%chk=000282695.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282695

0 1
O 4.092875 -0.249315 -0.895043
O 5.016303 -2.869525 0.662130
O 6.862710 -1.183289 0.515835
O 5.974701 2.256776 -1.577187
O -3.312285 0.300490 -0.011556
N 2.258064 -0.649280 0.548511
N 2.341829 0.178261 1.657823
N 0.610540 -1.176668 -1.232401
N -1.585596 1.882186 1.293584
N -1.998750 -0.181193 0.063645
C 4.528576 -1.581938 1.052323
C 5.663308 -0.525390 0.899618
C 3.486301 -1.224970 -0.043288
C 5.142346 0.468105 -0.167682
C 6.164215 0.885145 -1.227252
C 0.967698 -0.559569 -0.038374
C 0.220258 0.308734 0.786746
C 1.126962 0.730510 1.827477
C -1.184088 0.670628 0.664759
C -4.077026 -0.633768 -0.855781
C -5.509120 -0.245485 -0.616369
C -5.943114 0.079575 0.677041
C -6.416954 -0.227952 -1.685133
C -7.279942 0.419171 0.899299
C -7.754662 0.105154 -1.454774
C -8.187637 0.429509 -0.164846
H 4.110912 -1.638257 2.079272
H 5.937752 -0.023665 1.852035
H 3.233612 -2.080324 -0.714378
H 4.656430 1.353093 0.305137
H 6.091867 0.249282 -2.129356
H 7.200277 0.863326 -0.827144
H 5.773307 -3.128031 1.245871
H 6.703617 -1.747093 -0.286427
H 0.887398 1.383869 2.655060
H 5.124167 2.371265 -2.055800
H -0.396446 -1.254048 -1.390592
H 1.116635 -2.008356 -1.501409
H -2.509821 2.215267 1.034588
H -0.901402 2.626197 1.294529
H -3.873262 -1.672723 -0.535057
H -3.747425 -0.492605 -1.898676
H -5.226251 0.071600 1.500203
H -6.085815 -0.472103 -2.692308
H -7.614681 0.674098 1.903491
H -8.460576 0.114590 -2.283477
H -9.229403 0.690520 0.010232


%chk=000282695-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282695

0 1
O 3.703356 -0.218292 -1.042794
O 5.270203 -0.448108 2.281030
O 6.540739 -1.322869 0.043117
O 4.800340 -0.512399 -3.712632
O -3.218886 0.006448 0.456624
N 2.408549 -0.295353 0.994511
N 2.439803 -0.157616 2.410247
N 0.788068 -0.439745 -0.819832
N -1.942400 0.217880 2.674885
N -1.748863 -0.167534 0.319776
C 4.835813 0.133461 1.027997
C 5.936077 0.007530 -0.042650
C 3.676183 -0.645213 0.362687
C 5.149134 0.154541 -1.365023
C 5.626353 -0.730182 -2.519883
C 1.121395 -0.299209 0.497433
C 0.257190 -0.122526 1.620458
C 1.128153 -0.052592 2.752225
C -1.197619 -0.021138 1.535643
C -3.829199 -0.279175 -0.860853
C -5.295379 0.082720 -0.772536
C -6.292193 -0.923476 -0.771513
C -5.689730 1.443115 -0.687977
C -7.661893 -0.579762 -0.696401
C -7.055742 1.789750 -0.606980
C -8.046053 0.778107 -0.613730
H 4.520127 1.189151 1.145211
H 6.710241 0.791697 0.057890
H 3.852028 -1.739376 0.424371
H 5.110698 1.209772 -1.691676
H 5.631340 -1.789165 -2.204060
H 6.649477 -0.443473 -2.814334
H 4.443510 -0.458731 2.851959
H 6.589226 -1.541134 1.014322
H 0.873384 0.072527 3.804372
H 3.870625 -0.766830 -3.481394
H -0.220888 -0.398024 -1.014487
H 1.509988 -0.396691 -1.536922
H -2.954056 0.275011 2.578387
H -1.504771 0.347508 3.580341
H -3.687014 -1.350200 -1.103483
H -3.300925 0.330530 -1.620365
H -5.995159 -1.977788 -0.828451
H -4.921317 2.225104 -0.681716
H -8.424345 -1.366668 -0.700551
H -7.350280 2.843298 -0.542602
H -9.106883 1.046925 -0.555739


