%chk=000225065.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225065

0 1
O 2.279776 0.292048 2.334997
O 2.812824 -1.113637 -2.241508
O -2.277736 0.205651 -2.338527
O -2.801272 -1.059625 2.279890
O 3.050176 3.273260 -1.028686
O -3.062444 3.286051 0.931135
N 2.653345 1.753419 0.658518
N 2.946012 1.045676 -1.617050
N -2.658230 1.716513 -0.708126
N -2.946052 1.078472 1.588573
C 2.569293 -0.730046 0.150022
C -2.560171 -0.749387 -0.122489
C 1.249471 -1.531653 0.236288
C -1.235681 -1.545541 -0.184347
C 0.004375 -0.664534 0.012015
C 3.791983 -1.576832 0.605853
C -3.778009 -1.617143 -0.551038
C 2.478945 0.430562 1.150199
C 2.778053 -0.337187 -1.315334
C -2.476907 0.379928 -1.158458
C -2.770755 -0.312192 1.329999
C 3.938564 -2.907557 -0.116717
C -3.916540 -2.925510 0.212766
C 2.898803 2.120903 -0.692435
C -2.904991 2.124604 0.630880
H 1.285939 -2.354614 -0.511298
H 1.192027 -2.023492 1.231358
H -1.175678 -2.067948 -1.163546
H -1.267057 -2.344931 0.588630
H 0.141824 -0.013045 -0.875435
H -0.136901 0.014191 0.878182
H 3.703346 -1.759967 1.700917
H 4.715406 -0.975698 0.472761
H -3.688670 -1.833829 -1.639905
H -4.704901 -1.017570 -0.436275
H 3.160870 -3.624540 0.170907
H 3.886793 -2.796361 -1.211902
H 4.906283 -3.371884 0.113030
H -3.134767 -3.646565 -0.052767
H -3.865051 -2.779883 1.303920
H -4.881606 -3.402424 -0.001876
H 2.607831 2.527505 1.343766
H 3.106104 1.298976 -2.607803
H -2.617355 2.469087 -1.417218
H -3.107171 1.361648 2.571034


%chk=000225065-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225065

0 1
O 2.244377 -0.071190 2.459284
O 2.562901 -0.599208 -2.346227
O -2.235947 -0.161891 -2.449684
O -2.561015 -0.542864 2.369693
O 4.133809 3.220326 -0.223047
O -4.141979 3.203544 0.127066
N 3.210651 1.523037 1.094860
N 3.410351 1.242773 -1.241498
N -3.208983 1.470585 -1.136333
N -3.412785 1.261086 1.207155
C 2.607739 -0.715036 0.113600
C -2.598975 -0.733944 -0.085506
C 1.273626 -1.513967 0.111764
C -1.260032 -1.524657 -0.056392
C 0.004077 -0.638011 0.012901
C 3.845654 -1.686532 0.363731
C -3.830753 -1.719290 -0.308494
C 2.638640 0.253860 1.310448
C 2.822809 -0.040236 -1.249831
C -2.632319 0.197330 -1.311794
C -2.820085 -0.018647 1.256050
C 3.976941 -2.862424 -0.623183
C -3.958637 -2.864550 0.714353
C 3.628572 2.074904 -0.129703
C -3.631854 2.057913 0.069906
H 1.300208 -2.208097 -0.746398
H 1.237586 -2.110261 1.042342
H -1.219892 -2.152118 -0.966079
H -1.282758 -2.189238 0.824951
H 0.059240 -0.004785 -0.894534
H -0.054901 0.025211 0.898462
H 3.727682 -2.067931 1.395685
H 4.774687 -1.081968 0.346987
H -3.707492 -2.132160 -1.327628
H -4.763162 -1.119732 -0.313412
H 3.138263 -3.573319 -0.529387
H 4.016460 -2.522475 -1.671731
H 4.908052 -3.416278 -0.404320
H -3.114525 -3.571932 0.646594
H -4.005582 -2.492277 1.751551
H -4.884839 -3.431431 0.508533
H 3.314180 2.131616 1.913816
H 3.644178 1.650463 -2.153064
H -3.313637 2.053155 -1.973852
H -3.650434 1.695545 2.105265


