%chk=000077228.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077228

0 1
 O  -0.5243000      -3.298000      1.0300000E-02
 O   -2.437300      -2.264700      0.3133000    
 O   -3.213700       2.499200      0.1062000    
 N   -2.654600      0.2106000      0.1706000    
 N   -1.208600      -2.249800      6.7900002E-02
 C    2.915800      0.2496000     -0.9358000    
 C    3.745900      0.3604000      0.3450000    
 C    1.437500      0.2314000     -0.6421000    
 C    5.241300      0.4144000      3.2699998E-02
 C   0.8005000     -0.9815000     -0.4255000    
 C   0.7378000       1.428000     -0.5920000    
 C  -0.5674000     -0.9982000     -0.1527000    
 C   -1.282600      0.1983000     -9.9500000E-02
 C  -0.6300000       1.411300     -0.3192000    
 C    6.070000      0.5653000       1.298500    
 C   -3.506400       1.317400      0.2558000    
 C   -4.923900      0.9064000      0.5666000    
 H    3.193800     -0.6571000      -1.488300    
 H    3.144200       1.087700      -1.607100    
 H    3.537600     -0.4941000       1.001200    
 H    3.455700       1.262000      0.8995000    
 H    5.545200     -0.4993000     -0.4911000    
 H    5.452400       1.257500     -0.6354000    
 H    1.385200      -1.896900     -0.4711000    
 H    1.238900       2.377200     -0.7597000    
 H   -1.105600       2.380800     -0.2957000    
 H    5.905600     -0.2774000       1.977500    
 H    5.813500       1.488600       1.827900    
 H    7.135700      0.6002000       1.051900    
 H   -3.099600     -0.6869000      0.3258000    
 H   -5.306800      0.2656000     -0.2328000    
 H   -5.558200       1.793600      0.6455000    
 H   -4.953500      0.3642000       1.515900    


%chk=000077228-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077228

0 1
O -0.621166 -3.405570 -0.280210
O -2.601931 -2.372995 0.125487
O -3.184275 2.555684 0.291543
N -2.729089 0.243238 0.175550
N -1.313238 -2.329103 -0.132999
C 2.980392 0.099432 -0.939195
C 3.813865 0.418589 0.334253
C 1.484194 0.123588 -0.680111
C 5.334963 0.423429 0.062509
C 0.741605 -1.058914 -0.538456
C 0.786393 1.358413 -0.533921
C -0.649217 -1.026687 -0.255626
C -1.353613 0.221288 -0.104310
C -0.586277 1.415267 -0.255594
C 6.164042 0.745630 1.324295
C -3.571243 1.354211 0.358727
C -5.016648 0.962949 0.647801
H 3.283538 -0.892408 -1.325330
H 3.239457 0.840420 -1.721909
H 3.576836 -0.326199 1.120347
H 3.507307 1.405422 0.737068
H 5.637304 -0.565095 -0.339307
H 5.561819 1.164693 -0.731103
H 1.215755 -2.038723 -0.643406
H 1.338192 2.299578 -0.647801
H -1.103941 2.369930 -0.149210
H 5.978304 0.002184 2.122001
H 5.902333 1.742097 1.727184
H 7.247602 0.743423 1.106259
H -3.137416 -0.707709 0.250742
H -5.448978 0.393847 -0.195656
H -5.607394 1.876640 0.803554
H -5.085376 0.329252 1.550924


