%chk=000281724.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281724

0 1
O -1.022241 -1.298254 -0.983741
O -3.241617 0.760235 -0.505542
O -0.337028 -4.193032 -0.359649
O -4.403710 -0.242958 1.156329
N 2.970144 2.176279 -0.235612
C 0.495802 0.571884 -0.535594
C -0.981467 0.192435 -0.874735
C 0.729456 1.508789 0.626373
C 2.218472 1.614221 0.939382
C 1.222665 1.118322 -1.780390
C 1.035161 -0.755317 -0.059208
C -1.977737 0.589877 0.223748
C 2.850423 0.238567 1.318459
C 2.708638 1.395964 -1.482001
C 2.139608 -0.958681 0.757396
C 0.140618 -1.781099 -0.391247
C -0.261064 2.121048 1.277106
C -1.694236 1.948272 0.877895
C 2.446434 -2.293970 1.090033
C 2.673667 3.628454 -0.417587
C 0.440849 -3.104338 -0.051585
C 1.627542 -3.346593 0.672784
C -4.400027 0.268319 0.063263
C -5.529286 0.499060 -0.877780
H -1.323512 0.514603 -1.877914
H 2.381840 2.307666 1.804130
H 0.721995 2.044237 -2.119433
H 1.144483 0.393543 -2.613425
H -2.094277 -0.225973 0.976542
H 2.864915 0.155700 2.425324
H 3.918345 0.236578 1.006350
H 3.251913 0.428263 -1.372731
H 3.176777 1.919754 -2.341194
H -0.087948 2.781343 2.124517
H -2.361128 2.066471 1.758582
H -1.985368 2.763184 0.177363
H 3.324080 -2.511543 1.695536
H 3.273610 4.015580 -1.256575
H 2.992585 4.175485 0.484041
H 1.616039 3.861792 -0.610226
H 1.871500 -4.377904 0.928690
H -1.180516 -3.904881 -0.800655
H -5.949894 -0.461144 -1.219118
H -5.225293 1.065209 -1.772564
H -6.343911 1.051854 -0.384135


%chk=000281724-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281724

0 1
O -0.958634 -1.180623 -1.302942
O -3.292581 0.569585 -0.569342
O -0.476249 -4.104665 -0.695898
O -4.236863 0.030849 1.497080
N 3.032365 2.172998 -0.150212
C 0.534728 0.639725 -0.600241
C -0.933475 0.320785 -1.027300
C 0.723495 1.588132 0.574437
C 2.201307 1.637916 0.985113
C 1.393923 1.143319 -1.810547
C 1.003234 -0.716973 -0.104004
C -1.944846 0.662977 0.070821
C 2.745508 0.234635 1.440613
C 2.871749 1.345827 -1.379231
C 2.047490 -0.961462 0.796247
C 0.141311 -1.709039 -0.572955
C -0.308799 2.265372 1.134924
C -1.736803 2.087277 0.636664
C 2.274166 -2.327013 1.126554
C 2.835752 3.623092 -0.374543
C 0.354870 -3.061900 -0.254230
C 1.457909 -3.354138 0.590172
C -4.363662 0.225942 0.266724
C -5.650586 0.121126 -0.521805
H -1.224390 0.794889 -1.978876
H 2.330853 2.342076 1.828409
H 0.964183 2.097160 -2.176191
H 1.336316 0.408838 -2.637452
H -1.894632 -0.073582 0.893396
H 2.618431 0.155767 2.538206
H 3.836076 0.234331 1.249525
H 3.329144 0.357504 -1.190862
H 3.448639 1.819503 -2.194246
H -0.139754 2.929685 1.992943
H -2.454472 2.240053 1.462033
H -1.985310 2.832387 -0.147295
H 3.074135 -2.598410 1.824909
H 3.529525 3.959932 -1.165443
H 3.087830 4.169764 0.552499
H 1.800826 3.918270 -0.669829
H 1.632506 -4.401744 0.855316
H -1.226817 -3.733320 -1.225433
H -6.008899 -0.923129 -0.492745
H -5.506424 0.427889 -1.567491
H -6.425774 0.745693 -0.046270


