%chk=000244507.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244507

0 1
O 0.699399 1.309684 0.932647
O 0.728374 0.648752 -1.300872
O 1.892603 -1.615002 1.715265
O 2.088915 -2.264593 -0.338039
N 2.133472 -1.424853 0.539083
C 2.624017 -0.010301 0.132519
C 0.353236 1.705099 -0.405239
C 2.091768 1.039576 1.133270
C 2.121809 0.320094 -1.291486
C -1.182732 1.818298 -0.497644
C 4.149442 -0.074543 0.171477
C -1.913043 0.506981 -0.291966
C -1.672660 2.864812 0.507422
C -2.909546 0.132723 -1.207012
C -1.635002 -0.321747 0.804274
C -3.617624 -1.058383 -1.024094
C -2.342407 -1.513285 0.980408
C -3.336574 -1.883555 0.069003
H 0.894292 2.635747 -0.665558
H 2.106240 0.665575 2.180911
H 2.663974 1.980775 1.057486
H 2.700817 1.151298 -1.730351
H 2.154351 -0.566464 -1.963995
H -1.394297 2.184310 -1.539615
H 4.546616 -0.835494 -0.518047
H 4.603269 0.883052 -0.115301
H 4.527933 -0.320024 1.174915
H -2.767860 2.933285 0.497642
H -1.273214 3.860674 0.294714
H -1.375676 2.594382 1.531679
H -3.131970 0.762663 -2.065026
H -0.850688 -0.040165 1.512393
H -4.387108 -1.345124 -1.737951
H -2.112667 -2.157314 1.827949
H -3.884860 -2.812337 0.207335


%chk=000244507-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244507

0 1
O 0.733108 1.211192 1.008322
O 0.735620 0.543792 -1.308473
O 1.939654 -1.621582 1.711263
O 2.345106 -2.305160 -0.419623
N 2.278760 -1.405665 0.494057
C 2.741400 0.040921 0.094177
C 0.334864 1.576850 -0.354867
C 2.187074 1.059227 1.113536
C 2.190466 0.362577 -1.315599
C -1.190633 1.754781 -0.430448
C 4.284493 0.002613 0.101399
C -1.989438 0.460491 -0.249387
C -1.640072 2.857441 0.564535
C -2.883577 0.046303 -1.267931
C -1.902232 -0.317952 0.934783
C -3.677062 -1.113361 -1.113953
C -2.689139 -1.480256 1.088421
C -3.582352 -1.882212 0.067842
H 0.862096 2.529673 -0.618677
H 2.381253 0.735294 2.145918
H 2.690486 2.033167 0.921336
H 2.695250 1.289539 -1.669225
H 2.389119 -0.464042 -2.012632
H -1.377102 2.119522 -1.459929
H 4.657583 -0.746644 -0.617511
H 4.686971 0.990968 -0.181945
H 4.668518 -0.251831 1.104894
H -2.719032 3.055368 0.444830
H -1.092103 3.803557 0.391009
H -1.457706 2.541247 1.604850
H -2.954827 0.632190 -2.193221
H -1.201428 -0.024038 1.721625
H -4.360778 -1.417486 -1.914932
H -2.600007 -2.076963 2.003493
H -4.191739 -2.784926 0.190262


