%chk=000211255.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211255

0 1
O 0.495763 0.595364 -0.305440
O 2.220870 -0.941969 0.188246
O -2.397663 -0.310965 -0.672225
O -2.469737 0.785994 1.367460
N -3.529197 1.619975 -0.554742
C 1.943429 0.495108 -0.028070
C 2.296019 1.286905 1.226052
C 2.733464 1.005195 -1.228023
C 3.221805 2.417776 0.752342
C 3.714365 2.044668 -0.662976
C -0.025422 -0.678061 -0.181920
C 1.016093 -1.611229 0.105876
C -1.332749 -1.122856 -0.295184
C 0.785652 -2.962077 0.262287
C -1.593440 -2.503723 -0.130941
C -0.555281 -3.390337 0.133035
C -2.780754 0.733733 0.203931
C -4.391379 2.603202 0.134148
H 2.790494 0.629227 1.966734
H 1.381292 1.672152 1.717266
H 2.044474 1.449735 -1.972809
H 3.253708 0.175722 -1.741409
H 4.068739 2.558404 1.444128
H 2.674078 3.377333 0.729055
H 3.771933 2.934644 -1.311239
H 4.735124 1.624129 -0.616808
H 1.588142 -3.660413 0.477907
H -2.622212 -2.849574 -0.218269
H -0.775179 -4.451950 0.252702
H -3.764621 1.384415 -1.516711
H -5.431611 2.249849 0.231039
H -4.383012 3.550444 -0.433145
H -4.005688 2.815981 1.151100


%chk=000211255-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211255

0 1
O 0.507640 0.407439 -0.678787
O 2.276998 -1.099182 -0.131498
O -2.418153 -0.391720 -0.612853
O -1.882139 1.040571 1.219078
N -3.512628 1.580058 -0.394256
C 1.951726 0.366787 -0.233447
C 2.109582 1.082302 1.125121
C 2.839946 1.099258 -1.257608
C 2.565677 2.507813 0.730527
C 3.526171 2.249455 -0.464493
C -0.011119 -0.855359 -0.338846
C 1.030829 -1.763000 -0.046678
C -1.346993 -1.270035 -0.308805
C 0.794005 -3.112230 0.229463
C -1.620819 -2.631136 -0.023806
C -0.565022 -3.534925 0.230117
C -2.540971 0.802903 0.183702
C -3.928122 2.862285 0.178344
H 2.909239 0.566701 1.689693
H 1.175663 1.045013 1.709256
H 2.186397 1.494181 -2.054532
H 3.550528 0.394526 -1.719205
H 3.047903 3.047519 1.563504
H 1.694311 3.102851 0.397895
H 3.692760 3.146110 -1.085668
H 4.510485 1.915613 -0.085020
H 1.613783 -3.803066 0.440647
H -2.664408 -2.957817 0.002743
H -0.798698 -4.581520 0.449276
H -3.938439 1.232281 -1.253589
H -4.999092 2.851712 0.453099
H -3.746850 3.693243 -0.528134
H -3.332690 3.038171 1.088157


