%chk=000230543.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230543

0 1
O 1.639375 1.010771 -2.000037
O 0.028550 -0.386675 -2.641046
N -3.102670 1.047253 0.166681
C 1.876447 0.436786 0.285260
C 0.526596 -0.172069 -0.185853
C 2.127004 1.572207 -0.735018
C 2.072173 1.024642 1.680128
C 3.600393 1.942246 -0.763355
C -0.698283 0.602533 0.338406
C 3.531394 1.515593 1.783637
C 3.951802 2.465020 0.644024
C 0.645310 0.072727 -1.718055
C 0.414769 -1.639047 0.182699
C -2.027835 0.087704 -0.244691
C -0.019381 -2.606737 -0.733886
C 0.721015 -2.033567 1.496668
C -3.714217 0.640216 1.476454
C -4.147175 1.205525 -0.899608
C -0.128260 -3.946148 -0.348273
C 0.609421 -3.371518 1.879380
C 0.186406 -4.333795 0.956742
C -4.418459 1.836715 2.118984
C -3.571415 1.967855 -2.093438
H 2.652235 -0.363453 0.142052
H 1.488386 2.466916 -0.562093
H 1.865190 0.260464 2.456965
H 1.368537 1.855534 1.872535
H 3.804656 2.709977 -1.533019
H 4.227977 1.073700 -1.038396
H -0.599636 1.684115 0.109057
H -0.725352 0.538241 1.443779
H 4.209860 0.639697 1.796566
H 3.678375 2.026817 2.754024
H 3.474134 3.453259 0.795323
H 5.042473 2.644465 0.703766
H -1.957052 0.045549 -1.357265
H -2.217298 -0.955940 0.084110
H -0.280740 -2.325623 -1.759535
H 1.050071 -1.291160 2.227026
H -4.422075 -0.210821 1.375245
H -2.899141 0.294454 2.150493
H -4.570101 0.233564 -1.234000
H -4.990967 1.789306 -0.466940
H -0.461408 -4.688708 -1.072526
H 0.852022 -3.665759 2.899020
H 0.101975 -5.376896 1.253911
H -3.754916 2.711736 2.145777
H -5.312400 2.134790 1.559316
H -4.723231 1.610016 3.145083
H -4.352710 2.210263 -2.820107
H -2.796702 1.390296 -2.615022
H -3.103525 2.907263 -1.771053


%chk=000230543-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230543

0 1
O 1.691446 0.918861 -2.111890
O 0.053452 -0.590750 -2.739752
N -3.153964 1.084583 0.123309
C 1.895270 0.386857 0.205422
C 0.524548 -0.205399 -0.278102
C 2.174939 1.498475 -0.817463
C 2.116347 0.923222 1.629363
C 3.642370 1.911967 -0.820866
C -0.690175 0.688732 0.151109
C 3.590188 1.414379 1.727253
C 3.966610 2.430726 0.612284
C 0.687154 -0.041235 -1.823304
C 0.370724 -1.665648 0.177446
C -2.055966 0.234633 -0.412303
C 0.689223 -2.762481 -0.664880
C -0.010937 -1.941932 1.518448
C -3.640436 0.611461 1.448231
C -4.257182 1.295992 -0.853481
C 0.627123 -4.089138 -0.181672
C -0.073751 -3.266182 2.002692
C 0.246431 -4.349776 1.153492
C -4.261617 1.734984 2.300196
C -3.884723 2.291218 -1.968580
H 2.647931 -0.412444 0.030761
H 1.540962 2.386490 -0.617156
H 1.928804 0.134982 2.382161
H 1.424012 1.761172 1.844762
H 3.836372 2.699575 -1.571347
H 4.276041 1.040344 -1.073330
H -0.528610 1.736475 -0.163791
H -0.740284 0.708951 1.255853
H 4.260185 0.533619 1.653833
H 3.771028 1.871831 2.718465
H 3.414988 3.378056 0.783527
H 5.042923 2.675744 0.680864
H -2.039211 0.318488 -1.512113
H -2.222504 -0.844403 -0.185497
H 0.962513 -2.587250 -1.709384
H -0.267209 -1.119738 2.196298
H -4.372000 -0.229090 1.336653
H -2.774907 0.191977 1.995817
H -4.592234 0.328426 -1.305968
H -5.124592 1.699129 -0.299251
H 0.870744 -4.919699 -0.853815
H -0.373032 -3.451232 3.040737
H 0.196589 -5.379185 1.525452
H -3.524018 2.540276 2.462974
H -5.146140 2.181936 1.811207
H -4.585796 1.343424 3.282898
H -4.736733 2.434828 -2.659332
H -3.027035 1.936052 -2.567670
H -3.614264 3.268018 -1.530665


