%chk=000299243.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299243

0 1
S 1.574850 -2.940482 -0.567894
O 0.523026 -0.602246 0.057576
O -5.194480 2.476762 0.557150
O -6.025766 1.721737 -1.293235
O 6.377635 1.703066 0.009231
O 5.947429 1.766616 2.129028
N -0.984321 -2.105367 -0.754173
N -5.192155 1.724835 -0.402803
N 5.656361 1.508159 0.973058
C -2.035715 -1.121947 -0.663111
C -2.084118 -0.232547 0.427402
C -3.017892 -1.074424 -1.673722
C -4.094827 0.738601 -0.494132
C -3.114246 0.700103 0.510274
C -4.048039 -0.142698 -1.586759
C -1.340636 -3.469199 -1.238852
C 0.330643 -1.875434 -0.430116
C 1.861780 -0.181549 0.253946
C 2.699393 0.044616 -0.843477
C 2.209240 0.118672 1.575809
C 4.324728 0.915970 0.721113
C 3.953853 0.600212 -0.598380
C 3.464721 0.678504 1.807339
H -1.314878 -0.264490 1.205354
H -2.969476 -1.745387 -2.532525
H -3.170061 1.401498 1.352620
H -4.820692 -0.085539 -2.364099
H -1.006189 -3.613710 -2.282884
H -2.428208 -3.636481 -1.175968
H -0.849659 -4.248099 -0.618695
H 2.385999 -0.217068 -1.855038
H 1.519129 -0.088301 2.393153
H 4.653410 0.793521 -1.421359
H 3.789160 0.930597 2.824671


%chk=000299243-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299243

0 1
S 1.501928 -3.294971 -0.543417
O 0.549325 -0.784431 0.097228
O -5.213681 2.381345 0.857688
O -5.823997 2.007288 -1.310317
O 6.447605 1.673610 -0.105167
O 5.804529 2.265211 2.002927
N -1.010694 -2.220113 -0.765261
N -5.083786 1.777573 -0.276705
N 5.594805 1.692470 0.864440
C -2.002159 -1.178771 -0.631090
C -2.199610 -0.503410 0.601748
C -2.832973 -0.878328 -1.743010
C -4.018277 0.755313 -0.400113
C -3.207389 0.468299 0.720339
C -3.845154 0.091428 -1.633319
C -1.432313 -3.515108 -1.360505
C 0.321024 -2.081762 -0.411887
C 1.854881 -0.254800 0.266943
C 2.800230 -0.250952 -0.783588
C 2.111787 0.374615 1.503353
C 4.292183 1.015263 0.656985
C 4.035686 0.391023 -0.584504
C 3.345896 1.020291 1.704855
H -1.569876 -0.747599 1.459663
H -2.671392 -1.388929 -2.697442
H -3.385424 0.996066 1.660705
H -4.489425 0.347771 -2.478058
H -0.983998 -3.657550 -2.359585
H -2.529953 -3.531605 -1.428324
H -1.087652 -4.341208 -0.716943
H 2.574048 -0.740107 -1.733574
H 1.350193 0.352566 2.287299
H 4.796798 0.419836 -1.368026
H 3.586834 1.518178 2.647167


