%chk=000273142.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273142

0 1
S -2.409336 0.189667 0.476470
S 0.250109 -0.816592 1.173272
O -0.211880 -2.114220 0.650295
O 0.376576 -0.703038 2.616490
N -0.802570 0.322334 0.575444
C -2.823806 1.601437 -0.600529
C -2.802143 -1.199014 -0.619311
C -2.911262 2.849770 0.271879
C -4.285261 -1.520045 -0.502272
C 1.759803 -0.407158 0.433810
C -3.335971 4.069236 -0.544980
C -4.654367 -2.737659 -1.350268
C 2.463734 0.726144 0.849064
C 2.276851 -1.218120 -0.581032
C 4.205649 0.240767 -0.768933
C 3.683201 1.052731 0.251572
C 3.495345 -0.899897 -1.182042
C 5.517664 0.576680 -1.398270
H -2.054794 1.737236 -1.387818
H -3.777737 1.400525 -1.118448
H -2.498787 -1.023549 -1.664549
H -2.175144 -2.076436 -0.302656
H -3.624692 2.697679 1.107326
H -1.923352 3.046520 0.745976
H -4.553390 -1.722262 0.556917
H -4.903192 -0.654996 -0.817225
H -3.386123 4.965184 0.085642
H -2.625573 4.281546 -1.352917
H -4.322993 3.933712 -1.000417
H -5.718124 -2.981854 -1.252680
H -4.448355 -2.571974 -2.413582
H -4.085657 -3.625883 -1.044933
H 2.064896 1.359439 1.647684
H 1.725731 -2.110893 -0.900147
H 4.228023 1.934156 0.580914
H 3.895241 -1.537231 -1.966854
H 5.584521 0.232855 -2.439251
H 5.716375 1.656960 -1.403033
H 6.343092 0.099445 -0.847207


%chk=000273142-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273142

0 1
S -2.535178 0.174333 0.529975
S 0.240466 -0.467484 1.318172
O -0.214752 -2.046013 1.155741
O 0.391231 0.128706 2.834837
N -0.772434 0.570932 0.157364
C -3.188221 1.665262 -0.461883
C -2.907730 -1.273423 -0.694941
C -3.025532 2.956583 0.349619
C -4.363811 -1.748794 -0.617057
C 1.891419 -0.206488 0.448706
C -3.458986 4.182837 -0.487198
C -4.592429 -2.958746 -1.555773
C 2.774257 0.744043 0.983093
C 2.198006 -0.994185 -0.671638
C 4.381471 0.148288 -0.790779
C 4.024751 0.916075 0.348995
C 3.454716 -0.806683 -1.287996
C 5.742161 0.317473 -1.443451
H -2.575285 1.670337 -1.379788
H -4.241797 1.433440 -0.696545
H -2.615102 -0.891852 -1.688479
H -2.177671 -2.029448 -0.355919
H -3.628117 2.901679 1.276097
H -1.966597 3.055358 0.648760
H -4.606184 -2.040710 0.422473
H -5.059163 -0.932675 -0.897426
H -3.339939 5.108404 0.103095
H -2.841063 4.282674 -1.398363
H -4.518787 4.113458 -0.796117
H -5.638740 -3.307106 -1.492048
H -4.384625 -2.695578 -2.609228
H -3.934846 -3.802244 -1.278998
H 2.490107 1.310786 1.875839
H 1.482931 -1.739619 -1.033486
H 4.731878 1.654018 0.745651
H 3.719659 -1.409253 -2.164835
H 5.706092 0.088250 -2.522821
H 6.125164 1.345832 -1.323247
H 6.484982 -0.365266 -0.987000


