%chk=000009419.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000009419

0 1
 O   0.1336000      -2.394900      -1.206500    
 N   0.7420000     -0.2635000     -0.5071000    
 N   -1.919900      0.9907000     -0.7508000    
 N    4.304900      -1.306500     -5.7100002E-02
 C    2.135800     -0.5341000     -0.8869000    
 C   0.4450000       1.063700     -3.1700000E-02
 C  -0.8132000       1.680700     -0.2115000    
 C    2.926000      -1.021000      0.3240000    
 C   -2.367700     -0.2168000     -0.1911000    
 C   -1.499200      -1.299500     -3.1099999E-02
 C  -0.1563000      -1.333700     -0.6444000    
 C    1.490100       1.827900      0.5406000    
 C  -0.9602000       3.033800      0.1862000    
 C   -2.882600       1.754400      -1.549000    
 C   -3.689200     -0.3632000      0.2819000    
 C   -1.935700      -2.482400      0.5942000    
 C    1.313100       3.154300      0.9318000    
 C   8.5000001E-02   3.761100      0.7501000    
 C   -4.120400      -1.536200      0.9050000    
 C   -3.239400      -2.595300       1.067800    
 C    5.062400      -1.809300       1.090100    
 C    4.946100     -0.1100000     -0.6044000    
 H    2.158000      -1.302500      -1.670200    
 H    2.533000      0.3717000      -1.356200    
 H    2.883700     -0.3626000       1.194700    
 H    2.462600      -1.958300      0.6630000    
 H    2.498200       1.462000      0.6703000    
 H   -1.916200       3.542500      8.0899999E-02
 H   -3.579700       2.320000     -0.9204000    
 H   -3.465700       1.089800      -2.198400    
 H   -2.368300       2.456100      -2.217000    
 H   -4.403000      0.4533000      0.1987000    
 H   -1.266400      -3.332000      0.7103000    
 H    2.140500       3.711500       1.361000    
 H  -6.6500001E-02   4.794200       1.047100    
 H   -5.141000      -1.614600       1.267800    
 H   -3.567500      -3.510600       1.550800    
 H    6.079700      -2.083800      0.7897000    
 H    4.599100      -2.718800       1.489000    
 H    5.128100      -1.071900       1.898500    
 H    4.577000      0.1341000      -1.604800    
 H    6.020800     -0.2843000     -0.7401000    
 H    4.835200      0.7626000      4.9300000E-02


%chk=000009419-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000009419

0 1
O 0.419363 -2.510612 -0.264664
N 0.728121 -0.218523 -0.251994
N -1.907868 0.917276 -0.864378
N 4.449431 -1.146427 -0.257525
C 2.107092 -0.478734 -0.764868
C 0.378911 1.130603 0.104662
C -0.876329 1.707800 -0.252985
C 3.076445 -1.080239 0.285644
C -2.400925 -0.216088 -0.142966
C -1.513913 -1.225819 0.337338
C -0.075424 -1.350774 -0.072658
C 1.359714 1.949817 0.722564
C -1.091873 3.090006 -0.009080
C -2.834745 1.605330 -1.781135
C -3.797751 -0.364766 0.085011
C -2.040782 -2.318198 1.073551
C 1.133376 3.321056 0.958060
C -0.097170 3.898269 0.578094
C -4.300263 -1.458712 0.816654
C -3.418785 -2.434890 1.335829
C 5.245338 -2.261426 0.293080
C 5.171177 0.138542 -0.188294
H 2.028918 -1.202477 -1.593112
H 2.494706 0.472009 -1.166043
H 3.029340 -0.498017 1.241275
H 2.728188 -2.101610 0.510458
H 2.315470 1.505742 1.015910
H -2.052793 3.536774 -0.281580
H -3.609936 2.220138 -1.273286
H -3.348148 0.852029 -2.401695
H -2.253392 2.266752 -2.444303
H -4.494215 0.388770 -0.293469
H -1.340894 -3.098689 1.387773
H 1.911849 3.928181 1.431613
H -0.289394 4.963059 0.747131
H -5.379833 -1.543695 0.985505
H -3.802897 -3.284317 1.909341
H 6.211097 -2.325712 -0.240840
H 4.706602 -3.212405 0.140223
H 5.464754 -2.157175 1.386200
H 4.594219 0.935527 -0.689638
H 6.140622 0.050447 -0.710788
H 5.374396 0.469777 0.863485


