%chk=000297974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297974

0 1
S 1.550881 2.402719 -0.755545
O 0.942504 3.211042 0.276574
O 2.484589 3.007594 -1.682563
N 0.247731 1.815782 -1.759773
N -2.679342 -4.205553 -0.397786
C -0.424047 0.586374 -1.493788
C -1.228013 0.463083 -0.296175
C -1.820359 -0.794414 0.003223
C 2.227850 0.985559 -0.066235
C -0.320205 -0.481393 -2.375639
C 0.266606 2.276059 -3.172422
C -1.648483 -1.890183 -0.914366
C -1.495295 1.566108 0.574734
C -0.936746 -1.718037 -2.086819
C 3.265101 0.314104 -0.726218
C 1.769168 0.508424 1.169363
C -2.593844 -0.939202 1.197567
C 3.356443 -1.323928 1.060708
C -2.254912 1.405554 1.707012
C 3.825957 -0.834877 -0.171624
C 2.324606 -0.639617 1.729499
C -2.801071 0.132541 2.030190
C 3.938899 -2.557179 1.661622
C -2.223042 -3.166714 -0.625495
H 0.252698 -0.391843 -3.297146
H 1.047749 1.784641 -3.776234
H 0.461049 3.365903 -3.196971
H -0.713567 2.105037 -3.648553
H -1.095454 2.559675 0.325432
H -0.827288 -2.540574 -2.797531
H 3.646278 0.697112 -1.679977
H 0.970170 1.040865 1.701016
H -3.025608 -1.912608 1.433771
H -2.454439 2.250831 2.365254
H 4.630336 -1.351494 -0.692436
H 1.958285 -1.008806 2.686487
H -3.392461 0.026718 2.940016
H 3.187235 -3.360152 1.727806
H 4.785754 -2.959607 1.089202
H 4.301585 -2.376846 2.685320


%chk=000297974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297974

0 1
S 1.544518 2.558336 -0.717911
O 1.007339 3.501201 0.494566
O 2.651218 3.127913 -1.782520
N -0.156815 2.008775 -1.920490
N -2.341965 -4.341574 -0.289288
C -0.591409 0.704830 -1.610624
C -1.309880 0.511498 -0.355422
C -1.770146 -0.811497 0.006702
C 2.231336 0.961599 0.018054
C -0.425585 -0.398314 -2.484977
C 0.288180 2.304831 -3.299980
C -1.549719 -1.908620 -0.911719
C -1.592820 1.605129 0.521024
C -0.909043 -1.682004 -2.146285
C 3.202075 0.266001 -0.720242
C 1.767694 0.544869 1.277101
C -2.448927 -0.999649 1.253739
C 3.285170 -1.394555 1.103652
C -2.268092 1.395617 1.728372
C 3.727283 -0.919800 -0.159201
C 2.308720 -0.642505 1.812470
C -2.686577 0.083271 2.104732
C 3.840603 -2.677474 1.692835
C -1.983880 -3.234969 -0.574285
H 0.088893 -0.265976 -3.440925
H 1.053889 1.619300 -3.717593
H 0.705097 3.323638 -3.325323
H -0.610776 2.277360 -3.944243
H -1.282347 2.610877 0.226558
H -0.765441 -2.518341 -2.837405
H 3.557571 0.655496 -1.679664
H 1.027130 1.137237 1.823317
H -2.790597 -2.004345 1.526140
H -2.486113 2.246105 2.382696
H 4.492975 -1.478425 -0.708868
H 1.966974 -0.989097 2.794491
H -3.212541 -0.070524 3.053068
H 3.054104 -3.452026 1.766117
H 4.659337 -3.087766 1.078499
H 4.229866 -2.513726 2.714334


