%chk=000285694.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285694

0 1
O 4.013487 -0.478363 2.541864
N -2.353101 0.165977 0.122607
N -4.041605 -1.093315 -1.232168
N 4.699586 -0.220944 0.391697
N -4.669760 0.867960 0.092612
N -3.089828 2.204003 1.208739
N -6.232336 -0.216715 -1.331274
C -2.632291 -1.023989 -0.834963
C -0.979460 0.493895 0.439026
C -2.269870 -2.310575 -0.078920
C -1.774756 -0.840529 -2.096027
C -3.391514 1.050145 0.458351
C 1.679944 1.097205 1.058523
C -0.303382 1.490632 -0.284264
C -0.334488 -0.192749 1.481980
C 3.102332 1.426786 1.407339
C 1.024182 1.786931 0.027660
C 0.991737 0.110338 1.784096
C -4.922674 -0.196343 -0.823412
C 3.955903 0.168961 1.504029
C 4.602449 0.429823 -0.938169
C 5.550666 -1.442148 0.486345
C 3.483947 -0.170647 -1.788249
C 7.025561 -1.078171 0.642879
H -2.586478 -3.184973 -0.666805
H -2.789359 -2.376277 0.883786
H -1.194980 -2.399479 0.100376
H -2.013217 -1.631625 -2.822271
H -0.703464 -0.888076 -1.884433
H -1.987779 0.111482 -2.596022
H -0.817244 2.030650 -1.080340
H -0.867075 -0.957475 2.048133
H 3.127578 1.924073 2.407238
H 3.539008 2.165104 0.703585
H 1.545786 2.560104 -0.534754
H 1.508466 -0.424303 2.589169
H 4.436158 1.524206 -0.802269
H 5.581425 0.323477 -1.459417
H 5.213210 -2.043202 1.368248
H 5.392117 -2.069282 -0.417075
H -3.894872 2.714618 1.564024
H -2.315246 2.160734 1.857412
H 3.636501 -1.241870 -1.966743
H 2.503789 -0.067201 -1.302360
H 3.421888 0.320343 -2.765646
H 7.406452 -0.503704 -0.207715
H 7.191715 -0.474710 1.545722
H 7.640825 -1.980587 0.738146
H -6.543252 -1.088938 -1.738099
H -6.932983 0.275641 -0.793395


%chk=000285694-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285694

0 1
O 4.493818 0.034632 2.691319
N -2.269955 0.221408 -0.000120
N -3.877992 -0.723299 -1.636973
N 4.598125 -0.174547 0.380142
N -4.633552 0.542340 0.328444
N -3.116080 1.536604 1.791139
N -6.107301 -0.041463 -1.381237
C -2.563053 -0.916255 -1.009320
C -0.919393 0.577015 0.358223
C -2.540867 -2.267780 -0.240904
C -1.494778 -0.901179 -2.119506
C -3.358698 0.740953 0.689288
C 1.766304 1.281666 1.035292
C -0.270857 1.653201 -0.297895
C -0.218833 -0.133972 1.369467
C 3.197230 1.658274 1.410579
C 1.056682 1.996203 0.037318
C 1.106511 0.216211 1.702256
C -4.806913 -0.111541 -0.910892
C 4.146775 0.448978 1.535851
C 4.230035 0.202683 -1.003280
C 5.545146 -1.309354 0.537022
C 3.194229 -0.747777 -1.646495
C 7.013724 -0.839674 0.605100
H -2.810189 -3.080635 -0.937525
H -3.284220 -2.254040 0.576122
H -1.539733 -2.479835 0.177419
H -1.756594 -1.688846 -2.844864
H -0.480636 -1.095281 -1.727560
H -1.506270 0.066258 -2.649340
H -0.816863 2.207591 -1.068333
H -0.720393 -0.956889 1.890422
H 3.211042 2.117593 2.415365
H 3.589801 2.412689 0.704460
H 1.544111 2.831374 -0.481183
H 1.640340 -0.338512 2.483149
H 3.837821 1.232286 -1.010266
H 5.156119 0.210973 -1.612139
H 5.283489 -1.838601 1.468615
H 5.395426 -2.001226 -0.311932
H -3.925268 1.966484 2.231432
H -2.181143 1.669857 2.166472
H 3.563354 -1.788888 -1.669534
H 2.244067 -0.728971 -1.086175
H 2.990371 -0.437706 -2.687969
H 7.301307 -0.272592 -0.299584
H 7.163911 -0.195548 1.487927
H 7.690854 -1.709220 0.692330
H -6.340488 -0.489498 -2.262197
H -6.786823 0.504755 -0.861134


