%chk=000268755.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268755

0 1
O -1.069768 1.047818 -1.082836
O 1.083692 0.940502 -1.291656
O -5.203139 1.143296 -3.457260
O 3.646533 -2.724583 0.935583
O -6.901801 0.388800 -2.222062
O 5.737796 -2.041556 1.312685
O 0.112754 -0.182395 0.496855
N -6.358047 0.104431 0.484243
N 6.497508 0.299207 -0.017582
N -6.888085 -1.009728 0.648858
N 7.326141 -0.280882 -0.742350
C -4.662395 0.536509 -1.248041
C 4.199899 -0.613099 0.056923
C -4.976156 0.175727 0.082546
C 5.115459 0.348675 -0.418405
C -2.347181 0.676321 -0.607304
C 2.413606 0.678790 -0.894771
C -3.327043 0.786459 -1.597120
C 2.824122 -0.443365 -0.184997
C -3.959563 0.058257 1.051975
C 4.663475 1.474808 -1.144049
C -2.633807 0.313089 0.714511
C 3.308217 1.651102 -1.381089
C -5.722770 0.652225 -2.276151
C 4.661296 -1.798844 0.816789
C 0.050077 0.502738 -0.487558
C -8.297396 -1.036837 0.976210
C 8.685696 -0.381273 -0.257349
C -9.244613 -0.354837 0.193373
C 8.971781 -0.915544 1.010669
C -8.693472 -1.873212 2.034361
C 9.713817 -0.040407 -1.153332
C -10.601957 -0.516032 0.479377
C 10.304964 -1.107516 1.379375
C -10.054850 -2.012848 2.310002
C 11.040028 -0.230960 -0.761339
C -11.006830 -1.338263 1.536176
C 11.336319 -0.762937 0.499381
H -3.057094 1.070149 -2.621686
H 2.104819 -1.186074 0.191239
H -4.216810 -0.234118 2.072645
H 5.386977 2.206325 -1.510522
H -1.836416 0.215765 1.460116
H 2.927135 2.510759 -1.936829
H -8.913256 0.278527 -0.635593
H 8.154067 -1.188571 1.685298
H -7.948134 -2.403056 2.626166
H 9.476123 0.363799 -2.136455
H -11.345950 0.003796 -0.123742
H 10.539221 -1.525619 2.358132
H -10.376592 -2.653553 3.130331
H 11.847763 0.033337 -1.443010
H -12.066796 -1.456451 1.756894
H 12.374187 -0.911013 0.794660
H -5.899716 1.228154 -4.164930
H 3.931863 -3.528992 1.450845


%chk=000268755-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268755

0 1
O -1.063752 0.561340 -1.052931
O 1.121318 0.519763 -1.026360
O -5.026175 2.533946 -3.039648
O 3.659727 -1.955201 2.647174
O -6.843003 1.159082 -2.602863
O 5.753933 -2.419894 1.763781
O -0.016065 -0.824193 0.555436
N -6.611458 -0.014491 -0.068476
N 6.602945 -0.309242 0.139262
N -7.035587 -1.062389 0.587309
N 7.435183 -0.081573 -0.842709
C -4.721107 0.816699 -1.397739
C 4.253649 -0.840326 0.611606
C -5.207816 -0.001732 -0.327406
C 5.224358 -0.190043 -0.212549
C -2.429766 0.294963 -0.728258
C 2.468380 0.204435 -0.670535
C -3.328207 0.964659 -1.579305
C 2.868456 -0.632912 0.388465
C -4.273013 -0.664319 0.512921
C 4.780137 0.648794 -1.273619
C -2.886051 -0.531580 0.326766
C 3.413187 0.844413 -1.505960
C -5.655461 1.469511 -2.360299
C 4.673310 -1.794095 1.681170
C 0.010137 -0.014589 -0.390027
C -8.436286 -1.035731 0.889406
C 8.816354 -0.152654 -0.468059
C -9.350365 -0.073213 0.371792
C 9.282421 -0.614474 0.796696
C -8.895183 -2.078743 1.736445
C 9.738906 0.242054 -1.472678
C -10.709912 -0.157793 0.722487
C 10.666213 -0.658905 1.044993
C -10.258940 -2.148950 2.088992
C 11.123911 0.201570 -1.210217
C -11.167909 -1.189115 1.583530
C 11.589645 -0.247824 0.048398
H -2.944101 1.592032 -2.385957
H 2.141825 -1.130278 1.029884
H -4.666186 -1.276556 1.329937
H 5.536380 1.143943 -1.889136
H -2.181165 -1.047309 0.979870
H 3.053301 1.487104 -2.314451
H -8.971326 0.702312 -0.301033
H 8.548118 -0.939136 1.540437
H -8.168459 -2.811914 2.101743
H 9.346565 0.574428 -2.439502
H -11.422075 0.572949 0.323424
H 11.035053 -1.019977 2.011423
H -10.614055 -2.948676 2.747560
H 11.837069 0.511470 -1.981402
H -12.229239 -1.246971 1.849972
H 12.665716 -0.287367 0.251494
H -5.673859 2.917196 -3.690253
H 3.966024 -2.623700 3.317201


