%chk=000131749.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131749

0 1
 O    5.822500     -0.6560000      0.9987000    
 N  -0.2441000      0.9487000     -0.7655000    
 C   -1.497600      0.5672000     -8.5199997E-02
 C   -1.478400       1.253200       1.310800    
 C   -2.700100       1.142100     -0.8875000    
 C   -1.509800       2.783200       1.254500    
 C   -2.743400       2.672000     -0.9356000    
 C   -2.705300       3.285900      0.4569000    
 C   -1.598200     -0.9698000     -1.7700000E-02
 C   0.9090000      0.4418000     -3.9099999E-02
 C    2.200100      0.8104000     -0.7690000    
 C   -1.661400      -1.604000       1.219100    
 C   -1.624700      -1.712400      -1.194100    
 C    3.426500      0.2652000     -2.9800000E-02
 C   -1.752000      -2.994700       1.280200    
 C   -1.715400      -3.103000      -1.133000    
 C   -1.778900      -3.744100      0.1042000    
 C    4.731200      0.5878000     -0.7518000    
 C    5.919900      2.6600000E-02 -1.6200000E-02
 H   -2.395000      0.9608000       1.846300    
 H  -0.6672000      0.9308000       1.970500    
 H   -2.699700      0.7726000      -1.920900    
 H   -3.637000      0.7813000     -0.4401000    
 H  -0.5804000       3.166900      0.8177000    
 H   -1.564000       3.182100       2.274300    
 H   -3.656500       2.993000      -1.450200    
 H   -1.901600       3.050400      -1.527900    
 H   -2.665600       4.378300      0.3793000    
 H   -3.631500       3.038300      0.9902000    
 H  -0.2388000      0.6087000      -1.726000    
 H   0.8946000     -0.6477000      6.7900002E-02
 H    1.002700      0.8806000      0.9569000    
 H    2.282000       1.900900     -0.8587000    
 H    2.181900      0.4019000      -1.787500    
 H   -1.640100      -1.075500       2.164700    
 H   -1.571600      -1.238200      -2.169700    
 H    3.328800     -0.8225000      8.0200002E-02
 H    3.455600      0.6808000      0.9856000    
 H   -1.800300      -3.494800       2.243200    
 H   -1.734900      -3.686900      -2.048500    
 H   -1.848800      -4.826900      0.1518000    
 H    4.867300       1.671400     -0.8311000    
 H    4.731300      0.1642000      -1.761400    
 H    6.905000      0.2576000     -0.4556000    


%chk=000131749-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131749

0 1
O 6.281127 -0.420850 0.755307
N -0.200963 0.904300 -0.571284
C -1.526327 0.542941 0.024862
C -1.663725 1.219593 1.420296
C -2.628129 1.138699 -0.912624
C -1.575904 2.759237 1.337281
C -2.579512 2.682486 -0.999657
C -2.669243 3.327364 0.402550
C -1.721690 -1.001370 0.099105
C 1.019837 0.371387 0.073363
C 2.272455 0.803526 -0.715092
C -2.076866 -1.691416 1.286458
C -1.525967 -1.776475 -1.076929
C 3.581065 0.287209 -0.079156
C -2.236775 -3.097690 1.298255
C -1.686327 -3.177608 -1.074309
C -2.045712 -3.848880 0.118578
C 4.826428 0.712445 -0.877341
C 6.150673 0.250345 -0.296252
H -2.649434 0.942666 1.844544
H -0.896498 0.828562 2.116347
H -2.531676 0.695130 -1.924966
H -3.614431 0.815956 -0.524401
H -0.580302 3.043326 0.946851
H -1.675262 3.191849 2.352316
H -3.408214 3.039716 -1.642591
H -1.630864 2.991007 -1.478020
H -2.573431 4.427705 0.323435
H -3.669312 3.121684 0.839768
H -0.193602 0.714927 -1.584384
H 1.011154 -0.741194 0.170349
H 1.085048 0.780324 1.100246
H 2.286324 1.909800 -0.780272
H 2.195345 0.425537 -1.758160
H -2.228789 -1.139406 2.218758
H -1.235535 -1.278668 -2.011539
H 3.557712 -0.816745 -0.000860
H 3.670611 0.661011 0.959039
H -2.508550 -3.604213 2.231821
H -1.530664 -3.746972 -1.998121
H -2.169326 -4.937620 0.126729
H 4.879831 1.819471 -0.975953
H 4.778365 0.340157 -1.924796
H 7.053157 0.558948 -0.888651


