%chk=000059704.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059704

0 1
 O   -2.586900       2.047800     -0.1028000    
 O    4.731400       1.648000      6.8599999E-02
 O   -7.538900      -1.029500       2.302300    
 N   -7.325300     -0.8331000     -3.9900001E-02
 N    9.124200      -1.760100      0.1800000    
 C    1.047900       1.303400     -0.6971000    
 C  -0.1951000       1.937100     -7.5099997E-02
 C    2.324300       1.782400      5.0000002E-04
 C   -1.471700       1.434200     -0.7341000    
 C    3.580400       1.188200     -0.6250000    
 C   -3.758000       1.335600     -8.7099999E-02
 C   -6.133600     -0.1079000     -5.5700000E-02
 C    5.814500      0.8079000      9.6199997E-02
 C   -7.991900      -1.136000      -1.344400    
 C   -4.037100      0.4484000      -1.120000    
 C   -4.654100       1.508700      0.9614000    
 C   -5.229200     -0.2760000      -1.104200    
 C   -5.846000      0.7844000      0.9771000    
 C    8.010700     -0.8949000      0.1515000    
 C    6.032600     -6.7100003E-02 -0.9614000    
 C    6.682400      0.8408000       1.181000    
 C    7.134700     -0.9215000     -0.9336000    
 C    7.784600     -1.3700000E-02   1.208800    
 C   -7.991800      -1.226600       1.171800    
 C   -7.578400      -2.500900      -1.868400    
 C   -9.345300      -1.890000       1.059100    
 C    9.659200      -2.226000       1.444000    
 C    9.756500      -2.183500      -1.053500    
 H   0.9818000      0.2111000     -0.6254000    
 H    1.094400       1.556100      -1.763200    
 H  -0.2332000       1.720300      0.9999000    
 H  -0.1473000       3.030000     -0.1590000    
 H    2.292000       1.521400       1.065800    
 H    2.387600       2.877200     -3.7000000E-02
 H   -1.472400       1.695400      -1.798600    
 H   -1.495600      0.3418000     -0.6265000    
 H    3.651700       1.492700      -1.675800    
 H    3.486500      9.5600002E-02 -0.5715000    
 H   -7.734100     -0.3535000      -2.068700    
 H   -9.078700      -1.089300      -1.241400    
 H   -3.374600      0.3125000      -1.969300    
 H   -4.438600       2.211800       1.761000    
 H   -5.402500     -0.9363000      -1.943000    
 H   -6.540400      0.9922000       1.784400    
 H    5.390600     -0.1005000      -1.836300    
 H    6.510700       1.527500       2.005000    
 H    7.278900      -1.599500      -1.770100    
 H    8.453300      4.1099999E-02   2.063100    
 H   -6.501000      -2.632200      -1.976100    
 H   -7.918400      -3.300700      -1.203700    
 H   -8.034300      -2.674200      -2.848800    
 H   -9.668000      -2.216000       2.053400    
 H   -10.08350      -1.175700      0.6858000    
 H   -9.307000      -2.774500      0.4230000    
 H    8.860000      -2.501600       2.141200    
 H    10.28960      -1.458600       1.905200    
 H    10.27730      -3.120300       1.305500    
 H    9.854600      -1.351700      -1.760200    
 H    9.185700      -2.990100      -1.525400    
 H    10.76860      -2.561100     -0.8698000    


%chk=000059704-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059704

0 1
O -2.613446 0.923739 0.927635
O 4.781706 0.709964 0.909507
O -8.975150 0.374682 1.495014
N -8.002110 -0.232530 -0.563630
N 10.056670 -0.818917 -0.561344
C 1.065454 0.172143 0.267533
C -0.199622 0.808433 0.887021
C 2.367373 0.736694 0.879698
C -1.482366 0.254654 0.262636
C 3.614562 0.099776 0.260720
C -3.910126 0.575140 0.515202
C -6.633013 0.022300 -0.163118
C 6.057816 0.272925 0.485962
C -8.230925 -0.798445 -1.923113
C -4.213647 -0.360156 -0.500896
C -4.969669 1.229209 1.189004
C -5.561513 -0.629678 -0.827641
C -6.308029 0.961592 0.860732
C 8.741187 -0.462111 -0.218807
C 6.293098 -0.707451 -0.505693
C 7.162175 0.884318 1.124543
C 7.614480 -1.068007 -0.851418
C 8.477594 0.527888 0.782831
C -9.100670 -0.010929 0.292704
C -8.302066 -2.342530 -1.962647
C -10.503028 -0.220422 -0.288984
C 11.187654 -0.174200 0.110754
C 10.292036 -1.831851 -1.592271
H 1.035555 -0.928327 0.412481
H 1.067789 0.345057 -0.829381
H -0.222527 0.622789 1.977637
H -0.178806 1.906119 0.747894
H 2.380676 0.561154 1.972297
H 2.413377 1.832194 0.729515
H -1.513250 0.463148 -0.828289
H -1.556575 -0.843356 0.414696
H 3.650204 0.286743 -0.834700
H 3.620295 -0.999369 0.428195
H -7.421266 -0.435165 -2.578855
H -9.165660 -0.377503 -2.328663
H -3.423916 -0.890340 -1.040971
H -4.725456 1.951012 1.974421
H -5.752709 -1.370889 -1.608149
H -7.106710 1.460822 1.407601
H 5.463821 -1.202541 -1.020511
H 6.970987 1.642078 1.891276
H 7.757655 -1.829981 -1.622666
H 9.303210 1.024520 1.300028
H -7.382639 -2.803540 -1.564089
H -9.147570 -2.721836 -1.362207
H -8.441316 -2.688814 -3.003562
H -11.210675 -0.099332 0.544097
H -10.737473 0.540130 -1.057701
H -10.649370 -1.217353 -0.738714
H 11.177321 -0.352547 1.206764
H 11.197862 0.924334 -0.051575
H 12.131356 -0.581253 -0.286467
H 9.867530 -1.532615 -2.574193
H 9.849502 -2.813504 -1.319696
H 11.376150 -1.977065 -1.724948


