%chk=000091880.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091880

0 1
 O   0.1151000      -1.045900      -1.425000    
 O    3.062400      0.2114000      0.1779000    
 O    4.545300      -1.407300     -0.5107000    
 N    1.117200      -1.452200      0.6364000    
 C   -1.699300      0.7065000     -0.2518000    
 C   -1.052300     -0.4284000      0.5701000    
 C   -3.141700       1.037700      0.1679000    
 C  -0.8344000       1.974200     -0.1376000    
 C   -1.952900      -1.596800      0.9882000    
 C   -4.183600      0.1557000     -0.5205000    
 C   -2.963100      -2.058400     -6.0400002E-02
 C   -4.270400      -1.274500     -5.2000000E-03
 C   0.1112000     -0.9957000     -0.1978000    
 C  -0.8068000       2.462800       1.304600    
 C   -1.362000       3.055500      -1.071100    
 C    2.332700      -2.062500      0.1485000    
 C    3.440300      -1.066200     -0.1016000    
 C    4.060500       1.215600     -3.3599999E-02
 C    3.481900       2.568600      0.3218000    
 H   -1.725700      0.4287000      -1.313900    
 H  -0.6624000     -4.3099999E-02   1.515100    
 H   -3.261900      0.9556000       1.255300    
 H   -3.424400       2.061400     -8.5100003E-02
 H   0.1918000       1.744600     -0.4498000    
 H   -1.332200      -2.461700       1.258000    
 H   -2.484900      -1.327300       1.910000    
 H   -5.169800      0.6175000     -0.3828000    
 H   -4.004400      0.1465000      -1.602900    
 H   -2.535500      -2.037800      -1.068700    
 H   -3.205900      -3.107900      0.1504000    
 H   -4.657100      -1.270200       1.021500    
 H   -5.017700      -1.806000     -0.6079000    
 H  -0.2205000       1.823000       1.967900    
 H   -1.799000       2.605900       1.740800    
 H  -0.3124000       3.442000       1.343700    
 H   -1.607500       2.656000      -2.060700    
 H  -0.5867000       3.817500      -1.218200    
 H   -2.232200       3.589000     -0.6781000    
 H    1.016800      -1.355100       1.642400    
 H    2.667200      -2.771600      0.9109000    
 H    2.119600      -2.586400     -0.7881000    
 H    4.368300       1.209100      -1.085200    
 H    4.928500       1.006200      0.6013000    
 H    3.142200       2.581600       1.362700    
 H    2.607900       2.789000     -0.2997000    
 H    4.223100       3.360300      0.1812000    


%chk=000091880-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091880

0 1
O -0.163804 -1.636412 -1.311667
O 3.146685 0.397968 0.180173
O 4.620615 -1.147612 -0.757696
N 1.176704 -1.389584 0.569335
C -1.752693 0.597334 -0.121551
C -1.169959 -0.602712 0.695682
C -3.203086 0.992639 0.274020
C -0.749923 1.804580 -0.083038
C -2.193781 -1.714153 1.095403
C -4.297513 0.186157 -0.473577
C -3.200944 -2.145867 -0.001070
C -4.485603 -1.280401 -0.017981
C -0.027501 -1.239592 -0.111796
C -0.763776 2.572767 1.263312
C -0.987340 2.776891 -1.263386
C 2.371570 -1.889629 -0.098513
C 3.501041 -0.871129 -0.272661
C 4.182748 1.468042 0.009457
C 3.570348 2.761203 0.536072
H -1.785423 0.253438 -1.176234
H -0.746784 -0.210307 1.645155
H -3.352785 0.910526 1.370107
H -3.352540 2.062642 0.028445
H 0.269036 1.380306 -0.213478
H -1.616457 -2.595514 1.440164
H -2.763875 -1.359596 1.977962
H -5.269688 0.708759 -0.361059
H -4.058181 0.202696 -1.556899
H -2.704567 -2.137172 -0.989948
H -3.498083 -3.196094 0.190477
H -4.923406 -1.288494 1.003001
H -5.236146 -1.757031 -0.680904
H -0.599962 1.903978 2.129475
H -1.727353 3.092607 1.418300
H 0.034140 3.339201 1.279949
H -0.906825 2.249963 -2.232121
H -0.243499 3.596454 -1.256875
H -1.989938 3.242633 -1.212094
H 1.276521 -0.949065 1.484348
H 2.802264 -2.767818 0.418942
H 2.055162 -2.226418 -1.104708
H 4.441420 1.524607 -1.062895
H 5.087112 1.164732 0.567197
H 3.309186 2.671020 1.604614
H 2.657182 3.022083 -0.026277
H 4.295002 3.588274 0.425041


