%chk=000070989.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070989

0 1
 O    2.437500     -0.3107000       1.410000    
 N  -0.9569000       2.041800      0.1530000    
 C   0.6227000      0.6225000     -0.4930000    
 C  -0.5798000     -0.1114000     -0.2926000    
 C   -1.555100      0.8025000      0.1123000    
 C    1.925300      7.6300003E-02 -0.9251000    
 C   0.3591000       1.943200     -0.2112000    
 C  -0.9333000      -1.469800     -0.4171000    
 C   -2.871400      0.4244000      0.4001000    
 C    2.810400     -0.3615000      0.2386000    
 C   -2.246200      -1.862400     -0.1327000    
 C   -3.198700     -0.9283000      0.2695000    
 C    4.186500     -0.8665000     -0.1119000    
 H    1.780700     -0.7892000      -1.581300    
 H    2.476600      0.8339000      -1.494700    
 H   0.9882000       2.822100     -0.2359000    
 H   -1.422700       2.899700      0.4143000    
 H  -0.2030000      -2.211400     -0.7281000    
 H   -3.613600       1.150800      0.7134000    
 H   -2.524500      -2.908800     -0.2267000    
 H   -4.212700      -1.255300      0.4855000    
 H    4.716500      -1.158300      0.7990000    
 H    4.100100      -1.738300     -0.7651000    
 H    4.750200     -7.4800000E-02 -0.6113000    


%chk=000070989-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070989

0 1
O 4.101172 1.007991 -0.060314
N -0.852561 1.930338 0.572078
C 0.756774 0.826089 -0.619348
C -0.380142 -0.062306 -0.440229
C -1.377513 0.659359 0.308924
C 2.065640 0.510200 -1.313073
C 0.430444 2.026539 0.015526
C -0.658467 -1.395389 -0.846073
C -2.623398 0.090829 0.654294
C 3.170199 0.189696 -0.284325
C -1.898380 -1.968373 -0.503616
C -2.870361 -1.233498 0.239099
C 3.066970 -1.143623 0.444582
H 1.927698 -0.357390 -1.986326
H 2.414811 1.365093 -1.917428
H 1.020941 2.936139 0.109843
H -1.328332 2.671355 1.081706
H 0.076464 -1.971282 -1.420814
H -3.374644 0.651118 1.222249
H -2.126847 -2.994653 -0.811703
H -3.826030 -1.707106 0.489605
H 3.777179 -1.178290 1.285080
H 2.038047 -1.315831 0.807237
H 3.306237 -1.966505 -0.257974


