%chk=000179184.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179184

0 1
O -2.272899 0.458090 -0.359597
O -1.411328 -1.514737 0.390311
O 2.587224 1.204485 -0.339750
C -3.832015 -1.325422 -0.174043
C -4.204923 -1.132709 -1.647475
C -3.925500 -2.801571 0.225705
C -4.699085 -0.454643 0.741098
C -2.360283 -0.889823 0.006451
C -1.098960 1.205460 -0.361092
C 0.184970 0.663363 -0.284624
C 1.250779 1.568168 -0.341097
C -1.339059 2.583446 -0.492919
C 1.063142 2.955464 -0.475119
C -0.241159 3.445226 -0.553514
C 2.980042 -0.063605 0.113726
C 2.511540 -0.617045 1.309266
C 3.973477 -0.668231 -0.667755
C 3.063694 -1.830918 1.727626
C 4.512667 -1.876088 -0.220700
C 4.058770 -2.458199 0.969278
H -4.078591 -0.085702 -1.958442
H -3.588190 -1.748424 -2.312631
H -5.251035 -1.405002 -1.828953
H -3.278402 -3.435135 -0.394747
H -4.950581 -3.174112 0.121556
H -3.618194 -2.963602 1.267020
H -4.587909 0.612206 0.500340
H -5.760722 -0.706102 0.635076
H -4.438434 -0.581434 1.798326
H 0.343851 -0.412954 -0.192018
H -2.357743 2.954498 -0.549257
H 1.925514 3.615453 -0.517493
H -0.406562 4.518700 -0.659231
H 1.742068 -0.117638 1.894586
H 4.307131 -0.195604 -1.588538
H 2.714191 -2.288995 2.652948
H 5.288675 -2.368876 -0.805929
H 4.481239 -3.402788 1.305312


%chk=000179184-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179184

0 1
O -2.318217 0.490255 -0.397973
O -1.449569 -1.586383 0.281478
O 2.626174 1.145865 -0.525180
C -3.885941 -1.336704 -0.183793
C -4.366725 -1.108819 -1.647046
C -3.968828 -2.838485 0.180097
C -4.760894 -0.496519 0.792524
C -2.420844 -0.882077 -0.061879
C -1.109695 1.250506 -0.395028
C 0.189023 0.693342 -0.401594
C 1.286327 1.586698 -0.437349
C -1.323242 2.646604 -0.439414
C 1.105981 2.986359 -0.483394
C -0.205896 3.506121 -0.488298
C 3.055995 -0.088441 0.030883
C 2.548921 -0.609391 1.243736
C 4.115510 -0.725535 -0.651458
C 3.109719 -1.797568 1.762960
C 4.669537 -1.908269 -0.116035
C 4.167172 -2.452106 1.089901
H -4.313900 -0.042133 -1.921392
H -3.755200 -1.686288 -2.364204
H -5.414793 -1.447612 -1.742035
H -3.345012 -3.448906 -0.495493
H -5.016688 -3.178963 0.096502
H -3.620363 -3.020257 1.211470
H -4.717056 0.576500 0.542070
H -5.811188 -0.833873 0.721483
H -4.430215 -0.626655 1.839150
H 0.336725 -0.386082 -0.377370
H -2.346713 3.031061 -0.437571
H 1.985052 3.635523 -0.518271
H -0.358630 4.589589 -0.525432
H 1.739752 -0.101187 1.776369
H 4.487494 -0.285337 -1.581527
H 2.717177 -2.207639 2.699903
H 5.491027 -2.405422 -0.643495
H 4.595423 -3.372575 1.500405


