%chk=000030003.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030003

0 1
 O    3.508300      -3.004600     -0.8570000    
 N    2.433300     -0.6035000      0.3663000    
 N    2.069400       1.433100     -0.4458000    
 N   -3.214500       1.425700      0.1182000    
 N   -2.865500     -0.7599000     -8.5199997E-02
 C    3.670600     -1.9400001E-02  0.2750000    
 C    2.179900      -1.944700      0.8492000    
 C    1.573100      0.3199000     -7.5300001E-02
 C    3.416900       1.250900     -0.2345000    
 C    4.951000     -0.4793000      0.5850000    
 C    2.215900      -2.982300     -0.2649000    
 C   0.1502000     -6.3500002E-02 -8.0600001E-02
 C    4.492300       2.128100     -0.4541000    
 C   -2.294600      0.4193000      1.8600000E-02
 C  -0.9370000      0.7823000      4.1999999E-02
 C   -4.462200      0.8581000      7.5800002E-02
 C    6.009600      0.4068000      0.3601000    
 C   -4.217500     -0.5064000     -5.1399998E-02
 C    5.786600       1.687900     -0.1501000    
 C   -5.744600       1.404500      0.1362000    
 C   -5.304900      -1.393300     -0.1242000    
 C   -6.815100      0.5073000      6.2300000E-02
 C   -6.601400     -0.8671000     -6.5499999E-02
 H    2.949200      -2.171500       1.596500    
 H    1.223800      -1.963100       1.381100    
 H    5.132300      -1.471300      0.9823000    
 H  -7.8800000E-02  -1.119700     -0.2073000    
 H    2.005300      -3.976400      0.1416000    
 H    1.484100      -2.759200      -1.047300    
 H    4.329400       3.125400     -0.8501000    
 H  -0.7073000       1.841100      0.1626000    
 H    7.025100      9.1799997E-02  0.5874000    
 H    6.629800       2.354100     -0.3141000    
 H   -3.021300       2.415000      0.2075000    
 H   -5.907900       2.471600      0.2354000    
 H   -5.149300      -2.462800     -0.2236000    
 H   -7.832600      0.8879000      0.1054000    
 H   -7.453700      -1.539400     -0.1204000    
 H    3.490800      -3.681900      -1.554500    


%chk=000030003-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030003

0 1
O 3.685085 -3.239770 -0.870542
N 2.490301 -0.739331 0.420506
N 2.012991 1.463209 -0.052195
N -3.294221 1.563960 -0.187831
N -2.877591 -0.648411 0.221685
C 3.725366 -0.084918 0.297872
C 2.287420 -2.152889 0.763326
C 1.484044 0.235462 0.192155
C 3.402329 1.290376 0.014265
C 5.055647 -0.542568 0.403235
C 2.285716 -3.099415 -0.445433
C 0.069520 -0.071909 0.214618
C 4.440628 2.239618 -0.154854
C -2.314103 0.570155 0.019323
C -0.899943 0.877676 0.005627
C -4.550117 0.953795 -0.113294
C 6.071363 0.421344 0.238120
C -4.264496 -0.437018 0.144540
C 5.769746 1.791623 -0.034521
C -5.865336 1.446565 -0.238135
C -5.330943 -1.358680 0.280594
C -6.910489 0.508383 -0.098441
C -6.647129 -0.871437 0.156819
H 3.093592 -2.470802 1.448668
H 1.334607 -2.255508 1.310124
H 5.288460 -1.598917 0.562192
H -0.257536 -1.101580 0.398100
H 1.873254 -4.081696 -0.130410
H 1.648272 -2.683606 -1.252133
H 4.200422 3.284785 -0.371770
H -0.586028 1.912037 -0.181844
H 7.119728 0.110390 0.308441
H 6.593916 2.502747 -0.158812
H -3.106362 2.550631 -0.357249
H -6.077491 2.502910 -0.433451
H -5.123729 -2.414879 0.476794
H -7.948867 0.846169 -0.187450
H -7.490776 -1.562785 0.258343
H 3.731450 -3.614215 -1.784380


