%chk=000285662.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285662

0 1
S 3.003418 -1.286445 1.264099
O 0.176918 1.649633 -1.472732
O 2.053098 0.052470 0.783676
O 1.906887 4.141697 -0.875579
O -2.720228 -0.276964 -2.628334
O 4.267392 -1.103005 0.608091
O 2.192351 -2.435205 0.978620
O -4.631112 -0.603923 1.510877
N -1.315188 -0.060725 -0.800717
N -3.682182 -0.445609 -0.539021
C 2.036144 0.379476 -0.614201
C 1.091669 -0.556016 -1.384233
C 1.385899 1.783751 -0.674344
C -0.161724 0.273009 -1.693286
C 2.235022 2.847996 -1.383838
C -1.182227 -0.041623 0.600978
C -2.596417 -0.254426 -1.418206
C -2.242024 -0.230749 1.428045
C -3.597454 -0.440027 0.900102
C 3.076512 -0.942924 2.954105
C -2.096335 -0.246523 2.911707
H 3.080712 0.354004 -0.997283
H 1.556287 -0.919922 -2.320550
H 0.865683 -1.481860 -0.806924
H 1.065224 2.132432 0.334733
H -0.512067 0.233399 -2.758445
H 2.081292 2.821252 -2.479141
H 3.312746 2.753386 -1.145438
H -0.161214 0.123054 0.983543
H 0.989663 4.384212 -1.139806
H -4.607874 -0.592641 -0.968843
H 2.556214 -0.007383 3.232483
H 2.619051 -1.724469 3.585644
H 4.105458 -0.816235 3.334929
H -3.082043 -0.243889 3.410900
H -1.549314 0.630075 3.281417
H -1.573337 -1.151082 3.252773


%chk=000285662-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285662

0 1
S 2.841166 -1.384313 1.466728
O 0.211199 1.970626 -0.859141
O 1.999875 0.250926 0.983099
O 1.768531 4.039561 -2.000392
O -2.683920 0.282672 -2.632827
O 4.185314 -1.518819 0.571198
O 1.742426 -2.570798 1.480787
O -4.743647 -0.983756 1.365366
N -1.358872 0.166606 -0.677250
N -3.659328 -0.348381 -0.600993
C 2.110910 0.534225 -0.467510
C 1.085078 -0.257250 -1.314484
C 1.678676 2.004938 -0.627309
C -0.178993 0.644077 -1.413936
C 2.351787 2.716513 -1.821097
C -1.286863 -0.077188 0.700392
C -2.580127 0.054264 -1.395709
C -2.363352 -0.470732 1.456732
C -3.669396 -0.631263 0.798461
C 3.243730 -0.836394 3.237452
C -2.278722 -0.749339 2.936602
H 3.155345 0.354773 -0.785923
H 1.494748 -0.430195 -2.324433
H 0.858677 -1.241529 -0.873491
H 1.832822 2.590693 0.294327
H -0.524237 0.775239 -2.452250
H 2.249689 2.101096 -2.742541
H 3.423528 2.882704 -1.618466
H -0.297068 0.073853 1.139331
H 0.780549 3.929398 -2.002133
H -4.554199 -0.447254 -1.091332
H 2.283041 -0.559962 3.691318
H 3.708417 -1.704627 3.724952
H 3.926025 0.017323 3.140778
H -2.982876 -0.108301 3.497081
H -1.257832 -0.577021 3.318137
H -2.565197 -1.794162 3.154277


