%chk=000202446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202446

0 1
O -0.601940 1.258492 -0.776944
O -0.251219 -0.106282 1.456061
N 3.494319 1.011391 -0.050207
C 4.393667 1.441901 1.072660
C 3.286532 -0.476217 -0.027956
C 5.761740 0.752253 0.936109
C 4.636926 -1.194613 -0.180935
C 5.611925 -0.774030 0.925800
C 2.180226 1.728130 0.021548
C 1.587602 1.803508 -1.397255
C 0.165071 2.348519 -1.385845
C -1.907057 1.496337 -0.393746
C -2.418170 0.569644 0.544389
C -1.579645 -0.534498 1.156821
C -1.559238 -1.770262 0.271600
C -2.688746 2.533471 -0.916479
C -3.758531 0.700976 0.919229
C -4.022992 2.637805 -0.511474
C -4.559641 1.724238 0.397538
C -2.122602 -2.962580 0.747487
C -0.977200 -1.738540 -1.002416
C -2.103660 -4.112696 -0.047116
C -0.956848 -2.890426 -1.793038
C -1.520173 -4.079040 -1.317423
H 4.526495 2.542801 0.999216
H 3.961343 1.228006 2.074002
H 2.774741 -0.823297 0.897093
H 2.624774 -0.741220 -0.881072
H 6.422604 1.071782 1.761614
H 6.246977 1.084150 -0.003699
H 5.071811 -0.953747 -1.171407
H 4.478971 -2.288115 -0.163639
H 5.247629 -1.128294 1.908736
H 6.595718 -1.253281 0.770604
H 2.331645 2.755212 0.415424
H 1.444500 1.236275 0.709239
H 1.601064 0.796168 -1.866857
H 2.234257 2.431659 -2.042899
H 0.046910 3.255694 -0.770732
H -0.233897 2.512405 -2.401103
H -1.954201 -0.780924 2.184519
H -2.283097 3.239447 -1.632987
H -4.189534 -0.002869 1.632893
H -4.645034 3.437491 -0.913239
H -5.599598 1.805891 0.704934
H -2.572462 -3.000384 1.737832
H -0.546078 -0.807977 -1.380105
H 0.215256 0.246639 0.643097
H -2.542326 -5.036245 0.325898
H -0.503776 -2.861109 -2.782122
H -1.504641 -4.975039 -1.934248


%chk=000202446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202446

0 1
O -0.722295 1.279529 -0.305787
O -1.120727 -0.138010 2.037951
N 3.598677 0.803680 0.094167
C 4.501985 1.272792 1.179124
C 3.512212 -0.681746 0.083622
C 5.924569 0.706031 0.997787
C 4.900664 -1.317516 -0.131431
C 5.896778 -0.838940 0.949309
C 2.265476 1.449894 0.157860
C 1.528390 1.405562 -1.198086
C 0.159141 2.087358 -1.176307
C -2.098074 1.577825 -0.257792
C -2.886710 0.657593 0.492783
C -2.233052 -0.550463 1.161131
C -1.794115 -1.644983 0.166514
C -2.680754 2.703507 -0.881175
C -4.269561 0.908185 0.607516
C -4.073462 2.921142 -0.758897
C -4.872591 2.027949 -0.014859
C -0.669103 -2.451784 0.469251
C -2.520689 -1.900188 -1.023228
C -0.271763 -3.487482 -0.405696
C -2.125707 -2.938468 -1.897663
C -0.998360 -3.735794 -1.593592
H 4.529118 2.378553 1.154181
H 4.114582 0.970045 2.188824
H 3.078769 -1.056800 1.050145
H 2.825869 -0.997787 -0.721832
H 6.569437 1.059790 1.825366
H 6.344649 1.098929 0.051611
H 5.272506 -1.028394 -1.133366
H 4.805238 -2.420429 -0.113679
H 5.581262 -1.231521 1.938369
H 6.908869 -1.239567 0.750538
H 2.415531 2.510025 0.443002
H 1.624192 0.991164 0.953560
H 1.386601 0.362116 -1.533680
H 2.161247 1.908597 -1.954240
H 0.220323 3.120350 -0.773490
H -0.277447 2.122603 -2.194134
H -2.963422 -0.990631 1.865761
H -2.070223 3.411985 -1.448482
H -4.883408 0.214059 1.194485
H -4.525080 3.795070 -1.241313
H -5.949031 2.200279 0.085528
H -0.116691 -2.253886 1.393725
H -3.390507 -1.281160 -1.272070
H -0.486965 0.365251 1.455081
H 0.600900 -4.103702 -0.158715
H -2.695704 -3.122394 -2.815879
H -0.691147 -4.539618 -2.272396


