%chk=000080204.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080204

0 1
 O   0.9422000       2.390500      0.3222000    
 N  -0.5134000      -1.929700     -1.3800000E-02
 C   0.6197000      -1.165500      5.7999999E-03
 C   0.2501000      0.1551000      0.1531000    
 C    2.006500      -1.683500     -0.1117000    
 C    2.917800     -0.5449000     -0.5990000    
 C   -1.162900      0.1915000      0.2165000    
 C    2.707800      0.7551000      0.1944000    
 C   -1.608400      -1.110500      0.1120000    
 C    1.247300       1.206600      0.2090000    
 C   -2.012600       1.390400      0.3659000    
 C   -2.975200      -1.667600      0.1180000    
 C   -2.418900       2.012400     -0.9723000    
 H    2.346700      -2.039000      0.8678000    
 H    2.055900      -2.524700     -0.8114000    
 H    3.966100     -0.8570000     -0.5332000    
 H    2.707300     -0.3479000      -1.658800    
 H    3.312000       1.553100     -0.2508000    
 H    3.027600      0.6202000       1.233900    
 H  -0.5406000      -2.935800     -0.1095000    
 H   -2.924400       1.132800      0.9194000    
 H   -1.506900       2.147600      0.9753000    
 H   -3.433100      -1.543600       1.104600    
 H   -3.603700      -1.156100     -0.6181000    
 H   -2.982300      -2.735300     -0.1243000    
 H   -1.538800       2.327200      -1.542900    
 H   -3.050200       2.890600     -0.8048000    
 H   -2.980400       1.299200      -1.584900    


%chk=000080204-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080204

0 1
O 0.889299 2.464373 0.212823
N -0.509076 -1.984681 0.069003
C 0.632003 -1.205689 0.028246
C 0.217967 0.142316 0.115352
C 2.049531 -1.694383 -0.066386
C 2.928322 -0.541004 -0.621344
C -1.237256 0.164907 0.209909
C 2.674607 0.787527 0.133621
C -1.663321 -1.168093 0.178513
C 1.195545 1.230130 0.145505
C -2.110898 1.394278 0.302881
C -3.034892 -1.779332 0.232833
C -2.263656 2.134786 -1.052640
H 2.426176 -1.993292 0.935333
H 2.131681 -2.587679 -0.716825
H 3.997226 -0.816604 -0.547621
H 2.697546 -0.398136 -1.694592
H 3.268144 1.613012 -0.297790
H 2.996048 0.682966 1.191902
H -0.528036 -3.002702 0.014298
H -3.112273 1.116271 0.685914
H -1.665828 2.099467 1.028486
H -3.148856 -2.482236 1.081526
H -3.793529 -0.989434 0.355734
H -3.284925 -2.331610 -0.694540
H -1.278666 2.492110 -1.398328
H -2.926106 3.013556 -0.943370
H -2.691576 1.470374 -1.826045


