%chk=000207578.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207578

0 1
S 2.684012 0.310464 -1.116836
O 0.345228 -0.236630 -0.057023
O -4.991041 0.076194 -0.450712
O -1.082216 1.707853 1.241338
N -0.999300 -0.455650 0.319485
N -3.037383 0.889148 0.371631
C -1.596912 -1.224127 -0.819945
C -3.090113 -1.414542 -0.562824
C -3.816628 -0.129778 -0.246186
C -1.638500 0.812124 0.648296
C 1.211876 -0.263369 1.144410
C 2.548071 -0.277382 0.521932
C 3.757150 -0.697485 0.986264
C 4.813815 -0.542929 0.010937
C 4.392834 -0.021750 -1.173427
H -1.070672 -2.207611 -0.861055
H -1.412115 -0.725585 -1.799072
H -3.253692 -2.121470 0.285506
H -3.571391 -1.902316 -1.440241
H 0.988907 -1.161090 1.748326
H 1.003673 0.658282 1.729937
H -3.519123 1.753824 0.662887
H 3.944191 -1.103642 1.969880
H 5.832991 -0.827365 0.236905
H 4.969738 0.187632 -2.057014


%chk=000207578-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207578

0 1
S 3.339063 1.320218 -0.396031
O 0.360118 -0.263084 -0.384614
O -5.168291 -0.089089 -0.027767
O -1.032086 2.010745 0.448752
N -1.051667 -0.304814 -0.015664
N -3.076524 0.912630 0.133176
C -1.764530 -1.385351 -0.730075
C -3.173933 -1.537245 -0.127777
C -3.915475 -0.205678 -0.021871
C -1.650241 0.946239 0.185730
C 1.211736 -0.135734 0.866833
C 2.631795 -0.129622 0.423709
C 3.581547 -1.137777 0.542741
C 4.873579 -0.792732 0.005922
C 4.914588 0.484001 -0.534682
H -1.182836 -2.311643 -0.600305
H -1.816913 -1.161444 -1.815379
H -3.110180 -1.964840 0.891427
H -3.785931 -2.221859 -0.736646
H 1.008908 -1.004198 1.520710
H 0.908225 0.800247 1.367227
H -3.528174 1.821111 0.284209
H 3.357962 -2.102513 1.006544
H 5.735806 -1.463242 0.019265
H 5.746854 0.998475 -1.012034


