%chk=000241799.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241799

0 1
P 0.077818 -0.049458 -0.356258
O 0.272619 -0.477488 -1.777104
N 1.516136 0.675931 0.373704
N -0.325956 -1.375634 0.732875
N -1.179835 1.146498 -0.142980
C 2.634785 1.083075 -0.542597
C 0.242347 -2.740538 0.478356
C 1.805079 2.130446 0.180737
C 0.655724 -1.944497 1.705610
C 4.034764 0.743942 -0.067631
C -0.735917 -3.894415 0.596652
C -1.612108 1.365794 1.272712
C -2.332646 0.930284 -1.074489
C -2.517085 2.611152 1.332237
C -3.240857 2.172913 -1.040009
C -3.718367 2.465405 0.388640
C 4.548990 -0.530466 -0.730542
C -1.216169 -4.349661 -0.778095
H 2.512684 0.968502 -1.637318
H 0.976144 -2.886773 -0.334664
H 2.199241 2.635918 1.068426
H 1.125301 2.788352 -0.370277
H 0.233796 -2.179378 2.688254
H 1.671310 -1.547724 1.803607
H 4.050501 0.625969 1.036438
H 4.707382 1.595900 -0.294239
H -1.607155 -3.597339 1.218371
H -0.245905 -4.731046 1.133523
H -0.712209 1.533083 1.907795
H -2.157716 0.491257 1.698053
H -2.933173 0.027704 -0.817289
H -1.939573 0.783114 -2.110231
H -1.929654 3.506724 1.049143
H -2.857807 2.773181 2.370523
H -4.102930 2.021367 -1.714224
H -2.683587 3.046044 -1.433598
H -4.380995 1.652118 0.740955
H -4.327500 3.387822 0.404142
H 3.881029 -1.378455 -0.532174
H 4.619186 -0.424676 -1.819936
H 5.544252 -0.798209 -0.359585
H -1.648543 -3.511572 -1.342721
H -0.398540 -4.755570 -1.384751
H -1.985364 -5.124595 -0.695336


%chk=000241799-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241799

0 1
P -0.294482 -0.087434 -0.545982
O -0.329604 -0.424055 -2.113208
N 1.205370 0.725707 0.063493
N -0.493470 -1.542212 0.478291
N -1.532051 1.021545 -0.047989
C 2.431716 0.708555 -0.851055
C 0.546192 -2.646282 0.484927
C 1.626097 1.979095 -0.686229
C 0.343078 -1.789400 1.722313
C 3.783125 0.520496 -0.181672
C 0.000658 -4.058866 0.357466
C -1.691642 1.365682 1.384101
C -2.768677 1.114592 -0.860876
C -2.256829 2.796702 1.518376
C -3.335809 2.547174 -0.773882
C -3.561665 2.957078 0.701495
C 4.129605 -0.959411 0.091996
C -0.313629 -4.418611 -1.111551
H 2.285394 0.184139 -1.808072
H 1.464079 -2.453465 -0.090611
H 2.001668 2.780072 -0.039692
H 1.001736 2.303934 -1.528214
H -0.226026 -2.192554 2.567870
H 1.111439 -1.046227 1.967984
H 3.794770 1.092111 0.765706
H 4.555268 0.968891 -0.839573
H -0.916744 -4.138865 0.970739
H 0.741593 -4.768588 0.779049
H -0.707803 1.294331 1.881330
H -2.380409 0.643213 1.880328
H -3.532527 0.392683 -0.489696
H -2.520304 0.840850 -1.901125
H -1.498088 3.513464 1.148189
H -2.436847 3.019205 2.588331
H -4.285698 2.598560 -1.340641
H -2.620265 3.244938 -1.250504
H -4.350443 2.311363 1.141779
H -3.928503 3.999183 0.762861
H 3.409399 -1.406584 0.800651
H 4.109713 -1.554255 -0.840537
H 5.139048 -1.055212 0.531044
H -1.029728 -3.694112 -1.537571
H 0.599589 -4.391126 -1.734901
H -0.748800 -5.431305 -1.190034


