%chk=000207001.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207001

0 1
O 0.670964 -0.369115 0.189779
O 0.486035 -0.277215 -2.085550
O 2.512473 -3.352935 2.130561
O 0.658873 -2.420808 1.532419
N 2.159470 1.771993 -0.937348
N 1.875876 -2.457325 1.595607
C -5.680170 0.376328 0.376854
C -4.190848 0.235587 0.041831
C -6.431758 -0.695584 -0.435873
C -6.182505 1.781385 -0.008186
C -5.949438 0.167174 1.878108
C -3.690941 0.780053 -1.157601
C -3.313115 -0.466761 0.881283
C -2.349360 0.643346 -1.501829
C -1.964461 -0.607380 0.550558
C -1.479463 -0.049626 -0.641971
C -0.069459 -0.197158 -1.031545
C 2.025251 -0.345875 0.264745
C 2.813088 0.738131 -0.282530
C 4.221932 0.715620 -0.103256
C 2.642501 -1.356879 0.997492
C 4.828916 -0.350127 0.634342
C 4.063524 -1.345700 1.175607
C 4.976764 1.793560 -0.669672
C 4.325869 2.800696 -1.334106
C 2.893867 2.757245 -1.439971
H -7.509313 -0.654709 -0.245632
H -6.283355 -0.566209 -1.513283
H -6.090848 -1.705022 -0.179059
H -6.125150 1.959038 -1.087388
H -7.229376 1.920140 0.283218
H -5.597142 2.563154 0.488495
H -7.010461 0.310020 2.111644
H -5.685486 -0.844256 2.206588
H -5.382933 0.877542 2.490525
H -4.361522 1.315005 -1.830847
H -3.674502 -0.917835 1.806268
H -1.969713 1.067627 -2.433606
H -1.278555 -1.156783 1.210563
H 5.911738 -0.348679 0.759716
H 4.509210 -2.165870 1.753018
H 6.061982 1.792011 -0.560333
H 4.865069 3.634296 -1.781978
H 2.358469 3.565800 -1.955456


%chk=000207001-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207001

0 1
O 0.743102 -0.581401 0.432199
O 0.505672 -0.477153 -1.909437
O 3.062783 -3.934838 1.224163
O 1.159271 -2.849081 1.857048
N 1.975803 1.736888 -0.442888
N 2.333144 -2.868409 1.328986
C -5.737704 0.503196 0.278967
C -4.227513 0.272877 0.043436
C -6.543335 -0.620615 -0.442636
C -6.144140 1.888758 -0.309808
C -6.113839 0.484184 1.782489
C -3.712653 0.262790 -1.285630
C -3.308847 0.060531 1.105445
C -2.349038 0.049353 -1.542551
C -1.936732 -0.151855 0.862045
C -1.444877 -0.158137 -0.466414
C -0.020243 -0.382225 -0.787504
C 2.130634 -0.531667 0.387039
C 2.781756 0.673924 -0.072935
C 4.224895 0.731989 -0.108139
C 2.924537 -1.606112 0.828273
C 4.991310 -0.396169 0.330010
C 4.352900 -1.540386 0.790925
C 4.821018 1.945669 -0.582659
C 4.002397 3.006598 -0.972156
C 2.580399 2.858060 -0.874075
H -7.627842 -0.466025 -0.290291
H -6.351956 -0.628699 -1.530506
H -6.275586 -1.615814 -0.043413
H -5.939014 1.951138 -1.393300
H -7.226492 2.060341 -0.159275
H -5.591231 2.706163 0.188119
H -7.200362 0.654581 1.892016
H -5.879194 -0.488608 2.252437
H -5.592805 1.279903 2.346335
H -4.389355 0.422628 -2.132246
H -3.662033 0.055230 2.140061
H -1.961640 0.040011 -2.566833
H -1.243175 -0.323271 1.689390
H 6.085159 -0.348206 0.301922
H 4.910964 -2.419223 1.123234
H 5.912668 2.025343 -0.631815
H 4.423938 3.946282 -1.341434
H 1.919251 3.685358 -1.156397


