%chk=000289774.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289774

0 1
O 0.598885 1.519219 -1.282751
O 2.879624 -3.424457 0.724216
O 1.717360 1.826713 0.701315
O -0.156857 -1.019422 -1.791455
N 1.496532 -0.288046 -0.246841
N 1.286743 -2.515721 -0.695678
C -4.496313 0.697980 -0.660946
C -3.488992 1.700293 -0.081008
C -5.712350 0.527987 0.259391
C -2.271550 1.856834 -0.999211
C -6.718572 -0.474770 -0.321481
C -1.257083 2.855365 -0.426713
C -7.934456 -0.646503 0.598642
C 2.581200 -0.956464 0.557118
C -8.941649 -1.649399 0.018344
C 0.028388 2.875609 -1.242120
C 3.954864 -0.484533 0.147717
C 2.339589 -2.457368 0.264054
C 1.303257 1.119038 -0.187929
C 0.753400 -1.228693 -1.038506
C -10.154126 -1.824653 0.930144
C 4.477930 0.662560 0.765457
C 4.703137 -1.154364 -0.830059
C 5.748944 1.124179 0.416740
C 5.975784 -0.688156 -1.173083
C 6.500957 0.447889 -0.549791
H -4.826055 1.031966 -1.663623
H -4.002929 -0.281082 -0.819494
H -3.164543 1.366177 0.923561
H -3.978854 2.681254 0.070521
H -5.382399 0.191508 1.261146
H -6.205326 1.506464 0.417387
H -2.593887 2.180243 -2.007437
H -1.774564 0.872434 -1.153161
H -7.048911 -0.138753 -1.323272
H -6.225262 -1.453177 -0.480191
H -1.027207 2.602119 0.629350
H -1.692103 3.874499 -0.398761
H -8.428718 0.330940 0.758225
H -7.605575 -0.983186 1.600496
H 2.404061 -0.757238 1.651254
H -8.448727 -2.628567 -0.140004
H -9.273139 -1.312715 -0.983416
H 0.784956 3.572273 -0.842183
H -0.134891 3.043215 -2.323798
H -10.688331 -0.879192 1.077397
H -9.864310 -2.194329 1.920270
H -10.866716 -2.541841 0.507863
H 0.913363 -3.378997 -1.086619
H 3.881220 1.208200 1.502581
H 4.308325 -2.040473 -1.326015
H 6.152388 2.014462 0.898123
H 6.558244 -1.213788 -1.928947
H 7.493644 0.807262 -0.818015


%chk=000289774-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289774

0 1
O 0.586054 1.186929 -1.131416
O 3.830282 -3.076336 1.301521
O 1.977386 1.843698 0.644200
O 0.128469 -1.598216 -1.187270
N 1.897994 -0.379852 -0.069435
N 1.944927 -2.634245 -0.067415
C -4.768866 0.538710 -0.661573
C -3.709745 1.519478 -0.110056
C -6.065155 0.502595 0.178987
C -2.412279 1.544289 -0.948125
C -7.124615 -0.479229 -0.370416
C -1.366073 2.537958 -0.395968
C -8.421661 -0.513999 0.469293
C 3.110661 -0.741608 0.713280
C -9.480773 -1.498285 -0.077699
C -0.049697 2.546049 -1.180562
C 4.415426 -0.222594 0.110941
C 3.052570 -2.292576 0.719380
C 1.500270 0.977030 -0.125705
C 1.189002 -1.522396 -0.539798
C -10.773383 -1.523939 0.766747
C 5.456204 0.199957 0.968813
C 4.612678 -0.209445 -1.291356
C 6.688475 0.632141 0.431060
C 5.842699 0.227336 -1.828296
C 6.884614 0.647044 -0.968763
H -5.017608 0.818104 -1.706879
H -4.332708 -0.480584 -0.708894
H -3.464820 1.240564 0.936429
H -4.143943 2.540927 -0.065717
H -5.816184 0.223922 1.224547
H -6.500726 1.522962 0.225409
H -2.657853 1.818310 -1.995760
H -1.969542 0.530184 -0.987342
H -7.372901 -0.202309 -1.416599
H -6.689857 -1.499805 -0.414921
H -1.151478 2.319266 0.668929
H -1.775321 3.569495 -0.426447
H -8.858730 0.505855 0.512186
H -8.174408 -0.789331 1.516192
H 3.015138 -0.376457 1.751974
H -9.043938 -2.517113 -0.118500
H -9.726266 -1.223936 -1.124122
H 0.670112 3.281554 -0.781017
H -0.212834 2.708334 -2.258705
H -11.245129 -0.523520 0.798565
H -10.558907 -1.825574 1.809583
H -11.514204 -2.234120 0.355153
H 1.647056 -3.592512 -0.256553
H 5.302957 0.196026 2.054176
H 3.807120 -0.527544 -1.963910
H 7.489789 0.961400 1.101273
H 5.989211 0.240141 -2.913940
H 7.838910 0.986064 -1.386675


