%chk=000298841.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298841

0 1
S -1.181578 -0.472561 -1.267270
S 1.934940 0.253626 -2.602497
P 0.826941 -0.021884 -1.067768
O 0.696021 1.243451 -0.010796
O 1.246494 -1.258808 -0.053704
C -3.198480 -0.996151 0.442197
C -1.723238 -0.637526 0.490960
C -4.091558 0.188812 0.046362
C -5.570440 -0.187048 0.091667
C 1.768198 2.235908 0.021500
C 2.653840 -1.643742 0.026760
C 1.318062 3.182856 1.119142
C 2.633987 -2.791051 1.020433
H -3.379056 -1.850841 -0.243526
H -3.504770 -1.368628 1.444383
H -1.540981 0.311598 1.033027
H -1.128632 -1.429007 0.989853
H -3.901263 1.047513 0.719948
H -3.828753 0.543960 -0.970940
H -6.201165 0.661715 -0.197988
H -5.881933 -0.497971 1.095062
H -5.799909 -1.010760 -0.594428
H 2.726361 1.742976 0.265044
H 1.828758 2.739852 -0.963296
H 3.006240 -1.966889 -0.972744
H 3.249259 -0.787834 0.392157
H 2.014287 4.020724 1.235652
H 0.322749 3.594447 0.898202
H 1.235249 2.665743 2.084164
H 3.632606 -3.220643 1.156448
H 2.261936 -2.464703 2.000496
H 1.961426 -3.591933 0.680800


%chk=000298841-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298841

0 1
S -1.119698 -0.739543 -1.546199
S 2.255410 0.209785 -2.702797
P 1.043003 -0.265726 -1.099368
O 0.998357 0.920900 0.192629
O 1.436909 -1.630103 -0.103645
C -3.256319 -1.009763 0.292496
C -1.719991 -1.073223 0.248160
C -3.850340 0.397239 0.052473
C -5.390338 0.409462 0.156663
C 0.924970 2.360562 -0.183066
C 2.833583 -1.713795 0.428472
C 1.082041 3.151142 1.113108
C 2.909855 -3.025972 1.201939
H -3.687115 -1.727887 -0.433888
H -3.564549 -1.367780 1.297638
H -1.256170 -0.304238 0.888413
H -1.332522 -2.065683 0.522282
H -3.419589 1.102734 0.792092
H -3.539028 0.761742 -0.945336
H -5.796479 1.421627 -0.021865
H -5.726811 0.082062 1.158668
H -5.843322 -0.271062 -0.588760
H 1.731871 2.585650 -0.906322
H -0.053533 2.555455 -0.664233
H 3.538483 -1.693797 -0.424718
H 3.017312 -0.836907 1.076741
H 1.025718 4.234351 0.897758
H 0.282778 2.896111 1.829747
H 2.056645 2.939018 1.584531
H 3.924747 -3.152137 1.622750
H 2.184262 -3.033339 2.033053
H 2.695459 -3.881687 0.539882


