%chk=000198664.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198664

0 1
S 1.921691 -0.250966 -1.179299
P 0.463541 -0.156024 0.336461
O 0.459336 1.433235 0.837048
O 0.739085 -1.026209 1.504179
C -1.087750 -0.441187 -0.660381
C -2.296657 -0.207425 0.244324
C -3.603624 -0.400171 -0.525839
C 3.428019 -0.602980 -0.216673
C 0.216798 2.454913 -0.145313
H -1.093008 -1.482590 -1.048901
H -1.126693 0.202685 -1.558494
H -2.283537 -0.908188 1.109811
H -2.283898 0.813931 0.682622
H -3.685410 -1.414282 -0.934502
H -4.471421 -0.241313 0.125367
H -3.689978 0.298671 -1.364804
H 3.257227 -1.347873 0.577385
H 3.825322 0.309708 0.244186
H 4.176253 -1.007444 -0.909621
H 0.313073 3.376243 0.452316
H -0.797660 2.388026 -0.554088
H 0.979090 2.454739 -0.934987


%chk=000198664-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198664

0 1
S 2.109160 0.059796 -1.330246
P 0.438334 0.040631 0.296107
O 0.206711 1.688720 0.844231
O 0.795529 -0.916071 1.523598
C -1.137334 -0.367473 -0.636901
C -2.386042 -0.317983 0.271345
C -3.660238 -0.685542 -0.520548
C 3.418606 -0.799885 -0.262837
C 0.357055 2.813737 -0.095733
H -0.984720 -1.376915 -1.059413
H -1.215500 0.346425 -1.477836
H -2.251865 -1.018456 1.116777
H -2.489477 0.692730 0.709129
H -3.592801 -1.707924 -0.936423
H -4.549804 -0.645280 0.133364
H -3.826872 0.012664 -1.362090
H 2.925206 -1.182629 0.649508
H 4.203326 -0.076191 -0.002506
H 3.825318 -1.634105 -0.852565
H 0.317607 3.716993 0.531575
H -0.469515 2.841742 -0.833392
H 1.327115 2.760515 -0.624347


