%chk=000026145.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026145

0 1
 O   -2.741200     -0.8477000      0.7399000    
 O   -1.489400      -2.993400     -0.3392000    
 O   -2.143800       1.068000      -1.328100    
 O    7.226200       1.384900     -0.2101000    
 N    1.562100      -1.001600      0.3774000    
 C  -0.6947000      -2.001900      0.3149000    
 C   0.7322000      -2.015800     -0.2724000    
 C   -1.425000     -0.6722000      0.1980000    
 C   -1.523100     -0.2193000      -1.252800    
 C    2.863300     -0.9120000     -0.2661000    
 C    1.423300      -3.376200     -0.1675000    
 C    3.721800      0.1503000      0.4183000    
 C   -3.566700      0.2040000      0.4410000    
 C    5.091400      0.2673000     -0.2486000    
 C   -3.271800       1.138600     -0.5538000    
 C    5.971600       1.294000      0.4519000    
 C   -4.749400      0.3119000       1.173100    
 C   -4.137800       2.207000     -0.7876000    
 C   -5.621700       1.373000      0.9294000    
 C   -5.313800       2.322200     -4.5800000E-02
 C    8.086300       2.319000      0.4282000    
 H  -0.6557000      -2.297600       1.371600    
 H   0.6567000      -1.809500      -1.347000    
 H  -0.9171000      9.1499999E-02  0.8023000    
 H    1.676300      -1.225100       1.365700    
 H   -2.105700     -0.9152000      -1.869600    
 H  -0.5398000     -9.8899998E-02  -1.713600    
 H    2.746200     -0.6524000      -1.325200    
 H    3.422100      -1.850600     -0.2037000    
 H   0.7435000      -4.180300     -0.4708000    
 H    1.737200      -3.594500      0.8597000    
 H    2.291900      -3.462400     -0.8278000    
 H    3.852600     -0.1038000       1.477900    
 H    3.212800       1.121700      0.3798000    
 H   -2.370000      -2.982800      7.3399998E-02
 H    5.601400     -0.7042000     -0.2473000    
 H    4.977700      0.5452000      -1.303900    
 H    5.483100       2.275500      0.4381000    
 H    6.130700      0.9970000       1.495400    
 H   -4.992500     -0.4180000       1.940200    
 H   -3.910000       2.945700      -1.551200    
 H   -6.539900       1.462800       1.502600    
 H   -5.992800       3.149600     -0.2306000    
 H    9.030300       2.349700     -0.1226000    
 H    7.642800       3.319300      0.4167000    
 H    8.292900       2.009500       1.457300    


%chk=000026145-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026145

0 1
O -2.673387 -0.886510 0.641537
O -1.593017 -3.084172 -0.568457
O -1.750705 1.254034 -1.110647
O 7.007630 1.660487 -0.270021
N 1.581520 -1.389020 0.395025
C -0.736019 -2.229310 0.263327
C 0.710103 -2.406446 -0.252540
C -1.241456 -0.772761 0.220750
C -1.168490 -0.108333 -1.157735
C 2.890425 -1.144473 -0.257874
C 1.172927 -3.872427 -0.067333
C 3.630732 0.024972 0.420809
C -3.442961 0.280163 0.417041
C 4.998850 0.314917 -0.235667
C -2.984778 1.324880 -0.431496
C 5.730768 1.484119 0.429656
C -4.690836 0.386802 1.062901
C -3.770625 2.483148 -0.602946
C -5.482005 1.541510 0.877391
C -5.016452 2.593907 0.051426
C 7.791676 2.763969 0.277737
H -0.796348 -2.561222 1.325694
H 0.700771 -2.182376 -1.337535
H -0.698658 -0.154618 0.957538
H 1.708278 -1.597305 1.397833
H -1.704580 -0.713398 -1.913329
H -0.121072 0.043705 -1.456862
H 2.695965 -0.888496 -1.318562
H 3.556832 -2.041508 -0.262734
H 0.469165 -4.560794 -0.565078
H 1.208844 -4.135878 1.008088
H 2.179987 -4.027120 -0.494538
H 3.777983 -0.211559 1.496522
H 2.982611 0.922114 0.379803
H -2.530359 -2.893928 -0.298464
H 5.648074 -0.580628 -0.184195
H 4.863761 0.551319 -1.308916
H 5.125401 2.417508 0.361623
H 5.912876 1.272355 1.509054
H -5.018326 -0.433736 1.709509
H -3.393535 3.275455 -1.257246
H -6.451042 1.620864 1.380720
H -5.622815 3.494781 -0.088422
H 8.717049 2.814184 -0.317529
H 7.249336 3.730985 0.196352
H 8.050404 2.592141 1.345291


