%chk=000112237.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112237

0 1
 O   0.5988000      -2.132400      4.5000002E-02
 O   0.1697000       3.861400      5.4499999E-02
 O   -2.007300       2.531900     -6.5000001E-03
 O   -1.578400      -3.461900     -1.0300000E-02
 N    2.914200     -0.9803000      0.1070000    
 N   -4.323000       1.379700     -6.3000001E-02
 C   0.7470000      0.2180000      5.7200000E-02
 C   6.0400002E-02   1.433800      4.3900002E-02
 C    2.146500      0.2070000      9.1600001E-02
 C   -1.468900      -1.034300     -1.2000001E-03
 C   -2.155700      0.1815000     -1.4500000E-02
 C   7.4999998E-03  -1.060600      3.4800000E-02
 C   -1.416200       1.460000      7.0000002E-03
 C    4.342100     -0.9773000      0.1422000    
 C   0.7730000       2.638600      6.5300003E-02
 C    2.852900       1.410000      0.1128000    
 C   -3.555200      0.1925000     -4.8700001E-02
 C   -2.181700      -2.239100     -2.2000000E-02
 C    2.167600       2.623100      9.9799998E-02
 C    4.905100     -0.7021000      -1.249400    
 C    4.839600      -2.315300      0.6798000    
 C   -4.261600      -1.010500     -6.9399998E-02
 C   -3.576400      -2.223600     -5.6000002E-02
 H    4.729500     -0.2381000      0.8531000    
 H    2.429500      -1.859900     -2.0900000E-02
 H    3.933100       1.488100      0.1449000    
 H    2.726800       3.555100      0.1177000    
 H    6.000300     -0.7044000      -1.227000    
 H    4.585800      -1.474300      -1.959300    
 H    4.587200      0.2601000      -1.660000    
 H    4.442100      -2.504500       1.683400    
 H    5.932900      -2.331200      0.7403000    
 H    4.523500      -3.146200      3.8600001E-02
 H   -5.348600      -1.019700     -9.5799997E-02
 H   -4.136800      -3.154800     -7.2200000E-02
 H   -3.876500       2.285500     -5.1199999E-02
 H   -5.332900       1.326600     -8.9500003E-02
 H  -0.7943000       3.770100      3.4600001E-02
 H  -0.6145000      -3.370500      1.5400000E-02


%chk=000112237-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112237

0 1
O 0.661854 -2.186680 0.043186
O 0.049850 3.926748 0.076101
O -2.073408 2.658476 0.012936
O -1.464111 -3.453222 -0.024803
N 2.924651 -0.907741 0.120564
N -4.341531 1.370152 -0.056876
C 0.761955 0.237542 0.063809
C 0.021159 1.475828 0.055884
C 2.208922 0.265578 0.098782
C -1.430239 -1.002550 -0.002691
C -2.168681 0.235949 -0.010847
C 0.030029 -1.011380 0.036012
C -1.439851 1.487543 0.019845
C 4.395765 -1.030742 0.122008
C 0.712796 2.726524 0.082933
C 2.864380 1.550503 0.120056
C -3.607780 0.206456 -0.048722
C -2.125921 -2.251531 -0.031808
C 2.139632 2.738680 0.116069
C 4.985841 -0.818590 -1.296649
C 4.769121 -2.417765 0.685683
C -4.271904 -1.068720 -0.077720
C -3.553227 -2.261967 -0.069542
H 4.813978 -0.259946 0.801240
H 2.327294 -1.761886 0.092044
H 3.956197 1.598159 0.142271
H 2.642932 3.709860 0.135023
H 6.090054 -0.859040 -1.266161
H 4.627313 -1.608398 -1.981191
H 4.685102 0.157493 -1.716590
H 4.379362 -2.548661 1.710467
H 5.866104 -2.538210 0.711325
H 4.353959 -3.222835 0.050567
H -5.367686 -1.092894 -0.106507
H -4.058711 -3.231810 -0.091479
H -3.804653 2.253871 -0.033098
H -5.358286 1.342623 -0.082720
H -0.976458 3.680386 0.047443
H -0.438705 -3.205803 0.005157


