%chk=000095966.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095966

0 1
 O   -1.344900       3.615700     -0.5918000    
 O   0.5706000      -3.125000      0.3017000    
 O    3.616000       2.438600     -0.4932000    
 N   -2.632600       2.162200      0.6817000    
 N   -1.458700      -2.575900     -0.6850000    
 N    4.188200      0.1885000     -0.5430000    
 C   -3.965100       2.421500      0.2223000    
 C   -2.385300      -3.451400     -3.0300001E-02
 C    5.405900      0.1465000      0.2116000    
 C   -3.420900       3.113400       1.408100    
 C   -1.764300      -3.825400      -1.316900    
 C    5.426400      0.2714000      -1.259800    
 C   -4.970300       1.345200      0.3842000    
 C   -3.807000      -3.036900      1.7700000E-02
 C    5.772500      -1.136800      0.8551000    
 C   -1.511400       2.528300     -4.6300001E-02
 C  -0.2062000      -2.294800     -0.1621000    
 C    3.302400       1.251700     -0.4651000    
 C  -0.4577000       1.477900     -0.1376000    
 C   0.1731000     -0.8535000     -0.1946000    
 C    1.869300      0.8607000     -0.3405000    
 C  -0.8128000      0.1293000     -0.1081000    
 C   0.8834000       1.843600     -0.2539000    
 C    1.514200     -0.4878000     -0.3108000    
 C   -5.410600      0.7532000     -0.9507000    
 C   -4.265700      -2.690300       1.430400    
 C    5.691400      -1.070000       2.376500    
 H   -4.056000       2.989000     -0.6949000    
 H   -2.029800      -3.946800      0.8640000    
 H    5.640800       1.027000      0.7956000    
 H   -3.686200       2.774100       2.399100    
 H   -3.107700       4.144000       1.319400    
 H   -2.318800      -3.709600      -2.237000    
 H  -0.9646000      -4.552400      -1.324500    
 H    5.619700     -0.5976000      -1.872200    
 H    5.645000       1.232200      -1.704200    
 H   -5.854600       1.756200      0.8855000    
 H   -4.591300      0.5394000       1.024500    
 H   -4.430400      -3.859200     -0.3533000    
 H   -3.994000      -2.178600     -0.6390000    
 H    6.802100      -1.392400      0.5776000    
 H    5.137200      -1.957400      0.4993000    
 H   -1.857600     -0.1556000     -1.7600000E-02
 H    1.154700       2.896400     -0.2722000    
 H    2.262100      -1.273100     -0.3812000    
 H   -5.862700       1.518900      -1.589500    
 H   -6.147000     -4.0399998E-02 -0.7915000    
 H   -4.555900      0.3287000      -1.487600    
 H   -3.668600      -1.869900       1.841900    
 H   -5.316300      -2.384000       1.425800    
 H   -4.161300      -3.550900       2.099200    
 H    4.674700     -0.8242000       2.700600    
 H    5.970700      -2.032400       2.816100    
 H    6.365500     -0.3032000       2.772300    


%chk=000095966-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095966

0 1
O -1.384428 3.421230 1.882094
O 0.664627 -2.685787 -1.515437
O 3.305385 3.044378 -0.224441
N -3.010941 2.029588 0.922470
N -1.430028 -2.557744 -0.471984
N 4.133966 0.877695 -0.528603
C -3.820563 2.226810 -0.342113
C -1.877991 -3.119035 0.862864
C 4.826913 -0.090400 0.400091
C -4.118878 3.016997 0.934628
C -1.647567 -4.020366 -0.352356
C 5.541601 1.146777 -0.156568
C -4.746172 1.119658 -0.825371
C -3.282511 -2.829015 1.375411
C 5.185869 -1.487346 -0.088496
C -1.670034 2.424211 1.155260
C -0.163895 -2.027121 -0.814872
C 3.096469 1.794315 -0.261752
C -0.618531 1.530671 0.564623
C 0.101494 -0.616879 -0.379126
C 1.718885 1.211902 -0.115030
C -0.912705 0.207168 0.160066
C 0.700644 2.026188 0.437865
C 1.411668 -0.102468 -0.533557
C -4.133140 0.206594 -1.911304
C -3.365032 -1.698323 2.425899
C 4.170300 -2.588742 0.290850
H -3.299947 2.784321 -1.135327
H -1.091951 -3.148700 1.632647
H 4.510758 -0.024329 1.452417
H -4.992210 2.737900 1.534334
H -3.830238 4.073265 0.988269
H -2.519768 -4.411179 -0.887915
H -0.752356 -4.652115 -0.388652
H 6.277372 1.011279 -0.957011
H 5.717279 2.005438 0.502266
H -5.656835 1.606295 -1.230568
H -5.068686 0.520148 0.047940
H -3.664744 -3.767999 1.825688
H -3.935209 -2.604664 0.509784
H 6.173495 -1.738211 0.350217
H 5.324089 -1.454973 -1.185794
H -1.928041 -0.177476 0.265905
H 0.934704 3.046405 0.757796
H 2.172205 -0.727516 -1.007599
H -3.788043 0.798798 -2.779357
H -4.882673 -0.517558 -2.278645
H -3.271661 -0.369549 -1.532413
H -3.097209 -0.712637 2.007940
H -4.391651 -1.618980 2.827106
H -2.689477 -1.899070 3.278508
H 3.205762 -2.464398 -0.229960
H 4.563108 -3.584470 0.016856
H 3.976122 -2.592880 1.380255


