%chk=000135505.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135505

0 1
 O   -4.876700      -2.178400     -0.2920000    
 O   -4.663800       2.397400      0.1706000    
 N   -4.682100      0.1296000     -0.1117000    
 N   -5.311600       1.378200      0.4328000    
 N   -6.501600      -1.064800      0.8413000    
 C    1.609900      0.1836000     -0.5779000    
 C    2.818200      4.4500001E-02  0.3497000    
 C   0.2969000      7.9000004E-02  0.1996000    
 C    4.131800      0.1155000     -0.4326000    
 C  -0.9119000      0.1849000     -0.7324000    
 C    5.337700     -5.7100002E-02  0.4935000    
 C    6.680300     -2.5599999E-02 -0.2425000    
 C   -2.225500      0.1103000      5.1600002E-02
 C    7.884200     -0.2232000      0.6795000    
 C   -3.451900      0.2262000     -0.8476000    
 C    9.189900     -0.1964000     -0.1008000    
 C   -5.323800      -1.103700      0.1190000    
 H    1.654400       1.147800      -1.098700    
 H    1.644400     -0.6000000      -1.344600    
 H    2.761400     -0.9119000      0.8838000    
 H    2.796000      0.8390000       1.105400    
 H   0.2532000      0.8753000      0.9525000    
 H   0.2614000     -0.8765000      0.7369000    
 H    4.202400       1.078800     -0.9517000    
 H    4.146500     -0.6679000      -1.199900    
 H  -0.8796000     -0.6236000      -1.472700    
 H  -0.8698000       1.131900      -1.284100    
 H    5.248100      -1.010900       1.028500    
 H    5.327000      0.7340000       1.253600    
 H   -2.265200     -0.8362000      0.6057000    
 H   -2.245900      0.9093000      0.8033000    
 H    6.778200      0.9334000     -0.7664000    
 H    6.683400     -0.8076000      -1.012100    
 H    7.796600      -1.181500       1.204200    
 H    7.901100      0.5646000       1.441300    
 H   -3.425800     -0.5907000      -1.579800    
 H   -3.427500       1.153200      -1.431700    
 H    10.03830     -0.3387000      0.5759000    
 H    9.321000      0.7619000     -0.6134000    
 H    9.215600     -0.9939000     -0.8503000    
 H   -7.008800      -1.921200       1.039400    
 H   -6.913800     -0.2125000       1.202800    


%chk=000135505-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000135505

0 1
O -4.990904 -2.139461 -0.485274
O -4.787843 2.385453 0.344393
N -4.804676 0.178003 -0.125765
N -5.425510 1.283320 0.463573
N -6.673696 -1.023032 0.705678
C 1.608144 0.102492 -0.526901
C 2.851949 -0.000404 0.384319
C 0.273906 0.062146 0.251716
C 4.184726 0.020922 -0.397821
C -0.964829 0.186135 -0.663849
C 5.431313 -0.070502 0.511106
C 6.763091 -0.055800 -0.272920
C -2.296094 0.112873 0.116510
C 8.010584 -0.144634 0.635834
C -3.507826 0.262252 -0.833098
C 9.336143 -0.129015 -0.156181
C -5.491666 -1.096492 0.012103
H 1.661989 1.043348 -1.113916
H 1.626114 -0.726237 -1.265345
H 2.793051 -0.934424 0.981693
H 2.841844 0.836234 1.113995
H 0.260078 0.881720 0.999888
H 0.213109 -0.886011 0.825415
H 4.239923 0.950944 -1.001887
H 4.197517 -0.820441 -1.122114
H -0.939590 -0.621314 -1.424736
H -0.912776 1.145669 -1.219348
H 5.374624 -0.998066 1.118870
H 5.421541 0.773803 1.232080
H -2.367104 -0.859236 0.641396
H -2.325971 0.911444 0.882289
H 6.820552 0.870767 -0.882165
H 6.775141 -0.901160 -0.992678
H 7.952449 -1.070734 1.243825
H 7.997617 0.699915 1.354884
H -3.502695 -0.541278 -1.587379
H -3.479360 1.247484 -1.333178
H 10.211886 -0.199022 0.515175
H 9.434847 0.802819 -0.744750
H 9.383855 -0.978122 -0.864166
H -7.204560 -1.880161 0.837191
H -6.998293 -0.126096 1.069537


