%chk=000007077.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007077

0 1
 O   -1.117000      0.1811000      0.5581000    
 N   -4.414800      -1.125800     -0.4434000    
 C   0.6897000       1.259500     -0.5904000    
 C    1.053100     -8.2000000E-03  -1.290400    
 C   -2.984000      -1.140900     -0.1403000    
 C  -0.3759000       1.305100      0.3023000    
 C   -2.504800      0.2462000      0.2568000    
 C    2.058200     -0.8569000     -0.5392000    
 C    1.433400       2.413100     -0.8389000    
 C  -0.7063000       2.491300      0.9495000    
 C    1.107200       3.605800     -0.1933000    
 C    1.602500      -1.804900      0.3593000    
 C    3.408700     -0.6638000     -0.7687000    
 C   3.7500001E-02   3.644900      0.7009000    
 C   -5.176700     -0.6509000      0.7110000    
 C   -4.867000      -2.458400     -0.8414000    
 C    2.528100      -2.586100       1.051300    
 C    4.334300      -1.445000     -7.6700002E-02
 C    3.893900      -2.406000      0.8334000    
 H    1.449800      0.2211000      -2.289800    
 H   0.1553000     -0.6037000      -1.504700    
 H   -2.414600      -1.466500      -1.020600    
 H   -2.743800      -1.856800      0.6575000    
 H   -2.997000      0.6090000       1.163800    
 H   -2.697300      0.9554000     -0.5594000    
 H    2.269300       2.398900      -1.533300    
 H   -1.530900       2.534600       1.655300    
 H    1.686400       4.504000     -0.3864000    
 H   0.5423000      -1.961200      0.5323000    
 H    3.761800      8.1100002E-02  -1.475500    
 H  -0.2150000       4.573100       1.205100    
 H   -5.060500      0.4267000      0.8623000    
 H   -4.914000      -1.179300       1.634900    
 H   -6.251300     -0.7945000      0.5431000    
 H   -5.925100      -2.437900      -1.125600    
 H   -4.738700      -3.195600     -4.0500000E-02
 H   -4.314600      -2.805600      -1.721700    
 H    2.185200      -3.335700       1.758500    
 H    5.397900      -1.305100     -0.2465000    
 H    4.614600      -3.014500       1.371800    


%chk=000007077-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007077

0 1
O -1.203160 0.287756 -0.537094
N -4.593528 -1.177034 0.000230
C 0.906227 1.395305 -0.824760
C 1.452794 0.134063 -1.492286
C -3.199376 -1.060226 -0.486381
C -0.436558 1.456870 -0.351156
C -2.614446 0.310700 -0.117267
C 2.236889 -0.772440 -0.539525
C 1.720750 2.536869 -0.651064
C -0.941454 2.628772 0.263279
C 1.235049 3.712110 -0.032273
C 1.582791 -1.433380 0.533881
C 3.629841 -0.972072 -0.709506
C -0.100178 3.753075 0.422396
C -4.680210 -1.531223 1.432386
C -5.429829 -2.062216 -0.835609
C 2.305058 -2.270014 1.412330
C 4.356812 -1.808606 0.169798
C 3.696375 -2.461071 1.234995
H 2.112775 0.431395 -2.328343
H 0.607466 -0.432743 -1.921583
H -3.193840 -1.156005 -1.586781
H -2.532825 -1.863178 -0.086136
H -2.677039 0.495730 0.974211
H -3.163916 1.113401 -0.645939
H 2.757355 2.497701 -1.007811
H -1.975185 2.675830 0.617682
H 1.888850 4.582068 0.089464
H 0.505272 -1.286020 0.670237
H 4.148901 -0.472042 -1.537118
H -0.494271 4.656872 0.900502
H -4.100927 -0.817480 2.043256
H -4.297313 -2.560487 1.651085
H -5.732451 -1.478598 1.764107
H -6.475741 -2.022728 -0.481172
H -5.103187 -3.132774 -0.818961
H -5.413322 -1.714001 -1.883229
H 1.785147 -2.774669 2.235260
H 5.433641 -1.951438 0.022123
H 4.256662 -3.110471 1.917272


