%chk=000224416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224416

0 1
O -0.041001 -3.101115 0.328578
O 4.004261 0.528738 -0.560008
O -3.380203 -0.154778 0.224359
O 1.801707 2.603941 0.155342
O -3.319088 2.034496 -0.365450
N -0.793886 -0.516064 0.112391
C 0.581137 -0.793705 0.082833
C 1.547312 0.239842 -0.089703
C 0.973087 -2.149036 0.225241
C 2.895000 -0.183383 -0.241780
C -1.249074 0.796344 -0.031864
C 1.077662 1.637837 -0.012278
C -0.385325 1.834150 -0.106271
C 2.316780 -2.518148 0.158134
C 3.271538 -1.542282 -0.082744
C -2.737158 1.015981 -0.095452
C -4.848060 -0.171193 0.172318
C -0.208679 -3.622048 1.675201
C 3.958013 1.891559 -1.053893
C -5.305452 -0.270936 -1.265070
H -1.458248 -1.297896 0.199276
H -0.722581 2.868639 -0.212606
H 2.597787 -3.566097 0.273473
H 4.327421 -1.797864 -0.173214
H -5.058739 -1.078983 0.767486
H -5.223447 0.734099 0.682398
H -0.463931 -2.815508 2.366549
H 0.698262 -4.142537 1.993388
H -1.040819 -4.323820 1.548672
H 4.952155 1.988739 -1.506706
H 3.828263 2.576631 -0.202286
H 3.162241 2.021673 -1.789655
H -6.387300 -0.444026 -1.330198
H -5.090036 0.654078 -1.821946
H -4.806102 -1.091928 -1.796715


%chk=000224416-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224416

0 1
O -0.201891 -2.811671 0.813446
O 3.974694 0.889102 -0.041720
O -3.464121 -0.086849 0.201188
O 1.763782 2.844773 -0.284004
O -3.400294 2.210581 -0.255351
N -0.851227 -0.333216 0.241829
C 0.513707 -0.603466 0.294067
C 1.487234 0.426174 0.054893
C 0.890459 -1.944106 0.614780
C 2.876190 0.035705 0.122520
C -1.330513 0.938080 -0.004708
C 0.996783 1.824706 -0.156806
C -0.458449 1.993155 -0.197652
C 2.245262 -2.280751 0.714452
C 3.222364 -1.288159 0.459964
C -2.810660 1.128064 -0.043563
C -4.961024 -0.059641 0.173793
C 0.098977 -4.203643 1.153400
C 4.153242 1.589209 -1.333249
C -5.478199 -0.243542 -1.254823
H -1.507018 -1.102642 0.410223
H -0.853556 2.995678 -0.375658
H 2.561426 -3.296090 0.969424
H 4.287655 -1.528817 0.515554
H -5.246865 -0.894304 0.833242
H -5.295286 0.900301 0.604356
H 0.658219 -4.266846 2.106417
H 0.677668 -4.692579 0.346509
H -0.878648 -4.695213 1.261729
H 5.170187 2.007656 -1.281242
H 3.407399 2.394451 -1.430430
H 4.084495 0.866828 -2.170139
H -6.582516 -0.298032 -1.243129
H -5.184136 0.607143 -1.891838
H -5.091844 -1.176638 -1.699674


