%chk=000225243.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225243

0 1
O -3.858751 2.385781 1.413517
O 6.418310 0.134319 -0.505162
O -6.543058 0.212728 -1.657494
O 3.621614 3.742629 0.215732
N -2.033958 -0.116217 1.338727
N 3.882552 -1.635571 -0.417737
N -4.666344 -0.921034 -0.961304
N 2.614682 1.676409 0.120393
N -0.554672 -2.074620 1.456776
N 1.968467 -3.159533 -0.460647
N -5.205401 1.302732 -0.111569
N 5.030297 1.937651 -0.138875
N -2.557108 -1.899581 -0.031506
N 1.815227 -0.694559 -0.018187
C -3.234269 0.204267 0.664471
C 4.070678 -0.244869 -0.269333
C -3.528523 -0.916027 -0.159114
C 2.779215 0.305277 -0.051471
C -1.655666 -1.385836 0.897146
C 2.516537 -1.873932 -0.256490
C -0.228991 -3.379372 0.821968
C 0.487699 -3.268104 -0.536973
C -4.047342 1.387422 0.743283
C 5.283090 0.532180 -0.327515
C -5.548368 0.207372 -0.956427
C 3.757184 2.544010 0.067047
C -1.355782 0.750819 2.301323
C 4.953320 -2.604299 -0.655584
C -4.971476 -2.088784 -1.822458
C 1.259175 2.265791 0.224552
C -6.159028 2.446593 -0.116647
C 6.189093 2.872159 -0.196293
H 0.379590 -3.945970 1.562243
H -1.175401 -3.962486 0.687778
H 0.279407 -4.177519 -1.150370
H 0.073886 -2.410408 -1.124823
H 0.280887 -1.471132 1.552095
H 2.392826 -3.881051 0.132926
H -0.373134 1.093320 1.902861
H -1.974545 1.655482 2.505419
H -1.192425 0.226149 3.260183
H 5.120880 -3.246015 0.226912
H 4.716422 -3.240826 -1.528805
H 5.910944 -2.071976 -0.867794
H -5.924696 -1.925008 -2.361588
H -5.059378 -3.002538 -1.208319
H -4.164386 -2.239908 -2.560734
H 0.705086 2.140470 -0.723315
H 1.330539 3.348049 0.451902
H 0.684291 1.766508 1.033892
H -5.671735 3.342188 0.312923
H -7.050782 2.206298 0.486685
H -6.485882 2.672203 -1.147226
H 7.131384 2.310137 -0.053779
H 6.104232 3.640845 0.592459
H 6.226092 3.380187 -1.175078


%chk=000225243-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225243

0 1
O -4.480064 2.705384 0.134437
O 6.903901 -0.168026 -0.467337
O -7.576391 -0.829057 -0.344804
O 4.559458 3.408679 1.526854
N -2.297085 0.462315 0.297842
N 4.121455 -1.541632 -0.744025
N -5.311180 -1.403433 -0.113542
N 3.301276 1.561249 0.809427
N -0.536940 -1.211494 0.449472
N 2.057461 -2.754295 -0.994604
N -6.015486 0.904115 -0.103416
N 5.701777 1.623567 0.527853
N -2.880379 -1.755660 0.136784
N 2.202477 -0.504141 -0.023205
C -3.705042 0.407569 0.140358
C 4.498583 -0.285975 -0.213373
C -4.007995 -0.959189 0.049907
C 3.306000 0.310491 0.213291
C -1.851156 -0.855380 0.292236
C 2.740513 -1.629880 -0.603540
C -0.136375 -2.615852 0.316331
C 0.588466 -2.911588 -1.027054
C -4.683296 1.446397 0.066691
C 5.788896 0.324290 -0.092513
C -6.372052 -0.465728 -0.195915
C 4.524015 2.266376 0.986353
C -1.491580 1.677688 0.450944
C 5.022807 -2.546961 -1.322661
C -5.606861 -2.845020 -0.196635
C 2.050496 2.182878 1.276403
C -7.139787 1.862261 -0.192074
C 6.959087 2.382327 0.720820
H 0.519647 -2.909128 1.156872
H -1.057169 -3.219660 0.363681
H 0.405250 -3.963831 -1.308790
H 0.139979 -2.272231 -1.813156
H 0.249374 -0.539510 0.392785
H 2.613519 -3.511686 -1.389705
H -0.739640 1.753323 -0.356368
H -2.172345 2.541700 0.392370
H -0.978629 1.686585 1.430323
H 5.000515 -3.484950 -0.736249
H 4.755289 -2.758535 -2.374994
H 6.044478 -2.135914 -1.290899
H -6.695734 -2.953236 -0.306933
H -5.262417 -3.355425 0.718641
H -5.090129 -3.290207 -1.063861
H 1.401126 2.433812 0.420318
H 2.319499 3.105020 1.811971
H 1.516377 1.493305 1.951984
H -6.712967 2.871968 -0.101041
H -7.864715 1.672888 0.616667
H -7.661905 1.747519 -1.156317
H 7.776677 1.766075 0.319327
H 7.117667 2.585806 1.792418
H 6.903759 3.346838 0.190247


