%chk=000027111.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027111

0 1
 O    1.723700       1.754200      0.2200000    
 O   -1.140600      -1.441000       1.570700    
 O   -7.536800      4.3900002E-02 -0.8313000    
 O   -7.260800       1.759200      0.5106000    
 N    2.883400      -1.519700      0.1273000    
 N    3.162400     -0.1433000      0.2322000    
 N  -0.4066000     -0.1516000     -0.2472000    
 N   -6.815100      0.7481000     -8.4200002E-02
 C   0.8990000     -0.4616000     -8.6999997E-02
 C    1.515300      -1.649700     -0.1158000    
 C    1.950600      0.5563000      0.1708000    
 C  -0.7616000      0.7555000      -1.359400    
 C    4.461400      0.4021000      7.8800000E-02
 C   0.8901000      -2.988600     -0.3195000    
 C    3.573700      -2.438200       1.027500    
 C   -1.382000     -0.6832000      0.6310000    
 C   -1.058200     -1.3800000E-02  -2.630000    
 C   -2.794800     -0.3111000      0.4451000    
 C    4.719500       1.723600      0.4563000    
 C    5.494600     -0.3769000     -0.4516000    
 C    5.998000       2.260600      0.3049000    
 C    6.773100      0.1600000     -0.6026000    
 C   -3.597300      -1.083300     -0.3796000    
 C   -3.294800      0.8042000       1.097900    
 C    7.024800       1.478700     -0.2243000    
 C   -4.935200     -0.7305000     -0.5564000    
 C   -4.632800       1.156700      0.9213000    
 C   -5.453000      0.3894000      9.3999997E-02
 H   -1.628700       1.363100      -1.087000    
 H   5.4699998E-02   1.458900      -1.552300    
 H    1.452700      -3.558800      -1.066200    
 H  -0.1393000      -2.914600     -0.6828000    
 H   0.8814000      -3.557900      0.6152000    
 H    4.599500      -2.140100       1.256700    
 H    3.614400      -3.438900      0.5844000    
 H    3.040600      -2.506800       1.983000    
 H  -0.1772000     -0.5741000      -2.961400    
 H   -1.871100     -0.7313000      -2.504000    
 H   -1.338300      0.6757000      -3.432700    
 H    3.955700       2.355200      0.8981000    
 H    5.332100      -1.394800     -0.7943000    
 H    6.196100       3.285600      0.6049000    
 H    7.570800     -0.4456000      -1.022700    
 H   -3.204500      -1.962800     -0.8818000    
 H   -2.661600       1.406800       1.743100    
 H    8.020100       1.897000     -0.3425000    
 H   -5.544900      -1.352900      -1.206500    
 H   -5.001600       2.035500       1.444000    


%chk=000027111-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027111

0 1
O 1.956788 1.913088 -0.273300
O -1.051292 -0.985243 1.717969
O -7.656631 -0.048659 -1.131521
O -7.768751 0.770493 0.995110
N 2.838421 -1.497591 0.282496
N 3.165732 -0.108390 0.185726
N -0.462633 -0.027051 -0.339208
N -7.113025 0.295437 -0.010907
C 0.908222 -0.344307 -0.118875
C 1.444997 -1.602063 0.127676
C 1.978544 0.658013 -0.080522
C -0.745061 0.935664 -1.452263
C 4.510961 0.310462 -0.049870
C 0.739760 -2.915630 0.258499
C 3.546622 -2.267220 1.336484
C -1.396115 -0.409640 0.634603
C -0.523709 0.316201 -2.844300
C -2.864127 -0.156775 0.384651
C 4.904574 1.613725 0.347749
C 5.435932 -0.551878 -0.694727
C 6.225816 2.041568 0.100131
C 6.759337 -0.115594 -0.916008
C -3.514539 -0.523573 -0.823513
C -3.635961 0.335257 1.470272
C 7.161573 1.181270 -0.520685
C -4.908756 -0.384737 -0.957928
C -5.026985 0.499282 1.346224
C -5.644464 0.136080 0.128299
H -1.776884 1.302009 -1.340255
H -0.064374 1.795910 -1.312486
H 1.388548 -3.762970 -0.020610
H -0.145021 -2.923165 -0.401117
H 0.362058 -3.056004 1.288174
H 4.633897 -2.162852 1.205463
H 3.279149 -3.329500 1.230395
H 3.264914 -1.915896 2.347496
H 0.516037 -0.037878 -2.957204
H -1.200394 -0.537341 -3.032966
H -0.705640 1.078290 -3.623284
H 4.175574 2.275210 0.820777
H 5.107597 -1.535491 -1.047059
H 6.525735 3.050957 0.401913
H 7.470705 -0.784324 -1.413171
H -2.934196 -0.937961 -1.653558
H -3.130120 0.572552 2.410708
H 8.187728 1.519174 -0.700091
H -5.431553 -0.668973 -1.874729
H -5.638090 0.889265 2.164042


