%chk=000210644.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210644

0 1
S 3.399910 -0.597143 0.262022
O 0.462509 3.316278 1.023199
N 0.788400 -0.664314 0.120686
N 1.779638 1.568562 0.203246
C -0.645712 -0.188130 0.198404
C -1.415793 -1.031534 1.248378
C -1.265367 -0.334943 -1.213701
C -0.669104 1.289651 0.672153
C -2.920418 -0.738911 1.220447
C -2.773585 -0.065906 -1.213401
C 0.445227 2.201661 0.117384
C -3.504253 -0.937066 -0.184103
C 1.856900 0.283484 0.211060
C 1.252644 -2.000525 -0.069868
C 0.183862 2.726065 -1.294405
C 2.601088 -2.127940 0.005824
C 0.315879 -3.111014 -0.378305
H -1.005864 -0.837426 2.258670
H -1.258914 -2.116808 1.076903
H -1.069337 -1.353239 -1.608941
H -0.755803 0.365415 -1.912683
H -1.658159 1.731229 0.439080
H -0.600083 1.337029 1.782221
H -3.116095 0.294185 1.568818
H -3.438157 -1.400011 1.941952
H -3.183444 -0.250481 -2.224793
H -2.964652 1.005589 -1.001118
H -3.434846 -2.002632 -0.474681
H -4.583387 -0.692486 -0.181608
H -0.113970 1.917273 -1.976555
H -0.609190 3.483187 -1.279979
H 1.079920 3.203136 -1.713675
H 3.181198 -3.027192 -0.089788
H 1.371723 3.682946 1.111700
H -0.378088 -3.309007 0.460486
H 0.850815 -4.048370 -0.589608
H -0.305093 -2.876114 -1.263021


%chk=000210644-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210644

0 1
S 3.462432 -0.535952 -0.260479
O 0.638100 3.205561 1.181947
N 0.815343 -0.727839 0.122768
N 1.708756 1.559486 -0.156204
C -0.628061 -0.245610 0.161905
C -1.506952 -1.089730 1.136418
C -1.218632 -0.360453 -1.278191
C -0.604810 1.207679 0.736024
C -2.996959 -0.660070 1.095554
C -2.709893 0.046756 -1.350794
C 0.408337 2.193099 0.114692
C -3.564134 -0.758146 -0.341565
C 1.816441 0.264274 -0.075334
C 1.298973 -2.070408 0.009926
C -0.077572 2.950659 -1.137131
C 2.652822 -2.148141 -0.180004
C 0.455584 -3.321787 0.089409
H -1.100969 -1.009235 2.162591
H -1.479211 -2.152350 0.852005
H -1.124218 -1.416443 -1.602092
H -0.613402 0.233875 -1.985332
H -1.613068 1.645442 0.683724
H -0.335571 1.139084 1.806133
H -3.122087 0.369073 1.480608
H -3.573982 -1.317921 1.773764
H -3.082263 -0.121299 -2.379699
H -2.818787 1.131092 -1.154231
H -3.578384 -1.824078 -0.651595
H -4.613005 -0.405823 -0.362555
H -0.361251 2.272352 -1.959706
H -0.945171 3.579925 -0.871399
H 0.734881 3.603795 -1.499526
H 3.241005 -3.055858 -0.282713
H 1.575239 3.512341 1.058627
H 0.053270 -3.498757 1.102758
H 1.096577 -4.182488 -0.164976
H -0.388980 -3.317606 -0.622927


