%chk=000292010.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292010

0 1
O 4.517623 2.137270 -1.010106
O 4.364888 -2.520138 0.646753
O 6.004074 -0.235302 -0.230008
N -0.490070 -1.176593 -0.260278
N -0.420194 1.066090 0.187820
C -1.813969 -0.742412 -0.148527
C -1.749047 0.648903 0.132798
C -3.059569 -1.452361 -0.271229
C -2.953971 1.421851 0.316425
C -4.248254 -0.694416 -0.093594
C -4.195010 0.743994 0.201261
C 0.331460 -0.040234 -0.047685
C -3.124938 -2.834893 -0.553763
C 1.797525 -0.099491 -0.095473
C -2.911054 2.804843 0.601273
C -5.486090 -1.371885 -0.209905
C -5.379299 1.499676 0.380247
C -4.353827 -3.466898 -0.660896
C -5.540485 -2.728865 -0.487556
C -4.088023 3.515511 0.771003
C -5.328323 2.856588 0.659121
C 2.468631 -1.263114 0.296383
C 2.507921 1.015413 -0.560220
C 3.906675 0.964171 -0.612594
C 3.876552 -1.305927 0.248007
C 4.614112 -0.182454 -0.185815
C 5.518638 2.008563 -2.057787
C 5.798343 -2.746762 0.600876
C 6.628575 0.593921 0.795634
H -0.185935 -2.108772 -0.470756
H -2.207362 -3.402581 -0.687102
H -1.937275 3.293874 0.683974
H -6.413757 -0.810343 -0.077428
H -6.347222 1.002494 0.296781
H -4.409158 -4.532237 -0.878527
H -6.502409 -3.232402 -0.573218
H -4.061717 4.581422 0.990848
H -6.248759 3.422420 0.793882
H 1.941439 -2.135542 0.674302
H 1.987045 1.925753 -0.867237
H 5.971201 3.006232 -2.063785
H 5.007014 1.797215 -3.001279
H 6.252369 1.229887 -1.820556
H 6.285762 -2.159879 1.383679
H 6.198455 -2.489614 -0.386579
H 5.858607 -3.822951 0.799941
H 7.693723 0.458880 0.585694
H 6.360579 0.222394 1.787594
H 6.321504 1.638700 0.672706


%chk=000292010-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292010

0 1
O 4.627152 2.300795 0.046756
O 4.544068 -2.654447 -0.040773
O 6.076986 -0.193927 0.060803
N -0.476419 -1.215638 0.067468
N -0.393738 1.047138 -0.125448
C -1.805164 -0.782383 0.047422
C -1.727544 0.623909 -0.073862
C -3.043655 -1.504919 0.128013
C -2.924506 1.428973 -0.129689
C -4.255997 -0.718919 0.074559
C -4.196900 0.751580 -0.055629
C 0.349042 -0.084309 -0.038310
C -3.110035 -2.924639 0.254975
C 1.814170 -0.138807 -0.051637
C -2.861032 2.845650 -0.253960
C -5.494213 -1.424263 0.153111
C -5.373151 1.560324 -0.112366
C -4.345058 -3.580995 0.329595
C -5.545916 -2.821195 0.277788
C -4.036010 3.606759 -0.306409
C -5.299497 2.956256 -0.235102
C 2.523982 -1.366482 -0.101369
C 2.540724 1.080645 -0.033909
C 3.944896 1.064695 -0.031262
C 3.935496 -1.387632 -0.085574
C 4.665085 -0.166879 -0.017278
C 5.493172 2.608713 -1.115355
C 5.623366 -2.921260 -1.018704
C 6.611373 0.279136 1.364494
H -0.158203 -2.176844 0.168201
H -2.184562 -3.511973 0.295278
H -1.874136 3.315098 -0.306460
H -6.437166 -0.871551 0.116556
H -6.362151 1.095547 -0.059955
H -4.387019 -4.670941 0.427197
H -6.515112 -3.327950 0.335717
H -3.984958 4.696787 -0.401610
H -6.221142 3.547206 -0.275747
H 2.021211 -2.338008 -0.154993
H 2.004971 2.033077 -0.020713
H 5.961326 3.576693 -0.880681
H 4.878614 2.700659 -2.030773
H 6.263402 1.828714 -1.252748
H 6.449400 -2.201716 -0.899018
H 5.220936 -2.872888 -2.049027
H 5.960258 -3.945202 -0.796696
H 7.706729 0.233566 1.266489
H 6.272771 -0.392531 2.174429
H 6.281152 1.314377 1.561305


