%chk=000161374.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161374

0 1
 O   -2.749500      -1.696700     -0.8009000    
 O   -5.809600     -0.1595000      0.2645000    
 O   -5.231800      -2.331000     -5.6699999E-02
 N    3.612900      -1.696400      0.2576000    
 C    3.782200     -0.5394000       1.142500    
 C    3.450900      -1.099400      -1.072000    
 C    1.976200      0.7819000     -0.1242000    
 C    2.499100      0.3112000       1.252200    
 C    2.131200     -0.3107000      -1.206800    
 C    4.890400      0.2045000      0.3858000    
 C    4.669900     -0.1679000      -1.087100    
 C   0.5627000       1.329400     -5.1300000E-02
 C    2.597700      -2.654800      0.6519000    
 C  -0.4884000      0.4927000      0.3185000    
 C   0.3201000       2.668000     -0.3537000    
 C   -1.787500      0.9965000      0.3862000    
 C  -0.9787000       3.171800     -0.2859000    
 C   -2.032500       2.336100      8.4100001E-02
 C   -2.914500      0.1035000      0.7827000    
 C   -3.566500     -0.5960000     -0.4210000    
 C   -4.934300      -1.143800     -6.6500001E-02
 H    4.126600     -0.8333000       2.140000    
 H    3.526800      -1.847200      -1.868900    
 H    2.626500       1.613200     -0.4318000    
 H    2.698800       1.192400       1.876500    
 H    1.736700     -0.2620000       1.792700    
 H    1.291100      -1.014900      -1.184500    
 H    2.089200      0.1622000      -2.197100    
 H    5.878400     -0.1508000      0.7041000    
 H    4.862600       1.287500      0.5434000    
 H    4.524300      0.7163000      -1.716100    
 H    5.554300     -0.6983000      -1.461800    
 H    2.584600      -3.496700     -4.8900001E-02
 H    1.585000      -2.246100      0.6999000    
 H    2.836800      -3.070200       1.637100    
 H  -0.3056000     -0.5521000      0.5553000    
 H    1.129700       3.332200     -0.6435000    
 H   -1.169800       4.214600     -0.5217000    
 H   -3.040300       2.740400      0.1310000    
 H   -3.653400      0.6995000       1.333600    
 H   -2.551800     -0.6448000       1.500600    
 H   -3.670700      7.0400000E-02  -1.284700    
 H   -3.118000      -2.064800      -1.622200    
 H   -6.690900     -0.5187000      0.5021000    


%chk=000161374-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000161374

0 1
O -2.208308 -1.840431 0.282220
O -5.582552 -0.665189 -0.559720
O -4.816664 -2.561419 0.547622
N 3.430424 -1.789512 0.039227
C 3.642461 -0.723382 1.064722
C 3.354007 -1.005686 -1.231095
C 1.966248 0.859847 -0.101345
C 2.376750 0.169399 1.239371
C 2.057181 -0.144707 -1.297542
C 4.829786 0.061205 0.432429
C 4.635077 -0.128249 -1.113811
C 0.587104 1.512460 -0.021434
C 2.387009 -2.794990 0.290233
C -0.560223 0.734715 0.279017
C 0.420478 2.899729 -0.260260
C -1.853438 1.309861 0.334264
C -0.862295 3.489833 -0.206857
C -1.995552 2.699649 0.086092
C -3.081802 0.473016 0.676635
C -3.194602 -0.847869 -0.142787
C -4.588453 -1.460553 -0.008955
H 3.911901 -1.183773 2.033935
H 3.392299 -1.692061 -2.097878
H 2.703370 1.665953 -0.293465
H 2.558962 0.943370 2.010642
H 1.542567 -0.455661 1.612573
H 1.174603 -0.813391 -1.289605
H 2.018169 0.416582 -2.251710
H 5.786788 -0.378900 0.759473
H 4.824580 1.124116 0.735172
H 4.523955 0.832052 -1.649505
H 5.496512 -0.660615 -1.551017
H 2.406153 -3.543300 -0.523539
H 1.342798 -2.405581 0.362109
H 2.613772 -3.321009 1.236066
H -0.464318 -0.340588 0.465341
H 1.297797 3.517015 -0.491150
H -0.979748 4.563054 -0.395993
H -2.990818 3.160207 0.121016
H -3.992723 1.072471 0.495893
H -3.074536 0.189641 1.748253
H -3.013160 -0.624870 -1.210905
H -2.699511 -2.583046 0.730821
H -6.471147 -1.100597 -0.449553


