%chk=000270027.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270027

0 1
S -0.935390 2.396014 -0.533202
O 1.679108 0.515011 2.529043
O 0.459316 2.723332 -0.703981
O -1.855724 2.439112 -1.634339
N -0.947127 0.765898 0.082336
N -0.312281 -1.168731 1.171657
C 0.071798 0.056257 0.816049
C -2.026354 -0.158041 -0.038193
C 1.424261 0.664654 1.135672
C -1.623642 -1.346693 0.660144
C 2.488726 0.029690 0.264479
C -3.269146 -0.066757 -0.676456
C -2.488342 -2.447898 0.740895
C -1.578479 3.288426 0.808373
C -4.106653 -1.172420 -0.581723
C -3.726173 -2.340691 0.118625
C 2.990668 0.760324 -0.821650
C 2.966820 -1.260246 0.527330
C 3.984518 0.204349 -1.631115
C 3.964043 -1.809464 -0.283543
C 4.475336 -1.077385 -1.360187
H 1.430118 1.783951 1.021403
H -3.549001 0.820328 -1.247307
H -2.181663 -3.347262 1.271929
H -1.027175 3.142368 1.753291
H -1.570284 4.379298 0.645001
H -2.627338 3.044210 1.045711
H -5.083369 -1.146453 -1.065893
H -4.423863 -3.176669 0.160012
H 2.595124 1.758370 -1.039860
H 2.552097 -1.840384 1.351789
H 1.712284 -0.439838 2.784450
H 4.375314 0.771176 -2.474571
H 4.338614 -2.810682 -0.078292
H 5.252261 -1.506954 -1.990076


%chk=000270027-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270027

0 1
S -0.836183 2.382458 -0.689164
O 1.845597 0.224029 2.632753
O 0.678231 2.940787 -0.624779
O -1.654119 2.301680 -2.079923
N -0.833663 0.653239 0.080434
N -0.336376 -1.091167 1.442341
C 0.120320 0.065467 0.941262
C -1.970154 -0.198480 0.033220
C 1.513854 0.578568 1.243889
C -1.633602 -1.284047 0.906078
C 2.541077 0.028778 0.243018
C -3.196174 -0.135198 -0.660596
C -2.547990 -2.339000 1.113765
C -1.898344 3.306807 0.603745
C -4.099375 -1.197234 -0.434463
C -3.784282 -2.278553 0.438331
C 3.368884 0.920906 -0.478164
C 2.700397 -1.369309 0.067246
C 4.355862 0.422912 -1.358843
C 3.687565 -1.865863 -0.810384
C 4.519584 -0.971053 -1.525050
H 1.539089 1.679203 1.207801
H -3.423712 0.666101 -1.369201
H -2.291908 -3.170965 1.776651
H -1.333382 3.264059 1.544689
H -2.004595 4.330428 0.217607
H -2.854932 2.769127 0.654756
H -5.061826 -1.195918 -0.957260
H -4.515056 -3.082223 0.577177
H 3.233868 2.001582 -0.357448
H 2.048358 -2.064660 0.609215
H 1.467451 -0.681348 2.803144
H 4.992060 1.120326 -1.915117
H 3.807223 -2.947381 -0.941204
H 5.284653 -1.357857 -2.207726


