%chk=000195215.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195215

0 1
S 0.862369 0.379650 0.987176
O 1.618982 -1.840957 -2.667265
O 5.456966 -0.516117 0.152930
O 4.369524 1.435851 0.329172
O -2.124950 0.777119 -3.005666
N 2.332630 -0.091655 -1.171052
N -0.951328 -0.337549 -1.394127
N -3.404682 -0.769920 -0.054025
C 1.246726 0.840695 -0.732272
C 2.240996 -0.863633 1.183449
C 3.126840 -0.689380 -0.090131
C 0.310086 0.226962 -1.819508
C 1.439972 -0.841795 -2.052684
C 2.953070 -0.527951 2.475109
C 1.605975 -2.240994 1.208087
C 4.310329 0.248294 0.150098
C -2.139088 0.025129 -2.045910
C -3.422156 -0.627627 -1.541006
C -4.497549 -1.680253 0.429788
C -3.650946 0.541993 0.637419
C -5.698586 -0.807524 0.853897
C -5.150229 0.624281 0.995464
H 1.490490 1.915108 -0.824383
H 3.530880 -1.688885 -0.430162
H 0.168936 0.896595 -2.711586
H 2.316799 -0.704835 3.354581
H 3.855492 -1.141014 2.613145
H 3.261920 0.529227 2.531787
H 2.349658 -3.025879 1.409122
H 0.842358 -2.328876 1.995094
H 1.111410 -2.503219 0.262604
H -0.979844 -0.858899 -0.510408
H -4.285709 -0.039781 -1.931378
H -3.496861 -1.637488 -2.009559
H -4.080139 -2.227265 1.303268
H -4.776295 -2.440021 -0.321334
H -3.318247 1.403765 0.030839
H -3.023657 0.533045 1.555359
H -6.136220 -1.167314 1.799254
H -6.505427 -0.848886 0.103353
H -5.681500 1.319634 0.324058
H -5.292587 1.012177 2.017299
H 6.284187 0.023192 0.271805


%chk=000195215-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195215

0 1
S 0.854044 0.530055 1.027241
O 1.330732 -2.235267 -2.366951
O 5.462775 -0.515148 0.371978
O 4.320988 1.421654 -0.222992
O -2.148901 0.883717 -3.286866
N 2.206813 -0.313820 -1.148695
N -1.106998 -0.192768 -1.482034
N -3.388595 -0.707098 -0.196269
C 1.232998 0.757471 -0.831791
C 2.275643 -0.794819 1.264214
C 3.116334 -0.746938 -0.092487
C 0.237466 0.108547 -1.875488
C 1.279209 -1.078189 -1.920050
C 3.084196 -0.407731 2.517282
C 1.634638 -2.191573 1.416218
C 4.317750 0.193235 -0.008472
C -2.207488 0.214042 -2.213183
C -3.542408 -0.262155 -1.606705
C -4.385274 -1.725839 0.251935
C -3.561063 0.405601 0.795111
C -5.654582 -0.925212 0.684272
C -5.089603 0.459064 1.147762
H 1.572734 1.786892 -0.998990
H 3.479315 -1.764250 -0.317074
H 0.195006 0.671294 -2.826553
H 2.448965 -0.482984 3.416958
H 3.940603 -1.095807 2.644862
H 3.461642 0.626887 2.455115
H 2.413028 -2.942388 1.655459
H 0.895439 -2.188884 2.235463
H 1.119821 -2.511536 0.494143
H -1.336945 -0.700759 -0.611915
H -4.278332 0.557387 -1.752920
H -3.884861 -1.115713 -2.221521
H -3.961636 -2.260990 1.123190
H -4.573169 -2.466784 -0.542973
H -3.175597 1.351933 0.379775
H -2.966512 0.165986 1.695676
H -6.213944 -1.441206 1.483857
H -6.339631 -0.798741 -0.173240
H -5.594495 1.288396 0.622567
H -5.234845 0.619885 2.230257
H 6.235333 0.109554 0.445535


