%chk=000215970.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215970

0 1
O 3.327594 -1.202397 -0.235532
O 4.389480 0.785627 -0.076192
N -3.694466 -1.596201 -0.336891
N -1.911516 2.182176 0.109378
C -1.757119 -0.098994 -0.035756
C -2.637601 0.967985 0.046537
C -4.114510 0.831303 0.058932
C -2.205686 -1.515237 -0.109200
C -4.462570 -0.610668 0.497604
C -0.417380 0.434410 -0.028342
C -0.545150 1.869699 0.060718
C 0.859131 -0.135437 -0.087858
C -4.171283 -2.984378 -0.063121
C 0.580615 2.718027 0.091455
C 1.968249 0.708735 -0.056323
C 1.826107 2.122912 0.032421
C 3.343211 0.174314 -0.113692
C 4.614292 -1.894285 -0.279768
C 5.183280 -2.011098 1.119483
H -4.604051 1.561060 0.729945
H -4.514803 1.014788 -0.963808
H -1.729857 -2.019410 -0.984607
H -1.870946 -2.058689 0.804019
H -4.272947 -0.723714 1.586434
H -5.545978 -0.790344 0.329558
H -2.305874 3.100652 0.157941
H 0.984077 -1.218246 -0.158313
H -4.057595 -3.321021 0.977764
H -3.625637 -3.685783 -0.715854
H -5.235717 -3.058443 -0.339570
H 0.468052 3.795027 0.157812
H 2.734865 2.732492 0.052615
H 4.313195 -2.865502 -0.711957
H 5.285600 -1.347280 -0.966051
H 6.069603 -2.654727 1.141163
H 5.480387 -1.024259 1.506875
H 4.447350 -2.424195 1.820581


%chk=000215970-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215970

0 1
O 3.389075 -1.239399 -0.204767
O 4.416540 0.857123 -0.164821
N -3.735760 -1.580682 -0.279601
N -1.927715 2.166860 0.073105
C -1.786229 -0.109581 0.008664
C -2.664489 0.965522 0.065106
C -4.159191 0.847042 0.117002
C -2.272112 -1.535284 -0.018367
C -4.503229 -0.606535 0.532964
C -0.440471 0.429050 -0.016979
C -0.563870 1.869737 0.022827
C 0.848715 -0.147767 -0.074590
C -4.263800 -2.952834 -0.185477
C 0.561952 2.723024 0.009287
C 1.980597 0.702640 -0.090995
C 1.831887 2.125997 -0.047706
C 3.364526 0.164916 -0.152096
C 4.739531 -1.870395 -0.246439
C 5.300343 -2.054184 1.167413
H -4.604290 1.556833 0.843276
H -4.606463 1.056889 -0.874576
H -1.763205 -2.107194 -0.819442
H -2.014097 -2.043647 0.949915
H -4.307067 -0.729047 1.629645
H -5.579375 -0.794193 0.365772
H -2.329178 3.101597 0.107400
H 0.991933 -1.231295 -0.107787
H -4.192180 -3.391117 0.842880
H -3.702254 -3.611910 -0.872272
H -5.324941 -2.968147 -0.491804
H 0.457266 3.812943 0.039881
H 2.740210 2.736514 -0.061800
H 4.561227 -2.835365 -0.748505
H 5.405793 -1.237977 -0.859355
H 6.259294 -2.603800 1.122064
H 5.485113 -1.076245 1.642213
H 4.600319 -2.631189 1.796365


