%chk=000212594.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212594

0 1
O 0.875282 -0.753243 -0.642423
O 1.265711 1.072219 0.622002
N -2.779740 -0.162084 -0.304668
C -3.119533 0.562885 0.965425
C -3.766134 0.157766 -1.389413
C -4.520753 0.147145 1.442294
C -5.178171 -0.261766 -0.946303
C -5.574975 0.428627 0.364445
C -1.383066 0.158875 -0.738870
C 3.057903 0.198643 -0.860028
C 3.821343 -0.982835 -0.216899
C -0.466522 -0.883367 -0.083434
C 1.670926 0.277277 -0.194076
C 2.874020 -0.053996 -2.362769
C 3.768132 1.537103 -0.632401
C 4.057032 -0.826465 1.290901
C 4.704707 -2.074864 1.885252
H -3.068670 1.667723 0.855160
H -2.364551 0.280933 1.731196
H -3.475841 -0.420553 -2.293348
H -3.761898 1.232674 -1.670296
H -4.768705 0.681161 2.377133
H -4.519392 -0.933784 1.688042
H -5.206891 -1.361692 -0.809790
H -5.903718 -0.025218 -1.744988
H -6.566543 0.071753 0.698280
H -5.676895 1.518743 0.206206
H -1.046843 1.183312 -0.463604
H -1.282712 0.086777 -1.842775
H 4.793224 -1.105036 -0.733050
H 3.259764 -1.920560 -0.410453
H -0.727771 -1.919408 -0.364251
H -0.413298 -0.776544 1.012325
H 3.839607 -0.141163 -2.872275
H 2.320737 0.758611 -2.846736
H 2.311818 -0.980604 -2.546702
H 4.814434 1.489843 -0.951510
H 3.286880 2.352144 -1.185800
H 3.752648 1.828224 0.427475
H 4.698803 0.055484 1.485761
H 3.099498 -0.619320 1.810615
H 5.671508 -2.292747 1.417907
H 4.070819 -2.960001 1.757025
H 4.880426 -1.953074 2.960418


%chk=000212594-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212594

0 1
O 0.930664 -0.756679 -0.476063
O 1.200072 1.248860 0.674643
N -2.814147 -0.207846 -0.324171
C -3.095860 0.853773 0.678211
C -3.872481 -0.270599 -1.363722
C -4.445771 0.604873 1.380014
C -5.248931 -0.554462 -0.727665
C -5.588863 0.508222 0.343114
C -1.443169 -0.126226 -0.875608
C 3.069102 0.363837 -0.726188
C 3.829873 -0.926659 -0.268311
C -0.459595 -0.861042 0.055145
C 1.665344 0.374305 -0.093647
C 2.918670 0.330228 -2.275859
C 3.820227 1.647673 -0.299964
C 4.012077 -1.095355 1.256897
C 4.752655 -2.404901 1.606355
H -3.116783 1.863292 0.187934
H -2.276619 0.874015 1.419282
H -3.612706 -1.074559 -2.077500
H -3.930710 0.688044 -1.945404
H -4.640892 1.421988 2.101059
H -4.381762 -0.340695 1.952468
H -5.220558 -1.556574 -0.257512
H -6.022981 -0.574710 -1.519051
H -6.546370 0.264637 0.841186
H -5.721072 1.494729 -0.148346
H -1.100001 0.926387 -1.014889
H -1.422627 -0.614281 -1.867280
H 4.827011 -0.910901 -0.755560
H 3.289156 -1.807557 -0.664881
H -0.671876 -1.940278 0.078178
H -0.486042 -0.440862 1.075270
H 3.920599 0.341910 -2.743651
H 2.361856 1.212177 -2.642845
H 2.387299 -0.579317 -2.602849
H 4.853494 1.621293 -0.692764
H 3.317551 2.547065 -0.696744
H 3.859715 1.754342 0.796390
H 4.573540 -0.235800 1.670807
H 3.020832 -1.091671 1.753047
H 5.759217 -2.426459 1.147074
H 4.196073 -3.286259 1.235544
H 4.877387 -2.518360 2.698856


