%chk=000266808.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266808

0 1
S 0.001884 -0.827407 -0.918642
O -0.161621 -0.524564 -2.329860
O -0.276206 -2.155945 -0.409104
O -3.775494 0.142783 1.102322
O -5.132086 1.269923 -0.317035
N -1.067797 0.214914 -0.054613
C -1.752514 1.275657 -0.840703
C 1.569026 -0.324689 -0.412757
C -2.812720 1.987438 0.013895
C 2.100068 -0.788167 0.796058
C 2.319212 0.541168 -1.216931
C 4.122068 0.495536 0.406125
C 3.369237 -0.380923 1.207273
C 3.588657 0.952259 -0.812469
C -4.047086 1.146705 0.194079
C 5.485397 0.921819 0.835763
C -4.827974 -0.825689 1.358156
H -2.214549 0.876169 -1.776715
H -0.984623 2.019616 -1.160720
H -1.711529 -0.239733 0.620716
H -3.102400 2.948147 -0.465952
H -2.384151 2.254164 1.007270
H 1.524319 -1.480880 1.419635
H 1.912707 0.889767 -2.173840
H 3.777298 -0.746483 2.147672
H 4.168159 1.623161 -1.443707
H 6.247214 0.219234 0.461155
H 5.755482 1.917588 0.457298
H 5.591992 0.955470 1.929102
H -5.806061 -0.333059 1.394033
H -4.545299 -1.246473 2.328703
H -4.798209 -1.578106 0.563590


%chk=000266808-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266808

0 1
S 0.020046 -1.215744 -0.669484
O -0.167086 -1.090224 -2.290369
O -0.127760 -2.642109 0.102109
O -3.967660 -0.055962 0.483738
O -5.014287 2.013031 0.673840
N -1.161190 -0.089687 0.227709
C -1.616327 1.063739 -0.598327
C 1.681451 -0.436426 -0.255350
C -2.586364 1.925694 0.239036
C 2.204904 -0.616150 1.035840
C 2.351086 0.261293 -1.271029
C 4.182646 0.680461 0.328303
C 3.464217 -0.046328 1.317452
C 3.610943 0.823797 -0.962397
C -3.975751 1.347564 0.477550
C 5.547279 1.264268 0.645464
C -5.278354 -0.713871 0.725449
H -2.088517 0.752523 -1.551465
H -0.731718 1.679291 -0.842863
H -1.968744 -0.697627 0.479453
H -2.732185 2.905597 -0.247931
H -2.129255 2.123585 1.228537
H 1.652788 -1.188809 1.787406
H 1.906166 0.340831 -2.268550
H 3.897170 -0.169155 2.317073
H 4.156333 1.375284 -1.736606
H 6.319389 0.471417 0.667229
H 5.857077 2.008323 -0.107717
H 5.557019 1.754012 1.635646
H -5.672775 -0.416284 1.710812
H -5.062985 -1.790487 0.688735
H -5.995156 -0.422447 -0.059497


