%chk=000152625.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152625

0 1
 O    3.161700      -2.773000      9.4099998E-02
 O   -6.835900       1.089500      -1.046300    
 O    5.410500       2.280800     -0.5801000    
 O    5.959700      0.1556000     -0.5460000    
 N  -0.4197000     -0.3160000      0.5522000    
 N   -5.693200     -0.4824000      0.2375000    
 N    1.871500      -2.307900      0.2832000    
 N    4.057300      -1.738600     -0.1158000    
 N    5.097700       1.068200     -0.4551000    
 C   -2.811400      2.1400001E-02  0.9287000    
 C   -3.946800       1.043500       1.065400    
 C   -1.458100      0.6791000      0.6693000    
 C   -5.299900      0.3840000       1.314000    
 C   0.9117000     -1.4800000E-02  0.3110000    
 C    1.946300     -0.9741000      0.1934000    
 C    1.363100       1.317500      0.1582000    
 C    3.335700     -0.6123000     -6.0199998E-02
 C    3.750700      0.7241000     -0.2071000    
 C    2.716100       1.669800     -8.8699996E-02
 C   -6.432100     -5.5199999E-02 -0.8582000    
 C   -6.684700      -1.159300      -1.849700    
 H   -2.755200     -0.5839000       1.842500    
 H   -3.028600     -0.6736000      0.1080000    
 H   -3.725100       1.724000       1.896000    
 H   -3.996400       1.652200      0.1541000    
 H   -1.231400       1.363000       1.496200    
 H   -1.521100       1.267300     -0.2542000    
 H   -6.065000       1.156500       1.447900    
 H   -5.269000     -0.2207000       2.226600    
 H  -0.6629000      -1.295600      0.6504000    
 H   0.6581000       2.145200      0.2285000    
 H   -5.402800      -1.454900      0.2847000    
 H    2.937400       2.732500     -0.1877000    
 H   -7.450800     -0.8448000      -2.563800    
 H   -5.759600      -1.383200      -2.387800    
 H   -7.034400      -2.059200      -1.335700    


%chk=000152625-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152625

0 1
O 3.024116 -2.842490 0.254162
O -6.373126 1.166478 -1.104172
O 5.414385 2.315211 -0.693357
O 6.005216 0.104533 -0.573759
N -0.356193 -0.237974 0.589646
N -5.755799 -0.604397 0.259909
N 1.727704 -2.254590 0.424793
N 4.049170 -1.839175 -0.029130
N 5.133369 1.059253 -0.516592
C -2.789525 -0.008560 1.002911
C -3.973448 0.975273 1.105975
C -1.469839 0.720142 0.688013
C -5.332933 0.282070 1.361588
C 0.939687 0.111607 0.323305
C 1.945163 -0.931235 0.251458
C 1.400107 1.432022 0.105956
C 3.349731 -0.664584 -0.024887
C 3.751019 0.698300 -0.235097
C 2.768910 1.699282 -0.164199
C -6.276284 -0.085567 -0.918408
C -6.721555 -1.108274 -1.959627
H -2.682397 -0.568440 1.955063
H -2.997855 -0.748200 0.204016
H -3.794964 1.693015 1.931859
H -4.064230 1.568160 0.177051
H -1.249698 1.464276 1.481283
H -1.568779 1.276963 -0.266495
H -6.104773 1.063189 1.485578
H -5.294252 -0.319156 2.289082
H -0.559632 -1.231943 0.724335
H 0.698585 2.268587 0.142792
H -5.715631 -1.615788 0.386602
H 3.100405 2.729311 -0.329323
H -7.795270 -0.962551 -2.168974
H -6.180051 -0.924087 -2.903332
H -6.557934 -2.155959 -1.652525


