%chk=000026194.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026194

0 1
 O    1.538200      0.7967000      0.2680000    
 O  -0.2615000     -4.6100002E-02   1.734700    
 O   0.7016000     -0.2584000      -1.596400    
 N    4.796800     -0.1820000     -0.3040000    
 C    2.767900       1.018900     -0.4078000    
 C    3.761400       1.720800      0.5150000    
 C    3.408900     -0.3251000     -0.7495000    
 C    4.735300      0.6236000      0.9144000    
 C    5.450100      -1.464800     -9.2200004E-02
 C  -0.7163000     -1.9600000E-02  0.3712000    
 C   0.5684000      0.1375000     -0.4434000    
 C   -1.645400       1.182500      0.1815000    
 C   -1.390600      -1.381400      0.1488000    
 C   -2.757800       1.287100      0.9839000    
 C   -2.433600      -1.456200     -0.7417000    
 C   -1.331100       2.111300     -0.7832000    
 C  -0.9211000      -2.465200      0.8495000    
 C   -3.604200       2.382500      0.8114000    
 C   -3.045900      -2.693000     -0.9439000    
 C   -2.177500       3.206600     -0.9555000    
 C   -1.533500      -3.702000      0.6471000    
 C   -3.314000       3.342200     -0.1582000    
 C   -2.595900      -3.815800     -0.2496000    
 H    2.590100       1.637400      -1.296100    
 H    3.288900       2.183000       1.387200    
 H    4.297500       2.497700     -4.4300001E-02
 H    2.910300      -1.156200     -0.2340000    
 H    3.377700     -0.5183000      -1.827000    
 H    5.711800       1.033200       1.190600    
 H    4.335700      5.3100001E-02   1.762600    
 H    6.488900      -1.315900      0.2223000    
 H    5.478000      -2.037600      -1.025500    
 H    4.945800      -2.071500      0.6686000    
 H  -5.0200000E-02  0.8638000       2.006500    
 H   -2.991700      0.5499000       1.745700    
 H   -2.789400     -0.6098000      -1.318700    
 H  -0.4674000       2.053600      -1.434000    
 H  -8.3300002E-02  -2.411100       1.536900    
 H   -4.488500       2.488700       1.433000    
 H   -3.868600      -2.783500      -1.647100    
 H   -1.953100       3.953700      -1.711400    
 H   -1.179900      -4.577800       1.183400    
 H   -3.972900       4.194900     -0.2925000    
 H   -3.070900      -4.779400     -0.4092000    


%chk=000026194-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000026194

0 1
O 1.595421 0.644110 0.276880
O -0.298634 -0.092720 1.855813
O 0.556575 -0.021605 -1.697865
N 4.964555 -0.190762 -0.214033
C 2.862129 0.934056 -0.487344
C 3.790660 1.729995 0.456942
C 3.614663 -0.389699 -0.797767
C 4.779339 0.666061 0.981835
C 5.739939 -1.421998 -0.015917
C -0.727666 -0.016808 0.457046
C 0.514095 0.167684 -0.464341
C -1.679210 1.198764 0.262893
C -1.435049 -1.349433 0.123020
C -2.483021 1.584013 1.365159
C -2.118523 -1.515814 -1.106455
C -1.803319 1.898789 -0.962803
C -1.395252 -2.419959 1.047770
C -3.396780 2.652397 1.243643
C -2.751169 -2.741034 -1.407526
C -2.716725 2.971836 -1.079586
C -2.036386 -3.643345 0.746422
C -3.517549 3.352177 0.020075
C -2.714539 -3.809957 -0.481948
H 2.562702 1.480817 -1.395508
H 3.219483 2.239461 1.250172
H 4.336718 2.489468 -0.128083
H 3.060665 -1.232144 -0.312908
H 3.674780 -0.601814 -1.878677
H 5.743466 1.093566 1.308358
H 4.334093 0.109188 1.845984
H 6.742769 -1.173338 0.374556
H 5.872740 -1.940528 -0.982333
H 5.256033 -2.138933 0.695215
H 0.488135 0.504407 1.958561
H -2.375006 1.041012 2.308791
H -2.158182 -0.695363 -1.828623
H -1.191829 1.615885 -1.826622
H -0.870459 -2.277188 1.995388
H -4.014610 2.938552 2.102467
H -3.274814 -2.859727 -2.362736
H -2.800824 3.508420 -2.031439
H -2.004509 -4.464467 1.471751
H -4.225733 4.183139 -0.073566
H -3.210173 -4.759160 -0.715561


