%chk=000226107.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226107

0 1
O -4.468715 2.251277 0.248101
N 0.024148 0.660827 -0.101607
N 4.535710 -1.201636 -0.564470
N -1.023730 -1.976065 -0.140123
C 0.914194 -0.433073 -0.201133
C -1.380361 0.466399 -0.020916
C -1.839079 -0.952565 -0.046500
C 0.349259 -1.744341 -0.219240
C 3.157547 -1.368801 -0.377764
C 2.304329 -0.251873 -0.271459
C -3.298512 -1.188305 0.038279
C 0.554540 2.020285 -0.087017
C -4.185508 -0.099139 0.137449
C -2.245858 1.505938 0.072753
C 1.223594 -2.859305 -0.321816
C 2.585104 -2.684626 -0.396015
C 5.456408 -2.363200 -0.404901
C 5.162490 0.131567 -0.335966
C -3.692711 1.315648 0.160127
C -3.814337 -2.496854 0.020754
C -5.567374 -0.326533 0.217467
C 0.808638 2.670547 -1.303777
C 0.795764 2.649364 1.143461
C 5.648599 -2.801300 1.045562
C 5.275774 0.514773 1.138203
C -5.190835 -2.711050 0.100947
C -6.071403 -1.627222 0.199563
C 1.314887 3.972550 -1.279148
C 1.301373 3.951822 1.146673
C 1.561571 4.611752 -0.059295
H 2.716437 0.754993 -0.253719
H -1.925881 2.547938 0.087977
H 0.782486 -3.860420 -0.338223
H 3.233485 -3.554235 -0.481709
H 5.062275 -3.210134 -1.015462
H 6.436627 -2.087286 -0.856352
H 6.170605 0.120835 -0.809314
H 4.568333 0.897370 -0.889465
H -3.131692 -3.346231 -0.056400
H -6.238532 0.535195 0.293806
H 0.606454 2.169431 -2.250597
H 0.581609 2.132847 2.079148
H 6.055024 -1.986747 1.663547
H 4.701762 -3.109190 1.508490
H 6.339889 -3.648529 1.115555
H 4.291718 0.564369 1.623218
H 5.872812 -0.217068 1.702121
H 5.750515 1.495021 1.257146
H -5.581385 -3.728217 0.086470
H -7.144378 -1.798378 0.261791
H 1.511320 4.492795 -2.216753
H 1.487040 4.456158 2.095066
H 1.950767 5.629225 -0.048434


%chk=000226107-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226107

0 1
O -4.529911 2.337370 0.160993
N 0.010962 0.640482 -0.080204
N 4.564274 -1.217004 -0.371701
N -1.040565 -1.993457 -0.099083
C 0.902654 -0.449971 -0.149296
C -1.394620 0.456055 -0.024329
C -1.870172 -0.940097 -0.037816
C 0.326811 -1.770874 -0.156060
C 3.181638 -1.393023 -0.276664
C 2.299981 -0.271310 -0.203604
C -3.322295 -1.173780 0.021512
C 0.542597 1.994787 -0.060333
C -4.225654 -0.069808 0.087687
C -2.279599 1.526691 0.040722
C 1.215944 -2.879752 -0.217494
C 2.599535 -2.713522 -0.271032
C 5.482352 -2.377984 -0.404140
C 5.163857 0.135801 -0.337725
C -3.720458 1.340358 0.097224
C -3.841275 -2.499158 0.013813
C -5.622766 -0.305546 0.144789
C 0.753542 2.680331 -1.277542
C 0.837726 2.610297 1.176820
C 5.765221 -3.011295 0.979723
C 5.272680 0.755503 1.077188
C -5.228209 -2.719534 0.071044
C -6.125797 -1.618853 0.136936
C 1.272658 3.994720 -1.254710
C 1.356977 3.924682 1.193580
C 1.575823 4.617157 -0.020776
H 2.694794 0.744791 -0.188731
H -1.925714 2.560709 0.051894
H 0.768163 -3.878265 -0.217434
H 3.234579 -3.600978 -0.309663
H 5.079358 -3.142988 -1.094117
H 6.433017 -2.033325 -0.849787
H 6.172463 0.062073 -0.783151
H 4.582801 0.806997 -0.998793
H -3.132782 -3.330649 -0.037554
H -6.280903 0.567930 0.194183
H 0.504934 2.188435 -2.223512
H 0.652270 2.065643 2.108335
H 6.253711 -2.287820 1.655415
H 4.832068 -3.350135 1.462120
H 6.434224 -3.884804 0.869896
H 4.283782 0.816720 1.563385
H 5.934652 0.154683 1.724867
H 5.688198 1.778122 1.013705
H -5.618812 -3.743359 0.064595
H -7.206319 -1.795455 0.181213
H 1.431617 4.532440 -2.195519
H 1.581395 4.408028 2.150427
H 1.971390 5.638544 -0.005196


