%chk=000210993.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210993

0 1
S 2.193795 0.498095 1.059506
O -0.561797 -2.392808 -0.028169
O -4.378560 0.123508 0.114800
N 3.425309 0.172777 -1.227711
N 4.899380 0.778423 0.597702
C -0.212909 0.084514 -0.246012
C -0.981919 -1.093261 -0.087512
C 1.223735 0.131782 -0.373065
C -0.902233 1.316761 -0.281661
C -2.384151 -1.039131 0.030407
C -3.014704 0.207334 -0.011127
C -2.283881 1.401549 -0.167986
C 2.041970 0.025972 -1.460138
C 3.673509 0.443149 0.050152
C 0.841815 -2.733300 -0.109823
C -5.143021 1.354569 0.084230
H -0.320949 2.235178 -0.406208
H -2.959876 -1.954860 0.151212
H -2.775573 2.365860 -0.201008
H 1.731754 -0.168374 -2.484582
H 1.395325 -2.278361 0.715754
H 1.246036 -2.449588 -1.085125
H 0.803904 -3.825930 -0.002846
H -6.169081 0.981835 0.203533
H -5.017128 1.855617 -0.879753
H -4.859532 1.998411 0.921603
H 5.057037 0.546203 1.568615
H 5.712646 0.631877 0.006215


%chk=000210993-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210993

0 1
S 2.308337 0.402114 1.183095
O -0.558074 -2.453543 -0.024202
O -4.481865 0.123925 0.057076
N 3.444485 0.276211 -1.249447
N 5.027740 0.606375 0.515966
C -0.227559 0.069225 -0.202684
C -1.009806 -1.129490 -0.079673
C 1.245998 0.132547 -0.313072
C -0.938612 1.303302 -0.220291
C -2.421009 -1.052894 -0.001833
C -3.083646 0.188713 -0.030029
C -2.339296 1.393327 -0.139662
C 2.062789 0.123758 -1.428663
C 3.750481 0.432039 0.032354
C 0.863361 -2.822669 -0.064950
C -5.220810 1.388464 0.032206
H -0.346961 2.221258 -0.309000
H -2.997388 -1.977165 0.084049
H -2.825544 2.371891 -0.166001
H 1.682668 0.001853 -2.444504
H 1.434394 -2.342944 0.748679
H 1.320005 -2.566823 -1.035793
H 0.858561 -3.915139 0.074023
H -6.279810 1.102580 0.113324
H -5.053873 1.934642 -0.916523
H -4.942861 2.035142 0.887115
H 5.216774 0.736977 1.504816
H 5.792423 0.634125 -0.155373


