%chk=000292613.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292613

0 1
O 0.285448 -2.377906 -1.750146
O 1.877020 -0.558426 0.762642
O -0.989381 0.670191 -0.743621
O -2.854393 -2.201913 0.150905
O -2.096674 1.055840 1.192381
O 5.180960 -1.395502 2.161717
O -4.016435 -2.024087 -1.777261
N 2.337065 -2.541869 -0.484611
N 4.142784 -0.997764 0.164043
C -0.462933 -0.571300 -0.219291
C 1.058954 -0.513046 -0.405524
C -0.927089 -1.676115 -1.220386
C 1.325079 -1.920468 -1.000644
C -1.748862 -2.791443 -0.569790
C 2.902019 -1.641441 0.566350
C -1.809409 1.438870 0.083790
C 5.244759 -0.916935 1.048679
C -2.211844 2.675591 -0.616373
C -3.981220 -1.840536 -0.583247
C 6.429959 -0.207344 0.474845
C -4.998668 -1.260485 0.316742
C -2.920907 3.643855 0.115631
C -1.908934 2.890482 -1.969821
C 6.911203 0.936442 1.125177
C 7.070806 -0.700442 -0.669182
C -3.322270 4.824954 -0.510552
C -2.315858 4.074580 -2.588582
C -6.348372 -1.337285 -0.068138
C -4.635042 -0.637953 1.519898
C -3.020474 5.039702 -1.860465
C 8.032730 1.597569 0.616210
C 8.194678 -0.036930 -1.168752
C -7.331966 -0.797904 0.761391
C -5.627692 -0.098140 2.342555
C 8.672858 1.112081 -0.528921
C -6.971703 -0.180692 1.966175
H -0.799067 -0.734520 0.831144
H 1.371917 0.351237 -1.024644
H -1.413802 -1.247012 -2.124337
H -1.197165 -3.326977 0.227613
H -2.119805 -3.513112 -1.324212
H 2.976801 -2.146722 1.563437
H 4.182074 -0.562411 -0.754474
H -3.152871 3.464016 1.168968
H -1.358637 2.130514 -2.530277
H 6.416229 1.301431 2.026956
H 6.703888 -1.602766 -1.159834
H -3.871484 5.579055 0.052512
H -2.084920 4.245305 -3.639677
H -6.616983 -1.815154 -1.013067
H -3.577302 -0.566646 1.803192
H -3.336701 5.963360 -2.347024
H 8.410667 2.488260 1.116865
H 8.700493 -0.417871 -2.055096
H -8.380073 -0.856311 0.471150
H -5.348599 0.386913 3.277645
H 9.549217 1.627536 -0.921524
H -7.743877 0.238344 2.611962


%chk=000292613-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292613

0 1
O 0.485678 -2.857237 -0.580445
O 2.181047 -0.083870 0.842655
O -1.035130 0.477144 -0.231183
O -3.017786 -1.999491 0.463046
O -1.885752 0.918456 1.906626
O 5.524222 -0.051427 2.195949
O -3.750417 -2.466795 -1.703372
N 2.658851 -2.447954 0.408365
N 4.479122 -0.845686 0.272567
C -0.290441 -0.677282 0.285398
C 1.200444 -0.599846 -0.094299
C -0.749211 -1.964267 -0.491026
C 1.541513 -2.082180 -0.140110
C -1.814300 -2.819597 0.203683
C 3.269262 -1.210048 0.952244
C -1.799549 1.228568 0.697198
C 5.569500 -0.286637 0.952383
C -2.454147 2.394390 0.046786
C -3.941748 -1.902011 -0.598671
C 6.783109 0.019364 0.117176
C -5.121846 -1.077515 -0.227631
C -3.207698 3.271749 0.870594
C -2.342913 2.649104 -1.345152
C 7.705573 0.965686 0.632678
C 7.054834 -0.611844 -1.125476
C -3.844406 4.394699 0.306314
C -2.985417 3.772817 -1.905167
C -6.169112 -0.952131 -1.178628
C -5.217993 -0.423228 1.029319
C -3.735009 4.646963 -1.082449
C 8.867798 1.296368 -0.093322
C 8.223236 -0.285196 -1.847977
C -7.307938 -0.180908 -0.872546
C -6.360374 0.347943 1.327742
C 9.127955 0.674553 -1.337868
C -7.405591 0.469676 0.381355
H -0.437133 -0.765320 1.377172
H 1.285671 -0.110528 -1.087605
H -1.055699 -1.702796 -1.518302
H -1.471912 -3.146512 1.197495
H -2.077051 -3.685690 -0.427181
H 3.478878 -1.282683 2.029549
H 4.506468 -0.937840 -0.743856
H -3.276594 3.057370 1.942219
H -1.758907 1.969382 -1.971101
H 7.490082 1.421157 1.604661
H 6.391395 -1.391313 -1.520034
H -4.422236 5.072721 0.943255
H -2.902053 3.969027 -2.979398
H -6.070308 -1.464064 -2.141567
H -4.402650 -0.518906 1.751834
H -4.230444 5.520475 -1.520863
H 9.571021 2.033539 0.308835
H 8.432968 -0.785487 -2.799579
H -8.116720 -0.085703 -1.604850
H -6.435583 0.854154 2.295954
H 10.033111 0.927857 -1.900813
H -8.291473 1.069529 0.618520


