%chk=000247789.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247789

0 1
S -6.052002 0.977493 -0.028744
O 4.049062 2.015417 0.556536
O 6.406680 0.507402 -0.332581
O -6.360651 0.996166 -1.693308
O -7.115459 0.202442 0.553749
O -5.903395 2.375433 0.297797
N -0.946137 -1.995220 0.085526
N 0.250650 -1.337944 0.014138
C -4.573233 0.138728 0.008613
C -2.138798 -1.239850 0.056923
C 2.649234 -1.319153 -0.045933
C -4.559200 -1.260020 0.109746
C -3.359552 0.843463 -0.066648
C -3.358113 -1.958539 0.135663
C -2.146486 0.170572 -0.042274
C 3.998800 0.678746 0.178526
C 2.752707 0.048896 0.251509
C 5.151438 -0.058308 -0.175332
C 3.794594 -2.043842 -0.427315
C 5.040130 -1.420366 -0.488073
C 1.358988 -2.031390 0.026893
C 4.416970 2.914483 -0.527489
C 6.934888 1.146749 0.863494
H -5.505925 -1.812075 0.175791
H -3.369319 1.938840 -0.138670
H -3.365553 -3.042290 0.215398
H -1.203747 0.718613 -0.099957
H 1.874250 0.632624 0.536788
H 3.716150 -3.101519 -0.675863
H 5.934750 -1.972518 -0.775853
H -1.005401 -3.016535 0.150763
H 1.433281 -3.127822 0.083332
H -6.948911 1.694126 -2.009075
H 3.616493 2.927215 -1.272337
H 5.371679 2.613315 -0.972634
H 4.495343 3.877408 -0.011354
H 7.188444 0.374680 1.594999
H 6.217107 1.865122 1.276335
H 7.832143 1.644659 0.480621


%chk=000247789-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247789

0 1
S -6.291183 0.888963 0.261247
O 4.174991 2.140345 0.117776
O 6.563085 0.437475 0.034257
O -6.511323 1.260040 -1.554519
O -7.431767 -0.175603 0.697324
O -6.142179 2.300573 1.041284
N -0.957768 -1.898359 -0.166644
N 0.232999 -1.208857 -0.108417
C -4.649803 0.046052 0.117006
C -2.181639 -1.229184 -0.071501
C 2.666174 -1.265264 -0.147688
C -4.632437 -1.350041 -0.056542
C -3.481584 0.827306 0.196365
C -3.385499 -1.989543 -0.146158
C -2.236580 0.184144 0.105896
C 4.088491 0.732510 0.006576
C 2.814061 0.146210 -0.037999
C 5.258625 -0.091935 -0.017626
C 3.835319 -2.072823 -0.228776
C 5.115226 -1.489423 -0.159508
C 1.350667 -1.905408 -0.195938
C 4.797225 2.809639 -1.050013
C 6.883891 1.231305 1.247115
H -5.567820 -1.915914 -0.102383
H -3.548507 1.909725 0.343667
H -3.343237 -3.077265 -0.277087
H -1.303090 0.746438 0.167579
H 1.930898 0.790424 -0.001448
H 3.740067 -3.160680 -0.329407
H 6.023474 -2.098745 -0.197099
H -0.963294 -2.922468 -0.281251
H 1.341186 -3.008876 -0.309490
H -7.372852 1.761929 -1.650466
H 4.175346 2.652966 -1.951352
H 5.819203 2.428722 -1.228913
H 4.823138 3.879462 -0.793879
H 6.874699 0.573651 2.136292
H 6.164604 2.057576 1.383694
H 7.899089 1.620133 1.077727


