%chk=000242413.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242413

0 1
S -3.048857 0.625463 -1.024994
C 2.109230 0.097763 -0.454094
C 0.812786 0.325012 0.334797
C 3.331585 0.065643 0.473269
C -0.408478 0.356004 -0.597735
C 4.627635 -0.161493 -0.316227
C -1.690794 0.580498 0.193103
C -4.576684 0.413743 -0.028593
C 5.851948 -0.193869 0.609488
C -4.583045 -0.937288 0.686240
C -4.724215 1.579590 0.932785
C 7.144733 -0.419559 -0.171463
C -4.702250 -2.113068 -0.278676
H 2.043226 -0.850133 -1.022650
H 2.233338 0.894883 -1.212652
H 0.879118 1.273864 0.901260
H 0.689048 -0.472726 1.092215
H 3.208334 -0.731768 1.231223
H 3.398403 1.013722 1.040986
H -0.276372 1.153973 -1.357721
H -0.467085 -0.593807 -1.168730
H 4.752570 0.634925 -1.074860
H 4.562748 -1.109021 -0.884864
H -1.663021 1.532981 0.751765
H -1.864834 -0.229844 0.925062
H -5.390982 0.445958 -0.796755
H 5.919497 0.754694 1.177317
H 5.729483 -0.991985 1.367606
H -5.430015 -0.964406 1.404267
H -3.671930 -1.053396 1.308608
H -5.708775 1.572874 1.419004
H -4.630212 2.545748 0.417064
H -3.972795 1.566093 1.731022
H 7.316263 0.375151 -0.906390
H 7.126423 -1.370275 -0.716324
H 8.012642 -0.441141 0.496909
H -3.866751 -2.136501 -0.992126
H -4.699691 -3.067778 0.258388
H -5.626224 -2.067026 -0.865825


%chk=000242413-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242413

0 1
S -3.129635 0.498085 -1.137558
C 2.187000 0.082336 -0.467990
C 0.854355 0.291970 0.287002
C 3.422656 0.086928 0.460158
C -0.373862 0.280584 -0.654429
C 4.754165 -0.127019 -0.294787
C -1.696716 0.481340 0.107165
C -4.662256 0.424573 0.014899
C 5.990733 -0.126132 0.632980
C -4.821675 -0.954234 0.696115
C -4.668007 1.591913 1.018719
C 7.316355 -0.342069 -0.128856
C -5.053629 -2.118351 -0.288075
H 2.146899 -0.879714 -1.020147
H 2.301818 0.876097 -1.235377
H 0.891647 1.255894 0.836134
H 0.739330 -0.501581 1.054745
H 3.306499 -0.705490 1.229227
H 3.464707 1.050041 1.010964
H -0.261183 1.078804 -1.415422
H -0.410852 -0.679567 -1.206052
H 4.873281 0.665912 -1.062789
H 4.712791 -1.089258 -0.847115
H -1.691845 1.439827 0.655164
H -1.863178 -0.343267 0.823160
H -5.482218 0.563607 -0.717039
H 6.031675 0.835867 1.183822
H 5.870010 -0.918038 1.400421
H -5.679365 -0.884085 1.398270
H -3.930299 -1.159615 1.322552
H -5.626731 1.613406 1.572834
H -4.540728 2.560123 0.504479
H -3.857566 1.486041 1.763003
H 7.475944 0.454726 -0.879864
H 7.312000 -1.310087 -0.664811
H 8.184093 -0.339128 0.556326
H -4.215949 -2.188411 -1.004732
H -5.140515 -3.081801 0.246757
H -5.983750 -1.966727 -0.868153


