%chk=000150598.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150598

0 1
 O   0.2065000      -2.330300      7.5999998E-02
 O    5.786200      0.1204000      0.4100000    
 O    3.628900      -1.460700     -0.3662000    
 O    2.878900       3.831400      0.4243000    
 O   -4.535700      0.7127000      0.3580000    
 O  -0.4320000      -4.207400       1.043800    
 O  -2.3000000E-02  -4.219500      -1.224600    
 O   -6.428200       1.231800       1.382900    
 O   -6.506800      0.5961000     -0.8313000    
 N   0.6496000       2.019800     -0.4110000    
 C    2.144600      0.3731000     -0.3706000    
 C   0.8913000     -0.1667000     -0.7528000    
 C    1.963900       1.725200     -0.1663000    
 C  -1.3700000E-02  0.8735000     -0.7692000    
 C   0.6011000      -1.580200      -1.074900    
 C    3.430100     -0.2643000     -0.1945000    
 C    3.007800       2.626200      0.2342000    
 C   5.8699999E-02   3.339900     -0.3056000    
 C   -1.387800      0.9355000      -1.069500    
 C    4.530400      0.6682000      0.2248000    
 C    4.342100       1.984000      0.4210000    
 C   -2.355100      0.2262000     -0.4359000    
 C   -3.807800      0.2934000     -0.7877000    
 C  -7.7699997E-02  -3.645100     -0.1455000    
 C    5.951700     -0.3079000       1.746700    
 C   -5.888900      0.8247000      0.1999000    
 C  -0.7651000      -5.598700      0.9948000    
 C   -7.849900       1.398600       1.389100    
 H  -0.2039000      -1.632000      -1.819400    
 H    1.477800      -2.055000      -1.530300    
 H   0.3130000       3.754400      0.6738000    
 H   -1.028300       3.307000     -0.3862000    
 H   0.4700000       3.959900      -1.106500    
 H   -1.691300       1.615500      -1.863200    
 H    5.159500       2.631000      0.7225000    
 H   -2.081500     -0.4522000      0.3692000    
 H   -3.984400      0.9940000      -1.612200    
 H   -4.144900     -0.7044000      -1.091300    
 H    6.945700     -0.7557000       1.840500    
 H    5.213000      -1.070200       2.018300    
 H    5.895800      0.5342000       2.445400    
 H   -1.627000      -5.758700      0.3399000    
 H   9.4800003E-02  -6.182100      0.6523000    
 H   -1.027800      -5.921200       2.005800    
 H   -8.144400       2.165700      0.6665000    
 H   -8.343600      0.4478000       1.166900    
 H   -8.149600       1.724500       2.388700    


%chk=000150598-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150598

0 1
O -0.368519 -1.716504 0.359140
O 5.798789 0.146076 1.021485
O 3.497234 -1.395169 0.075771
O 3.315078 4.142535 0.400566
O -4.665533 0.938272 -0.452030
O -1.890115 -3.118949 1.185156
O -1.280734 -3.347841 -1.074782
O -5.947986 0.143503 1.185161
O -4.661685 -1.381376 -0.053473
N 0.900580 2.466343 -0.429157
C 2.191113 0.629901 -0.105622
C 0.893225 0.176761 -0.517722
C 2.167878 2.044407 -0.054573
C 0.097399 1.340939 -0.708750
C 0.483471 -1.234452 -0.792153
C 3.405917 -0.129884 0.199556
C 3.329259 2.859733 0.347327
C 0.436901 3.867142 -0.492496
C -1.280673 1.495540 -1.157983
C 4.592418 0.709332 0.662680
C 4.526489 2.089801 0.703195
C -2.271033 0.567754 -0.997493
C -3.654144 0.738403 -1.555151
C -1.187980 -2.792986 0.044367
C 6.020262 -1.311853 1.187596
C -5.049247 -0.215771 0.200940
C -2.969545 -4.120243 0.981731
C -6.453871 -0.985660 2.002667
H -0.118968 -1.323359 -1.714653
H 1.361436 -1.894990 -0.848415
H 1.249777 4.513120 -0.130089
H -0.459676 3.994913 0.137129
H 0.192043 4.143430 -1.533723
H -1.526118 2.436584 -1.672147
H 5.403561 2.662134 1.019468
H -2.089834 -0.340702 -0.415783
H -3.759542 1.653961 -2.157598
H -3.963351 -0.149369 -2.137006
H 7.037126 -1.366422 1.604963
H 5.957542 -1.830890 0.219276
H 5.284508 -1.748727 1.881616
H -3.814372 -3.627355 0.473760
H -2.600330 -4.969189 0.383115
H -3.244888 -4.439269 1.996889
H -6.979950 -1.716078 1.365287
H -5.618225 -1.483019 2.523422
H -7.142687 -0.518127 2.719140


