%chk=000239278.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239278

0 1
S 1.278364 2.987014 0.277430
O -2.290194 -2.141853 -0.386853
N 2.829408 -1.753596 0.050410
N -0.403119 0.880381 0.082559
N 1.998568 0.471232 0.128934
N -3.042120 -0.052267 0.147613
C -0.613921 -0.470498 -0.020549
C 1.759710 -0.890166 0.033634
C 0.421444 -1.393513 -0.050578
C -2.047632 -0.973940 -0.114316
C 0.901550 1.273015 0.150920
C 4.226256 -1.277204 0.070472
C -4.464799 -0.436508 0.076169
C -0.334440 3.788647 0.261934
H 0.207238 -2.457569 -0.140537
H 2.677991 -2.743417 -0.105312
H -2.830416 0.924874 0.338506
H 4.323619 -0.359851 0.687379
H 4.579338 -1.020459 -0.944483
H 4.880548 -2.051980 0.499571
H -4.966276 -0.239014 1.038181
H -4.566735 -1.519369 -0.144782
H -4.982635 0.120133 -0.722540
H -0.946198 3.493519 1.124039
H -0.903102 3.548200 -0.646484
H -0.168146 4.872888 0.298482


%chk=000239278-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239278

0 1
S 1.249905 3.000661 0.288315
O -2.322413 -2.287217 -0.110347
N 2.868977 -1.738820 -0.005564
N -0.429442 0.821149 0.122751
N 1.973832 0.433985 0.116043
N -2.977473 -0.037104 0.042652
C -0.618972 -0.545677 0.028669
C 1.766385 -0.918805 0.027832
C 0.435540 -1.457917 -0.019959
C -2.048331 -1.048040 -0.020600
C 0.866977 1.224165 0.164515
C 4.250065 -1.241669 0.020111
C -4.418554 -0.279809 0.012965
C -0.479105 3.736506 0.320392
H 0.216562 -2.526594 -0.090644
H 2.707117 -2.739865 -0.111443
H -2.586534 0.909929 0.113738
H 4.295686 -0.331526 0.637680
H 4.612271 -0.979071 -0.992739
H 4.909974 -2.014098 0.449960
H -4.907836 0.099729 0.929393
H -4.576302 -1.368779 -0.051028
H -4.889440 0.201171 -0.864855
H -1.029650 3.363253 1.195541
H -1.013572 3.477453 -0.604505
H -0.331368 4.825689 0.390925


