%chk=000068752.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068752

0 1
 O   -6.359600     -0.1562000     -0.7038000    
 O   -4.425300     -3.8999999E-03  -1.874800    
 N    3.477700     -0.6592000     -0.1295000    
 N    2.141900       1.107600      0.1820000    
 C   -4.300100     -0.1897000      0.5574000    
 C   -2.813900     -0.1514000      0.4410000    
 C  -2.7400000E-02 -7.9400003E-02  0.2230000    
 C    1.397600     -4.2700000E-02  0.1113000    
 C   -2.052900      -1.241100      0.8643000    
 C   -2.184600      0.9742000     -9.0800002E-02
 C  -0.6627000      -1.205100      0.7557000    
 C  -0.7945000       1.010000     -0.1998000    
 C    3.392600      0.7208000      3.5399999E-02
 C    2.196500      -1.145400     -7.9899997E-02
 C   -4.884800      0.9088000       1.468700    
 C    4.678200      -1.341500     -0.3060000    
 C   -5.004600     -0.1090000     -0.8014000    
 C    4.616900       1.451600      1.9300001E-02
 C    5.827000     -0.6461000     -0.3208000    
 C    5.782100      0.7976000     -0.1512000    
 H   -4.595000      -1.160200      0.9798000    
 H   -2.526900      -2.124600       1.283800    
 H   -2.759600       1.833300     -0.4258000    
 H  -0.1002000      -2.066800       1.106700    
 H  -0.3267000       1.896900     -0.6211000    
 H    1.986500      -2.201300     -0.1901000    
 H   -4.379800      0.9146000       2.440900    
 H   -4.774000       1.904100       1.024000    
 H   -5.952900      0.7478000       1.650300    
 H    4.639800      -2.417300     -0.4261000    
 H    4.595900       2.528400      0.1448000    
 H    6.786900      -1.129500     -0.4550000    
 H    6.723500       1.336300     -0.1663000    
 H   -6.791200     -9.8200001E-02  -1.582800    


%chk=000068752-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000068752

0 1
O -5.533145 -0.702506 -1.501220
O -5.273137 1.560056 -1.055884
N 3.551406 -0.726453 0.051210
N 2.068151 1.002117 -0.261787
C -4.467944 -0.117620 0.592710
C -2.940862 -0.139502 0.420929
C -0.090709 -0.179663 0.197799
C 1.376910 -0.168011 0.080034
C -2.212744 -1.330487 0.662907
C -2.226844 1.031763 0.055543
C -0.807563 -1.352124 0.556089
C -0.824014 1.011780 -0.054463
C 3.382769 0.668244 -0.279663
C 2.274680 -1.240312 0.275390
C -4.900880 0.782211 1.778982
C 4.806610 -1.320354 0.102268
C -5.118361 0.371106 -0.699413
C 4.543707 1.440852 -0.558182
C 5.930416 -0.552742 -0.172146
C 5.803129 0.839110 -0.505405
H -4.813883 -1.152111 0.760414
H -2.749825 -2.246842 0.935937
H -2.775363 1.957512 -0.153530
H -0.271445 -2.287800 0.752782
H -0.265428 1.909487 -0.336470
H 2.115389 -2.280702 0.542467
H -4.403684 0.446090 2.704962
H -4.621620 1.832423 1.590982
H -5.994641 0.740793 1.930024
H 4.847026 -2.381015 0.360491
H 4.408957 2.495908 -0.808068
H 6.914445 -1.026749 -0.130044
H 6.701312 1.426407 -0.718359
H -5.906414 -0.347466 -2.354085


