%chk=000295693.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295693

0 1
S -0.215830 -4.381776 1.472999
O 1.523615 2.515024 -0.088740
O -3.945407 0.489355 -0.724821
O -2.015302 1.599192 -1.126077
N 0.309701 0.233464 -0.571691
N 0.021524 -1.939182 0.382525
N -2.217658 -2.827567 0.764927
C 1.742719 0.222994 -0.513702
C -0.523371 -0.760650 -0.128704
C -1.952522 -0.614877 -0.198367
C 2.400741 1.470357 -0.278376
C 2.522560 -0.916161 -0.727556
C 3.791898 1.557932 -0.257185
C 3.921629 -0.825715 -0.699056
C -2.744853 -1.695474 0.265574
C 4.548399 0.396395 -0.465591
C -2.573435 0.592678 -0.718921
C -0.836895 -2.889844 0.800569
C -4.711990 1.648227 -1.189881
C -4.785212 2.685993 -0.090254
C 2.075223 3.848542 0.038699
C 1.571676 -4.186511 1.406093
H -0.122405 1.143580 -0.865199
H 2.044414 -1.881417 -0.915351
H 4.293041 2.503735 -0.076272
H 4.516143 -1.722060 -0.864880
H -3.845084 -1.626752 0.227248
H 5.636309 0.457947 -0.444740
H -4.241674 2.034853 -2.111746
H -5.684906 1.171758 -1.409831
H -5.479702 3.494456 -0.346283
H -5.117333 2.245796 0.859051
H -3.799524 3.140826 0.091449
H 2.637210 4.117219 -0.860084
H 2.684997 3.919397 0.943802
H 1.162036 4.453475 0.129045
H 1.901059 -3.223186 1.824774
H 1.950361 -4.240861 0.377849
H 2.021750 -4.995462 1.995706


%chk=000295693-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295693

0 1
S -0.349807 -4.788462 0.862924
O 1.424364 2.512414 -0.705849
O -3.886682 0.616437 -0.649444
O -1.820084 1.698384 -0.728336
N 0.371716 0.174798 -0.219107
N -0.018268 -2.125067 0.282195
N -2.286233 -3.041699 0.314643
C 1.784560 0.231287 -0.127623
C -0.494908 -0.873421 -0.044276
C -1.927180 -0.671557 -0.200481
C 2.363392 1.516307 -0.396062
C 2.645522 -0.844294 0.196481
C 3.757503 1.710283 -0.341043
C 4.044539 -0.645818 0.251023
C -2.753509 -1.807356 -0.004748
C 4.602203 0.621677 -0.015570
C -2.497976 0.639433 -0.540312
C -0.919255 -3.120843 0.441188
C -4.555394 1.918411 -0.958120
C -4.814406 2.712198 0.325360
C 1.911393 3.855998 -1.014002
C 1.508505 -4.532465 0.944416
H -0.093504 1.074365 -0.464223
H 2.198654 -1.816583 0.397992
H 4.189831 2.693845 -0.547931
H 4.695620 -1.489641 0.503469
H -3.836789 -1.706085 -0.110967
H 5.686194 0.772142 0.027001
H -3.917450 2.483657 -1.659562
H -5.490952 1.613288 -1.453220
H -5.385549 3.628785 0.086717
H -5.402217 2.117058 1.045317
H -3.864593 3.011941 0.798932
H 2.576165 3.845032 -1.899359
H 2.447083 4.293980 -0.149622
H 1.008534 4.444492 -1.231243
H 1.751669 -3.800927 1.728376
H 1.881706 -4.186826 -0.030264
H 1.929506 -5.519471 1.192331


