%chk=000091814.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091814

0 1
 O    1.274500       2.368900     -0.6431000    
 O   0.4464000       1.139500       2.572500    
 O  -0.5993000       3.604900     -0.9101000    
 O    3.302500      -2.517800     -0.7667000    
 N   4.7699999E-02  0.3255000      0.4341000    
 N   -2.686600      -1.474700      -1.158300    
 N    3.076100     -0.3605000      8.0700003E-02
 N   -4.041900      -1.638800      0.5934000    
 C  -0.8429000       1.378000      2.7999999E-03
 C   -1.842500      0.8656000      -1.043200    
 C   -2.676800     -0.2854000     -0.5308000    
 C    1.502200     -0.9295000       1.881700    
 C   0.6223000      0.2968000       1.696700    
 C    2.951000     -0.7033000       1.472000    
 C  -6.3900001E-02   2.559300     -0.5569000    
 C   -3.498700     -0.3799000      0.5335000    
 C   -3.532800      -2.272600     -0.4398000    
 C    3.242100      -1.301500     -0.9261000    
 C    3.320600     -0.6746000      -2.292300    
 H   -1.371800       1.749200      0.8898000    
 H   -2.518900       1.675800      -1.344400    
 H   -1.305300      0.5598000      -1.951300    
 H   0.3221000     -0.3751000     -0.2490000    
 H    1.459700      -1.206500       2.941700    
 H    1.074500      -1.770800       1.322300    
 H    3.382200      0.1253000       2.043700    
 H    3.540400      -1.603600       1.675900    
 H   -2.176800      -1.738900      -1.991500    
 H   -3.743900      0.3710000       1.270200    
 H    3.021600      0.6228000     -0.1696000    
 H   -3.732600      -3.297100     -0.7199000    
 H    1.734200       3.153300      -1.011500    
 H    3.656800      -1.417900      -3.020400    
 H    2.331600     -0.3080000      -2.581100    
 H    4.030400      0.1575000      -2.287500    


%chk=000091814-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091814

0 1
O 1.338640 2.100325 -0.913567
O -0.026148 0.506496 2.309608
O -0.594524 2.997241 -1.820320
O 4.756549 -1.839778 -0.341197
N 0.067637 -0.081655 0.064496
N -4.064426 -0.963410 -0.959783
N 3.201723 -0.179668 0.177273
N -4.230605 -1.364314 1.256169
C -0.801256 1.012998 -0.351697
C -2.038300 0.562430 -1.173426
C -2.992102 -0.275007 -0.363352
C 1.495233 -1.311546 1.649951
C 0.438384 -0.244441 1.397551
C 2.922377 -0.696786 1.524230
C -0.058364 2.121334 -1.112723
C -3.117902 -0.539728 1.005955
C -4.780477 -1.600795 0.051901
C 4.119057 -0.791772 -0.667248
C 4.321286 -0.103751 -2.016786
H -1.144037 1.481978 0.597668
H -2.533304 1.478855 -1.548509
H -1.692789 0.006680 -2.070778
H 0.462644 -0.705187 -0.641465
H 1.359786 -1.688689 2.677419
H 1.402329 -2.159450 0.947210
H 3.033487 0.112860 2.268992
H 3.676116 -1.475615 1.729496
H -4.282198 -0.980163 -1.955802
H -2.479025 -0.200555 1.819186
H 2.696079 0.654860 -0.141338
H -5.664410 -2.206259 -0.134059
H 1.727284 2.899558 -1.364912
H 5.320406 0.367098 -2.036724
H 4.304871 -0.864524 -2.814690
H 3.560177 0.667082 -2.231231


