%chk=000218160.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218160

0 1
S 1.491764 -0.989470 0.923418
S 2.991180 -0.164885 -0.216346
O -4.789582 -2.075134 -0.345118
O 2.297080 -0.367451 -1.722003
O 3.010991 1.243866 0.028357
O 4.146669 -0.994557 -0.222541
N -1.486356 0.515913 0.603897
N 0.186338 2.164035 -0.063935
C -3.793771 0.138956 -0.096979
C -2.529804 0.983969 -0.323077
C -3.569670 -1.328729 -0.471441
C -0.296107 1.031300 0.646304
C 0.663182 0.452324 1.656650
H -4.632567 0.564946 -0.677142
H -4.100193 0.195493 0.969481
H -2.202684 0.902027 -1.384562
H -2.771649 2.057951 -0.143559
H -3.179769 -1.448405 -1.496162
H -2.894672 -1.836946 0.246231
H 1.385888 1.203943 2.040054
H 0.109343 0.069973 2.550620
H -0.222886 2.344609 -0.969740
H 1.194393 2.327484 -0.065798
H -5.477193 -1.718643 -0.936026
H 2.829676 -0.823570 -2.399182


%chk=000218160-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218160

0 1
S 1.598834 -1.279779 0.537001
S 3.529820 0.116358 -0.106319
O -5.351848 -1.849111 0.062553
O 3.533451 -0.370075 -1.894104
O 3.015312 1.659970 0.008445
O 4.991789 -0.229685 0.489620
N -1.631335 0.291753 0.545123
N 0.111221 1.704032 -0.383926
C -4.039860 0.282709 -0.015321
C -2.663323 0.904214 -0.323521
C -4.071237 -1.227703 -0.311061
C -0.389782 0.729832 0.463309
C 0.624566 0.098560 1.387409
H -4.815623 0.803015 -0.615818
H -4.279589 0.439202 1.052319
H -2.414687 0.736651 -1.400051
H -2.714930 2.007697 -0.175850
H -3.838571 -1.413744 -1.383795
H -3.316366 -1.740903 0.303822
H 1.347959 0.830828 1.788630
H 0.101798 -0.399830 2.221576
H -0.487310 2.149585 -1.076814
H 1.117656 1.920297 -0.378880
H -6.080833 -1.414292 -0.448449
H 4.482490 -0.300581 -2.214495


