%chk=000216649.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216649

0 1
O 0.647024 -0.631809 0.370220
N -7.028992 0.291586 -0.736445
C 4.159842 0.557516 -0.017025
C 5.479516 -0.224115 0.031777
C 2.959910 -0.370283 0.198188
C 6.687138 0.699198 -0.182545
C 1.648082 0.410261 0.148722
C 8.002737 -0.074382 -0.135187
C -3.429489 0.174979 0.493205
C -0.678328 -0.263756 0.392904
C -4.913214 0.404556 0.542042
C -2.911704 -1.123866 0.672035
C -2.551193 1.239210 0.263100
C -1.543744 -1.355230 0.624515
C -1.167085 1.034301 0.210883
C -5.545947 0.156711 -0.840078
H 4.068085 1.076944 -0.990978
H 4.167231 1.353192 0.753513
H 5.475994 -1.021357 -0.736633
H 5.574545 -0.746216 1.003625
H 3.039969 -0.898541 1.170287
H 2.941601 -1.174191 -0.565831
H 6.595505 1.220236 -1.155714
H 6.694521 1.495306 0.587602
H 1.461626 0.874005 -0.833979
H 1.562928 1.157463 0.955013
H 8.859475 0.591512 -0.288277
H 8.144039 -0.573065 0.830576
H 8.045662 -0.847079 -0.911337
H -5.391544 -0.264813 1.289686
H -5.142922 1.429967 0.892476
H -3.594167 -1.955587 0.849980
H -2.941887 2.246466 0.122188
H -1.124394 -2.348981 0.761463
H -0.505552 1.873958 0.033458
H -5.089922 0.837179 -1.590910
H -5.320586 -0.882056 -1.172343
H -7.286724 1.232986 -0.457611
H -7.462434 0.119896 -1.638466


%chk=000216649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216649

0 1
O 0.635183 -0.835605 0.401025
N -7.094219 0.497455 -0.796087
C 4.186612 0.491667 -0.028962
C 5.571837 -0.191448 0.020758
C 3.021614 -0.499214 0.199126
C 6.743794 0.792435 -0.199288
C 1.659123 0.195809 0.157410
C 8.124837 0.104752 -0.138738
C -3.498652 0.178826 0.524874
C -0.710211 -0.428411 0.424877
C -4.988264 0.482498 0.529164
C -3.027092 -1.147618 0.725521
C -2.537696 1.187322 0.275493
C -1.654857 -1.454560 0.678033
C -1.153069 0.902012 0.222963
C -5.641333 0.247567 -0.859601
H 4.062917 0.993566 -1.011625
H 4.148774 1.293146 0.738573
H 5.615887 -0.990846 -0.747951
H 5.697061 -0.695866 1.001494
H 3.137050 -0.999435 1.179818
H 3.043308 -1.293596 -0.571374
H 6.620444 1.292218 -1.181884
H 6.694107 1.594039 0.565832
H 1.484828 0.668905 -0.832449
H 1.591233 0.981125 0.940216
H 8.945518 0.827022 -0.302982
H 8.286588 -0.372744 0.846152
H 8.209015 -0.683787 -0.910367
H -5.524794 -0.151811 1.258752
H -5.162010 1.536489 0.826985
H -3.748249 -1.949104 0.928856
H -2.872453 2.221486 0.124269
H -1.290583 -2.474107 0.838585
H -0.443531 1.712362 0.031544
H -5.099253 0.870410 -1.612507
H -5.484754 -0.808418 -1.150476
H -7.341498 1.459266 -0.542094
H -7.621611 0.168295 -1.609838


