%chk=000164606.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164606

0 1
 O   0.6758000       1.519400      -1.269100    
 O    5.733600      0.9938000      0.3905000    
 N   -2.767700     -0.1887000      -1.300200    
 N   0.8897000      -1.650200      0.2817000    
 C   -1.160200     -0.2809000      0.5605000    
 C   -2.191300      0.6047000     -0.1926000    
 C   -3.408100      -1.439900      0.7574000    
 C  -1.2100000E-02 -0.7040000     -0.3901000    
 C   -3.307500       1.060200      0.7844000    
 C   -1.926600      -1.489500       1.168700    
 C   -4.046200     -0.1708000       1.335900    
 C   -3.487700      -1.369900     -0.7804000    
 C  -0.5396000      -1.321300      -1.692600    
 C   -1.729300     -0.5444000      -2.277000    
 C   -4.279700       2.049300      0.1383000    
 C   0.9352000      0.4797000     -0.6927000    
 C    2.259500      0.1578000     -0.1820000    
 C    2.165000      -1.116400      0.3604000    
 C   -5.287600       2.567000       1.144400    
 C    3.424800      0.8985000     -0.1997000    
 C    3.282200      -1.691600      0.9381000    
 C    4.552800      0.3147000      0.3744000    
 C    4.482500     -0.9705000      0.9403000    
 C    5.742400       2.292700     -0.1985000    
 H  -0.7335000      0.3011000       1.389600    
 H   -1.712600       1.505500     -0.5921000    
 H   -3.934500      -2.326200       1.127900    
 H   -2.822600       1.572900       1.627200    
 H   -1.842800      -1.458800       2.262200    
 H   -1.505100      -2.450200      0.8558000    
 H   -5.110400     -0.1716000       1.075400    
 H   -3.988900     -0.1816000       2.431100    
 H   -3.117600      -2.309300      -1.208400    
 H   -4.536800      -1.289800      -1.090000    
 H  -0.8417000      -2.361400      -1.514700    
 H   0.2561000      -1.368800      -2.447500    
 H   -1.361300      0.3790000      -2.742000    
 H   -2.173900      -1.120400      -3.098200    
 H   -4.813800       1.589300     -0.7012000    
 H   -3.718300       2.899200     -0.2682000    
 H   0.6589000      -2.602900      0.5201000    
 H   -5.970400       1.789400       1.497000    
 H   -4.788800       3.006800       2.014300    
 H   -5.901200       3.349200      0.6847000    
 H    3.400800       1.881800     -0.6512000    
 H    3.239000      -2.680600       1.382900    
 H    5.368600      -1.413500       1.388600    
 H    6.759300       2.686300     -9.9200003E-02
 H    5.079300       2.981500      0.3360000    
 H    5.519100       2.250400      -1.270000    


%chk=000164606-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000164606

0 1
O 0.519235 1.482995 -1.417039
O 5.783426 1.078709 0.487074
N -2.836377 -0.234078 -1.305268
N 0.934702 -1.717357 0.189935
C -1.173970 -0.381509 0.540757
C -2.209723 0.535392 -0.187903
C -3.465674 -1.499918 0.756391
C -0.027707 -0.786824 -0.458036
C -3.286090 1.034029 0.810650
C -1.958480 -1.618934 1.113179
C -4.050996 -0.209994 1.383055
C -3.614129 -1.410304 -0.785250
C -0.624218 -1.412489 -1.755001
C -1.809083 -0.571174 -2.323268
C -4.226061 2.076650 0.156641
C 0.888330 0.448165 -0.780842
C 2.214996 0.161354 -0.226183
C 2.184268 -1.140719 0.356142
C -5.191542 2.746803 1.157466
C 3.388099 0.955364 -0.223370
C 3.350307 -1.667665 0.975650
C 4.539648 0.425079 0.390432
C 4.509681 -0.875857 0.983953
C 5.872922 2.413800 -0.104833
H -0.703229 0.178780 1.372791
H -1.689470 1.401354 -0.633019
H -4.012665 -2.388104 1.128927
H -2.741759 1.540519 1.635715
H -1.840591 -1.675498 2.211301
H -1.574386 -2.575511 0.702468
H -5.128791 -0.144921 1.137269
H -3.976663 -0.257614 2.486162
H -3.251767 -2.352156 -1.250458
H -4.686335 -1.309183 -1.053388
H -0.975638 -2.436668 -1.516294
H 0.170974 -1.520291 -2.516320
H -1.416448 0.376599 -2.731710
H -2.288876 -1.125001 -3.151460
H -4.790128 1.581898 -0.657284
H -3.608243 2.858480 -0.330045
H 0.638364 -2.582664 0.635686
H -5.840858 2.004487 1.658545
H -4.634999 3.290001 1.945302
H -5.850154 3.474602 0.648529
H 3.361393 1.944378 -0.689493
H 3.357116 -2.662448 1.433106
H 5.431220 -1.240597 1.449498
H 6.907193 2.742415 0.074226
H 5.167495 3.117377 0.379932
H 5.672478 2.385247 -1.194114


