%chk=000208477.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208477

0 1
O 6.005910 -0.498304 1.903501
O 0.905347 1.539927 -1.841975
O -1.986164 0.720591 -1.493713
O 0.257184 2.759552 0.018169
N 3.829372 0.101267 0.076987
C 4.047397 0.907668 1.308566
C 4.294421 -1.294435 0.288127
C 2.447888 0.193669 -0.443414
C 5.535969 0.881102 1.691893
C 5.780887 -1.290070 0.682544
C 2.302691 1.454627 -1.316399
C -3.262209 -1.754566 -1.535821
C -3.261769 -0.894754 -0.268794
C -2.586212 0.361758 -0.254624
C -4.417794 -2.779108 -1.590241
C -1.889995 -2.470623 -1.701204
C -3.878695 -1.292620 0.938225
C -2.522647 1.167133 0.902131
C -3.154981 0.746741 2.101365
C -3.831823 -0.494180 2.105305
C -1.425466 2.065983 -1.648210
C -0.023378 2.179994 -1.038287
C -3.108023 1.627214 3.338970
H 3.732707 1.952377 1.131153
H 3.441098 0.510392 2.160391
H 3.706757 -1.809035 1.088598
H 4.166689 -1.863578 -0.651823
H 1.683920 0.211702 0.369403
H 2.239894 -0.692417 -1.070180
H 5.709649 1.401324 2.648245
H 6.134958 1.362516 0.888904
H 6.383172 -0.870353 -0.152144
H 6.132825 -2.307297 0.921072
H 2.935509 1.389702 -2.213183
H 2.525307 2.374603 -0.749145
H -3.370290 -1.066138 -2.396830
H -5.400808 -2.294041 -1.447826
H -4.424132 -3.286256 -2.572527
H -4.305884 -3.564004 -0.818315
H -1.066590 -1.736210 -1.729946
H -1.867882 -3.052244 -2.642160
H -1.711609 -3.167248 -0.860504
H -4.414083 -2.247150 0.969911
H -1.961808 2.107833 0.903882
H -4.322775 -0.841078 3.022049
H -2.078285 2.832068 -1.192933
H -1.362183 2.211188 -2.737875
H -3.311156 1.044727 4.254435
H -3.865240 2.433574 3.284439
H -2.122373 2.113178 3.452805


%chk=000208477-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208477

0 1
O 5.762415 -0.097394 2.128873
O 0.466338 1.078573 -1.704690
O -2.299528 1.024527 -1.649103
O 0.466534 3.195952 -0.715537
N 3.407218 0.059003 0.440092
C 3.977028 1.273630 1.081859
C 3.675699 -1.140689 1.274256
C 1.988484 0.214530 0.053405
C 5.487488 1.088744 1.300362
C 5.191431 -1.293117 1.486417
C 1.901475 0.887547 -1.329506
C -3.322483 -1.559908 -1.801974
C -3.061624 -0.900696 -0.445154
C -2.500009 0.409081 -0.386714
C -4.366356 -2.697679 -1.749670
C -1.982607 -2.071159 -2.408453
C -3.299907 -1.542598 0.789827
C -2.188543 1.034775 0.839953
C -2.432279 0.367352 2.069412
C -2.991946 -0.929411 2.028087
C -1.617041 2.307243 -1.681874
C -0.132106 2.256514 -1.290012
C -2.117496 1.054324 3.387896
H 3.803813 2.153421 0.435273
H 3.485837 1.474836 2.066690
H 3.173314 -1.072226 2.271346
H 3.286302 -2.036346 0.754793
H 1.404350 0.808703 0.795474
H 1.517131 -0.782767 -0.007725
H 5.916567 1.940292 1.853684
H 5.995871 0.985755 0.317373
H 5.685959 -1.463634 0.505632
H 5.416539 -2.130201 2.167697
H 2.309797 0.234513 -2.114121
H 2.407102 1.868307 -1.338858
H -3.703319 -0.772711 -2.481321
H -5.316358 -2.360922 -1.295623
H -4.582983 -3.055451 -2.772938
H -3.996581 -3.566033 -1.171910
H -1.249127 -1.250203 -2.485157
H -2.150552 -2.486709 -3.419975
H -1.552618 -2.870157 -1.775092
H -3.735247 -2.547383 0.790120
H -1.759854 2.042779 0.870053
H -3.189937 -1.464212 2.964320
H -2.108408 3.062927 -1.040793
H -1.690034 2.635237 -2.733511
H -2.084263 0.329948 4.219935
H -2.885536 1.811765 3.637959
H -1.144658 1.578028 3.351922


