%chk=000268843.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268843

0 1
S 1.369880 -0.949222 0.374771
S -3.060080 1.721347 -1.332969
O 0.490057 -1.264679 -0.738053
O 1.279931 -1.788453 1.555030
O -2.948673 1.556346 -2.766584
O -3.960187 2.718266 -0.787327
N 1.031462 0.656010 0.951640
N -1.463512 2.196035 -0.826963
C 1.479171 1.802194 0.106874
C -1.303420 2.732338 0.549280
C -0.171564 0.766818 1.708650
C -0.357426 1.906543 -1.644390
C 0.934647 1.777230 -1.283393
C -1.164686 1.662001 1.590225
C 2.995815 -0.857315 -0.176906
C -3.351960 0.219532 -0.561283
C 3.266707 -0.816047 -1.550238
C -2.475922 -0.861350 -0.724105
C 4.051940 -0.858855 0.742082
C -4.492154 0.071902 0.241394
C 5.646937 -0.752157 -1.083882
C -3.879303 -2.226408 0.712504
C 4.583379 -0.759506 -2.004346
C -2.736510 -2.076111 -0.089758
C 5.371192 -0.801762 0.294475
C -4.759588 -1.140089 0.873492
C 7.056009 -0.678298 -1.565984
C -4.147768 -3.529942 1.385989
H 2.594866 1.776540 0.092326
H 1.211928 2.756501 0.624441
H -2.195434 3.373949 0.767014
H -0.423790 3.422370 0.578331
H -0.215853 -0.004492 2.502305
H -0.637771 1.783432 -2.711424
H 1.677525 1.616060 -2.062038
H -1.986155 1.631179 2.308721
H 2.439338 -0.834634 -2.271304
H -1.563940 -0.770749 -1.335198
H 3.844972 -0.911810 1.816906
H -5.177887 0.917374 0.376291
H 4.787417 -0.726131 -3.073246
H -2.035284 -2.902630 -0.214505
H 6.188161 -0.801425 1.013936
H -5.648279 -1.245258 1.491700
H 7.764738 -1.158875 -0.876617
H 7.191907 -1.156893 -2.546461
H 7.376151 0.370337 -1.674895
H -4.315549 -4.329947 0.648540
H -3.292583 -3.843626 2.005162
H -5.028051 -3.504941 2.041092


%chk=000268843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268843

0 1
S 1.131866 -1.071421 -0.325483
S -3.812518 2.213545 -0.844943
O 0.610023 -1.346013 -1.852822
O 0.615896 -2.023662 0.897782
O -4.254618 2.294425 -2.404981
O -4.554916 3.057428 0.329226
N 0.850711 0.777096 0.330256
N -1.966677 2.855930 -0.830269
C 1.080434 1.786650 -0.749151
C -1.456746 3.072531 0.548551
C -0.229551 0.842568 1.217845
C -1.224971 2.290324 -1.869603
C 0.078821 1.864668 -1.887578
C -1.165938 1.832448 1.385021
C 3.013687 -1.076880 -0.377494
C -3.684277 0.414848 -0.291100
C 3.635426 -1.184136 -1.630099
C -3.024290 -0.494660 -1.136431
C 3.719353 -1.023921 0.836666
C -4.143951 0.087647 0.993510
C 5.811691 -1.165543 -0.465754
C -3.170176 -2.158518 0.678786
C 5.048577 -1.228261 -1.660238
C -2.763765 -1.784422 -0.631029
C 5.127801 -1.067296 0.777931
C -3.890223 -1.220126 1.464734
C 7.328099 -1.197648 -0.504698
C -2.783273 -3.515190 1.230908
H 2.080198 1.571673 -1.167456
H 1.185903 2.742116 -0.200808
H -2.228226 3.670658 1.063834
H -0.580712 3.737801 0.430185
H -0.246700 -0.009642 1.909363
H -1.798498 2.247286 -2.805047
H 0.445050 1.525486 -2.862131
H -1.814402 1.701650 2.259130
H 3.032583 -1.250310 -2.541850
H -2.696599 -0.211330 -2.139858
H 3.189555 -0.959416 1.791773
H -4.664723 0.833456 1.602770
H 5.560917 -1.316723 -2.624715
H -2.204621 -2.492823 -1.251087
H 5.704299 -1.027586 1.709434
H -4.234802 -1.504746 2.465424
H 7.733064 -1.932695 0.214127
H 7.704896 -1.458320 -1.507791
H 7.751574 -0.211823 -0.233519
H -3.066334 -4.331338 0.541537
H -1.684425 -3.560647 1.359321
H -3.253692 -3.712437 2.209122


