%chk=000277774.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277774

0 1
S -1.736607 2.454829 -0.185272
O 0.479906 3.935176 -0.255260
N -0.124556 0.381172 -0.018104
C -2.518528 -0.231571 -0.005898
C -1.381977 0.683501 -0.048588
C 0.755690 1.503426 -0.090457
C 2.843631 0.135105 0.015638
C 2.097059 1.403718 -0.072586
C 0.053961 2.828149 -0.185951
C -2.428714 -1.475752 -0.656049
C -3.694202 0.121230 0.678272
C 3.185780 -0.387773 1.271557
C 3.231808 -0.528476 -1.157794
C -3.515126 -2.352826 -0.629673
C -4.773788 -0.764759 0.700438
C -4.687413 -1.998285 0.045839
C 3.923129 -1.572455 1.348490
C 3.969072 -1.712395 -1.069706
C 4.317074 -2.233819 0.180668
H 2.720320 2.308408 -0.126187
H -1.507282 -1.752393 -1.172964
H -3.769063 1.076855 1.199761
H 2.869074 0.120713 2.180537
H 2.952462 -0.127996 -2.130603
H -3.446249 -3.315699 -1.134616
H -5.685877 -0.492599 1.230508
H -5.533780 -2.684280 0.064273
H 4.187776 -1.982412 2.322228
H 4.270379 -2.230847 -1.978830
H 4.891141 -3.156445 0.245025


%chk=000277774-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277774

0 1
S -1.825286 2.557483 -0.308861
O 0.632596 3.810911 -0.764982
N -0.270050 0.344886 -0.076781
C -2.659629 -0.154745 0.244385
C -1.528777 0.742269 -0.022401
C 0.651914 1.366253 -0.344570
C 2.857830 0.039404 -0.331789
C 2.026105 1.227288 -0.455726
C 0.056441 2.734799 -0.523181
C -2.411392 -1.540418 0.469120
C -3.998798 0.322451 0.283827
C 2.340306 -1.265010 -0.053918
C 4.270205 0.192137 -0.498772
C -3.478261 -2.420878 0.726445
C -5.064409 -0.563643 0.541719
C -4.809544 -1.937191 0.763769
C 3.211055 -2.365366 0.050652
C 5.135536 -0.912880 -0.393062
C 4.608462 -2.197605 -0.117528
H 2.552630 2.168658 -0.670545
H -1.377929 -1.897934 0.436292
H -4.204028 1.385447 0.112236
H 1.260747 -1.380378 0.072932
H 4.678171 1.187849 -0.712318
H -3.278059 -3.484010 0.898394
H -6.091608 -0.185039 0.569736
H -5.638871 -2.624459 0.964070
H 2.805496 -3.360618 0.263808
H 6.214600 -0.778446 -0.523699
H 5.279648 -3.059714 -0.034557


