%chk=000201992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201992

0 1
O 3.016757 1.290803 0.229682
O -2.012104 1.275795 -1.467766
O -4.122385 -0.194978 -0.838570
N 2.684603 -1.475140 -0.514869
C 0.711714 0.745578 -0.544543
C 1.780132 0.638569 0.595801
C 2.185512 -0.849522 0.757597
C 1.244188 0.099039 -1.853244
C 0.422010 2.249192 -0.752430
C 1.295682 1.291684 1.906622
C -0.512886 -0.063611 -0.132164
C 0.957627 -1.669831 1.212570
C 2.621182 -0.560265 -1.702680
C -0.081621 2.921281 0.530585
C 0.910943 2.760818 1.689133
C -0.373652 -1.204979 0.688912
C -1.805774 0.228011 -0.604249
C 4.086319 -1.969960 -0.345439
C -1.492178 -1.976838 1.056178
C -2.920899 -0.557707 -0.226191
C -2.774253 -1.661640 0.606785
C -5.157598 0.221175 0.089705
H 2.968884 -0.906433 1.556412
H 1.295479 0.849884 -2.662874
H 0.518811 -0.661829 -2.209941
H -0.319541 2.390629 -1.566302
H 1.346404 2.747745 -1.105213
H 2.097516 1.222019 2.665421
H 0.429282 0.736781 2.312970
H 0.929158 -1.696949 2.320581
H 1.110974 -2.727279 0.886682
H 2.825180 -1.188024 -2.598261
H 3.407451 0.229905 -1.663818
H -1.061170 2.484464 0.811118
H -0.271719 3.993894 0.340873
H 1.821034 3.361488 1.495583
H 0.473818 3.171255 2.619036
H 2.853618 2.234564 0.021426
H 4.825602 -1.183308 -0.128153
H 4.395337 -2.491877 -1.264823
H 4.110969 -2.710810 0.468310
H -1.355560 -2.849092 1.693171
H -3.634397 -2.266634 0.882277
H -2.984197 1.307057 -1.734996
H -5.977853 0.493263 -0.584600
H -4.818474 1.078400 0.676586
H -5.442425 -0.614189 0.734711


%chk=000201992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201992

0 1
O 3.209213 1.368804 0.084291
O -1.942944 1.281925 -1.574232
O -4.038595 -0.061529 -0.832458
N 2.312771 -1.425019 -0.568583
C 0.780262 0.974886 -0.452439
C 1.936857 0.790450 0.591010
C 2.209552 -0.719412 0.745520
C 1.256129 0.441235 -1.857830
C 0.467192 2.504702 -0.565207
C 1.612424 1.474943 1.949677
C -0.439893 0.131094 0.011923
C 1.040621 -1.350663 1.531690
C 2.416936 -0.579865 -1.778913
C 0.141869 3.178711 0.785356
C 1.300178 2.981172 1.789386
C -0.312275 -0.946187 0.950574
C -1.725154 0.333960 -0.554521
C 3.290647 -2.523126 -0.544468
C -1.441930 -1.704292 1.331997
C -2.852606 -0.434753 -0.151532
C -2.727462 -1.453056 0.805189
C -5.254054 -0.813483 -0.533234
H 3.156680 -0.823217 1.323325
H 1.587147 1.295711 -2.478044
H 0.385715 -0.006492 -2.367468
H -0.353572 2.656029 -1.281471
H 1.362601 2.997865 -1.004548
H 2.473297 1.319504 2.628477
H 0.728320 1.003504 2.413137
H 1.101664 -1.088198 2.607002
H 1.136524 -2.451072 1.472006
H 2.364846 -1.256595 -2.655076
H 3.391131 -0.042657 -1.823321
H -0.786518 2.742471 1.205288
H -0.054605 4.256905 0.627139
H 2.198240 3.536320 1.440415
H 1.044412 3.410983 2.776639
H 3.088457 2.347728 -0.007434
H 4.351050 -2.170604 -0.474600
H 3.192613 -3.130352 -1.463469
H 3.098511 -3.187573 0.318594
H -1.309455 -2.524876 2.046906
H -3.585002 -2.056033 1.118254
H -2.906371 1.228373 -1.823540
H -6.037779 -0.373407 -1.167344
H -5.532731 -0.707106 0.532942
H -5.127413 -1.885310 -0.779403


