%chk=000221599.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221599

0 1
O -2.412738 -0.706890 -0.000504
O 4.487004 -0.556467 0.000126
O -5.785429 0.248588 -0.000458
O -4.834410 -1.702557 -0.001403
O 3.524068 1.524476 0.001260
N -4.811203 -0.486818 -0.000705
N 2.262305 -0.497562 0.000076
N 1.060662 0.128572 0.000309
C -1.294528 0.140051 -0.000031
C -1.680605 1.468206 0.000450
C -3.513650 0.168108 -0.000278
C -3.109134 1.488106 0.000294
C 5.830219 0.064944 0.000557
C -0.036820 -0.585831 -0.000175
C 6.758404 -1.126780 -0.000172
C 3.428020 0.326887 0.000587
H -1.026708 2.326069 0.000874
H -3.742778 2.362053 0.000575
H 5.905486 0.691320 -0.905275
H 5.905430 0.690166 0.907191
H -0.129201 -1.684127 -0.000811
H 7.809403 -0.808784 0.000099
H 6.600856 -1.764639 0.881367
H 6.600960 -1.763480 -0.882567
H 2.378287 -1.521411 -0.000485


%chk=000221599-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221599

0 1
O -2.442821 -0.720714 -0.000426
O 4.497544 -0.594060 0.000400
O -5.870797 0.325011 -0.000505
O -4.942321 -1.783350 -0.000821
O 3.570289 1.578067 0.001338
N -4.858688 -0.492420 -0.000670
N 2.259591 -0.407132 0.000279
N 1.054216 0.236316 0.000305
C -1.324011 0.141843 -0.000097
C -1.757367 1.477546 0.000149
C -3.562965 0.116472 -0.000381
C -3.186078 1.458998 -0.000048
C 5.873480 -0.008856 0.000919
C -0.037779 -0.509122 -0.000099
C 6.849254 -1.179982 -0.000578
C 3.453090 0.339088 0.000736
H -1.101099 2.344264 0.000420
H -3.868358 2.304681 0.000044
H 5.976215 0.630789 -0.894066
H 5.976427 0.628672 0.897389
H -0.043431 -1.614165 -0.000407
H 7.885798 -0.796928 -0.000247
H 6.713034 -1.810204 0.894405
H 6.712811 -1.808065 -0.897028
H 2.347867 -1.434549 -0.000107


