%chk=000182947.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182947

0 1
S 1.121140 -0.410247 0.341998
O 5.345950 -1.816904 -0.053343
N 3.621704 -0.765985 1.215867
N -1.218635 1.066642 -0.017584
N 0.629112 2.313224 0.120092
N -1.557626 2.403499 -0.117259
N -0.463225 3.100458 -0.034685
C 2.826682 0.267265 0.527577
C 3.697811 0.026053 -0.725274
C 4.447726 -1.046363 0.093250
C 0.183430 1.021928 0.136294
C -2.187070 -0.003835 -0.063863
C -1.905229 -1.160760 -0.806882
C -3.397112 0.146651 0.633072
C -2.849960 -2.189884 -0.827144
C -4.328655 -0.893236 0.592604
C -4.055897 -2.059928 -0.129777
H 2.818891 1.282627 0.973080
H 4.319626 0.877635 -1.038618
H 3.191704 -0.349781 -1.625101
H 3.563288 -1.104741 2.155319
H -0.976635 -1.259959 -1.370305
H -3.608621 1.063245 1.188208
H -2.644086 -3.097652 -1.395940
H -5.273358 -0.790944 1.128566
H -4.786856 -2.868408 -0.152752


%chk=000182947-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182947

0 1
S 1.152542 -0.753754 0.247193
O 5.791620 -1.235910 -0.376104
N 3.844331 -0.934928 1.053018
N -1.152160 0.882063 -0.066675
N 0.779411 2.008136 0.029672
N -1.465755 2.275523 -0.149542
N -0.293647 2.916446 -0.085091
C 2.866216 0.071224 0.647492
C 3.758380 0.390561 -0.596212
C 4.709038 -0.723845 -0.052978
C 0.219498 0.763284 0.043586
C -2.209342 -0.087879 -0.078884
C -1.994348 -1.379769 -0.614377
C -3.473906 0.283542 0.438105
C -3.052187 -2.314513 -0.604779
C -4.523372 -0.657313 0.430273
C -4.316871 -1.959479 -0.083559
H 2.645259 0.891477 1.343557
H 4.197231 1.399988 -0.590648
H 3.302936 0.182590 -1.574984
H 3.903204 -1.531368 1.881553
H -1.029273 -1.652969 -1.053257
H -3.619513 1.293568 0.829961
H -2.888027 -3.315343 -1.017405
H -5.502444 -0.373303 0.829843
H -5.134722 -2.687429 -0.082355


