%chk=000279672.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279672

0 1
S 0.795992 -0.979917 0.435437
O 0.798871 -1.877947 1.570021
O 0.689513 -1.500931 -0.904171
O -0.415025 2.525900 1.076404
O 0.122221 1.814052 -1.007338
N 2.184071 0.040065 0.562217
C 3.260241 -0.426113 1.493785
C 2.859683 0.388520 -0.729749
C 4.429197 -0.940732 0.627251
C 4.158807 -0.438861 -0.803670
C -0.508975 0.222471 0.747663
C -1.826729 -0.317548 0.261656
C -0.219298 1.555760 0.121354
C -2.837817 -0.612973 1.188521
C -2.051926 -0.517493 -1.109596
C -4.066563 -1.107736 0.742329
C -3.283102 -1.010584 -1.546568
C -4.292021 -1.305288 -0.623402
C -0.181444 3.901289 0.666228
H 2.893152 -1.197561 2.204677
H 3.571946 0.453487 2.098811
H 3.078525 1.478698 -0.701172
H 2.198286 0.216656 -1.606648
H 4.486163 -2.043056 0.653027
H 5.395599 -0.571494 1.007609
H 4.995636 0.168117 -1.185217
H 4.044871 -1.286967 -1.502709
H -0.568322 0.373049 1.869098
H -2.670199 -0.465105 2.254316
H -1.256808 -0.305683 -1.833141
H -4.848799 -1.341150 1.463181
H -3.452828 -1.169885 -2.611037
H -5.249830 -1.691558 -0.967678
H -0.744221 4.122687 -0.246707
H 0.891385 4.048576 0.509345
H -0.552754 4.471456 1.524570


%chk=000279672-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279672

0 1
S 0.737356 -0.861951 0.600161
O 0.886483 -1.642537 2.030175
O 0.567356 -1.727842 -0.772458
O -0.107215 2.593082 1.283429
O -0.318018 2.035674 -0.973438
N 2.235404 0.454972 0.428078
C 3.281877 0.107111 1.459670
C 2.866833 0.229315 -0.919709
C 4.496520 -0.524694 0.709676
C 3.953809 -0.848471 -0.709567
C -0.944922 0.437226 0.811320
C -2.100794 -0.256398 0.202155
C -0.439685 1.736291 0.238250
C -2.929368 -1.050715 1.047221
C -2.389016 -0.186526 -1.190670
C -4.035331 -1.742186 0.517132
C -3.499713 -0.878863 -1.713329
C -4.324952 -1.655462 -0.866056
C 0.540175 3.862380 0.878678
H 2.842443 -0.578841 2.210509
H 3.544616 1.045957 1.980101
H 3.307144 1.204221 -1.210342
H 2.100587 -0.041568 -1.664538
H 4.874631 -1.424244 1.223279
H 5.325814 0.203300 0.643271
H 4.739660 -0.813524 -1.483364
H 3.483174 -1.848073 -0.740036
H -0.938704 0.454484 1.909936
H -2.698428 -1.122229 2.116680
H -1.743855 0.407748 -1.843292
H -4.667533 -2.348425 1.174516
H -3.718649 -0.821960 -2.784989
H -5.184216 -2.194749 -1.280275
H -0.091866 4.404409 0.155697
H 1.517041 3.635866 0.418756
H 0.658840 4.429423 1.812070


