%chk=000227336.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227336

0 1
 O   0.5396000      0.9030000      -1.821700    
 N   -2.137200      0.8721000      8.6999997E-02
 N    1.149900      0.7585000      0.4176000    
 C   -1.015400       1.618400     -0.2048000    
 C   -2.242700     -0.5056000      3.3000000E-02
 C   -3.155100       1.728800      0.4467000    
 C   -1.324100       2.949300     -3.0300001E-02
 C   0.2411000       1.069000     -0.6188000    
 C   -2.677900       3.019100      0.3818000    
 C   -3.120800      -1.171500      0.8879000    
 C   -1.471900      -1.229200     -0.8767000    
 C    2.467300      0.2422000      0.3302000    
 C   -3.228300      -2.561200      0.8332000    
 C   -1.579200      -2.618800     -0.9316000    
 C   -2.457400      -3.284900     -7.6600000E-02
 C    3.008500     -2.0000000E-02 -0.9161000    
 C    3.181100      1.4000000E-02   1.493500    
 C    4.305100     -0.5270000      -1.001800    
 C    4.477800     -0.4928000       1.407700    
 C    5.039800     -0.7634000      0.1600000    
 H   -4.145500       1.374100      0.7004000    
 H  -0.6515000       3.782200     -0.1834000    
 H   -3.245400       3.912400      0.6016000    
 H   -3.722000     -0.6460000       1.625000    
 H  -0.8688000     -0.7883000      -1.652900    
 H   0.8240000      0.9302000       1.367100    
 H   -3.909300      -3.080600       1.501100    
 H   -1.000500      -3.181200      -1.658700    
 H   -2.545000      -4.366400     -0.1232000    
 H    2.512000      0.1321000      -1.861800    
 H    2.752600      0.2213000       2.469900    
 H    4.744200     -0.7384000      -1.972700    
 H    5.049900     -0.6770000       2.312300    
 H    6.049300      -1.158200      9.3300000E-02


%chk=000227336-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227336

0 1
O 0.488935 -0.461304 -1.143271
N -2.146223 0.627536 0.040399
N 1.491797 0.812421 0.563469
C -0.837092 1.157451 0.113135
C -2.574145 -0.734505 -0.209256
C -3.048250 1.626412 0.419148
C -0.950505 2.502366 0.527838
C 0.403642 0.416648 -0.226298
C -2.337745 2.796689 0.712698
C -3.378496 -1.369634 0.768832
C -2.266683 -1.392879 -1.422199
C 2.862466 0.454412 0.439387
C -3.878877 -2.668367 0.531485
C -2.765919 -2.694289 -1.646480
C -3.573212 -3.334469 -0.677457
C 3.347590 -0.444122 -0.549791
C 3.772034 1.036434 1.365616
C 4.727772 -0.736036 -0.599725
C 5.145711 0.729832 1.304348
C 5.634893 -0.158793 0.318152
H -4.117348 1.425517 0.424092
H -0.122728 3.206348 0.613490
H -2.772878 3.752398 0.998341
H -3.592149 -0.852730 1.710794
H -1.630439 -0.898420 -2.157919
H 1.263096 1.436094 1.341522
H -4.495993 -3.159653 1.291491
H -2.523707 -3.206567 -2.583650
H -3.957277 -4.343801 -0.861417
H 2.644380 -0.898741 -1.249203
H 3.401361 1.729939 2.132089
H 5.094473 -1.428609 -1.365838
H 5.833144 1.185973 2.025365
H 6.702575 -0.397352 0.269014


