%chk=000030275.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030275

0 1
 O   0.6406000     -0.6168000      0.9814000    
 O   -3.596400      -2.373600     -0.3074000    
 O   0.6207000       1.984600       1.426600    
 N    3.817800      -1.692900     -0.5396000    
 C    2.917200     -0.9158000      0.2988000    
 C   -1.137500      0.8605000      0.3428000    
 C    1.483100      -1.392100      0.1314000    
 C  -0.6374000     -0.4038000      0.5586000    
 C  -0.5010000       3.302900     -0.2509000    
 C  -0.2643000       2.048400      0.5763000    
 C   0.7868000       4.093500     -0.4827000    
 C   -2.428600       1.086200     -8.1200004E-02
 C   -1.471200      -1.500400      0.3387000    
 C   -2.783500      -1.303500     -9.1200002E-02
 C   -3.262100     -1.0200000E-02 -0.3010000    
 C    3.731200      -3.118000     -0.2112000    
 C    5.197600      -1.223500     -0.3922000    
 C    1.812800       3.275200      -1.249500    
 C   -4.925800      -2.100700     -0.7478000    
 H    2.964400      0.1457000      2.4900001E-02
 H    3.199600     -0.9659000       1.359300    
 H    1.176000      -1.294000     -0.9186000    
 H    1.353300      -2.432500      0.4430000    
 H   -1.224800       3.928900      0.2823000    
 H  -0.9223000       3.036000      -1.226400    
 H    1.217500       4.412000      0.4736000    
 H   0.5516000       5.001400      -1.049700    
 H   -2.833200       2.081700     -0.2320000    
 H   -1.110600      -2.511800      0.5080000    
 H   -4.271200      0.2141000     -0.6298000    
 H    2.797000      -3.562900     -0.5673000    
 H    4.521300      -3.676500     -0.7282000    
 H    3.840000      -3.308500      0.8627000    
 H    5.864800      -1.767300      -1.070200    
 H    5.273900     -0.1642000     -0.6622000    
 H    5.568700      -1.346700      0.6318000    
 H    2.158100       2.408200     -0.6801000    
 H    2.690000       3.891600      -1.471800    
 H    1.402800       2.920900      -2.200900    
 H   -5.429900      -3.064800     -0.8705000    
 H   -5.490700      -1.537800      3.0000000E-03
 H   -4.932600      -1.609500      -1.726800    


%chk=000030275-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030275

0 1
O 1.032307 -0.365620 -0.080854
O -3.300392 -2.392543 -0.658258
O 1.105135 2.240581 0.677409
N 3.877942 -2.771949 -0.196345
C 3.156699 -1.479200 -0.124119
C -0.913844 1.072218 -0.006907
C 1.642403 -1.701897 -0.236976
C -0.348601 -0.249497 -0.143963
C -0.764200 3.673375 0.061882
C -0.091391 2.294255 0.266650
C 0.244906 4.841450 0.050477
C -2.325988 1.178815 -0.115662
C -1.185141 -1.367095 -0.362240
C -2.586829 -1.208395 -0.446703
C -3.173784 0.075261 -0.324269
C 3.883503 -3.505565 1.086800
C 5.237262 -2.644439 -0.759943
C 1.114286 4.873076 -1.225551
C -4.760026 -2.299404 -0.769131
H 3.474709 -0.841628 -0.967800
H 3.371984 -0.910002 0.811196
H 1.389401 -2.133308 -1.224803
H 1.267513 -2.376173 0.558700
H -1.493066 3.820236 0.887561
H -1.352895 3.669973 -0.876768
H 0.902912 4.750922 0.934164
H -0.312257 5.794162 0.147027
H -2.786659 2.165575 -0.015252
H -0.781675 -2.375310 -0.477888
H -4.255053 0.221757 -0.385305
H 2.852784 -3.653064 1.453274
H 4.332043 -4.504414 0.940124
H 4.460556 -2.978693 1.888564
H 5.682689 -3.648855 -0.879112
H 5.186080 -2.174921 -1.757935
H 5.929594 -2.036166 -0.124575
H 1.717774 3.952360 -1.304745
H 1.809288 5.732684 -1.210375
H 0.488615 4.959818 -2.134903
H -5.099960 -3.331727 -0.936061
H -5.208251 -1.904011 0.162447
H -5.056673 -1.664544 -1.625833


