%chk=000251609.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251609

0 1
S -1.369906 0.495149 -0.827943
O 3.975694 2.289758 0.602101
O 5.123727 0.375213 -0.207528
O -1.259445 -0.566534 -1.816388
O -1.025022 1.858850 -1.178594
C 1.030097 0.032290 0.322908
C 1.704274 -1.096151 -0.174225
C -0.439167 0.010802 0.604612
C 0.982572 -2.365851 -0.534615
C 1.721164 1.244117 0.607703
C 3.111402 -1.071268 -0.382620
C 3.077096 1.248896 0.394859
C 3.767104 0.099583 -0.091621
C 0.558254 -3.160843 0.709142
C -2.999744 0.490474 -0.213093
C 5.287852 1.772256 0.206584
C -0.163634 -4.450970 0.332764
C -3.552915 1.666218 0.300212
C -3.762573 -0.678664 -0.268592
C -4.862430 1.666288 0.790986
C -5.072311 -0.682521 0.221167
C -5.619630 0.490265 0.753493
H -0.669074 0.662625 1.473072
H -0.736907 -1.007696 0.958121
H 0.095998 -2.128098 -1.174681
H 1.614613 -3.003437 -1.186155
H 1.193662 2.130085 0.953578
H 3.638139 -1.943499 -0.760791
H 1.448781 -3.390061 1.327229
H -0.100186 -2.531076 1.346526
H 5.935851 1.785649 1.092187
H 5.627583 2.344500 -0.666849
H -1.048641 -4.255403 -0.284346
H 0.485765 -5.122638 -0.241869
H -0.492713 -4.998059 1.222943
H -2.968373 2.593102 0.305601
H -3.342786 -1.589436 -0.708993
H -5.294065 2.581899 1.192362
H -5.667535 -1.593268 0.179455
H -6.641769 0.489253 1.134099


%chk=000251609-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251609

0 1
S -1.474054 0.513882 -0.866750
O 3.964945 2.298227 0.744179
O 5.150459 0.441115 -0.204405
O -1.454116 -0.678282 -1.996873
O -0.970496 2.036409 -1.201735
C 1.046489 -0.089780 0.471146
C 1.752232 -1.196079 -0.111084
C -0.402079 -0.159004 0.752730
C 1.056551 -2.506967 -0.454590
C 1.720061 1.139924 0.770822
C 3.148102 -1.081186 -0.363443
C 3.080310 1.215359 0.500683
C 3.782401 0.122967 -0.052577
C 0.952119 -3.479024 0.755909
C -3.263224 0.644673 -0.229786
C 5.246030 1.896158 0.110661
C 0.248142 -4.800191 0.381250
C -3.681864 1.870198 0.314264
C -4.099817 -0.474256 -0.374367
C -5.019543 1.965550 0.765199
C -5.433926 -0.360088 0.082906
C -5.887050 0.852464 0.655453
H -0.759377 0.544532 1.518981
H -0.841881 -1.158252 0.868642
H 0.052002 -2.313293 -0.875314
H 1.623164 -3.015530 -1.257766
H 1.174439 1.992525 1.182767
H 3.705365 -1.911904 -0.804825
H 1.969335 -3.688504 1.141444
H 0.407700 -2.985464 1.586462
H 6.067134 2.052025 0.826543
H 5.377485 2.455700 -0.834183
H -0.779386 -4.614125 0.016247
H 0.795682 -5.326690 -0.422911
H 0.183642 -5.481846 1.248900
H -2.995488 2.723205 0.348266
H -3.727653 -1.383731 -0.858130
H -5.383559 2.906562 1.190988
H -6.116967 -1.210307 -0.016453
H -6.922504 0.934825 1.003551


