%chk=000260144.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260144

0 1
S -5.759326 -0.725590 -1.301721
S 5.749619 -0.771168 1.303063
O -5.249444 -1.685185 -2.266708
O -6.908562 0.101718 -1.621933
O 5.231951 -1.728889 2.265759
O 6.904683 0.047008 1.625772
O 0.006896 2.319817 0.002262
O -1.296465 4.090963 0.580015
O 1.323874 4.081529 -0.573426
C -4.432600 0.348167 -0.887783
C 4.431157 0.313164 0.890275
C -6.074491 -1.554713 0.190117
C 6.059803 -1.599625 -0.190187
C -4.699277 1.597464 -0.326063
C 4.707473 1.561614 0.331336
C -3.120756 -0.049611 -1.147023
C 3.116210 -0.075481 1.147653
C -2.322436 2.040211 -0.230413
C 2.334024 2.022043 0.234718
C -3.643087 2.449793 0.010968
C 3.657853 2.422381 -0.004780
C -2.056201 0.796103 -0.816646
C 2.058175 0.778727 0.818183
C -7.026511 -1.049445 1.080275
C 7.016392 -1.099757 -1.078494
C -5.398361 -2.742028 0.484934
C 5.374976 -2.781191 -0.488007
C -1.230109 2.978167 0.144589
C 1.248953 2.968775 -0.139271
C -7.282503 -1.716094 2.282233
C 7.268390 -1.765877 -2.281588
C -5.652196 -3.411004 1.686040
C 5.624797 -3.449621 -1.690257
C -6.592175 -2.894980 2.585217
C 6.569438 -2.938891 -2.587570
H -5.732354 1.924108 -0.162976
H 5.743056 1.880980 0.169732
H -2.920605 -1.015982 -1.625314
H 2.908566 -1.041332 1.623795
H -3.838934 3.431602 0.452082
H 3.861276 3.403617 -0.443742
H -1.024061 0.497078 -1.016183
H 1.023701 0.486908 1.016313
H -7.584158 -0.139557 0.832693
H 7.580676 -0.194609 -0.828577
H -4.679962 -3.158755 -0.228856
H 4.652824 -3.193928 0.224309
H -8.023022 -1.322366 2.977202
H 8.012470 -1.376343 -2.975117
H -5.125143 -4.335529 1.917469
H 5.090973 -4.369661 -1.924027
H -6.791572 -3.416464 3.522561
H 6.765706 -3.459960 -3.525805


%chk=000260144-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260144

0 1
S -6.258258 -0.457805 -1.204780
S 6.246870 -0.509989 1.209638
O -5.798438 -1.489355 -2.390658
O -7.451109 0.650803 -1.371381
O 5.775262 -1.542119 2.390389
O 7.447679 0.588792 1.384012
O 0.005671 2.064238 -0.001191
O -1.233512 3.900500 0.796048
O 1.260905 3.890673 -0.795916
C -4.691799 0.513082 -0.720049
C 4.689323 0.474301 0.723154
C -6.687884 -1.508865 0.318163
C 6.673378 -1.558799 -0.315716
C -4.852123 1.766200 -0.106095
C 4.860843 1.727033 0.111442
C -3.447835 -0.036896 -1.065934
C 3.440344 -0.066419 1.065503
C -2.407673 1.957536 -0.094840
C 2.418016 1.937632 0.095266
C -3.687787 2.491783 0.214735
C 3.702954 2.462197 -0.210923
C -2.288786 0.699872 -0.742650
C 2.287848 0.680011 0.740981
C -7.585515 -0.968483 1.251949
C 7.578529 -1.022030 -1.244306
C -6.141850 -2.798990 0.403544
C 6.117318 -2.844160 -0.407986
C -1.217953 2.777701 0.268099
C 1.235521 2.767716 -0.268712
C -7.928963 -1.770150 2.365737
C 7.919410 -1.822097 -2.360026
C -6.497641 -3.584534 1.525009
C 6.470703 -3.628182 -1.531276
C -7.381157 -3.067901 2.502622
C 7.361706 -3.114874 -2.503833
H -5.853237 2.166357 0.083540
H 5.865451 2.119659 -0.075429
H -3.398737 -0.993473 -1.596364
H 3.382693 -1.023504 1.594158
H -3.748883 3.473928 0.694081
H 3.772799 3.444486 -0.688777
H -1.297264 0.315946 -0.995090
H 1.292781 0.303614 0.990781
H -8.018969 0.024966 1.095320
H 8.019406 -0.032725 -1.082251
H -5.491424 -3.181700 -0.389987
H 5.460995 -3.224634 0.381758
H -8.627255 -1.385450 3.116122
H 8.623355 -1.440109 -3.106503
H -6.094372 -4.597227 1.627845
H 6.059687 -4.637199 -1.639461
H -7.654282 -3.683628 3.366373
H 7.632862 -3.729428 -3.369040


