%chk=000286522.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286522

0 1
S -4.154351 2.063273 -1.562113
S 4.141731 2.177265 1.734860
O -1.087842 -1.289189 -0.211232
O 1.175609 -1.241560 0.421973
O -1.253782 -0.032589 1.680022
O 1.242648 -0.128345 -1.562517
O -5.208824 -1.299971 0.369210
O 5.308710 -1.108940 -0.456487
N -3.933967 0.539912 0.814003
N 3.887722 0.625666 -0.910606
C -2.505889 1.369972 -1.079659
C 2.572466 1.487499 1.052282
C -2.903174 0.177772 -0.166622
C 2.958060 0.266769 0.172604
C 0.043296 -2.117973 0.154660
C -1.731776 2.454988 -0.354087
C -1.781996 0.875436 -2.314867
C 1.800373 1.036055 2.278964
C 1.846760 2.574134 0.280414
C -1.675627 -0.346416 0.597742
C 1.706545 -0.354267 -0.471958
C -0.168044 -2.826209 1.471233
C 0.274282 -2.965251 -1.074516
C -5.076042 -0.258514 0.983144
C 5.027149 -0.163493 -1.164204
H -3.300271 -0.674500 -0.812159
H 3.450228 -0.521817 0.830140
H -0.706650 2.122874 -0.096068
H -2.208933 2.770559 0.582432
H -1.616318 3.359006 -0.966818
H -2.400615 0.214257 -2.937292
H -1.426803 1.691013 -2.954606
H -0.881149 0.283756 -2.047410
H 0.858669 0.519163 2.010187
H 2.363491 0.327716 2.903372
H 1.517149 1.877674 2.925462
H 0.843338 2.237709 -0.046185
H 1.685331 3.467562 0.903042
H 2.381508 2.907343 -0.614821
H -3.791564 1.400040 1.337068
H 3.535176 1.283449 -1.603703
H 0.666278 -3.500760 1.707208
H -1.093833 -3.416861 1.464029
H -0.240246 -2.105567 2.306055
H -0.546051 -3.679025 -1.232522
H 0.331755 -2.340991 -1.983937
H 1.211174 -3.532704 -0.999920
H -3.763121 2.830052 -2.603185
H 4.762999 2.540791 0.593692
H -5.798111 0.142149 1.710954
H 5.625435 0.184788 -2.020459


%chk=000286522-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286522

0 1
S -4.635350 1.782708 -2.036889
S 4.538531 1.885666 1.959494
O -1.161504 -1.314566 -0.436363
O 1.165862 -1.310464 0.498422
O -1.163929 0.351347 1.216990
O 1.211998 0.063620 -1.402359
O -3.588701 -1.560251 1.737600
O 5.506655 -1.194902 -0.452116
N -4.045794 0.421521 0.611985
N 3.924003 0.490347 -0.879281
C -2.836952 1.442526 -1.338500
C 2.823571 1.416421 1.213533
C -3.028357 0.183785 -0.424961
C 3.042540 0.183558 0.256689
C -0.043529 -2.129475 0.114418
C -2.363804 2.691780 -0.568432
C -1.907299 1.110015 -2.520760
C 1.965327 1.024881 2.435656
C 2.234753 2.638788 0.479828
C -1.701154 -0.230797 0.254481
C 1.712047 -0.342364 -0.326163
C -0.476198 -2.801794 1.414741
C 0.338775 -3.071922 -1.026092
C -4.270938 -0.501293 1.604081
C 5.054192 -0.263789 -1.168620
H -3.330663 -0.667522 -1.064092
H 3.522894 -0.620413 0.839472
H -1.365053 2.514628 -0.131352
H -3.045363 2.962858 0.255486
H -2.289225 3.553951 -1.255398
H -2.292062 0.252914 -3.098803
H -1.834907 1.977220 -3.200702
H -0.888960 0.860192 -2.169908
H 0.928857 0.797256 2.135091
H 2.381764 0.139584 2.946887
H 1.941406 1.861663 3.156058
H 1.237791 2.402026 0.061856
H 2.123551 3.475569 1.189438
H 2.884445 2.986132 -0.344206
H -4.666132 1.228534 0.489768
H 3.543251 1.099513 -1.609191
H 0.328940 -3.466512 1.768077
H -1.391753 -3.388051 1.237587
H -0.692632 -2.050736 2.188660
H -0.512170 -3.734227 -1.254827
H 0.594434 -2.498111 -1.930776
H 1.200653 -3.688536 -0.722763
H -4.314480 3.016604 -2.575642
H 5.173167 2.087625 0.743834
H -5.105302 -0.225536 2.283999
H 5.535705 0.061731 -2.119136


