%chk=000265410.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265410

0 1
S -3.811075 1.234657 0.686326
S 3.813577 -1.239408 0.692577
O -2.748737 0.295359 -0.224760
O 2.752527 -0.300266 -0.220380
O -3.658449 2.583429 0.194797
O -3.529450 0.943569 2.071923
O 3.661857 -2.588132 0.200750
O 3.529556 -0.948164 2.077634
C -1.331759 0.593942 -0.151251
C 1.335477 -0.598942 -0.148992
C -0.761894 -0.045179 1.122674
C -0.760845 -0.039203 -1.429569
C 0.763610 0.040593 1.123834
C 0.766458 0.033654 -1.428436
C -5.295145 0.542110 0.187485
C 5.298035 -0.546226 0.195797
C -5.831249 -0.546922 0.886588
C 5.833491 0.541996 0.896652
C -5.975090 1.062470 -0.921126
C 5.978788 -1.065034 -0.913043
C -7.037511 -1.115452 0.480434
C 7.040703 1.110272 0.492967
C -7.181738 0.498184 -1.331702
C 7.186362 -0.500963 -1.321194
C -7.720777 -0.598422 -0.634912
C 7.726446 0.592709 -0.620610
C -9.017360 -1.196759 -1.064453
C 9.009752 1.208771 -1.064712
H -1.200654 1.699537 -0.156443
H 1.204455 -1.704551 -0.153974
H -1.096165 -1.099343 1.194324
H -1.180851 0.446777 2.027051
H -1.175559 0.472512 -2.318625
H -1.108038 -1.089453 -1.504889
H 1.097779 1.094768 1.195682
H 1.181170 -0.451103 2.029006
H 1.182470 -0.478495 -2.316637
H 1.113745 1.083862 -1.503689
H -5.305779 -0.950646 1.760318
H 5.306805 0.945212 1.769888
H -5.562134 1.920603 -1.464638
H 5.565804 -1.921846 -1.458601
H -7.449996 -1.960576 1.028926
H 7.451450 1.956288 1.041381
H -7.706763 0.908319 -2.192578
H 7.710764 -0.908348 -2.183752
H -9.191668 -1.096201 -2.145083
H -9.086774 -2.268187 -0.828508
H -9.860816 -0.701862 -0.556476
H 9.572921 1.657203 -0.233949
H 9.679863 0.485524 -1.550641
H 8.822211 2.012563 -1.794892


%chk=000265410-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265410

0 1
S -4.011261 1.035782 0.939713
S 4.004914 -1.026599 0.958789
O -2.844352 -0.025675 -0.067042
O 2.850190 0.054471 -0.041708
O -3.767171 2.577977 0.494681
O -3.936553 0.626669 2.507563
O 3.738309 -2.563403 0.507460
O 3.939056 -0.622576 2.528184
C -1.420148 0.399141 0.042549
C 1.424684 -0.370198 0.046503
C -0.760011 -0.164218 1.315579
C -0.750191 -0.134911 -1.239747
C 0.753487 0.165379 1.325685
C 0.766697 0.193123 -1.229484
C -5.595585 0.378271 0.195414
C 5.596112 -0.387279 0.213024
C -6.234240 -0.686293 0.849532
C 6.255124 0.660282 0.874133
C -6.089423 0.988225 -0.968248
C 6.077385 -0.997861 -0.955664
C -7.441707 -1.162572 0.294628
C 7.469814 1.119392 0.320142
C -7.299581 0.492624 -1.499864
C 7.294813 -0.519592 -1.486239
C -7.989872 -0.584259 -0.881315
C 8.001495 0.545417 -0.865348
C -9.305508 -1.084930 -1.447361
C 9.291965 1.069439 -1.466982
H -1.380046 1.509889 0.043863
H 1.383297 -1.480644 0.022974
H -0.914326 -1.260968 1.336702
H -1.247702 0.248785 2.216594
H -1.231464 0.311673 -2.127847
H -0.903491 -1.230062 -1.292184
H 0.907838 1.261321 1.372644
H 1.232871 -0.267502 2.221903
H 1.255667 -0.233636 -2.123113
H 0.920679 1.289097 -1.255871
H -5.808831 -1.114445 1.762536
H 5.843182 1.083742 1.795490
H -5.556448 1.825387 -1.429566
H 5.533151 -1.827551 -1.417368
H -7.962994 -1.994343 0.781626
H 8.010593 1.932927 0.816565
H -7.711497 0.948036 -2.407493
H 7.700473 -0.980614 -2.393905
H -9.356499 -0.947158 -2.541164
H -9.461201 -2.155103 -1.227547
H -10.156948 -0.531326 -1.006292
H 9.953189 1.502035 -0.696691
H 9.848803 0.273597 -1.991085
H 9.083060 1.866237 -2.206845


