%chk=000134315.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134315

0 1
 O    3.822900      0.8879000      -1.713200    
 O    1.940400      -2.146100      0.2526000    
 O    4.924000       2.793600      -2.429000    
 O   -2.313100     -0.3413000     -0.7696000    
 O    5.963900      -4.619400      0.5514000    
 O   -2.474300      0.4434000       1.419600    
 N   -8.553100     -0.7563000     -0.1591000    
 N   -10.71620      0.1243000     -0.1441000    
 N   -9.001500       1.574400      0.2618000    
 C    3.330000      0.3234000     -0.4567000    
 C    3.721000       1.383000      0.5225000    
 C    1.828400      0.1511000     -0.5724000    
 C    4.042600     -0.9932000     -0.2183000    
 C    4.361600       2.416900     -0.1367000    
 C    1.232200      -1.057700     -0.1960000    
 C    3.309100      -2.131400      0.1354000    
 C    4.429300       2.108100      -1.556800    
 C    3.531600       1.442700       1.894300    
 C   0.9978000       1.192300      -1.023400    
 C    5.441200      -1.103900     -0.3126000    
 C    4.837500       3.538900      0.5159000    
 C  -0.1559000      -1.220900     -0.2572000    
 C    3.953300      -3.345100      0.3979000    
 C  -0.3867000       1.027000      -1.091300    
 C    4.001900       2.565300       2.581900    
 C    6.083400      -2.316800     -5.7100002E-02
 C  -0.9636000     -0.1792000     -0.7060000    
 C    4.650500       3.606500       1.896900    
 C    5.339400      -3.437000      0.2999000    
 C   -2.992100      2.2700001E-02  0.3959000    
 C   -4.455400     -0.1820000      0.2498000    
 C   -5.198500     -0.5036000       1.367000    
 C   -5.026800     -4.4300001E-02 -0.9986000    
 C   -6.573200     -0.6962000       1.229800    
 C   -6.401400     -0.2367000      -1.136000    
 C   -7.174800     -0.5625000     -2.1700000E-02
 C   -9.355100      0.2720000     -1.7000001E-02
 H    3.031500      0.6421000       2.428800    
 H    1.420500       2.148300      -1.322100    
 H    6.048200     -0.2430000     -0.5810000    
 H    5.337600       4.340300     -1.5900001E-02
 H  -0.6062000      -2.164800      4.1400000E-02
 H    3.365600      -4.217400      0.6748000    
 H   -1.008000       1.846200      -1.443000    
 H    3.864900       2.634700       3.657700    
 H    7.165500      -2.377900     -0.1353000    
 H    5.009000       4.470800       2.449100    
 H    5.295200      -5.286300      0.7840000    
 H   -4.741200     -0.6136000       2.345800    
 H   -4.448200      0.2217000      -1.878000    
 H   -7.167100     -0.9513000       2.103600    
 H   -6.861500     -0.1282000      -2.114800    
 H   -11.12800     -0.7795000     -0.3492000    
 H   -11.34720      0.9108000     -3.5799999E-02
 H   -9.705200       2.299400      0.3520000    
 H   -8.035500       1.856400      0.3864000    


%chk=000134315-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134315

0 1
O 3.551380 1.201668 -1.550719
O 1.609856 -1.941938 -0.705405
O 4.696560 3.121178 -2.237258
O -2.413782 0.308406 0.356512
O 5.474728 -4.803139 -1.283935
O -2.916644 2.326313 1.481089
N -8.827580 -0.199577 0.453189
N -10.750120 -1.173539 -0.410026
N -8.930764 -0.844955 -1.874888
C 3.321099 0.423327 -0.206438
C 4.114773 1.276836 0.780669
C 1.825604 0.414614 0.034800
C 3.869928 -0.971514 -0.413141
C 4.708269 2.372936 0.124927
C 1.044265 -0.727509 -0.267903
C 3.011456 -2.059204 -0.701470
C 4.367424 2.339062 -1.325512
C 4.292415 1.089024 2.163316
C 1.137278 1.566315 0.489137
C 5.267231 -1.226430 -0.421718
C 5.495189 3.317257 0.814660
C -0.355625 -0.728589 -0.139815
C 3.502305 -3.348696 -0.994789
C -0.260444 1.604383 0.635633
C 5.080475 2.030415 2.868820
C 5.788060 -2.495727 -0.707728
C -1.004155 0.438520 0.307907
C 5.677387 3.134793 2.203732
C 4.895590 -3.558609 -1.001216
C -3.304615 1.270389 0.927451
C -4.705280 0.836259 0.767791
C -5.730206 1.673417 1.297621
C -5.075966 -0.376041 0.123270
C -7.079006 1.320169 1.173647
C -6.427955 -0.729533 -0.011934
C -7.467747 0.118940 0.499742
C -9.448063 -0.729550 -0.586698
H 3.833814 0.240591 2.681610
H 1.714163 2.466008 0.727835
H 5.956086 -0.402369 -0.208826
H 5.942535 4.159030 0.276294
H -0.929883 -1.625318 -0.382197
H 2.787115 -4.150988 -1.206402
H -0.765548 2.500046 0.994043
H 5.232498 1.906615 3.946751
H 6.863855 -2.687359 -0.720633
H 6.281172 3.847310 2.775801
H 4.785334 -5.480373 -1.495816
H -5.437239 2.599493 1.803524
H -4.292721 -1.034124 -0.262876
H -7.869757 1.952883 1.587864
H -6.693996 -1.689757 -0.469400
H -11.142385 -1.074946 0.522579
H -11.316331 -1.555448 -1.161244
H -9.496479 -1.143779 -2.664964
H -7.995353 -0.488585 -2.058960


