%chk=000115269.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115269

0 1
 O    2.941300       2.284200      0.4491000    
 N   -2.094300     -0.2813000      0.5695000    
 N    1.355500      0.6472000     -6.3900001E-02
 C   -1.415200     -0.1342000     -0.7366000    
 C  -0.2378000      -1.124400     -0.9032000    
 C  -0.8920000       1.298300     -0.9521000    
 C   0.9903000     -0.7833000     -4.8000002E-03
 C  -0.7597000      -2.557900     -0.6990000    
 C   0.2679000       1.621400     -8.5000005E-03
 C   -2.031200       2.314100     -0.7978000    
 C   -2.591600      -1.653800      0.7645000    
 C   -3.221700      0.6612000      0.6882000    
 C   -1.486200      -2.698900      0.6327000    
 C   -2.788600       2.115100      0.5107000    
 C    2.177200      -1.689400     -0.3808000    
 C    2.631800       1.103400      0.2851000    
 C    3.472800      -1.198800      0.1610000    
 C    3.681400      7.6899998E-02  0.4861000    
 H   -2.144500     -0.3467000      -1.533400    
 H   9.5100001E-02  -1.047900      -1.949100    
 H  -0.5141000       1.374100      -1.981400    
 H   0.7432000     -0.9622000       1.049900    
 H   4.1200001E-02  -3.299200     -0.7717000    
 H   -1.461500      -2.795600      -1.509800    
 H   0.6589000       2.618200     -0.2447000    
 H  -5.4499999E-02   1.655600       1.038500    
 H   -2.731400       2.192600      -1.634500    
 H   -1.647400       3.339100     -0.8563000    
 H   -3.386000      -1.882300      4.1200001E-02
 H   -3.030600      -1.746800       1.765400    
 H   -3.680500      0.5628000       1.679700    
 H   -3.999300      0.4270000     -5.1500000E-02
 H   -1.922700      -3.701800      0.7059000    
 H  -0.7791000      -2.604000       1.464700    
 H   -2.165700       2.422600       1.358700    
 H   -3.671900       2.764400      0.5233000    
 H    2.277400      -1.776300      -1.469700    
 H    2.003600      -2.698200      1.0100000E-02
 H    4.281100      -1.914900      0.2754000    
 H    4.644100      0.4063000      0.8609000    


%chk=000115269-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115269

0 1
O 2.916393 2.363493 0.298123
N -2.122072 -0.284542 0.545314
N 1.371486 0.640968 -0.072550
C -1.398161 -0.124910 -0.751746
C -0.218107 -1.127741 -0.882995
C -0.878618 1.324983 -0.927019
C 0.996193 -0.801577 0.044229
C -0.745673 -2.572561 -0.686355
C 0.260272 1.611344 0.066584
C -2.029030 2.348837 -0.781810
C -2.625267 -1.670919 0.735542
C -3.256825 0.673359 0.661067
C -1.499512 -2.715338 0.654576
C -2.802258 2.137954 0.539750
C 2.185335 -1.729063 -0.318059
C 2.659635 1.116221 0.196151
C 3.526925 -1.219520 0.154332
C 3.735595 0.104219 0.369927
H -2.106443 -0.344201 -1.599816
H 0.154865 -1.022840 -1.923978
H -0.457748 1.397954 -1.950532
H 0.701170 -0.982784 1.101071
H 0.067657 -3.316399 -0.765674
H -1.451738 -2.794771 -1.513027
H 0.687317 2.614599 -0.093334
H -0.127264 1.560718 1.104149
H -2.730457 2.223151 -1.632401
H -1.632921 3.380755 -0.842460
H -3.400466 -1.919042 -0.040183
H -3.124719 -1.720549 1.721688
H -3.745726 0.504024 1.639338
H -4.026001 0.466502 -0.132330
H -1.935518 -3.728669 0.743136
H -0.809354 -2.581300 1.508812
H -2.168305 2.399137 1.406741
H -3.689838 2.798154 0.575499
H 2.227189 -1.860331 -1.421846
H 1.997048 -2.732917 0.102999
H 4.344618 -1.942894 0.270080
H 4.705624 0.513098 0.668808


