%chk=000227924.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227924

0 1
O -3.177856 -0.249669 -0.124193
O 2.141659 -0.876933 1.390840
O 1.135243 -1.459319 -1.399208
O -1.379973 -1.362612 0.669221
O 3.367302 0.447436 0.013839
N -0.506977 2.777645 -1.264663
C 0.310273 0.715497 -0.836611
C -1.089943 0.735023 -0.488757
C 0.655322 1.980500 -1.310403
C -1.578092 2.015534 -0.762778
C 1.935459 2.498093 -1.821035
C -2.922133 2.595558 -0.595666
C 1.200996 -0.449333 -0.756980
C -1.813341 -0.398516 0.082200
C 2.384010 -0.224394 0.231532
C -4.054918 -1.294581 0.400174
C 3.158771 -0.826445 2.449292
C -4.260164 -1.095760 1.888101
C 4.299527 -1.758096 2.103924
H -0.560614 3.739212 -1.551295
H 2.797401 2.020977 -1.301432
H 2.064246 2.275374 -2.893016
H 2.058841 3.580483 -1.687563
H -2.934708 3.436837 0.111514
H -3.349910 2.940743 -1.548771
H -3.626827 1.831223 -0.202426
H -4.968216 -1.120283 -0.196085
H -3.611646 -2.279094 0.162196
H 3.480632 0.221379 2.574909
H 2.558807 -1.166798 3.313931
H -5.016546 -1.783074 2.283910
H -3.325712 -1.281754 2.440714
H -4.576836 -0.072768 2.121944
H 4.991338 -1.878095 2.945395
H 3.931762 -2.756360 1.827278
H 4.878523 -1.381531 1.247165


%chk=000227924-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227924

0 1
O -3.492758 -0.415942 -0.169808
O 3.036793 -1.492084 1.124020
O 0.307054 -1.793676 0.831780
O -2.252982 -0.632218 1.799970
O 2.574935 0.670257 1.871576
N -0.335856 2.260476 -1.224917
C 0.115175 0.490622 0.084060
C -1.331305 0.597523 -0.091270
C 0.707870 1.550628 -0.641045
C -1.585560 1.708597 -0.908187
C 2.136377 1.952318 -0.885713
C -2.855139 2.354046 -1.382099
C 0.812338 -0.643340 0.705917
C -2.347330 -0.203151 0.627608
C 2.226362 -0.383166 1.285039
C -4.596122 -1.189204 0.477425
C 4.400696 -1.425047 1.741662
C -5.520740 -0.267514 1.279400
C 5.404512 -0.807224 0.764163
H -0.207659 3.082927 -1.814769
H 2.587723 2.371514 0.029961
H 2.755528 1.089433 -1.188229
H 2.203313 2.706239 -1.690796
H -3.007699 3.350283 -0.923221
H -2.854332 2.484948 -2.481383
H -3.709120 1.712786 -1.122344
H -5.115152 -1.660086 -0.373153
H -4.146273 -1.962180 1.124380
H 4.334405 -0.842446 2.677100
H 4.631523 -2.479085 1.961290
H -6.365139 -0.851937 1.690384
H -4.977386 0.190167 2.122867
H -5.936113 0.532952 0.641779
H 6.421144 -0.856244 1.196327
H 5.410573 -1.357449 -0.192481
H 5.166043 0.252374 0.569903


