%chk=000298112.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298112

0 1
O 1.525636 -0.993859 -0.337845
O 1.383521 -0.097072 1.735093
O -1.190453 -2.153290 0.506970
N -2.559593 0.239504 1.208441
N -1.166117 0.011599 1.262843
C -3.052108 0.477043 -0.211033
C 0.985963 -1.219768 0.968767
C -2.655819 1.894583 -0.633146
C -4.573125 0.294811 -0.207110
C -0.562765 -1.171186 0.880073
C 1.524585 -2.168843 -1.205603
C 2.828782 0.134811 1.788027
C 2.027806 -1.634878 -2.532052
C 2.955901 1.345085 2.691050
H -2.595598 -0.261626 -0.923607
H 1.348739 -2.171223 1.404936
H -3.047599 -0.593154 1.598935
H -3.088931 2.154499 -1.604282
H -2.999751 2.638920 0.096562
H -1.568015 2.000154 -0.716044
H -4.863012 -0.739449 0.011103
H -4.998029 0.550289 -1.184786
H -5.057357 0.942474 0.535359
H -0.621441 0.839414 1.533999
H 2.194919 -2.925816 -0.764912
H 0.490134 -2.560215 -1.263545
H 3.309111 -0.766629 2.202776
H 3.179026 0.319953 0.756769
H 2.046850 -2.419555 -3.296465
H 1.386371 -0.819601 -2.896315
H 3.039676 -1.219272 -2.439333
H 4.005962 1.614220 2.851166
H 2.443379 2.217342 2.262660
H 2.497050 1.161138 3.672450


%chk=000298112-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298112

0 1
O 1.490406 -0.909918 -0.520824
O 1.333291 0.045010 1.629159
O -1.197926 -2.170211 0.327976
N -2.662465 0.138610 1.178785
N -1.240473 0.004395 1.185681
C -3.206968 0.537430 -0.171479
C 0.940458 -1.082328 0.830802
C -2.796887 1.986143 -0.489585
C -4.735844 0.368290 -0.104944
C -0.599226 -1.133954 0.762205
C 1.647149 -2.182229 -1.267507
C 2.796050 0.144439 1.855966
C 2.315235 -1.838471 -2.597362
C 3.042185 1.396709 2.693097
H -2.799654 -0.137659 -0.956538
H 1.318195 -2.043630 1.255304
H -3.056025 -0.780548 1.447188
H -3.186448 2.286707 -1.479153
H -3.199874 2.675319 0.274732
H -1.697186 2.091695 -0.513982
H -5.018462 -0.684958 0.084245
H -5.196562 0.673659 -1.060771
H -5.156433 0.994226 0.702937
H -0.691665 0.758723 1.604246
H 2.272009 -2.881423 -0.668480
H 0.652691 -2.644564 -1.415520
H 3.133905 -0.771644 2.386974
H 3.302069 0.197392 0.874743
H 2.459315 -2.755021 -3.198172
H 1.687235 -1.138279 -3.174503
H 3.300165 -1.367079 -2.434300
H 4.122035 1.508674 2.900333
H 2.697280 2.296076 2.154470
H 2.506121 1.338822 3.656179


