%chk=000269245.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269245

0 1
O -3.572128 0.275223 -0.077376
O -2.383202 -1.684866 -0.035798
N -0.281991 0.117360 -1.087124
N -1.704997 0.198845 -1.323690
C 0.416784 1.086207 -2.012918
C 0.213316 -1.290155 -1.308794
C 3.000047 -0.201545 -1.165589
C 1.450933 1.826391 -1.196421
C 1.136873 -1.612781 -0.158420
C 2.669265 1.228505 -0.819492
C 2.457543 -1.129019 -0.106891
C -4.756256 -0.257574 0.664828
C 1.184099 3.152071 -0.820799
C 0.651115 -2.421895 0.880085
C 3.603497 1.976870 -0.084838
C 3.284105 -1.497121 0.966447
C 2.120355 3.887410 -0.091470
C 1.479895 -2.781391 1.944013
C 3.333898 3.298161 0.275466
C 2.800772 -2.323439 1.982967
C -2.508233 -0.531769 -0.385618
C -4.286296 -0.700691 2.041579
C -5.630014 0.993183 0.704439
C -5.365241 -1.385036 -0.154979
H -0.296276 1.805420 -2.476183
H 0.901310 0.574357 -2.876183
H 0.735491 -1.416118 -2.282246
H -0.631881 -2.022827 -1.337231
H 2.597352 -0.469241 -2.165590
H 4.098715 -0.331247 -1.266981
H -1.997698 1.197946 -1.376367
H 0.236100 3.612867 -1.092813
H -0.391054 -2.754932 0.855958
H 4.543665 1.518184 0.217231
H 4.306162 -1.127543 1.013836
H 1.903061 4.914303 0.194567
H 1.096223 -3.411766 2.743171
H 4.065674 3.866346 0.846644
H 3.450193 -2.603598 2.809694
H -3.740357 0.097389 2.559248
H -5.123470 -1.003323 2.677926
H -3.597049 -1.558438 1.970081
H -5.885500 1.335329 -0.306180
H -5.110791 1.825137 1.197838
H -6.562907 0.807567 1.246410
H -4.685964 -2.251374 -0.207954
H -6.307539 -1.735087 0.278535
H -5.565599 -1.073796 -1.186817


%chk=000269245-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269245

0 1
O -3.956398 -0.113643 -0.427446
O -2.353630 0.042766 1.326761
N -0.379301 -0.029254 -0.789587
N -1.781938 -0.074816 -0.969343
C 0.195014 1.256046 -1.316972
C 0.268543 -1.287476 -1.294920
C 3.004585 0.065833 -1.507507
C 1.377246 1.818045 -0.535923
C 1.484977 -1.768516 -0.511877
C 2.704292 1.319107 -0.683227
C 2.779872 -1.193835 -0.669262
C -5.165320 -0.083947 0.491949
C 1.149631 2.919396 0.326779
C 1.326403 -2.874354 0.360602
C 3.760243 1.951368 0.018610
C 3.873426 -1.755763 0.034850
C 2.205869 3.535649 1.031367
C 2.419470 -3.420617 1.066859
C 3.523436 3.053277 0.868361
C 3.705319 -2.861725 0.895576
C -2.655102 -0.040014 0.115572
C -5.196447 1.254151 1.258483
C -6.329895 -0.186820 -0.509122
C -5.125394 -1.302923 1.436440
H -0.626153 1.989604 -1.270047
H 0.470360 1.137420 -2.394518
H 0.533225 -1.172010 -2.375727
H -0.507658 -2.067471 -1.231931
H 2.376021 0.042139 -2.417399
H 4.056233 0.095480 -1.844651
H -2.201460 -0.125145 -1.907996
H 0.126074 3.293144 0.450543
H 0.327671 -3.308706 0.489837
H 4.781568 1.568801 -0.100276
H 4.869729 -1.314208 -0.091472
H 2.003568 4.383315 1.695169
H 2.270010 -4.273549 1.737869
H 4.356350 3.527008 1.399958
H 4.566507 -3.279990 1.428603
H -5.172807 2.103469 0.552364
H -6.130230 1.320994 1.846508
H -4.338991 1.332991 1.945204
H -6.264665 -1.125914 -1.085441
H -6.309240 0.659806 -1.217022
H -7.293194 -0.171114 0.031491
H -4.276286 -1.233508 2.134393
H -6.063409 -1.348630 2.019839
H -5.036127 -2.237362 0.853879


