%chk=000186687.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186687

0 1
O -1.189016 0.961726 -0.730411
O 2.908214 -0.050391 -1.432246
N 0.194184 0.910464 -0.613786
N 1.784682 -0.554057 0.557599
N 4.148770 -0.682215 0.428568
C -3.248982 -0.186881 -0.048795
C -1.742106 -0.111277 -0.014733
C -3.718760 -1.386559 0.788698
C -3.685820 -0.355802 -1.513411
C -3.810279 1.121164 0.533192
C -0.733060 -0.848328 0.545920
C 0.493354 -0.172493 0.138337
C 2.949955 -0.364606 -0.264252
C 5.414434 -0.320353 -0.255210
H -3.405253 -1.299634 1.834981
H -3.324575 -2.332322 0.399636
H -4.812313 -1.463452 0.781835
H -3.291663 -1.280264 -1.951102
H -4.776605 -0.386861 -1.603185
H -3.327087 0.474692 -2.136488
H -3.453386 1.994477 -0.029336
H -3.510071 1.263509 1.577332
H -4.904756 1.134287 0.499555
H -0.795308 -1.732605 1.142691
H 1.811849 -1.231669 1.320864
H 4.177612 -0.556812 1.439393
H 5.300832 -0.420623 -1.353754
H 6.203356 -1.019471 0.068655
H 5.735098 0.713255 -0.048347


%chk=000186687-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186687

0 1
O -1.243545 0.880438 -0.999713
O 3.099477 0.766074 -1.154172
N 0.244427 0.838667 -0.978778
N 1.787722 -0.584283 0.273431
N 4.126147 -0.698710 0.359923
C -3.263217 -0.192087 -0.037577
C -1.753384 -0.090772 -0.132230
C -3.644901 -1.307503 0.967818
C -3.837145 -0.528836 -1.446840
C -3.836738 1.174450 0.442779
C -0.697823 -0.763550 0.454613
C 0.500725 -0.164758 -0.091378
C 3.017139 -0.100863 -0.245944
C 5.487530 -0.346069 -0.054221
H -3.256126 -1.088695 1.979470
H -3.256565 -2.291342 0.645885
H -4.744930 -1.383598 1.036308
H -3.453361 -1.498796 -1.812009
H -4.939903 -0.588207 -1.396806
H -3.559565 0.248289 -2.179268
H -3.552840 1.984505 -0.250375
H -3.458377 1.432567 1.448488
H -4.939935 1.121144 0.489245
H -0.754618 -1.576768 1.174518
H 1.814918 -1.331267 0.968708
H 4.009342 -1.365621 1.123042
H 5.401830 0.398303 -0.862065
H 6.034863 -1.226732 -0.439193
H 6.062152 0.100918 0.778541


