.267995
C 2.908006 2.237999 0.843873
H -0.777827 1.864820 0.472618
H -1.754430 1.138962 1.799925
H -2.157575 -1.478734 1.600556
H -1.343431 -2.291438 0.204596
H -3.243679 2.227787 0.187952
H -2.470505 1.379308 -1.198714
H -2.834690 -1.138155 -1.394600
H -3.841709 -1.930244 -0.129891
H -4.918860 0.496569 -1.717894
H -5.465289 1.352889 -0.231532
H -5.714201 -0.410724 -0.382889
H 0.895213 2.088996 1.614130
H 1.965649 -2.809048 -1.790260
H 3.286923 3.127220 1.344930


