%chk=000030440.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030440

0 1
 O   -1.788500      0.6185000      0.1040000    
 O   -1.680100       2.773800      0.9050000    
 N    4.339500       1.091000     -0.4441000    
 N   -5.189900     -0.8076000      5.9500001E-02
 C    3.240500     -0.7781000      6.8700001E-02
 C    4.477400     -0.2515000     -0.2402000    
 C    3.042700      -2.225300      0.3660000    
 C    5.750900      -1.007500     -0.3670000    
 C    4.249800      -3.060500     -0.1038000    
 C    5.592200      -2.402000      0.2673000    
 C    2.307100      0.2964000      5.9700001E-02
 C    3.021500       1.454800     -0.2655000    
 C   0.9216000      0.4008000      0.2979000    
 C    2.413800       2.711700     -0.3659000    
 C   0.3026000       1.652100      0.2010000    
 C    1.039200       2.788500     -0.1260000    
 C   -3.749300     -0.7443000     -0.1373000    
 C   -1.126900       1.766100      0.4458000    
 C   -3.206900      0.6074000      0.2985000    
 C   -5.707500      -2.124200     -0.3209000    
 C   -5.864600      0.2417000     -0.7086000    
 C   -5.022400      -3.230800      0.4629000    
 C   -7.362800      0.2289000     -0.4570000    
 H    2.131200      -2.596700     -0.1153000    
 H    2.917000      -2.347700       1.448700    
 H    6.576400     -0.4722000      0.1145000    
 H    5.997900      -1.116000      -1.429800    
 H    4.205300      -3.184600      -1.193500    
 H    4.191600      -4.063100      0.3347000    
 H    5.652900      -2.314600       1.359900    
 H    6.423300      -3.042700     -4.8099998E-02
 H    5.086600       1.725700     -0.6909000    
 H   0.3634000     -0.4924000      0.5643000    
 H    2.986000       3.597600     -0.6205000    
 H   0.5537000       3.759000     -0.2034000    
 H   -3.467000     -0.9385000      -1.181000    
 H   -3.218300      -1.487900      0.4673000    
 H   -3.596600       1.429500     -0.3069000    
 H   -3.427200      0.7920000       1.356800    
 H   -5.596800      -2.312600      -1.396200    
 H   -6.771800      -2.205000     -7.7500001E-02
 H   -5.664400      0.1590000      -1.784000    
 H   -5.547800       1.236900     -0.3861000    
 H   -5.583400      -4.164800      0.3425000    
 H   -4.987500      -3.009700       1.535300    
 H   -4.007900      -3.432000      0.1052000    
 H   -7.865800     -0.5985000     -0.9666000    
 H   -7.595400      0.1832000      0.6125000    
 H   -7.808700       1.150700     -0.8478000    


%chk=000030440-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030440

0 1
O -1.791990 0.471823 0.245687
O -1.784929 2.765023 0.662131
N 4.483814 1.200049 0.114009
N -5.244281 -0.923653 -0.152653
C 3.345684 -0.762718 -0.163106
C 4.612907 -0.185384 -0.121756
C 3.131589 -2.238641 -0.402962
C 5.921911 -0.903183 -0.305115
C 4.428656 -2.888843 -0.957903
C 5.684417 -2.433501 -0.171018
C 2.382690 0.300635 0.059213
C 3.131017 1.525656 0.228981
C 0.971649 0.344019 0.126321
C 2.500565 2.768027 0.464958
C 0.333143 1.585899 0.360556
C 1.097702 2.784841 0.529132
C -3.761076 -0.882769 -0.137401
C -1.145772 1.702956 0.443620
C -3.278149 0.497377 0.325779
C -5.805964 -2.238642 0.253768
C -5.820986 -0.402348 -1.422209
C -5.698280 -2.492468 1.769539
C -7.238860 0.174679 -1.247674
H 2.296129 -2.402903 -1.111685
H 2.837773 -2.742975 0.541416
H 6.671781 -0.569618 0.440625
H 6.350333 -0.679242 -1.304890
H 4.551097 -2.609524 -2.023739
H 4.340761 -3.991122 -0.919378
H 5.553820 -2.689407 0.898999
H 6.577882 -2.977653 -0.530613
H 5.258857 1.855124 0.194709
H 0.364903 -0.557342 0.003272
H 3.077228 3.690438 0.593710
H 0.554005 3.717603 0.709351
H -3.316894 -1.114756 -1.134203
H -3.379609 -1.643617 0.565974
H -3.660483 1.315185 -0.311176
H -3.586163 0.698471 1.366610
H -5.324316 -3.080431 -0.306599
H -6.874538 -2.247762 -0.028143
H -5.826438 -1.189518 -2.218761
H -5.157229 0.403402 -1.787612
H -6.140883 -3.472130 2.030427
H -6.231628 -1.701856 2.325287
H -4.647444 -2.498563 2.111946
H -7.957110 -0.590747 -0.901769
H -7.226783 0.989543 -0.503357
H -7.613909 0.575065 -2.208198


