%chk=000283012.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283012

0 1
O -2.630936 -2.952962 1.328034
N -0.606260 -1.577512 -1.446900
N -1.999242 1.811640 2.484417
C -0.926978 -0.796925 -2.686309
C 0.407347 -2.651780 -1.702590
C -1.835783 -2.109657 -0.790459
C -1.321785 0.642681 -2.309544
C 1.820662 -2.039885 -1.665605
C -0.093752 1.518788 -2.028701
C 2.202054 -1.560226 -0.259451
C -1.600877 -2.126075 0.741518
C -0.500073 2.904287 -1.511283
C 3.574102 -0.876437 -0.247137
C 0.727559 3.757285 -1.162265
C 3.949589 -0.397613 1.162458
C -1.757655 -0.755895 1.360868
C 0.325818 5.108140 -0.574474
C 5.310877 0.293962 1.180624
C -0.728785 0.184229 1.212111
C -2.905953 -0.402820 2.079164
C -0.889805 1.453940 1.784004
C -2.985561 0.887804 2.625580
H -0.031074 -0.773876 -3.345327
H -1.736738 -1.264849 -3.286008
H 0.326886 -3.434593 -0.918329
H 0.249290 -3.170730 -2.672316
H -2.709651 -1.456842 -1.012702
H -2.128749 -3.124347 -1.130896
H -1.979752 0.633611 -1.415875
H -1.922747 1.082689 -3.127167
H 1.881566 -1.191435 -2.376279
H 2.549474 -2.792021 -2.022678
H 0.553027 1.009507 -1.284526
H 0.519159 1.620121 -2.943440
H 1.419464 -0.852831 0.109392
H 2.194536 -2.410762 0.447020
H -0.607804 -2.560824 1.000002
H -1.118173 3.426452 -2.265834
H -1.148267 2.798564 -0.618158
H 4.348391 -1.571086 -0.625136
H 3.575071 -0.017771 -0.946001
H 1.348229 3.911233 -2.066244
H 1.371539 3.214591 -0.442865
H 3.957477 -1.255988 1.862415
H 3.173874 0.295090 1.544129
H -2.425002 -3.896255 1.197751
H -0.263547 4.989148 0.343080
H 1.205615 5.710286 -0.323366
H -0.281854 5.689736 -1.276769
H 5.325887 1.173717 0.527282
H 5.569259 0.632035 2.190563
H 6.109714 -0.376892 0.845080
H 0.171980 -0.066699 0.632910
H -3.711825 -1.125556 2.213181
H -0.115105 2.223332 1.684997
H -3.863915 1.206980 3.197453


%chk=000283012-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000283012

0 1
O -3.034924 -2.817086 1.230171
N -0.536245 -1.591321 -1.352107
N -2.121949 1.986436 2.403089
C -0.712854 -0.844828 -2.632772
C 0.446159 -2.708026 -1.456353
C -1.822162 -2.044350 -0.782987
C -1.211960 0.604054 -2.433716
C 1.921662 -2.259236 -1.542584
C -0.146732 1.539172 -1.821247
C 2.423518 -1.504751 -0.293184
C -1.845564 -2.071153 0.778850
C -0.703804 2.923237 -1.422454
C 3.913399 -1.106747 -0.379752
C 0.371458 3.865188 -0.834594
C 4.413759 -0.350107 0.872208
C -1.941199 -0.680258 1.377780
C -0.204329 5.220653 -0.370930
C 5.901379 0.052657 0.780388
C -0.779277 0.073984 1.663612
C -3.197932 -0.076376 1.627175
C -0.916289 1.387056 2.167472
C -3.237789 1.241565 2.133327
H 0.267274 -0.809706 -3.142812
H -1.406383 -1.395375 -3.317274
H 0.332570 -3.341393 -0.554395
H 0.207907 -3.362192 -2.334479
H -2.635760 -1.378365 -1.119232
H -2.082507 -3.075935 -1.143699
H -2.112492 0.606823 -1.786396
H -1.537237 1.000404 -3.417864
H 2.078811 -1.627546 -2.439966
H 2.539314 -3.168313 -1.698206
H 0.278633 1.045435 -0.926493
H 0.687663 1.668189 -2.543470
H 1.804145 -0.597890 -0.153290
H 2.266189 -2.139766 0.605365
H -0.921078 -2.568722 1.141464
H -1.172828 3.408628 -2.304816
H -1.510818 2.787347 -0.673036
H 4.533784 -2.015963 -0.528200
H 4.073039 -0.472159 -1.276822
H 1.165918 4.033499 -1.590951
H 0.860795 3.360547 0.024005
H 4.256070 -0.984988 1.768200
H 3.792153 0.556730 1.020623
H -3.062284 -3.688624 0.759024
H -0.965720 5.073131 0.417660
H 0.584690 5.878901 0.037837
H -0.687738 5.754683 -1.211162
H 6.079327 0.716183 -0.086955
H 6.233624 0.587954 1.688815
H 6.546283 -0.838237 0.658050
H 0.215424 -0.349491 1.496137
H -4.118384 -0.639486 1.451221
H -0.031905 1.992322 2.399253
H -4.196003 1.732320 2.339875


