%chk=000222873.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222873

0 1
S 1.185536 -1.929379 0.009911
O 0.250626 -3.037742 -0.075911
O 2.345502 -1.897533 -0.861791
N 1.830915 -1.990673 1.608595
C 0.914416 0.819047 -0.087979
C 2.421457 1.015911 -0.105637
C 0.311543 -0.445398 -0.046156
C -1.909402 0.568458 -0.056413
C -3.420750 0.444418 -0.053853
C -1.089472 -0.560558 -0.036310
C 0.081641 1.957404 -0.092020
C -1.303665 1.837693 -0.078283
C 2.892388 1.377580 1.308303
C 2.838562 2.083009 -1.125390
C -3.901802 -0.256138 1.223069
C -3.900810 -0.294181 -1.309250
H 2.937795 0.064254 -0.421034
H -3.867283 1.473036 -0.069324
H -1.551105 -1.558113 -0.017287
H 0.534865 2.948991 -0.106400
H -1.923482 2.735464 -0.085052
H 2.479086 2.334752 1.644663
H 3.984241 1.458389 1.348555
H 2.588384 0.615421 2.037804
H 2.437996 1.855726 -2.120969
H 3.930758 2.122951 -1.216760
H 2.498764 3.085996 -0.847371
H -3.561317 -1.296919 1.272934
H -4.995862 -0.271596 1.276861
H -3.531175 0.252136 2.120177
H -3.535452 0.191108 -2.221405
H -4.994683 -0.318857 -1.360367
H -3.552249 -1.333533 -1.333026
H 1.402576 -2.637137 2.267508
H 2.842756 -2.045286 1.705706


%chk=000222873-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222873

0 1
S 1.230486 -2.030040 -0.066120
O 0.122461 -3.226968 -0.106809
O 2.448334 -2.006442 -1.146386
N 2.087039 -2.026484 1.576893
C 0.940136 0.859381 0.007822
C 2.459884 1.052674 0.023633
C 0.270651 -0.384916 -0.014542
C -1.960410 0.585647 -0.006096
C -3.483412 0.446450 -0.030432
C -1.122967 -0.556214 -0.024724
C 0.072574 1.985924 0.032035
C -1.331438 1.855227 0.025358
C 2.914299 1.685221 1.365567
C 2.927929 1.894809 -1.192767
C -4.008004 -0.336966 1.202068
C -3.968844 -0.210105 -1.350759
H 2.946810 0.066605 -0.063760
H -3.909551 1.469122 0.014259
H -1.533325 -1.571879 -0.056992
H 0.517088 2.987204 0.054615
H -1.954922 2.757549 0.041232
H 2.466137 2.685005 1.517985
H 4.013574 1.803119 1.373785
H 2.629245 1.040535 2.215174
H 2.638294 1.412410 -2.142773
H 4.028757 1.992459 -1.179685
H 2.499375 2.914428 -1.176406
H -3.630588 -1.376307 1.203296
H -5.112519 -0.381529 1.188271
H -3.692096 0.140933 2.146826
H -3.633787 0.365206 -2.232363
H -5.072787 -0.265608 -1.371110
H -3.576995 -1.239209 -1.450008
H 1.470922 -2.482496 2.272224
H 2.978948 -2.536044 1.446784


