%chk=000133109.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133109

0 1
 O   -3.878900      -3.039600      0.4525000    
 O   -3.236000       3.217100     -0.3180000    
 N   0.8043000      -1.245200     -0.4099000    
 N    2.244500      0.1472000      0.8773000    
 N    4.608700      0.1822000      0.4120000    
 N    3.697500       1.505400       2.122200    
 C  -0.4833000     -0.6819000     -0.2873000    
 C   -2.856500     -0.9470000      7.9499997E-02
 C   -1.929800       1.253200     -0.2912000    
 C  -0.6565000      0.6964000     -0.4123000    
 C   -1.583200      -1.503600     -4.1400000E-02
 C   -3.029700      0.4315000     -4.5400001E-02
 C    2.091800     -0.7530000     -0.1214000    
 C   -4.003000      -1.804100      0.3365000    
 C   -2.110100       2.690400     -0.4211000    
 C    3.146300      -1.222200     -0.8849000    
 C    4.391000     -0.7162000     -0.5708000    
 C   -5.397700      -1.202400      0.4707000    
 C  -0.9118000       3.594300     -0.6899000    
 C    3.507500      0.5652000       1.086100    
 C    5.584800      -1.167700      -1.343200    
 H   0.2093000       1.318400     -0.6179000    
 H   -1.436000      -2.577000      5.5399999E-02
 H   -4.013300      0.8820000      4.5899998E-02
 H   0.7951000      -2.241400     -0.6126000    
 H    3.006400      -1.942900      -1.682300    
 H   -5.686600     -0.7054000     -0.4589000    
 H   -5.432300     -0.5119000       1.317400    
 H   -6.116600      -2.005700      0.6612000    
 H  -0.4520000       3.338100      -1.647900    
 H  -0.1909000       3.521100      0.1284000    
 H   -1.253200       4.633000     -0.7464000    
 H    5.469200     -0.9187000      -2.402800    
 H    6.495800     -0.6811000     -0.9796000    
 H    5.717000      -2.249700      -1.242100    
 H    2.900800       1.824200       2.656000    
 H    4.627600       1.849400       2.316700    


%chk=000133109-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133109

0 1
O -3.838954 -3.154468 -0.418753
O -3.393477 3.200759 0.557683
N 0.808499 -1.215588 -0.332899
N 2.268250 0.662600 -0.084043
N 4.700308 0.349668 -0.246728
N 3.760678 2.450723 0.151303
C -0.463260 -0.615757 -0.176780
C -2.907022 -0.953410 -0.115705
C -1.971556 1.288540 0.194382
C -0.660280 0.774025 0.052179
C -1.594234 -1.465935 -0.258149
C -3.095879 0.428893 0.111318
C 2.096063 -0.674696 -0.300676
C -4.056771 -1.923885 -0.213729
C -2.214329 2.756100 0.436442
C 3.206192 -1.549808 -0.498304
C 4.501400 -0.989620 -0.463650
C -5.476577 -1.395786 -0.061369
C -1.016168 3.694316 0.534645
C 3.568378 1.106418 -0.067171
C 5.737786 -1.837632 -0.663901
H 0.224594 1.408404 0.111440
H -1.490357 -2.544953 -0.433181
H -4.089608 0.871779 0.227412
H 0.783096 -2.224044 -0.496742
H 3.064648 -2.620921 -0.671740
H -5.704556 -0.644621 -0.840352
H -5.612710 -0.900213 0.917682
H -6.184791 -2.233418 -0.146967
H -0.422400 3.672951 -0.398402
H -0.345983 3.391690 1.360866
H -1.375668 4.718744 0.713754
H 5.721576 -2.338571 -1.649362
H 6.634170 -1.202111 -0.602581
H 5.807447 -2.628081 0.106066
H 2.960289 3.060688 0.289338
H 4.711404 2.809625 0.167175


