%chk=000210409.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210409

1 1
S -1.908249 1.270104 -0.637512
N -1.788518 -1.151524 0.143868
N 4.659606 0.256447 0.040331
C -3.188988 -0.856221 0.017447
C -0.965556 -0.109662 -0.158229
C -3.410963 0.416310 -0.430808
C 0.458839 -0.046311 -0.106151
C -4.690598 1.108241 -0.712898
C -1.310504 -2.488117 0.547322
C -4.197143 -1.884625 0.349381
C 1.184755 0.567813 -1.164495
C 1.189652 -0.537515 1.008692
C 3.298493 0.163274 -0.004523
C 2.554141 0.664419 -1.126619
C 2.559569 -0.441523 1.069691
C -5.236095 1.815098 0.526369
C 5.463085 0.880278 -1.034400
C 5.438425 -0.249386 1.193759
H -4.575865 1.841032 -1.544485
H -5.444383 0.377850 -1.091853
H -0.253211 -2.644293 0.249424
H -1.389733 -2.627266 1.642491
H -1.902163 -3.285320 0.055165
H -4.050999 -2.319907 1.351918
H -5.220000 -1.463176 0.349662
H -4.206938 -2.714630 -0.378000
H 0.644555 0.952972 -2.034437
H 0.646802 -0.978028 1.848742
H 3.089843 1.127991 -1.957643
H 3.083323 -0.816918 1.946707
H -5.389920 1.123349 1.363588
H -6.207628 2.284428 0.313670
H -4.569453 2.612059 0.879023
H 4.838010 1.222887 -1.880564
H 6.197957 0.158475 -1.437951
H 6.011160 1.760863 -0.649357
H 6.521071 -0.081621 1.050421
H 5.292233 -1.337361 1.327208
H 5.150190 0.267114 2.128444


%chk=000210409-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210409

1 1
S -1.968710 1.239223 -0.641827
N -1.821175 -1.210516 0.228204
N 4.704116 0.275147 0.046492
C -3.224850 -0.955087 0.115751
C -0.990770 -0.168729 -0.109617
C -3.507437 0.306629 -0.363531
C 0.450372 -0.108341 -0.063799
C -4.825286 0.971207 -0.654132
C -1.322660 -2.566528 0.565830
C -4.216300 -2.022974 0.490437
C 1.153209 0.734892 -0.987851
C 1.238327 -0.794875 0.919635
C 3.331335 0.157551 0.016403
C 2.539893 0.862119 -0.960302
C 2.626378 -0.666793 0.963886
C -5.095926 2.233259 0.208482
C 5.401353 1.156105 -0.913887
C 5.499009 -0.471626 1.043294
H -4.869163 1.245877 -1.726306
H -5.634434 0.235913 -0.496329
H -0.331624 -2.713215 0.112611
H -1.252282 -2.704754 1.658053
H -2.013180 -3.316980 0.155111
H -4.008219 -2.440704 1.491567
H -5.233098 -1.603918 0.514551
H -4.224271 -2.858433 -0.234203
H 0.593144 1.271198 -1.763179
H 0.753907 -1.385834 1.702543
H 3.022589 1.499433 -1.704438
H 3.173613 -1.186943 1.753305
H -5.089676 1.990935 1.285172
H -6.083085 2.655754 -0.044696
H -4.338789 3.017724 0.029242
H 5.238653 0.825007 -1.957076
H 6.481963 1.128851 -0.713994
H 5.063514 2.204971 -0.817774
H 6.568193 -0.280009 0.874020
H 5.331009 -1.561371 0.955907
H 5.255159 -0.156566 2.075841


