%chk=000001925.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001925

0 1
 O  -0.6797000       3.144400       1.280000    
 O    3.629200      0.8608000       2.137900    
 N   0.9117000     -0.1962000      -1.552700    
 N    1.557300       1.561700      0.5015000    
 N    2.691700      -1.640200     -0.7966000    
 N    4.055200      -1.115300       1.052300    
 N    4.355500      -3.100000     -0.1742000    
 C   0.1025000       1.008700      -1.481600    
 C   -1.355500      0.5868000      -1.284400    
 C   0.5778000       1.871500     -0.2963000    
 C   0.2749000       1.770500      -2.798000    
 C   -1.530100     -0.1894000      1.7300000E-02
 C    1.943000     -0.4913000     -0.6932000    
 C  -0.1341000       3.179300     -2.0300001E-02
 C    2.228600      0.3847000      0.2907000    
 C   -2.966900     -0.5943000      0.2262000    
 C    3.359700      6.7900002E-02   1.238400    
 C   -3.822500      0.2572000      0.9094000    
 C   -3.410900      -1.811800     -0.2684000    
 C    3.716900      -1.913100      7.4199997E-02
 C   -5.152200     -0.1173000       1.102700    
 C   -4.740700      -2.186100     -7.5199999E-02
 C   -5.611300      -1.338700      0.6104000    
 H   -1.680600     -3.8400002E-02  -2.127700    
 H   -2.017000       1.462000      -1.284900    
 H   0.7215000     -0.8768000      -2.281100    
 H    1.309600       2.111900      -2.921500    
 H   3.3700000E-02   1.136900      -3.659500    
 H  -0.3684000       2.655100      -2.847000    
 H   -1.201700      0.3862000      0.8890000    
 H  -0.9167000      -1.098900      2.1299999E-02
 H  -0.9277000       3.386900     -0.7400000    
 H   0.5969000       3.992100     -7.0299998E-02
 H    2.450200      -2.278200      -1.546600    
 H   -3.476000       1.211500       1.295100    
 H   -2.741500      -2.477700     -0.8056000    
 H   -1.445300       2.546600       1.263200    
 H   -5.830200      0.5427000       1.635900    
 H   -5.098600      -3.137000     -0.4591000    
 H   -6.646700      -1.630100      0.7605000    
 H    5.130100      -3.410100      0.4023000    
 H    4.074500      -3.701800     -0.9406000    


%chk=000001925-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001925

0 1
O -1.255755 3.542719 -0.349837
O 2.871970 0.161057 2.733921
N 1.106983 0.055092 -1.764793
N 1.454275 1.532400 0.585235
N 2.615722 -1.615342 -0.967144
N 3.579517 -1.505472 1.241993
N 4.182347 -3.231380 -0.230978
C 0.098394 1.140329 -1.521963
C -1.305553 0.541302 -1.189162
C 0.633984 1.990837 -0.333694
C -0.008321 1.971917 -2.822251
C -1.374088 -0.357272 0.073048
C 1.898552 -0.434701 -0.750877
C 0.220510 3.438414 -0.211492
C 2.018968 0.249650 0.464890
C -2.803510 -0.798980 0.359995
C 2.817343 -0.328127 1.573288
C -3.758477 0.136489 0.840162
C -3.221147 -2.135555 0.139054
C 3.466827 -2.079745 0.064341
C -5.091911 -0.253569 1.091371
C -4.556490 -2.531039 0.386992
C -5.497475 -1.590287 0.863308
H -1.652326 -0.038435 -2.070615
H -1.994150 1.396034 -1.059722
H 1.254314 -0.244397 -2.730992
H 0.964966 2.415769 -3.099018
H -0.356650 1.333454 -3.657794
H -0.745230 2.779497 -2.686371
H -0.975935 0.207531 0.937101
H -0.729039 -1.245653 -0.060766
H 0.704162 4.047640 -1.007320
H 0.567282 3.792259 0.776240
H 2.385603 -2.216082 -1.762036
H -3.446569 1.172382 1.025309
H -2.492967 -2.873121 -0.221857
H -1.526224 4.476214 -0.159082
H -5.813614 0.479786 1.469574
H -4.859927 -3.570368 0.215119
H -6.531526 -1.894997 1.060785
H 4.766805 -3.587822 0.522391
H 4.354559 -3.545727 -1.182854


