%chk=000251475.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251475

0 1
S 2.640431 1.098124 -0.084834
O 5.577508 -1.445966 -0.017554
O 5.448324 0.794222 -0.097598
N -0.046027 1.652706 -0.082768
N 0.460261 -0.590560 -0.006002
C -1.275285 0.960915 -0.047685
C -0.943179 -0.437181 -0.000029
C -3.607234 0.438228 -0.009927
C -3.287809 -0.962708 0.037971
C -2.607878 1.402130 -0.052782
C -1.970445 -1.397742 0.042935
C 0.953960 0.658791 -0.055036
C -5.038555 0.871343 -0.013920
C -4.391361 -1.971704 0.083297
C 3.412553 -0.541084 -0.031381
C 4.872684 -0.265568 -0.054162
H -2.840250 2.461679 -0.089093
H -1.710522 -2.454529 0.078880
H 0.077985 2.646857 -0.118973
H -5.562055 0.525306 0.889288
H -5.152704 1.962351 -0.052398
H -5.576469 0.461361 -0.881181
H -4.016990 -3.003657 0.117566
H -5.024943 -1.831875 0.970628
H -5.039186 -1.895890 -0.801527
H 3.084351 -1.183736 -0.882989
H 3.099592 -1.119422 0.870532
H 6.563543 -1.303990 -0.031356


%chk=000251475-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251475

0 1
S 2.694321 1.285995 -0.095610
O 5.456408 -1.667151 -0.003980
O 5.625508 0.651330 -0.094368
N -0.065595 1.729663 -0.086936
N 0.507631 -0.484151 -0.014175
C -1.283737 1.021872 -0.051414
C -0.905826 -0.358614 -0.006220
C -3.629266 0.426824 -0.008921
C -3.266106 -0.967125 0.036646
C -2.630488 1.428398 -0.053367
C -1.906355 -1.352359 0.037712
C 0.959527 0.776252 -0.062351
C -5.093535 0.831321 -0.009132
C -4.348831 -2.032499 0.084493
C 3.407682 -0.456901 -0.034339
C 4.917768 -0.375510 -0.049466
H -2.916106 2.485487 -0.087790
H -1.625026 -2.409783 0.072545
H 0.052180 2.740402 -0.123227
H -5.616699 0.471136 0.897749
H -5.206970 1.928161 -0.048478
H -5.634606 0.405708 -0.876282
H -3.908983 -3.043495 0.117179
H -4.997217 -1.918982 0.974905
H -5.012991 -1.983242 -0.800201
H 3.031317 -1.030686 -0.895810
H 3.045777 -0.962708 0.874621
H 6.450518 -1.610942 -0.013884


