%chk=000274517.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274517

0 1
O 0.402759 0.931085 1.489705
O -0.329898 0.961702 -0.685396
N -1.653382 0.156625 1.095309
C 2.663294 -0.119098 -0.736417
C 4.844215 0.292152 -0.252496
C 2.630044 0.252758 0.782358
C 3.790854 0.806448 -1.274963
C 4.124563 0.566342 1.098797
C 3.326863 -1.519703 -0.857629
C 4.817069 -1.240874 -0.516287
C 1.716856 1.439121 1.080920
C -0.520444 0.704062 0.482965
C -2.862363 -0.194227 0.413317
C -3.909153 -0.725894 1.194584
C -3.015599 -0.025657 -0.973161
C -5.104977 -1.085167 0.571667
C -4.221539 -0.392610 -1.571808
C -5.267184 -0.921469 -0.807917
H 1.689086 -0.031280 -1.237346
H 5.840986 0.739849 -0.323233
H 2.280927 -0.615689 1.384374
H 3.569671 1.875610 -1.189329
H 4.055896 0.611517 -2.320605
H 4.507037 -0.071921 1.907436
H 4.277272 1.607125 1.418827
H 3.214346 -1.920094 -1.876165
H 2.875924 -2.254725 -0.177183
H 5.154837 -1.816190 0.356235
H 5.478590 -1.510027 -1.352482
H 1.592507 2.128867 0.227795
H 2.007567 1.995361 1.990955
H -1.620608 0.012806 2.109260
H -3.796173 -0.858034 2.267130
H -2.202320 0.387805 -1.578303
H -5.918381 -1.496859 1.169084
H -4.345275 -0.263559 -2.647527
H -6.202569 -1.204059 -1.284574


%chk=000274517-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274517

0 1
O 0.419071 0.520208 1.456902
O -0.467156 1.301119 -0.591882
N -1.687834 -0.062820 0.917873
C 2.742680 -0.537181 -0.444693
C 4.799819 0.452933 -0.506156
C 2.826904 0.183717 0.941182
C 3.509103 0.446340 -1.376181
C 4.234155 0.897220 0.875540
C 3.720202 -1.749816 -0.408288
C 5.140608 -1.067261 -0.434368
C 1.713133 1.208513 1.189024
C -0.584264 0.648175 0.475295
C -2.951767 -0.203528 0.281993
C -3.930061 -0.993233 0.944740
C -3.262522 0.407182 -0.961932
C -5.205856 -1.169882 0.372440
C -4.545446 0.219537 -1.520211
C -5.523509 -0.563748 -0.865579
H 1.716216 -0.795982 -0.750475
H 5.630593 1.081303 -0.868032
H 2.794461 -0.558728 1.761256
H 3.031139 1.438171 -1.465120
H 3.670128 0.038937 -2.390339
H 4.891967 0.606504 1.714087
H 4.120560 1.999278 0.909203
H 3.572852 -2.394240 -1.294077
H 3.566521 -2.377387 0.488440
H 5.744492 -1.308974 0.459378
H 5.719868 -1.382301 -1.321579
H 1.576658 1.886139 0.326615
H 1.914798 1.798001 2.100847
H -1.561589 -0.525671 1.820703
H -3.690762 -1.466114 1.906083
H -2.508752 1.012724 -1.469183
H -5.950512 -1.780886 0.894552
H -4.779776 0.694081 -2.479835
H -6.514823 -0.700232 -1.310326


