%chk=000134160.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134160

0 1
 O  -0.1681000      -1.447900      0.9615000    
 O    1.734900      0.8535000       1.498800    
 O    2.470600     -0.8770000      -2.736500    
 O   -1.836000      -2.644000     -5.9900001E-02
 N    1.979100      0.2851000     -0.7623000    
 N    2.230600       3.688400      0.4803000    
 N   -2.814900       1.697300      0.9085000    
 C    2.077700      -2.332400       1.511100    
 C    2.498700      -3.141500     -0.5269000    
 C    2.846100      -1.181100      0.8295000    
 C    3.126500      -1.736700     -0.5770000    
 C    2.816500      -3.542900      0.9220000    
 C   0.6682000      -2.583400      0.9342000    
 C   0.9573000      -3.074400     -0.4926000    
 C    2.122100      0.1175000      0.6020000    
 C    2.500700     -0.7462000      -1.520900    
 C    1.335900       1.444600      -1.348600    
 C    2.331300       2.543800      -1.714900    
 C   -1.429400      -1.593200      0.4251000    
 C    3.113000       3.111100     -0.5265000    
 C   -2.242900     -0.3759000      0.4870000    
 C   -3.559300     -0.2112000      2.5100000E-02
 C   -1.795900      0.7902000       1.023600    
 C   -3.904300       1.113300      0.3024000    
 C    1.451100       4.789800     -8.7700002E-02
 C    3.000600       4.154400       1.634900    
 C   -4.508400      -1.042000     -0.6030000    
 C   -5.156000       1.650800     -1.8500000E-02
 C   -5.764400     -0.5180000     -0.9297000    
 C   -6.081200      0.8079000     -0.6410000    
 H    2.085700      -2.258100       2.601000    
 H    2.884300      -3.817000      -1.293600    
 H    3.789400     -0.9766000       1.349900    
 H    4.205600      -1.785500     -0.7627000    
 H    3.889000      -3.548700       1.145000    
 H    2.379900      -4.505200       1.210800    
 H   0.1881000      -3.383300       1.514900    
 H   0.5427000      -2.443900      -1.283700    
 H   0.5476000      -4.083700     -0.6222000    
 H   0.5789000       1.824400     -0.6555000    
 H   0.8181000       1.122500      -2.259500    
 H    1.817500       3.335500      -2.271100    
 H    3.064200       2.128500      -2.419800    
 H    3.722800       2.314100     -8.4700003E-02
 H    3.821500       3.862500     -0.9008000    
 H  -0.8653000       1.082100       1.486600    
 H   -2.774600       2.656600       1.224000    
 H   0.7051000       4.436800     -0.8060000    
 H    2.083300       5.544600     -0.5693000    
 H   0.8738000       5.291200      0.6987000    
 H    3.709700       4.946000       1.367100    
 H    3.560500       3.326400       2.083800    
 H    2.332300       4.537500       2.414300    
 H   -4.284800      -2.078300     -0.8381000    
 H   -5.403400       2.682900      0.2058000    
 H   -6.500500      -1.154000      -1.414300    
 H   -7.062800       1.194200     -0.9035000    


%chk=000134160-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134160

0 1
O -0.019581 -1.580454 0.659625
O 1.831494 0.679686 1.523173
O 2.951982 -0.934894 -2.737825
O -1.979131 -2.739250 0.101518
N 2.243031 0.103158 -0.737931
N 1.562176 3.949674 0.110585
N -2.329877 1.869955 0.926027
C 2.049047 -2.681364 1.446337
C 2.739270 -3.414798 -0.619223
C 2.915960 -1.489589 0.904621
C 3.375010 -1.987452 -0.506479
C 2.862698 -3.882883 0.866625
C 0.727722 -2.851752 0.652677
C 1.194843 -3.301775 -0.775095
C 2.248071 -0.134463 0.659778
C 2.864175 -0.931470 -1.484923
C 1.584895 1.251064 -1.399971
C 2.533248 2.442773 -1.659268
C -1.412463 -1.654954 0.400143
C 2.794053 3.281957 -0.388468
C -2.038035 -0.344987 0.523900
C -3.422850 -0.012154 0.217769
C -1.408827 0.835109 0.956036
C -3.577049 1.393106 0.475537
C 1.231981 5.172589 -0.649539
C 1.608317 4.196228 1.569176
C -4.534027 -0.757505 -0.250571
C -4.797641 2.071997 0.278669
C -5.757326 -0.085773 -0.448806
C -5.889035 1.309958 -0.188565
H 1.903778 -2.650587 2.536157
H 3.223113 -4.044942 -1.379994
H 3.757135 -1.332489 1.603025
H 4.473297 -2.057558 -0.604087
H 3.903089 -3.915868 1.235252
H 2.385883 -4.861811 1.052459
H 0.088646 -3.622800 1.118622
H 0.889334 -2.576019 -1.547438
H 0.750313 -4.274109 -1.044921
H 0.755473 1.589093 -0.757247
H 1.181993 0.869478 -2.354188
H 2.074503 3.077943 -2.441405
H 3.490812 2.077172 -2.076536
H 3.161888 2.616728 0.412731
H 3.604017 4.026700 -0.594241
H -0.380783 0.981373 1.288367
H -2.119219 2.835233 1.173621
H 1.128041 4.941323 -1.723892
H 2.005627 5.975945 -0.544426
H 0.266946 5.581805 -0.299084
H 2.425760 4.896492 1.877019
H 1.750084 3.235144 2.091910
H 0.650781 4.640190 1.901574
H -4.428139 -1.828349 -0.446222
H -4.902293 3.144215 0.478117
H -6.628262 -0.644073 -0.809685
H -6.855246 1.799433 -0.353917


