%chk=000102758.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102758

0 1
 O    3.955900       1.185800      0.7479000    
 N   -3.113100     -0.1548000      0.1252000    
 C  -0.8263000      0.3644000     -4.3699998E-02
 C   -1.342100      0.8758000       1.325600    
 C   -1.858900     -0.7414000     -0.3497000    
 C   -2.803500      0.4321000       1.427000    
 C  -0.9254000       1.493800      -1.096200    
 C   0.6229000     -0.1160000     -6.6999998E-03
 C   -4.198500      -1.121300      0.1871000    
 C  -0.5549000      0.9908000      -2.475600    
 C    1.638500      0.7654000      0.3588000    
 C   0.9259000      -1.434700     -0.3403000    
 C    2.962200      0.3266000      0.3912000    
 C    2.249600      -1.873400     -0.3082000    
 C    3.267700     -0.9930000      5.7599999E-02
 H   -1.251400       1.964700       1.414800    
 H  -0.7766000      0.4330000       2.155200    
 H   -1.921300      -1.041300      -1.398000    
 H   -1.658500      -1.645700      0.2417000    
 H   -2.902000     -0.2950000       2.243000    
 H   -3.462900       1.278800       1.643700    
 H  -0.2766000       2.339700     -0.8385000    
 H   -1.941300       1.906700      -1.136300    
 H   -5.117500     -0.6402000      0.5393000    
 H   -3.974400      -1.962100      0.8534000    
 H   -4.410100      -1.521700     -0.8103000    
 H   0.4565000      0.5796000      -2.531200    
 H   -1.257400      0.2510000      -2.865900    
 H  -0.5828000       1.832800      -3.177600    
 H    1.415200       1.793100      0.6329000    
 H   0.1797000      -2.154400     -0.6567000    
 H    2.489000      -2.899100     -0.5738000    
 H    4.294900      -1.347000      7.7299997E-02
 H    4.806200      0.7146000      0.7157000    


%chk=000102758-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102758

0 1
O 3.884607 1.132431 1.157505
N -3.138797 -0.166122 0.221361
C -0.834357 0.347451 -0.090500
C -1.318453 1.007085 1.263523
C -1.891995 -0.778476 -0.287993
C -2.754542 0.464061 1.510390
C -0.961464 1.415730 -1.235789
C 0.609999 -0.162045 -0.021043
C -4.293370 -1.070670 0.298502
C -0.547402 0.946055 -2.645961
C 1.613362 0.664638 0.541915
C 0.994841 -1.419704 -0.559742
C 2.959316 0.243330 0.574271
C 2.343758 -1.836321 -0.523281
C 3.340276 -1.012590 0.043865
H -1.312672 2.107977 1.176383
H -0.650244 0.733813 2.097767
H -2.016592 -1.088326 -1.340994
H -1.601776 -1.683584 0.307816
H -2.738878 -0.290149 2.339004
H -3.478646 1.251732 1.787229
H -0.340729 2.289710 -0.952663
H -2.016723 1.750140 -1.245473
H -5.179384 -0.516518 0.657609
H -4.127577 -1.938209 0.988644
H -4.527210 -1.470607 -0.704536
H 0.507543 0.619490 -2.671066
H -1.171815 0.104784 -2.999710
H -0.666121 1.770446 -3.373091
H 1.368852 1.644896 0.964088
H 0.244914 -2.075179 -1.013056
H 2.624678 -2.809721 -0.940881
H 4.387872 -1.339866 0.071221
H 4.797427 0.751917 1.133387


