%chk=000232039.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232039

0 1
S -0.699498 -2.088230 -0.645288
O -0.813465 -3.460510 -0.198036
O -0.940677 -1.722644 -2.016777
O 4.228566 1.811831 -0.442439
O 2.416503 2.069508 -1.598761
N -1.769946 -1.245973 0.392677
N 3.125726 1.455240 -0.821791
C 0.864526 -1.485054 -0.179364
C -2.070654 0.146620 0.309464
C -2.510522 0.834958 1.472247
C 1.340905 -0.279464 -0.691709
C 1.646134 -2.236226 0.706847
C -1.918350 0.837687 -0.904248
C 2.608928 0.173637 -0.293129
C -2.759297 2.209109 1.383851
C -2.711906 0.123727 2.771447
C 2.910588 -1.779238 1.096534
C 3.399122 -0.570576 0.600806
C -2.163740 2.211430 -0.958894
C -2.579077 2.900417 0.181678
H -2.314083 -1.774525 1.086821
H 0.749005 0.320802 -1.402421
H 1.269654 -3.194459 1.093524
H -1.651527 0.310098 -1.826607
H -3.096356 2.751897 2.267053
H -3.539098 -0.597989 2.710939
H -1.807737 -0.418164 3.082321
H -2.960094 0.814976 3.589106
H 3.515782 -2.370067 1.786415
H 4.387148 -0.193618 0.894837
H -2.035189 2.741910 -1.902762
H -2.768570 3.970688 0.136556


%chk=000232039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232039

0 1
S -0.816274 -2.207277 -0.863464
O -0.882257 -3.754222 -0.365822
O -0.839208 -1.762717 -2.421101
O 4.072502 1.990314 -0.115606
O 2.404608 2.057067 -1.671753
N -2.365242 -1.347304 -0.023093
N 3.006393 1.518900 -0.668121
C 0.760398 -1.439210 -0.114306
C -2.297251 0.069943 0.081579
C -2.146781 0.732506 1.345643
C 1.264696 -0.266838 -0.692268
C 1.356282 -2.096250 0.976349
C -2.423496 0.822041 -1.120727
C 2.430946 0.265490 -0.102604
C -2.158592 2.146980 1.356801
C -2.004684 -0.055219 2.636257
C 2.533125 -1.537258 1.527656
C 3.073499 -0.346907 0.995292
C -2.393010 2.228577 -1.081111
C -2.268275 2.894910 0.161665
H -2.436775 -1.854256 0.878256
H 0.801245 0.205551 -1.563314
H 0.927727 -3.031161 1.353842
H -2.551573 0.281739 -2.063742
H -2.065496 2.670491 2.315750
H -2.911617 -0.648575 2.865424
H -1.148764 -0.757948 2.600890
H -1.837941 0.622334 3.489646
H 3.029308 -2.033377 2.367167
H 3.979557 0.107864 1.404248
H -2.482217 2.802257 -2.009279
H -2.258034 3.989350 0.200742


