%chk=000198947.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198947

0 1
O -1.506844 1.452553 -1.956852
N -0.708121 2.553416 -0.154497
C -0.491886 0.055368 -0.220848
C -0.637376 -1.059712 -1.288754
C -1.434881 -0.211296 0.977010
C 0.971801 0.163540 0.186818
C -0.948102 1.387777 -0.874136
C 1.885130 0.748643 -0.709346
C 1.445064 -0.335080 1.407775
C -0.248115 -2.414972 -0.781735
C -2.893578 -0.076048 0.646941
C 3.237287 0.848701 -0.379293
C 2.801591 -0.233206 1.736243
C 3.700296 0.360645 0.847717
C -1.011289 -3.497389 -0.918179
C -3.832580 0.087325 1.576671
H -0.014493 -0.809622 -2.176303
H -1.680452 -1.051589 -1.676755
H -1.172240 0.459989 1.820155
H -1.259079 -1.247196 1.348962
H 1.541074 1.125863 -1.673587
H 0.769984 -0.817771 2.112655
H 0.732520 -2.460945 -0.301581
H -3.144951 -0.134276 -0.416562
H 3.934088 1.305534 -1.081192
H 3.155878 -0.623492 2.689445
H -0.233442 2.567304 0.729261
H -1.009980 3.441387 -0.524138
H 4.754781 0.439662 1.104668
H -0.715289 -4.477056 -0.573112
H -1.985240 -3.493786 -1.385738
H -4.883945 0.170549 1.340958
H -3.634611 0.149979 2.635727


%chk=000198947-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198947

0 1
O -1.768673 1.470275 -1.804735
N -0.724425 2.517610 -0.025836
C -0.515642 0.040674 -0.196034
C -0.639542 -1.033680 -1.337083
C -1.435481 -0.341348 1.020282
C 0.966774 0.173224 0.221437
C -1.046135 1.396476 -0.767889
C 1.895245 0.727795 -0.704128
C 1.463844 -0.275585 1.472026
C -0.234713 -2.427396 -0.911581
C -2.919190 -0.322619 0.720900
C 3.266056 0.831560 -0.392191
C 2.839250 -0.172709 1.789187
C 3.747038 0.380029 0.860095
C -1.018033 -3.530246 -1.023771
C -3.837823 0.370473 1.438133
H 0.003058 -0.703574 -2.176968
H -1.670786 -1.021385 -1.726988
H -1.230587 0.336458 1.870880
H -1.150657 -1.366610 1.334193
H 1.536674 1.087830 -1.676582
H 0.786051 -0.715464 2.209745
H 0.783841 -2.536588 -0.507915
H -3.258837 -0.933679 -0.127133
H 3.959022 1.264314 -1.122521
H 3.198438 -0.529228 2.761338
H -0.072833 2.472507 0.756320
H -1.100863 3.418835 -0.318152
H 4.812068 0.457948 1.104943
H -0.659898 -4.522307 -0.725849
H -2.037687 -3.472690 -1.425794
H -4.904232 0.334112 1.190529
H -3.548320 0.999787 2.289541


