%chk=000210703.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210703

0 1
O -0.340016 -0.985771 2.691124
O -1.095323 -0.294660 -1.250940
O -5.728492 -1.095307 -0.617734
N 3.102098 -0.088849 0.425715
N 5.640890 1.052005 -0.417089
C 3.222969 1.359559 0.053618
C 4.402101 -0.564289 1.005984
C 4.340624 1.529326 -0.994751
C 5.522627 -0.395691 -0.039626
C 1.979585 -0.306334 1.395771
C 0.655839 -0.358489 0.619364
C 6.747968 1.243018 -1.401451
C -0.499016 -0.743779 1.506539
C -1.854007 -0.821537 0.907078
C -2.168170 -0.605791 -0.458627
C -2.916416 -1.144889 1.774543
C -3.476585 -0.704591 -0.942191
C -4.231080 -1.251535 1.333730
C -4.494646 -1.028448 -0.029268
C -1.315273 -0.087977 -2.671433
C -6.869759 -1.423685 0.216134
H 3.431823 2.012648 0.929638
H 2.256536 1.689532 -0.382153
H 4.297574 -1.641040 1.258462
H 4.679359 -0.027383 1.939610
H 4.060525 0.995786 -1.928716
H 4.447966 2.605742 -1.245127
H 6.488357 -0.717446 0.404302
H 5.320617 -1.055221 -0.911467
H 1.923176 0.465450 2.193603
H 2.125850 -1.277233 1.922054
H 0.446202 0.612367 0.121092
H 0.743878 -1.079181 -0.227825
H 6.843741 2.317063 -1.627423
H 6.628742 0.698284 -2.349252
H 7.696356 0.928025 -0.937231
H -2.679144 -1.316223 2.834190
H -3.734021 -0.542743 -1.982838
H -5.019921 -1.501529 2.032741
H -1.969338 0.773985 -2.830662
H -1.715322 -0.997461 -3.129184
H -0.295054 0.115561 -3.023724
H -6.749334 -2.422352 0.646004
H -7.691042 -1.403603 -0.512498
H -7.008045 -0.659316 0.986313


%chk=000210703-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210703

0 1
O -0.288419 -1.172737 2.586478
O -1.248681 -0.138479 -1.430640
O -5.893895 -1.076428 -0.528233
N 3.211163 -0.132465 0.446856
N 5.731260 1.047364 -0.397371
C 3.265308 1.214315 -0.175397
C 4.477960 -0.400913 1.175379
C 4.470467 1.324360 -1.124257
C 5.681673 -0.296492 0.225780
C 2.030185 -0.324225 1.328007
C 0.714957 -0.360168 0.532309
C 6.923978 1.234975 -1.242825
C -0.469693 -0.818616 1.377133
C -1.861302 -0.860427 0.805549
C -2.253322 -0.536155 -0.538652
C -2.892518 -1.266794 1.694253
C -3.605012 -0.621969 -0.936379
C -4.242659 -1.358978 1.320845
C -4.595084 -1.030873 -0.012999
C -1.628932 0.178407 -2.811936
C -6.972086 -1.498024 0.374004
H 3.342498 2.017683 0.602009
H 2.338912 1.385288 -0.752837
H 4.429944 -1.421289 1.599635
H 4.625716 0.319569 2.019580
H 4.322967 0.609638 -1.975126
H 4.519423 2.348605 -1.540663
H 6.616488 -0.457536 0.795554
H 5.602472 -1.104314 -0.547017
H 1.968331 0.461662 2.122401
H 2.149339 -1.286932 1.856352
H 0.465284 0.620981 0.086801
H 0.824956 -1.038605 -0.336598
H 6.945901 2.269185 -1.632068
H 6.964968 0.535916 -2.117948
H 7.836311 1.077845 -0.639221
H -2.577770 -1.513484 2.714013
H -3.928782 -0.381569 -1.951431
H -4.991413 -1.677475 2.050590
H -2.331581 1.032608 -2.848492
H -2.078483 -0.699037 -3.314253
H -0.685843 0.449256 -3.308592
H -6.805855 -2.528746 0.740729
H -7.885282 -1.462464 -0.237398
H -7.068448 -0.806463 1.232475


