%chk=000225668.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225668

0 1
S 1.156682 -2.595360 -0.789858
S -1.115110 -2.366213 1.792631
P -0.041538 -1.479196 0.508665
O -0.785297 -0.519885 -0.632064
O 0.985439 -0.363974 1.187523
C -1.629194 1.804955 0.924501
C 1.576375 1.618239 -0.860543
C -2.594181 0.847246 0.261029
C 2.610575 0.666450 -0.301109
C -2.161598 -0.288228 -0.444130
C 2.291075 -0.300983 0.666417
C -1.715756 1.677307 2.448374
C -1.885061 3.247271 0.466924
C 1.215831 1.236370 -2.299660
C 2.060938 3.070924 -0.768625
C -3.981536 1.054224 0.323110
C 3.951309 0.719289 -0.715358
C -3.034226 -1.169703 -1.090550
C 3.242989 -1.144133 1.250961
C -4.413142 -0.928605 -1.017706
C 4.575390 -1.055998 0.825931
C -4.878500 0.186432 -0.300860
C 4.918109 -0.125776 -0.170038
C -5.368103 -1.861810 -1.686423
C 5.609114 -1.944846 1.434784
H -0.572791 1.541352 0.605532
H 0.634914 1.538372 -0.231427
H -2.689700 1.996643 2.832588
H -0.947710 2.284371 2.939387
H -1.565567 0.639612 2.774402
H -1.874521 3.321911 -0.626374
H -1.113723 3.921439 0.855043
H -2.852014 3.625183 0.814396
H 2.098712 1.156704 -2.940530
H 0.544223 1.976800 -2.747793
H 0.689671 0.272070 -2.331829
H 2.405361 3.309789 0.244184
H 1.252130 3.767347 -1.015951
H 2.887924 3.274572 -1.456361
H -4.363753 1.914738 0.874107
H 4.240615 1.442746 -1.479128
H -2.645119 -2.021992 -1.641795
H 2.951242 -1.844577 2.031653
H -5.947402 0.375799 -0.228037
H 5.947473 -0.057948 -0.516306
H -5.054321 -2.101177 -2.712039
H -5.431980 -2.813011 -1.135844
H -6.386033 -1.455703 -1.747617
H 6.599041 -1.824156 0.976417
H 5.723854 -1.739928 2.509796
H 5.334582 -3.005240 1.335761
H 0.579911 -3.810713 -0.546261


%chk=000225668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225668

0 1
S 0.385576 -2.010716 -2.239579
S -0.421308 -2.354832 1.380867
P -0.115264 -1.066105 -0.191891
O -1.387931 0.027334 -0.687620
O 1.055135 0.227908 -0.002071
C -2.081209 1.459581 1.731394
C 2.539769 1.394181 -2.150158
C -3.102315 0.612799 0.969371
C 3.223597 0.573552 -1.055517
C -2.726478 -0.103776 -0.198246
C 2.464728 -0.017291 -0.008925
C -2.488438 1.752543 3.192331
C -1.799103 2.779756 0.957902
C 3.381293 1.527960 -3.438761
C 2.147336 2.795047 -1.597893
C -4.468660 0.524141 1.331878
C 4.626039 0.389353 -0.979131
C -3.631049 -0.861963 -0.964258
C 3.045717 -0.739050 1.053014
C -4.992860 -0.940708 -0.583513
C 4.450436 -0.914018 1.107467
C -5.393732 -0.231326 0.576334
C 5.228320 -0.340271 0.071094
C -5.977985 -1.773471 -1.385017
C 5.093323 -1.671234 2.256392
H -1.128450 0.893342 1.759251
H 1.597588 0.873985 -2.411092
H -3.376147 2.410842 3.246636
H -1.663534 2.273052 3.711545
H -2.710701 0.823311 3.747879
H -1.432163 2.565636 -0.060305
H -1.030946 3.375149 1.485364
H -2.718171 3.390488 0.880493
H 4.287452 2.141401 -3.274874
H 2.785450 2.028915 -4.222993
H 3.694892 0.541347 -3.825919
H 1.479655 2.698030 -0.724576
H 1.619516 3.378927 -2.374733
H 3.047041 3.361103 -1.291648
H -4.818404 1.052595 2.224332
H 5.261750 0.815426 -1.761859
H -3.264829 -1.384240 -1.855375
H 2.400891 -1.158342 1.833515
H -6.442409 -0.272790 0.894221
H 6.317769 -0.463561 0.086542
H -5.860191 -1.606999 -2.471057
H -5.826606 -2.854742 -1.202349
H -7.020698 -1.533614 -1.114615
H 6.148065 -1.912368 2.039007
H 5.073370 -1.074065 3.188245
H 4.562308 -2.617463 2.465896
H 0.998167 -3.115761 -1.667095


