%chk=000288317.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288317

0 1
O 2.443414 1.143199 -0.223100
O -0.878263 0.017760 0.866784
O 0.461342 -2.377122 0.498427
O -1.711633 1.000511 -1.059305
N -3.048034 -0.271343 0.383046
C 0.429282 0.009348 0.394864
C 1.092406 1.164762 0.122082
C 1.050899 -1.337719 0.310407
C 0.600159 2.553587 0.111099
C 2.483292 -1.252549 -0.044446
C 3.086256 -0.080025 -0.287413
C -1.889990 0.306122 -0.081530
C -4.324899 -0.071039 -0.330073
H 1.373774 3.275946 -0.192229
H 0.219600 2.857554 1.100132
H -0.249599 2.651105 -0.601959
H 3.011492 -2.205424 -0.104810
H 4.119782 0.117836 -0.563131
H -3.034331 -0.886747 1.192877
H -4.723778 -1.037433 -0.685859
H -4.189119 0.584443 -1.212920
H -5.066850 0.401727 0.336356


%chk=000288317-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288317

0 1
O 2.608990 1.148032 -0.127778
O -0.945645 0.564039 0.677152
O -0.028306 -2.062919 0.173406
O -1.800572 0.123221 -1.504223
N -3.111428 -0.108762 0.443788
C 0.380719 0.318351 0.277004
C 1.252615 1.379006 0.171671
C 0.788916 -1.091255 0.062362
C 0.944438 2.830785 0.361043
C 2.212803 -1.241349 -0.272695
C 3.043352 -0.158192 -0.349302
C -1.974184 0.143182 -0.269424
C -4.363510 -0.507150 -0.205659
H 1.517663 3.247445 1.209311
H -0.129719 2.959713 0.558180
H 1.218042 3.404679 -0.542539
H 2.603007 -2.246853 -0.450811
H 4.109039 -0.178324 -0.583648
H -3.026169 -0.133582 1.460035
H -4.610155 -1.562588 0.012980
H -4.234791 -0.398936 -1.293992
H -5.199902 0.135954 0.122439


