%chk=000241360.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241360

0 1
S 1.052306 2.032170 -0.323012
O 1.094320 3.162620 0.568852
O 1.576856 2.113712 -1.665346
O 3.596527 -2.128952 3.011816
O 2.636799 -0.204886 2.883061
N 1.983325 0.827410 0.548579
N 3.128820 -1.207967 2.360362
C -4.496660 -0.415049 -0.392057
C -3.085656 0.185019 -0.370659
C -4.956656 -0.783310 1.030265
C -5.428958 0.657814 -0.985886
C -4.546084 -1.688165 -1.256163
C -2.214088 0.020011 -1.461804
C -2.654781 0.958453 0.721998
C -0.512932 1.337395 -0.346473
C -0.941067 0.588070 -1.448892
C -1.382078 1.526975 0.735400
C 2.601750 -0.309310 0.045936
C 3.148463 -1.303997 0.912110
C 2.694210 -0.528056 -1.361361
C 3.747759 -2.469584 0.359391
C 3.279850 -1.669532 -1.865125
C 3.807681 -2.659528 -1.003091
H -5.941150 -1.265184 1.014313
H -4.260998 -1.481648 1.509330
H -5.045477 0.095822 1.678145
H -5.132283 0.933726 -2.003855
H -6.463647 0.300437 -1.032744
H -5.427381 1.573921 -0.384717
H -5.542443 -2.144684 -1.227417
H -4.322397 -1.483446 -2.308819
H -3.833899 -2.441895 -0.901838
H -2.531511 -0.553942 -2.333315
H -3.319558 1.121786 1.571777
H -0.278941 0.452857 -2.311478
H -1.067827 2.131535 1.594427
H 2.103814 0.987222 1.587229
H 2.344444 0.245911 -2.058281
H 4.160891 -3.215294 1.051379
H 3.347980 -1.815594 -2.946257
H 4.264078 -3.553343 -1.422376


%chk=000241360-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241360

0 1
S 1.125445 1.997607 -0.489801
O 1.126268 3.304227 0.465104
O 1.676274 2.030046 -2.017709
O 4.131025 -1.639959 3.277127
O 3.018474 0.301342 2.871475
N 2.109507 0.801895 0.519717
N 3.532576 -0.840077 2.461934
C -4.643472 -0.373856 -0.472763
C -3.203786 0.188172 -0.505214
C -4.812025 -1.279843 0.784903
C -5.650676 0.814521 -0.393979
C -4.978847 -1.216936 -1.729477
C -2.321414 -0.034154 -1.594786
C -2.734285 0.975049 0.586196
C -0.605049 1.250779 -0.497362
C -1.011194 0.497399 -1.606010
C -1.434091 1.515956 0.605547
C 2.720305 -0.369123 0.104568
C 3.421472 -1.204209 1.053824
C 2.687265 -0.822321 -1.253749
C 4.033908 -2.422490 0.656020
C 3.296331 -2.026841 -1.626924
C 3.971673 -2.841951 -0.676426
H -5.841460 -1.681337 0.823982
H -4.109551 -2.132639 0.756122
H -4.632206 -0.723581 1.721981
H -5.556693 1.472857 -1.276745
H -6.686297 0.428911 -0.358696
H -5.489039 1.430870 0.508144
H -6.013346 -1.596674 -1.651038
H -4.915222 -0.618478 -2.657107
H -4.310337 -2.092217 -1.828272
H -2.649543 -0.622402 -2.455463
H -3.393288 1.175859 1.437298
H -0.344133 0.352755 -2.461607
H -1.083088 2.138773 1.434507
H 2.276158 1.096357 1.506238
H 2.223562 -0.184336 -2.010222
H 4.547538 -3.007670 1.423393
H 3.258987 -2.334428 -2.677693
H 4.445675 -3.778355 -0.983635


