%chk=000203207.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203207

1 1
O -2.576580 -1.155442 -0.216679
O 2.669814 2.722776 0.202189
O 4.326875 -1.130236 -0.115386
O 4.702370 1.091563 0.086083
N -5.260419 -0.399383 -0.186885
N -1.733794 0.994086 -0.011715
C -4.162811 0.650957 -0.077255
C -5.176335 -1.370926 0.968354
C -6.598195 0.310206 -0.142259
C -5.141492 -1.150399 -1.493558
C -2.736946 0.044666 -0.111271
C -0.311964 0.715119 -0.016816
C 0.521232 1.829471 0.093328
C 0.196111 -0.590921 -0.125316
C 2.455637 0.308657 -0.014305
C 1.918097 1.621121 0.094302
C 1.576610 -0.779256 -0.122763
C 3.912936 0.154370 -0.007677
C 5.794982 -1.356752 -0.114923
C 5.913792 -2.855385 -0.247213
H -4.270377 1.389859 -0.909860
H -4.295711 1.230586 0.869905
H -4.216091 -1.942788 0.945052
H -5.989155 -2.119930 0.933446
H -5.230357 -0.863260 1.947228
H -6.717565 1.027387 -0.976253
H -7.439263 -0.408230 -0.218526
H -6.742737 0.868085 0.802208
H -5.953009 -1.891728 -1.615065
H -4.180775 -1.719611 -1.545364
H -5.169422 -0.476761 -2.367777
H -1.975719 1.989100 0.074187
H 0.158910 2.852008 0.178705
H -0.466870 -1.454470 -0.211011
H 1.994884 -1.790522 -0.206365
H 3.702308 2.520152 0.198572
H 6.213192 -0.794898 -0.968043
H 6.187582 -0.956154 0.835747
H 6.968361 -3.166169 -0.260794
H 5.425356 -3.380262 0.585922
H 5.449038 -3.223087 -1.172949


%chk=000203207-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203207

1 1
O -2.657618 -1.354478 -0.105149
O 2.655486 2.717067 0.031349
O 4.433040 -1.131892 -0.110898
O 4.713085 1.175547 -0.030900
N -5.355694 -0.353158 -0.172001
N -1.746522 0.813790 -0.010713
C -4.171110 0.593839 0.073493
C -5.431497 -1.430834 0.921534
C -6.635758 0.485481 -0.124261
C -5.252988 -1.021905 -1.550024
C -2.777824 -0.093328 -0.031338
C -0.330635 0.567134 -0.029689
C 0.492016 1.712410 0.007266
C 0.225247 -0.742910 -0.081147
C 2.478234 0.258272 -0.055210
C 1.899200 1.574011 -0.005512
C 1.623129 -0.871420 -0.092237
C 3.949909 0.148826 -0.064396
C 5.933069 -1.290512 -0.119068
C 6.214752 -2.785557 -0.174848
H -4.261993 1.413045 -0.662508
H -4.308944 1.016376 1.085587
H -4.508719 -2.024912 0.883327
H -6.312567 -2.059519 0.722114
H -5.536722 -0.935301 1.899436
H -6.614253 1.230374 -0.934519
H -7.499798 -0.182604 -0.257666
H -6.704898 0.989753 0.851858
H -6.167466 -1.611794 -1.714632
H -4.367148 -1.670669 -1.557560
H -5.168685 -0.239093 -2.320196
H -1.992656 1.808372 0.034148
H 0.082564 2.728319 0.047406
H -0.420308 -1.619795 -0.112432
H 2.079791 -1.864480 -0.130626
H 3.645246 2.442907 0.017127
H 6.322333 -0.744654 -0.996209
H 6.324551 -0.810964 0.795089
H 7.307127 -2.950694 -0.180319
H 5.793162 -3.304149 0.702627
H 5.794360 -3.237303 -1.089101


