%chk=000212509.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212509

0 1
O 2.166622 -0.466355 1.280263
O 1.536768 0.926395 -0.437994
O -1.578213 0.811584 0.274256
O -3.845674 0.844467 -0.234722
N -2.561528 2.787414 -0.005326
C 3.351849 -0.304072 0.450011
C 2.822056 0.375029 -0.844230
C 1.025809 0.168784 0.668864
C 4.358001 0.486966 1.265008
C 3.620209 1.538900 -1.392755
C 0.035505 -0.874835 0.214091
C -1.315013 -0.530217 -0.005677
C 0.407739 -2.206206 0.004447
C -2.266179 -1.457201 -0.435053
C -0.527932 -3.153136 -0.425301
C -1.856093 -2.776375 -0.646616
C -2.811098 1.427805 -0.014270
C -3.692335 3.737103 0.032680
H 3.702677 -1.341218 0.263095
H 2.607089 -0.382907 -1.629840
H 0.610348 0.900505 1.389167
H 5.322738 0.573761 0.756140
H 3.990767 1.498626 1.483795
H 4.525817 0.002432 2.237527
H 3.670053 2.367665 -0.672668
H 4.642852 1.245707 -1.651227
H 3.141126 1.943988 -2.295543
H 1.441888 -2.500757 0.196159
H -3.307323 -1.162574 -0.596419
H -0.220906 -4.184442 -0.583390
H -2.584264 -3.515133 -0.982858
H -1.635077 3.137526 0.230159
H -3.484273 4.580107 -0.649583
H -3.862522 4.129427 1.049808
H -4.627888 3.249638 -0.307098


%chk=000212509-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212509

0 1
O 2.283012 -0.735813 1.288608
O 1.435039 0.982544 -0.095987
O -1.535308 0.730183 0.346049
O -3.736059 0.995003 -0.556435
N -2.421256 2.788397 0.207616
C 3.404121 -0.204323 0.449783
C 2.654167 0.433306 -0.752204
C 1.037741 -0.051496 0.885139
C 4.263429 0.747824 1.288641
C 3.346867 1.563574 -1.504868
C 0.038327 -1.050616 0.311053
C -1.290189 -0.631550 0.024389
C 0.383680 -2.397589 0.068003
C -2.250276 -1.520993 -0.506957
C -0.558405 -3.302631 -0.471380
C -1.867489 -2.858697 -0.758639
C -2.684240 1.467948 -0.062923
C -3.405698 3.844287 -0.037158
H 3.990753 -1.086191 0.132047
H 2.346946 -0.372890 -1.451596
H 0.618410 0.498424 1.744304
H 5.167487 1.064313 0.735444
H 3.688583 1.645771 1.575379
H 4.584578 0.233683 2.210502
H 3.607587 2.391154 -0.824785
H 4.270024 1.197429 -1.989783
H 2.679119 1.956699 -2.290270
H 1.394346 -2.722352 0.332494
H -3.261161 -1.170213 -0.718504
H -0.275304 -4.344606 -0.654605
H -2.606823 -3.553248 -1.172832
H -1.486795 3.013483 0.551116
H -3.039684 4.566766 -0.789867
H -3.648043 4.388343 0.894219
H -4.323888 3.372477 -0.421094


