%chk=000266412.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266412

0 1
S -1.473774 -0.996065 -1.288162
N 0.800851 0.408095 0.221413
N 3.607899 -0.267038 0.180444
C 1.576307 0.438629 -1.066133
C 1.693191 0.772942 1.370704
C 2.722751 -0.587915 -0.982478
C 2.827734 -0.269463 1.456613
C -0.432333 1.157696 0.151634
C -1.546146 0.558876 -0.470227
C -0.590896 2.428826 0.741043
C -2.780104 1.212415 -0.507571
C -1.826796 3.075174 0.702335
C -0.944972 -2.170703 0.009693
C -2.923057 2.474433 0.075492
C -1.144212 -3.564264 -0.570812
C -0.719480 -4.639622 0.429797
H 1.989541 1.450357 -1.273075
H 0.899751 0.175126 -1.908781
H 1.095074 0.752366 2.306166
H 2.133541 1.789678 1.268799
H 2.297793 -1.614716 -0.936995
H 3.340039 -0.524335 -1.904998
H 3.521425 0.008889 2.279233
H 2.399111 -1.265203 1.703787
H 4.355891 -0.967444 0.239802
H 0.252710 2.923035 1.217691
H -3.638588 0.737158 -0.987813
H -1.935251 4.058286 1.159820
H -1.543257 -2.014054 0.923919
H 0.111928 -1.976324 0.278189
H -3.883333 2.983684 0.044689
H -2.207099 -3.720111 -0.851897
H -0.563849 -3.682583 -1.509373
H -1.305125 -4.584177 1.354766
H -0.861812 -5.642949 0.012207
H 0.337149 -4.544099 0.703279


%chk=000266412-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266412

0 1
S -1.570243 -0.941037 -1.465201
N 0.810371 0.498851 0.178316
N 3.502637 -0.479223 0.093820
C 1.516232 0.311783 -1.123094
C 1.759956 0.800787 1.275742
C 2.567685 -0.804081 -1.005517
C 2.801097 -0.330926 1.384831
C -0.442550 1.182234 0.161624
C -1.579743 0.666834 -0.549894
C -0.620624 2.392547 0.896406
C -2.796025 1.387071 -0.560500
C -1.846000 3.089932 0.894393
C -1.194307 -2.143758 -0.028708
C -2.939821 2.601906 0.146906
C -0.783063 -3.513066 -0.592777
C -0.534212 -4.536693 0.539217
H 2.027146 1.259102 -1.409750
H 0.779450 0.047866 -1.896972
H 1.200933 0.877695 2.225315
H 2.301134 1.760714 1.102041
H 2.032285 -1.773461 -0.845529
H 3.132217 -0.873318 -1.953160
H 3.535082 -0.073312 2.170480
H 2.266165 -1.263613 1.697317
H 4.303355 -1.120920 0.144736
H 0.226913 2.810175 1.448564
H -3.645117 0.962123 -1.106203
H -1.937453 4.022259 1.463488
H -2.107188 -2.212418 0.587072
H -0.380840 -1.681044 0.555017
H -3.893886 3.138873 0.129670
H -1.571570 -3.894447 -1.271107
H 0.133473 -3.395680 -1.203534
H -1.448085 -4.694351 1.141659
H -0.227244 -5.515029 0.126688
H 0.264443 -4.189774 1.221847


