%chk=000026762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000026762

0 1
O -4.298774 0.611395 0.961332
N -1.021338 0.037669 -0.187699
C 0.382854 -0.144534 0.348938
C 1.326525 -0.154171 -0.884513
C -2.078280 -0.344952 0.807087
C 0.543916 -1.451747 1.132803
C 2.769735 -0.042780 -0.484679
C -1.222425 1.453977 -0.626844
C -3.429707 -0.204666 0.206635
C 3.284912 1.184528 -0.036216
C 3.616956 -1.159095 -0.561690
C -4.080120 -0.688137 -0.898316
C 4.628484 1.289967 0.330807
C 4.960829 -1.047623 -0.194622
C 5.469869 0.175220 0.253010
C -5.425143 -0.164547 -0.856105
C -5.517933 0.605450 0.271735
H 0.670003 0.707444 1.020625
H 1.061733 0.678516 -1.572875
H 1.136717 -1.071284 -1.478983
H -2.024172 0.236575 1.757826
H -1.930863 -1.421533 1.072740
H 1.607145 -1.654539 1.323267
H 0.149047 -2.310661 0.576100
H 0.049433 -1.418062 2.108178
H -0.439146 1.725395 -1.354909
H -1.216711 2.193547 0.186659
H -2.188529 1.530474 -1.155329
H 2.637250 2.056247 0.023716
H 3.228406 -2.113985 -0.909809
H -3.679711 -1.326216 -1.662369
H 5.022215 2.244012 0.677393
H 5.613189 -1.916981 -0.258509
H 6.515783 0.259957 0.538101
H -6.185039 -0.362209 -1.586535
H -6.271211 1.188450 0.749049


%chk=000026762-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026762

0 1
O -4.559833 0.335350 0.960904
N -1.041790 0.256649 -0.032066
C 0.361253 -0.033139 0.413915
C 1.283231 -0.139890 -0.847934
C -2.124194 -0.139089 0.905873
C 0.492567 -1.321776 1.250811
C 2.768276 -0.093547 -0.520645
C -1.208031 1.669195 -0.447924
C -3.463115 -0.164178 0.218118
C 3.369263 1.113431 -0.072417
C 3.587481 -1.245261 -0.642557
C -3.912366 -0.606258 -1.015595
C 4.744358 1.167639 0.244918
C 4.965459 -1.196849 -0.327864
C 5.549105 0.010578 0.119170
C -5.344799 -0.382133 -1.060311
C -5.702648 0.183518 0.150562
H 0.738055 0.817220 1.039348
H 1.036907 0.685457 -1.540562
H 1.025235 -1.079548 -1.370813
H -2.206361 0.538359 1.793436
H -1.902668 -1.147983 1.291362
H 1.563522 -1.535685 1.410752
H 0.049621 -2.184913 0.718893
H 0.022638 -1.236043 2.246052
H -0.481964 1.933206 -1.234111
H -1.072102 2.383077 0.403038
H -2.218723 1.816350 -0.863644
H 2.755895 2.019395 0.016829
H 3.142007 -2.185098 -0.992042
H -3.284049 -1.029162 -1.796078
H 5.190065 2.109588 0.585074
H 5.581211 -2.097567 -0.432971
H 6.616823 0.051445 0.362367
H -6.016488 -0.612964 -1.885114
H -6.637942 0.521726 0.587224


