%chk=000123802.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123802

0 1
 O   -1.473300      3.3500001E-02  0.1931000    
 O   0.9075000      -3.345200      0.1523000    
 O   0.5013000       1.425300       1.602600    
 O   -2.435200      -1.115800      -1.648600    
 O  -0.7975000       2.790100      -1.535700    
 O   -4.126400      -2.289600      9.3800001E-02
 O   -1.042800       5.097100     -5.0799999E-02
 O   -3.821400     -0.3274000       1.213200    
 O    3.327800     -0.6798000       1.345900    
 O    5.629700     -0.3995000     -2.1100000E-02
 N    2.066500     -0.7650000     -0.6066000    
 C   0.7688000     -0.9268000      9.8999999E-03
 C  -0.1660000      0.2379000     -0.3561000    
 C   0.1534000      -2.270100     -0.4030000    
 C   -1.282000      -2.387200      0.1061000    
 C   -2.103400      -1.155900     -0.2684000    
 C   0.3348000       1.570700      0.1948000    
 C  -0.6118000       2.736700     -0.1166000    
 C   -3.423900      -1.181700      0.4350000    
 C  -9.1100000E-02   4.103700      0.3212000    
 C    3.240500     -0.6549000      0.1212000    
 C    4.444600     -0.4963000     -0.7823000    
 H   0.9032000     -0.9601000       1.098600    
 H  -0.2523000      0.3104000      -1.448300    
 H   0.1781000      -2.384600      -1.492900    
 H   -1.263300      -2.507700       1.198200    
 H   -1.725900      -3.307600     -0.2942000    
 H    1.319600       1.791200     -0.2333000    
 H   -1.596500       2.575400      0.3380000    
 H    2.108900     -0.7314000      -1.621300    
 H   0.9155000      -3.242500       1.119200    
 H   0.8512000       4.342300     -0.1827000    
 H   5.4200001E-02   4.144900       1.404800    
 H  -0.3731000       1.240800       1.986500    
 H   -1.920400      -1.792000      -2.118700    
 H   -1.414000       3.518900      -1.721800    
 H    4.522700      -1.369500      -1.436800    
 H    4.336200      0.4029000      -1.396700    
 H   -4.995800      -2.326200      0.5467000    
 H  -0.6857000       5.954500      0.2369000    
 H    5.582900      0.4269000      0.4893000    


%chk=000123802-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123802

0 1
O -1.788863 -0.356408 0.581852
O 1.321846 -3.113858 0.684137
O -1.705375 2.094799 1.163184
O -2.271080 -1.761502 -1.321067
O 1.121097 2.356009 -1.193261
O -4.510507 -1.567929 0.068751
O 0.489261 4.889176 -1.135354
O -3.572419 -2.577317 1.947790
O 3.493479 -1.735239 0.129136
O 5.459698 -0.394039 -1.025053
N 1.838622 -0.128685 -0.350840
C 0.668220 -0.711280 0.362186
C -0.549416 0.186322 -0.008882
C 0.401314 -2.215124 0.009156
C -0.981523 -2.678323 0.509590
C -2.107333 -1.735576 0.107310
C -0.452647 1.654723 0.551122
C -0.166762 2.687631 -0.555533
C -3.436207 -2.027388 0.844254
C -0.073265 4.116762 -0.005575
C 3.107767 -0.611717 -0.364438
C 4.175480 0.271601 -1.039181
H 0.836288 -0.664650 1.459805
H -0.664159 0.195434 -1.112053
H 0.461367 -2.312059 -1.097023
H -0.949277 -2.744265 1.609940
H -1.172967 -3.690464 0.116961
H 0.356366 1.693112 1.311992
H -0.974396 2.636867 -1.313286
H 1.688956 0.812081 -0.787239
H 2.267314 -2.778866 0.532312
H 0.608960 4.151907 0.868464
H -1.075769 4.474569 0.285396
H -2.251443 1.273907 1.314894
H -3.149105 -1.354414 -1.549908
H 1.428105 3.185903 -1.650766
H 3.870474 0.482126 -2.084365
H 4.241597 1.237780 -0.497618
H -5.375362 -1.730937 0.530420
H 0.620799 5.834901 -0.885147
H 5.316464 -1.259168 -0.540664


