%chk=000247163.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247163

0 1
O 2.092673 1.545436 0.464600
O 5.093897 -1.821381 0.756637
O 6.017662 3.141146 -1.240583
O -3.927741 -1.745964 -0.036241
O -3.820282 3.725924 -1.194724
O -7.877827 -0.655177 1.608769
N 4.329341 0.984446 0.359223
N -4.534528 0.421907 0.405064
N 2.632063 -0.654522 -0.085078
N -2.218640 -0.175198 0.129159
C 1.320687 -1.222046 -0.149151
C 5.324580 0.272899 -0.487565
C 4.640504 2.411897 0.642584
C -4.244021 1.865632 0.290801
C -5.961796 0.017996 0.297866
C -1.096555 -1.046405 -0.050277
C 1.214822 -2.615689 -0.419448
C 2.930418 0.684803 0.227172
C 0.174459 -0.444055 0.039062
C -3.572136 -0.589480 0.133937
C -1.220282 -2.415131 -0.319055
C -0.063734 -3.176646 -0.498825
C 6.033509 -0.817103 0.331987
C 4.734977 3.294091 -0.612488
C -4.099778 2.324234 -1.175679
C -6.520794 -0.212234 1.716107
C 2.411830 -3.483935 -0.638964
H 4.850132 -0.173103 -1.390589
H 6.081938 0.995528 -0.889732
H 3.846708 2.812712 1.322460
H 5.597852 2.436501 1.208536
H -5.062944 2.444350 0.781377
H -3.327532 2.115627 0.871055
H -6.560041 0.789208 -0.231682
H -6.055604 -0.920920 -0.301567
H 0.273825 0.624704 0.255067
H 3.418891 -1.337987 -0.172112
H -1.990432 0.789315 0.384996
H -2.205762 -2.887057 -0.384586
H -0.166715 -4.243396 -0.707529
H 6.555223 -0.404782 1.211783
H 6.746042 -1.385906 -0.296593
H 4.558246 4.357623 -0.378243
H 4.028198 2.977281 -1.405326
H -3.320766 1.765829 -1.722390
H -5.056155 2.250097 -1.729226
H -5.921613 -0.946719 2.282460
H -6.604586 0.726014 2.294155
H 2.657110 -3.547580 -1.709375
H 3.315211 -3.126412 -0.116200
H 2.241448 -4.509979 -0.283982
H 4.661205 -1.533723 1.594685
H 6.705761 3.621048 -0.739782
H -2.888345 3.897742 -0.950595
H -7.912503 -1.576561 1.278945


%chk=000247163-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247163

0 1
O 2.035937 1.602256 0.457904
O 5.180434 -1.654390 1.107143
O 5.655633 3.063076 -1.823440
O -4.045461 -1.817692 -0.224041
O -3.614227 4.067746 -0.432071
O -8.015212 -0.689022 1.240960
N 4.269383 1.004628 0.099894
N -4.541144 0.426833 0.179904
N 2.598427 -0.671745 0.095421
N -2.280271 -0.285282 0.082596
C 1.308258 -1.269127 -0.010791
C 5.238289 0.142174 -0.615837
C 4.646308 2.404095 0.385991
C -4.167839 1.818827 0.489693
C -5.978321 0.100875 0.054531
C -1.146962 -1.143411 -0.028012
C 1.250896 -2.683475 -0.231866
C 2.896200 0.689024 0.223923
C 0.117642 -0.514229 0.093017
C -3.633921 -0.634331 -0.000435
C -1.229391 -2.541247 -0.240446
C -0.027430 -3.274868 -0.334593
C 6.061711 -0.756530 0.324071
C 4.585704 3.338539 -0.840160
C -3.837601 2.657682 -0.774126
C -6.577230 -0.417840 1.382923
C 2.510077 -3.520817 -0.377789
H 4.693403 -0.489787 -1.341653
H 5.907911 0.792905 -1.207370
H 3.934679 2.785290 1.139031
H 5.663852 2.419413 0.825969
H -5.014530 2.306098 1.004717
H -3.322308 1.852224 1.208690
H -6.527778 1.002716 -0.270547
H -6.092643 -0.677143 -0.721343
H 0.201796 0.560674 0.278401
H 3.393851 -1.320132 0.185957
H -2.044251 0.696464 0.225996
H -2.203902 -3.021556 -0.331715
H -0.087050 -4.356810 -0.504195
H 6.692963 -0.150304 1.004506
H 6.714130 -1.423906 -0.264174
H 4.626027 4.396415 -0.504627
H 3.641322 3.175757 -1.381030
H -2.975356 2.227186 -1.325608
H -4.706683 2.664888 -1.451718
H -6.019745 -1.317486 1.709349
H -6.515222 0.352154 2.170599
H 3.114053 -3.209801 -1.254412
H 3.175649 -3.461981 0.505767
H 2.249306 -4.582627 -0.520840
H 4.868869 -1.174788 1.915802
H 6.503051 3.456380 -1.494535
H -2.738012 4.168254 0.018164
H -8.135169 -1.487347 0.667350


