%chk=000210791.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210791

0 1
O 3.362586 1.645979 -0.514634
O 0.639677 1.676720 0.853923
O -3.802706 1.328801 -0.367240
N 0.799518 -1.392550 0.491887
N -2.607238 -0.637516 -0.313393
N -1.575441 1.508667 0.238985
N -1.038476 -2.593017 -0.159506
C 2.179025 -1.014393 0.852332
C -0.252342 -0.474923 0.324453
C 3.034377 -0.768310 -0.396877
C -1.379172 -1.248812 -0.074284
C 4.016474 0.406619 -0.201698
C -0.281972 0.956041 0.507274
C 0.291899 -2.646130 0.180222
C -2.739303 0.777305 -0.162363
C 5.186190 0.347448 -1.176842
C -3.777678 -1.448259 -0.728771
C -1.761624 2.980229 0.377252
H 2.622636 -1.811553 1.489660
H 2.126706 -0.086666 1.484073
H 3.581617 -1.686457 -0.678078
H 2.395091 -0.531772 -1.276953
H 4.373219 0.464999 0.851859
H 0.867712 -3.563308 0.210718
H 4.840738 0.270620 -2.215972
H 5.768164 1.280009 -1.121682
H 5.858472 -0.488489 -0.968599
H -4.662121 -0.797663 -0.870002
H -4.008911 -2.206341 0.041050
H -3.562124 -1.971464 -1.677768
H -0.811324 3.454375 0.688177
H -2.535828 3.200004 1.132822
H -2.081758 3.418544 -0.584237
H 2.525817 1.757265 0.002912


%chk=000210791-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210791

0 1
O 3.614540 1.216872 1.005799
O 0.891629 1.624335 0.355064
O -3.715337 1.403505 -0.551347
N 0.776931 -1.531740 0.489589
N -2.594506 -0.636800 -0.250851
N -1.418218 1.467154 -0.084953
N -1.196595 -2.638417 0.121938
C 2.208948 -1.295844 0.783467
C -0.200508 -0.549789 0.237558
C 2.982942 -0.715877 -0.425760
C -1.393092 -1.269805 0.021439
C 4.119442 0.237454 0.034711
C -0.138297 0.887968 0.191263
C 0.130163 -2.750418 0.405233
C -2.647816 0.773966 -0.311197
C 4.788444 0.934897 -1.164523
C -3.822627 -1.426773 -0.472424
C -1.513963 2.945342 -0.153994
H 2.635381 -2.257845 1.116893
H 2.280660 -0.576262 1.618682
H 3.393980 -1.524020 -1.059129
H 2.284140 -0.131370 -1.053371
H 4.883045 -0.333577 0.597980
H 0.646592 -3.695510 0.556224
H 4.046290 1.521131 -1.738300
H 5.567345 1.627905 -0.803833
H 5.258828 0.202858 -1.848733
H -4.641713 -0.720234 -0.668971
H -4.046149 -2.033621 0.420571
H -3.685166 -2.102981 -1.332325
H -0.512064 3.351629 0.043191
H -2.234958 3.309071 0.595766
H -1.868513 3.253024 -1.151066
H 2.712122 1.539772 0.714110


