%chk=000247385.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247385

0 1
S 6.794138 0.100023 -0.001153
O 5.229987 -0.527481 -0.008553
O 6.959755 0.791494 1.249619
O 6.960489 0.818992 -1.236224
C -2.185610 -0.412389 -0.007448
C -3.450386 0.456786 0.005250
C -0.914532 0.447533 0.004174
C -4.721685 -0.402824 -0.006833
C 0.349879 -0.422064 -0.008187
C -5.986590 0.466203 0.005645
C 1.620557 0.438458 0.003338
C -7.257690 -0.393305 -0.006561
C 2.880218 -0.433686 -0.008976
C -8.523848 0.474852 0.005598
C 4.143081 0.427235 0.001738
C -9.792272 -0.375499 -0.006707
C 7.653748 -1.406450 -0.017563
H -2.188839 -1.067811 -0.899717
H -2.188200 -1.092652 0.866028
H -3.448349 1.137399 -0.867942
H -3.448019 1.112067 0.897608
H -0.912975 1.127772 -0.869436
H -0.912543 1.103289 0.896308
H -4.724649 -1.058178 -0.899085
H -4.724466 -1.083225 0.866481
H 0.346911 -1.077843 -0.900441
H 0.347412 -1.102212 0.865639
H -5.984131 1.146708 -0.867578
H -5.984037 1.121458 0.897980
H 1.621405 1.093736 0.896593
H 1.620957 1.118086 -0.871528
H -7.261840 -1.049200 -0.898195
H -7.261958 -1.074063 0.866236
H 2.893618 -1.118049 0.862992
H 2.892532 -1.094741 -0.898734
H -8.522143 1.130112 0.898572
H -8.521871 1.155284 -0.868348
H 4.227143 1.062648 -0.899992
H 4.226053 1.041679 0.917991
H -9.844866 -1.034477 0.867351
H -10.690078 0.252500 0.001447
H -9.843993 -1.010257 -0.898564
H 8.747721 -1.283877 -0.015857
H 7.424304 -2.043383 0.852754
H 7.424862 -2.023952 -0.901917


%chk=000247385-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247385

0 1
S 7.011204 0.203176 0.019894
O 5.333954 -0.619117 -0.008229
O 7.247291 0.923787 1.451405
O 7.232866 1.046044 -1.345945
C -2.221340 -0.430710 0.000911
C -3.500726 0.436058 -0.001292
C -0.919473 0.401979 0.001842
C -4.803525 -0.395147 -0.000754
C 0.359243 -0.465805 0.001463
C -6.082946 0.471835 -0.004179
C 1.658413 0.371320 0.005633
C -7.386313 -0.358589 -0.002869
C 2.931641 -0.509865 -0.000631
C -8.665692 0.509318 -0.007023
C 4.205511 0.346313 0.011308
C -9.962737 -0.328557 -0.005252
C 7.948275 -1.442688 -0.055488
H -2.229398 -1.097647 -0.886630
H -2.231469 -1.096296 0.889442
H -3.491244 1.101063 -0.890293
H -3.492383 1.103976 0.885533
H -0.910790 1.068674 -0.885725
H -0.911277 1.067415 0.890360
H -4.811990 -1.063727 -0.887131
H -4.813874 -1.059578 0.888719
H 0.352305 -1.128698 -0.888661
H 0.349771 -1.133395 0.888028
H -6.073010 1.135928 -0.893964
H -6.074411 1.140904 0.881882
H 1.665967 1.030103 0.898368
H 1.665082 1.040556 -0.879271
H -7.396485 -1.028025 -0.888662
H -7.398321 -1.022323 0.887184
H 2.934255 -1.175555 0.883258
H 2.937931 -1.156185 -0.898850
H -8.654253 1.178109 0.877925
H -8.652658 1.171922 -0.896597
H 4.256640 0.996947 -0.883281
H 4.259797 0.965351 0.927995
H -10.013732 -0.976967 0.889961
H -10.862236 0.314413 -0.008625
H -10.011831 -0.983683 -0.895668
H 9.015720 -1.183533 -0.047055
H 7.640362 -2.006358 0.834216
H 7.635084 -1.926044 -0.989450


