%chk=000293021.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293021

0 1
S 2.542399 1.090743 -0.794572
O -4.646702 -0.995270 -0.235029
O -4.603193 1.134853 0.138943
N 2.396087 -0.911661 0.889679
N -4.061146 0.053653 -0.021921
C 4.182265 0.428200 -0.257999
C 3.847583 -0.713762 0.731320
C 1.658572 -0.107593 0.214995
C 4.943134 -0.027327 -1.481388
C 0.192770 -0.064211 0.166577
C -0.528566 -1.249128 -0.061638
C -0.478673 1.157834 0.341093
C -1.921028 -1.214271 -0.124271
C -1.871273 1.198467 0.281269
C -2.581771 0.011655 0.045850
H 4.721251 1.253441 0.260723
H 4.288415 -1.684789 0.403529
H 4.276508 -0.508685 1.739878
H 5.930178 -0.430193 -1.213936
H 4.413283 -0.813442 -2.039210
H 5.118639 0.795892 -2.188887
H 0.003934 -2.196174 -0.180609
H 0.083961 2.076274 0.527465
H -2.500561 -2.127513 -0.301689
H -2.413365 2.141703 0.415128


%chk=000293021-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293021

0 1
S 2.748732 1.448780 0.198976
O -4.663459 -1.058800 0.049513
O -4.586624 1.199445 -0.265441
N 2.400288 -1.239769 0.410019
N -4.020609 0.054570 -0.072903
C 4.302121 0.345379 -0.014197
C 3.858508 -1.036968 0.565209
C 1.737048 -0.126480 0.267615
C 4.714488 0.282611 -1.492531
C 0.262302 -0.056907 0.172392
C -0.495437 -1.255848 0.302493
C -0.411687 1.175648 -0.039540
C -1.897170 -1.227013 0.221662
C -1.815904 1.219948 -0.118726
C -2.539026 0.015223 0.012579
H 5.090970 0.801508 0.606067
H 4.398699 -1.856345 0.057588
H 4.088642 -1.101398 1.648066
H 5.636187 -0.321262 -1.604258
H 3.920131 -0.181391 -2.103649
H 4.914865 1.288901 -1.898116
H 0.041387 -2.194498 0.466046
H 0.163556 2.100871 -0.150268
H -2.499719 -2.133774 0.317472
H -2.355591 2.156265 -0.280769


