%chk=000239297.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239297

0 1
O -0.122327 -0.928943 -0.313753
N -1.010733 1.031698 -1.088727
N 1.430671 0.741388 -0.778749
C -2.728201 0.458701 0.670302
C -2.318047 0.381049 -0.808874
C -4.113947 -0.159779 0.892480
C 1.535661 3.179780 -0.140190
C 1.862771 2.089226 -1.178629
C 0.399575 4.109464 -0.582697
C 0.193841 0.365000 -0.732609
C -4.533088 -0.088289 2.358838
C 0.065101 5.143629 0.488713
C 0.835809 -1.955739 -0.309014
C 0.658558 -2.857317 0.750994
C 1.782804 -2.147321 -1.318516
C 1.464824 -3.996301 0.782567
C 2.579870 -3.293576 -1.255896
C 2.422142 -4.216076 -0.215331
H -1.973945 -0.072649 1.287720
H -2.722172 1.507125 1.021683
H -2.265815 -0.683658 -1.138338
H -3.070438 0.883502 -1.457222
H -4.111683 -1.216393 0.557056
H -4.865488 0.357234 0.263922
H 2.446906 3.779291 0.054233
H 1.295809 2.714361 0.836726
H 2.972472 2.002636 -1.284897
H 1.476585 2.364752 -2.184791
H -0.510668 3.516718 -0.824261
H 0.678227 4.623110 -1.524583
H -1.000070 2.040393 -0.846646
H -4.586574 0.946427 2.715710
H -5.520608 -0.538960 2.510431
H -3.827600 -0.621691 3.006788
H -0.250334 4.671337 1.426199
H 0.929526 5.777548 0.720522
H -0.745869 5.805509 0.164093
H -0.088162 -2.662071 1.515344
H 1.908992 -1.414684 -2.113480
H 1.349111 -4.715178 1.592737
H 3.330226 -3.467114 -2.026629
H 3.047787 -5.104638 -0.179224


%chk=000239297-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239297

0 1
O -0.177963 -0.844113 -0.382785
N -1.302599 0.992440 -1.116460
N 1.120575 0.919503 -1.315912
C -3.025193 0.411315 0.654584
C -2.584195 0.324607 -0.826171
C -4.380999 -0.289587 0.897907
C 1.705679 3.350448 -1.063909
C 1.232416 2.217593 -2.009847
C 0.671686 3.749037 0.013036
C -0.036554 0.427901 -0.978426
C -4.837544 -0.209884 2.370778
C 1.187015 4.865952 0.945957
C 0.843634 -1.818187 -0.218491
C 0.344750 -3.057820 0.250461
C 2.226541 -1.629529 -0.451352
C 1.235922 -4.124446 0.485218
C 3.102774 -2.714768 -0.212789
C 2.622860 -3.959224 0.252586
H -2.242115 -0.053761 1.283012
H -3.095602 1.475941 0.958725
H -2.499705 -0.735196 -1.121852
H -3.356669 0.787208 -1.472768
H -4.302037 -1.353068 0.592552
H -5.155538 0.164989 0.245828
H 1.961015 4.238015 -1.679340
H 2.639250 3.020074 -0.567796
H 1.990267 2.093977 -2.807170
H 0.291252 2.540276 -2.519750
H 0.409971 2.856529 0.614711
H -0.262244 4.090737 -0.484587
H -1.324572 1.987139 -1.336167
H -4.954392 0.841998 2.693211
H -5.806546 -0.719889 2.522830
H -4.095983 -0.684346 3.040369
H 2.101384 4.541599 1.477120
H 1.438113 5.778984 0.373465
H 0.433241 5.139289 1.707014
H -0.730990 -3.164270 0.422652
H 2.576734 -0.661530 -0.810415
H 0.847141 -5.082774 0.847375
H 4.174977 -2.575654 -0.393500
H 3.315743 -4.788003 0.434099


