%chk=000281312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281312

0 1
S 2.056736 -0.275140 1.009913
O -3.218574 1.464123 -0.401605
N -0.188411 -2.080644 -0.018917
N 0.151550 1.521661 0.627297
N -1.784033 -0.376323 -0.241672
N -1.082191 1.896364 0.303959
N -1.086648 -3.090564 -0.442010
C 0.460952 0.238161 0.526599
C -0.520418 -0.755449 0.083224
C 3.131354 0.469571 -0.271057
C 4.536650 0.019490 0.060083
C -2.152336 0.961941 -0.153407
H 2.815973 0.137264 -1.276573
H 3.033638 1.572236 -0.240582
H 4.860101 0.352649 1.057324
H 4.649665 -1.073207 0.026992
H 5.257779 0.434770 -0.659658
H 0.748357 -2.436103 0.209758
H -1.285466 2.903967 0.389093
H -1.465475 -2.858298 -1.375490
H -1.909905 -3.114866 0.183229


%chk=000281312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281312

0 1
S 2.188945 -0.824152 0.211427
O -3.168828 1.574850 -0.345937
N -0.519578 -2.291179 0.039368
N 0.425959 1.253046 -0.067049
N -1.892610 -0.410960 -0.148322
N -0.852412 1.744230 -0.197668
N -1.624455 -3.178469 -0.072094
C 0.540814 -0.068379 0.022306
C -0.657528 -0.922226 -0.024673
C 3.297739 0.713403 0.032804
C 4.763436 0.271272 0.114721
C -2.067163 0.977916 -0.235181
H 3.044985 1.176900 -0.933737
H 3.015703 1.404616 0.841925
H 4.992689 -0.205633 1.083708
H 5.022996 -0.435186 -0.693003
H 5.415131 1.158079 0.012017
H 0.402796 -2.728930 0.002538
H -0.925843 2.761412 -0.266910
H -2.263333 -2.833473 -0.805628
H -2.130146 -3.225532 0.825889


