%chk=000240975.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240975

0 1
O 0.818493 0.246018 1.192083
N -1.945197 -0.944144 -0.078850
N -3.248852 1.766908 0.853889
C -1.336162 0.409277 0.051838
C -0.576463 0.515596 1.400785
C -3.089901 -1.210919 0.849419
C -2.234345 -1.329584 -1.491189
C -2.285753 1.597493 -0.092350
C -3.157918 -2.707651 1.159670
C -3.403889 -0.618292 -2.174307
C -2.132310 2.498883 -1.167042
C 1.147569 -1.165761 1.079143
C 2.545227 -1.233986 0.529493
C -3.001391 3.585847 -1.268225
C -4.089227 2.829070 0.740089
C -4.001409 3.760065 -0.305555
C 3.369630 -0.100938 0.499542
C 3.034016 -2.459245 0.052084
C 5.160892 -1.414373 -0.480876
C 4.668353 -0.189445 -0.003779
C 4.334200 -2.548954 -0.447602
C 6.557992 -1.514056 -1.003614
H -0.550318 0.487375 -0.756990
H -0.996050 -0.144617 2.178083
H -0.546511 1.556150 1.777059
H -2.935386 -0.640586 1.794060
H -4.061156 -0.857465 0.437567
H -1.303662 -1.180955 -2.082787
H -2.422896 -2.428496 -1.483597
H -3.460631 -3.293745 0.285286
H -2.181669 -3.090194 1.482765
H -3.878239 -2.905213 1.960284
H -3.637660 -1.083155 -3.137724
H -3.189838 0.438786 -2.363495
H -4.313392 -0.658562 -1.561256
H -1.344058 2.350672 -1.901978
H 1.089983 -1.601310 2.094373
H 0.413892 -1.667346 0.417844
H -2.900623 4.295201 -2.089718
H -4.848940 2.921693 1.524825
H -4.691194 4.597398 -0.361721
H 2.981860 0.850989 0.869993
H 2.401708 -3.344781 0.069236
H 5.299797 0.695953 -0.023023
H 4.706192 -3.503442 -0.812645
H 6.897185 -0.576540 -1.463366
H 6.664276 -2.300051 -1.762408
H 7.259577 -1.749668 -0.189812


%chk=000240975-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240975

0 1
O 0.925804 0.573354 0.652631
N -1.796038 -0.544375 -0.394970
N -3.217059 1.859870 1.217927
C -1.414384 0.881714 -0.175739
C -0.417846 1.037720 1.004370
C -2.741662 -1.142535 0.579046
C -1.956423 -0.975379 -1.804794
C -2.588093 1.859866 -0.004043
C -2.565598 -2.668448 0.721470
C -3.313063 -0.664628 -2.495549
C -2.993133 2.731372 -1.048014
C 1.164679 -0.850874 0.914248
C 2.588620 -1.203454 0.521538
C -4.076236 3.612443 -0.839889
C -4.267168 2.710319 1.404028
C -4.734993 3.601380 0.411634
C 3.473451 -0.243393 -0.022398
C 3.051527 -2.532642 0.691760
C 5.263323 -1.933221 -0.213893
C 4.790334 -0.607871 -0.384825
C 4.367210 -2.891067 0.328761
C 6.690355 -2.311293 -0.575804
H -0.852880 1.188920 -1.079143
H -0.794852 0.526809 1.912597
H -0.299273 2.110900 1.239222
H -2.569639 -0.657489 1.555080
H -3.804539 -0.919529 0.325049
H -1.134266 -0.515253 -2.385554
H -1.785680 -2.068803 -1.848176
H -2.811459 -3.206637 -0.212051
H -1.524400 -2.917078 0.995893
H -3.236400 -3.052751 1.512119
H -3.302484 -1.049391 -3.532892
H -3.514625 0.419859 -2.532711
H -4.155939 -1.147986 -1.968694
H -2.455496 2.722510 -2.002764
H 1.005560 -1.056153 1.998464
H 0.431515 -1.456544 0.344350
H -4.396880 4.296540 -1.633107
H -4.740054 2.675494 2.392867
H -5.579206 4.266619 0.618372
H 3.116099 0.781128 -0.156267
H 2.378934 -3.295272 1.106586
H 5.461508 0.150485 -0.808122
H 4.704013 -3.926348 0.466368
H 7.069139 -1.702300 -1.415967
H 6.767873 -3.375059 -0.863353
H 7.375625 -2.151627 0.279841


