%chk=000291365.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291365

0 1
O -2.442578 -3.730871 -0.238682
O -1.050907 2.122614 0.317000
O -4.402031 -2.071496 -0.125495
O 7.683838 0.857270 1.208270
N 1.043970 0.568392 0.105593
C -1.260692 -0.218700 0.046932
C -2.176295 -1.319783 -0.045652
C 0.126969 -0.469525 0.016476
C -3.266994 1.359428 0.140803
C -4.155150 0.275889 0.037068
C -1.785971 1.147575 0.176148
C -3.632483 -1.111842 -0.047902
C -1.683477 -2.617424 -0.142926
C 0.601616 -1.839005 -0.060626
C 2.451792 0.453202 -0.148963
C -0.268516 -2.880377 -0.140503
C -3.769812 2.663895 0.217379
C -5.537448 0.500029 0.011482
C 5.209679 0.358234 -0.621513
C 2.943183 -0.213889 -1.282635
C 3.336898 1.086683 0.746531
C 6.691828 0.327985 -0.866788
C -5.151659 2.885141 0.189854
C -6.033731 1.806133 0.087588
C 4.320995 -0.263177 -1.508301
C 4.705906 1.036571 0.502992
C 7.471902 -0.257774 0.312757
H 0.686806 1.529029 0.306708
H 1.679399 -2.022922 -0.026693
H 0.057067 -3.921509 -0.195493
H -3.069815 3.501774 0.299638
H -6.216650 -0.354273 -0.068210
H 2.258309 -0.674013 -1.993581
H 2.953703 1.609911 1.621882
H 7.051307 1.371293 -1.040704
H 6.937916 -0.230055 -1.791308
H -5.537980 3.903120 0.249139
H -7.109890 1.979181 0.067051
H 4.697559 -0.783051 -2.388462
H 5.410126 1.519305 1.189841
H 8.458181 -0.643499 -0.000818
H 6.909568 -1.044534 0.845104
H -3.461490 -3.515471 -0.229337
H 8.135349 0.558336 2.019054


%chk=000291365-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291365

0 1
O -2.759395 -3.762192 -0.360287
O -0.894138 2.038740 0.323972
O -4.574934 -2.074464 -0.199484
O 7.538755 1.043727 1.387519
N 1.043906 0.357001 0.033682
C -1.295951 -0.325664 -0.003821
C -2.274376 -1.379136 -0.112321
C 0.107485 -0.655691 -0.062614
C -3.196431 1.343283 0.179436
C -4.158550 0.294817 0.053537
C -1.737484 1.058107 0.169908
C -3.707926 -1.099437 -0.089586
C -1.859228 -2.740221 -0.249774
C 0.486735 -2.045074 -0.158789
C 2.446670 0.307985 -0.186359
C -0.464065 -3.054197 -0.247903
C -3.642491 2.681845 0.322563
C -5.544931 0.597480 0.071525
C 5.277292 0.411598 -0.614444
C 3.054785 -0.508087 -1.177415
C 3.265418 1.191620 0.570098
C 6.780419 0.455987 -0.844294
C -5.019351 2.974177 0.336427
C -5.974196 1.929711 0.210981
C 4.450877 -0.454511 -1.374402
C 4.655068 1.243477 0.356081
C 7.622498 -0.009680 0.358187
H 0.592071 1.285769 0.239767
H 1.546556 -2.308503 -0.120414
H -0.172775 -4.107027 -0.303209
H -2.887162 3.467346 0.419991
H -6.255823 -0.228740 -0.024978
H 2.439408 -1.138408 -1.826806
H 2.799959 1.829000 1.330596
H 7.108487 1.485530 -1.087502
H 7.043538 -0.179503 -1.711141
H -5.356669 4.010596 0.444796
H -7.044181 2.162719 0.223740
H 4.901186 -1.084412 -2.151626
H 5.280131 1.915025 0.951356
H 8.676973 -0.145090 0.035955
H 7.237780 -0.976241 0.746372
H -3.716136 -3.311048 -0.322328
H 7.990491 0.739587 2.213705


