%chk=000023890.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023890

0 1
 O   0.9480000       1.738900      -1.397700    
 O    3.677300       1.687400      -1.217700    
 O    4.915100      0.1961000      0.7533000    
 O   -4.962500       1.939200      0.3131000    
 O   -4.493200     -6.2399998E-02  -1.547100    
 O   -1.170700      -3.488100      -2.188600    
 N   0.2127000      -2.461700     -0.6089000    
 C  -0.7656000      -2.255300      0.4420000    
 C  -0.1565000      -2.458800       1.847900    
 C   0.5723000      -1.273000       2.493500    
 C   -1.487800     -0.9264000      0.1998000    
 C    1.395500     -0.4677000       1.523100    
 C   0.7579000      0.3010000      0.5267000    
 C  -0.7324000      0.3130000      0.4425000    
 C    1.535100       1.019600     -0.3954000    
 C    2.794700     -0.4915000       1.587200    
 C   -2.736700     -0.9878000     -0.2978000    
 C   -1.281600       1.514900      0.7026000    
 C    2.927300      0.9877000     -0.3185000    
 C    3.555400      0.2354000      0.6717000    
 C   -3.673600      0.1057000     -0.6458000    
 C   -2.669800       1.882700      0.7928000    
 C   -3.724100       1.329200      0.1880000    
 C  -9.0000004E-02  -3.054400      -1.810500    
 C   0.7152000       1.058800      -2.627500    
 C    4.020100       3.026700     -0.8702000    
 C    5.578800     -0.8288000      1.6600000E-02
 C   -5.660700       1.419400       1.424900    
 H   -1.486300      -3.078000      0.3300000    
 H   0.5383000      -3.308900       1.803600    
 H  -0.9561000      -2.762200       2.536800    
 H  -0.1531000     -0.6082000       2.980900    
 H    1.202100      -1.648200       3.310200    
 H    3.295200      -1.082600       2.350600    
 H    1.168300      -2.150700     -0.4650000    
 H   -3.158200      -1.966200     -0.5273000    
 H  -0.6292000       2.360600      0.9276000    
 H   -2.837700       2.791200       1.371200    
 H   0.8047000      -3.103000      -2.453000    
 H    1.656800      0.7034000      -3.058000    
 H   2.9400000E-02  0.2183000      -2.485300    
 H   0.2581000       1.764400      -3.326600    
 H    4.611500       3.451300      -1.685900    
 H    3.118800       3.633800     -0.7392000    
 H    4.621400       3.045800      4.4199999E-02
 H    6.655400     -0.7226000      0.1756000    
 H    5.268500      -1.817200      0.3700000    
 H    5.371800     -0.7303000      -1.053700    
 H   -5.835500      0.3428000       1.319300    
 H   -5.130800       1.623300       2.362000    
 H   -6.635600       1.913500       1.477300    


%chk=000023890-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023890

0 1
O 1.053025 1.722751 -1.270262
O 3.861296 1.542566 -1.140945
O 5.059707 -0.156954 0.908570
O -4.848402 2.218813 0.655459
O -5.154332 -0.528036 -0.062151
O -1.182835 -3.891933 -1.964326
N 0.184616 -2.504260 -0.653346
C -0.777776 -2.347789 0.462087
C -0.131479 -2.680137 1.841920
C 0.584353 -1.485166 2.532019
C -1.492428 -0.973147 0.452879
C 1.446888 -0.690026 1.568185
C 0.810549 0.127720 0.580312
C -0.686300 0.233247 0.514971
C 1.641833 0.859244 -0.316679
C 2.853400 -0.782157 1.612117
C -2.883362 -1.054405 0.358646
C -1.209969 1.537520 0.541262
C 3.062291 0.788997 -0.248983
C 3.674588 -0.059721 0.713759
C -3.984517 -0.094998 0.265411
C -2.544288 2.019177 0.582161
C -3.774628 1.351721 0.537783
C -0.104500 -3.264557 -1.771148
C 1.139730 1.240063 -2.669764
C 3.839656 3.005315 -0.882489
C 5.912373 -0.413342 -0.275020
C -6.221625 1.770825 0.999081
H -1.539790 -3.119432 0.257781
H 0.577385 -3.515314 1.685066
H -0.925714 -3.050503 2.517640
H -0.184423 -0.818485 2.967007
H 1.194304 -1.866720 3.370240
H 3.347551 -1.408208 2.361810
H 1.088269 -2.030625 -0.594612
H -3.291582 -2.069414 0.247119
H -0.458257 2.333401 0.580583
H -2.648638 3.107081 0.686123
H 0.738926 -3.272331 -2.500086
H 2.195753 1.106948 -2.965958
H 0.580116 0.291795 -2.777597
H 0.665070 2.023171 -3.279609
H 4.488535 3.448227 -1.653354
H 2.810317 3.393133 -0.974881
H 4.245377 3.216976 0.123990
H 6.941147 -0.418757 0.115176
H 5.669923 -1.403848 -0.706013
H 5.781995 0.372852 -1.035464
H -6.647104 1.162794 0.189942
H -6.211696 1.180568 1.931807
H -6.767328 2.715463 1.147080


