%chk=000289688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289688

0 1
O 8.050879 -0.282844 0.050785
N -6.072569 -0.210153 -0.056346
N 2.494771 -0.184017 0.027813
C -6.812304 -1.439198 -0.433682
C -6.898447 0.972286 0.289608
C -4.677800 -0.166816 -0.034062
C -7.052741 -2.342683 0.790578
C -7.149327 1.858529 -0.945118
C -3.909449 -1.325168 -0.332602
C -3.992127 1.034688 0.288431
C -7.803849 -3.609855 0.398448
C -7.990125 3.077666 -0.583974
C -1.838600 -0.079546 0.013653
C -2.523765 -1.269880 -0.307146
C -2.604342 1.063955 0.309631
C -0.378095 -0.076572 0.027191
C 4.658081 0.960098 0.335773
C 0.391811 0.992549 0.307105
C 1.859966 0.957860 0.311024
C 3.884696 -0.198159 0.036262
C 3.946432 2.170023 0.635527
C 2.580071 2.175113 0.625021
C 6.073669 0.879886 0.327715
C 6.676506 -0.331074 0.026773
C 4.546729 -1.432373 -0.270016
C 5.917190 -1.502349 -0.275876
C 8.798974 -1.503710 -0.251206
C 10.242885 -1.058012 -0.126311
H -6.247287 -1.994836 -1.217448
H -7.781520 -1.154276 -0.899618
H -7.864619 0.629364 0.721593
H -6.396437 1.561784 1.091326
H -7.616120 -1.788450 1.566049
H -6.082980 -2.602236 1.262080
H -7.649504 1.270377 -1.738738
H -6.180857 2.176534 -1.382194
H -4.400931 -2.261464 -0.581802
H -4.546933 1.939347 0.520254
H -7.973067 -4.251913 1.271718
H -7.246286 -4.204023 -0.335153
H -8.785445 -3.386434 -0.034896
H -8.166388 3.707713 -1.464563
H -7.497002 3.705112 0.167806
H -8.971381 2.794846 -0.185953
H -1.951994 -2.170336 -0.540029
H -2.096954 1.997575 0.560915
H 0.095331 -1.039141 -0.214837
H -0.046763 1.961150 0.550643
H 4.517336 3.068707 0.867665
H 2.014144 3.076503 0.847995
H 6.679321 1.753640 0.553836
H 3.929910 -2.305035 -0.495920
H 6.418256 -2.437246 -0.507889
H 8.524236 -2.274392 0.488976
H 8.539284 -1.829405 -1.272860
H 10.454105 -0.671707 0.880995
H 10.468712 -0.240687 -0.825946
H 10.935514 -1.882215 -0.328503


%chk=000289688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289688

0 1
O 8.156612 -0.327188 0.058586
N -6.128840 -0.229020 -0.056783
N 2.520219 -0.069701 0.035501
C -6.817035 -1.478302 -0.434417
C -6.984487 0.921750 0.291117
C -4.732367 -0.139502 -0.033941
C -7.021688 -2.466468 0.742945
C -7.276375 1.872997 -0.898319
C -3.899310 -1.281202 -0.272383
C -4.065463 1.104890 0.230638
C -7.762291 -3.745857 0.299551
C -8.177759 3.054649 -0.481030
C -1.833380 0.058412 0.021631
C -2.500925 -1.172818 -0.247015
C -2.667897 1.191875 0.260141
C -0.373993 0.096003 0.040055
C 4.731947 1.054487 0.298540
C 0.436423 1.180875 0.276246
C 1.901614 1.118747 0.277629
C 3.901735 -0.111218 0.043567
C 4.047879 2.293634 0.549042
C 2.658696 2.324727 0.538651
C 6.149578 0.931336 0.292158
C 6.751605 -0.310069 0.041047
C 4.550630 -1.361440 -0.210048
C 5.943296 -1.468150 -0.213146
C 8.841783 -1.609600 -0.196745
C 10.340016 -1.329977 -0.111000
H -6.263805 -1.978096 -1.252800
H -7.806568 -1.210217 -0.853476
H -7.944448 0.528850 0.679457
H -6.528186 1.491171 1.123649
H -7.593223 -1.956444 1.543399
H -6.038105 -2.725152 1.178053
H -7.760377 1.294880 -1.709921
H -6.320231 2.248581 -1.309132
H -4.343814 -2.261638 -0.465357
H -4.647937 2.014681 0.401829
H -7.907671 -4.436682 1.149019
H -7.195001 -4.287881 -0.480805
H -8.760234 -3.508473 -0.116053
H -8.385193 3.720133 -1.337837
H -7.698541 3.663247 0.309082
H -9.149259 2.699425 -0.087693
H -1.896369 -2.069869 -0.431806
H -2.211990 2.167196 0.465978
H 0.146567 -0.852270 -0.156288
H 0.003114 2.169064 0.481208
H 4.629715 3.201666 0.746052
H 2.117145 3.258392 0.727340
H 6.787042 1.801367 0.483415
H 3.915080 -2.231605 -0.400954
H 6.407980 -2.438758 -0.410197
H 8.528864 -2.355491 0.562763
H 8.561071 -1.987194 -1.201570
H 10.606735 -0.944720 0.887798
H 10.639096 -0.580403 -0.863219
H 10.911122 -2.258531 -0.293647


