%chk=000191275.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191275

0 1
O -1.435439 -0.356355 -0.212304
O -0.312630 1.176023 1.102636
O 0.427636 -2.992041 1.307515
N 0.836375 -0.545481 -0.005363
N 0.658779 -1.784477 -0.638418
C 2.024197 -0.471931 0.918747
C 3.008688 0.502636 0.320990
C 4.164498 0.036156 -0.319689
C 2.766702 1.881500 0.416692
C -0.315728 0.181698 0.421696
C 5.082067 0.948744 -0.849240
C 3.686023 2.787591 -0.116276
C 4.845581 2.323060 -0.747030
C -2.690535 0.272738 -0.159424
C 0.326510 -2.963727 0.099631
C -2.888061 1.629302 0.099457
C -3.738328 -0.610603 -0.461524
C -0.028700 -4.130515 -0.770448
C -4.197977 2.117572 0.045806
C -5.032805 -0.092546 -0.511503
C -5.264290 1.266269 -0.260036
H 2.472161 -1.482770 1.060704
H 1.703917 -0.137170 1.935732
H 4.348601 -1.032613 -0.409222
H 1.853932 2.239370 0.900628
H 0.314101 -1.664526 -1.601337
H 5.981685 0.586823 -1.343677
H 3.498378 3.857483 -0.040972
H 5.561645 3.031181 -1.159295
H -2.053178 2.286194 0.351875
H -3.534496 -1.661432 -0.645236
H -1.016128 -4.010095 -1.238218
H 0.703980 -4.308661 -1.570318
H -0.072786 -5.051954 -0.163953
H -4.383162 3.173277 0.246187
H -5.868469 -0.752262 -0.744474
H -6.278442 1.658642 -0.299634


%chk=000191275-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191275

0 1
O -1.603868 -0.166683 -0.088057
O -0.702287 1.137468 1.682519
O 0.540404 -3.109909 0.987672
N 0.611075 -0.363476 0.458227
N 0.664002 -1.349313 -0.532443
C 1.830773 -0.146135 1.282064
C 2.973851 0.457742 0.478069
C 4.159469 -0.279500 0.243222
C 2.865457 1.772118 -0.046193
C -0.585394 0.274402 0.781653
C 5.222479 0.283934 -0.501113
C 3.922654 2.336132 -0.792029
C 5.105563 1.592559 -1.021845
C -2.938796 0.343185 -0.020092
C 0.596115 -2.708338 -0.207220
C -3.270239 1.655811 0.383636
C -3.921536 -0.560678 -0.477380
C 0.628001 -3.640181 -1.412524
C -4.626173 2.052929 0.324008
C -5.268763 -0.144310 -0.532673
C -5.626567 1.164612 -0.131842
H 2.117305 -1.118825 1.719994
H 1.517119 0.523796 2.100625
H 4.251410 -1.295726 0.646467
H 1.953727 2.353143 0.140322
H 0.669206 -1.031953 -1.503942
H 6.136726 -0.295152 -0.673125
H 3.830887 3.354025 -1.187489
H 5.928079 2.031507 -1.597653
H -2.502471 2.336008 0.755067
H -3.619959 -1.568918 -0.776446
H -0.265951 -4.286027 -1.382654
H 0.654335 -3.110621 -2.380269
H 1.511997 -4.296754 -1.340991
H -4.896273 3.066518 0.640093
H -6.035489 -0.842778 -0.884879
H -6.672565 1.486489 -0.172072


