%chk=000241055.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241055

0 1
O 2.234621 -1.695213 1.254749
O -3.262117 -0.342557 -0.715868
O -3.026290 -2.104051 0.700507
N 0.948124 -0.587336 -0.261141
C 2.112293 0.166999 -0.834069
C 2.797227 1.035298 0.242201
C 3.125993 -0.812566 -1.461328
C 3.959416 1.819714 -0.375764
C 4.293311 -0.033891 -2.079873
C 4.970065 0.874249 -1.042392
C -0.390077 -0.242374 -0.792708
C 1.114438 -1.486148 0.811046
C -1.200545 0.658831 0.109148
C -0.101230 -2.179318 1.345981
C -2.600504 0.547876 0.154794
C -0.615702 1.654020 0.904008
C -3.408401 1.360620 0.954866
C -1.400577 2.483463 1.710008
C -2.792368 2.339910 1.737346
C -3.476641 -1.662771 -0.323948
C -4.287228 -2.322128 -1.380627
H 1.711504 0.838582 -1.638959
H 3.171667 0.380615 1.060883
H 2.059717 1.720343 0.708821
H 2.635188 -1.447354 -2.218379
H 3.502372 -1.505347 -0.676006
H 4.464505 2.415640 0.407740
H 3.578377 2.547693 -1.116625
H 3.937036 0.570981 -2.934945
H 5.033490 -0.744023 -2.494785
H 5.777244 1.458638 -1.519920
H 5.456856 0.249260 -0.267324
H -0.954030 -1.183594 -0.999828
H -0.274736 0.262004 -1.784283
H 0.164693 -2.769560 2.237259
H -0.907003 -1.490004 1.647402
H -0.546483 -2.875439 0.622836
H 0.476988 1.778097 0.898116
H -4.488005 1.227911 0.955579
H -0.923081 3.246595 2.323890
H -3.397161 2.988882 2.369805
H -5.267601 -2.632522 -0.981746
H -3.787841 -3.231460 -1.752118
H -4.476604 -1.662565 -2.244548


%chk=000241055-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241055

0 1
O 2.862897 -1.693657 1.592888
O -2.915983 -0.019336 -1.216503
O -3.271578 -1.967145 0.044119
N 1.040931 -0.819678 0.426530
C 1.908121 0.019802 -0.467877
C 2.786380 1.033722 0.308323
C 2.763081 -0.851200 -1.426536
C 3.594902 1.915673 -0.674282
C 3.578957 0.037703 -2.397500
C 4.455805 1.053560 -1.627214
C -0.392986 -0.859386 0.088295
C 1.604139 -1.629191 1.412902
C -1.187678 0.369435 0.536272
C 0.653791 -2.447138 2.292760
C -2.408072 0.722291 -0.089379
C -0.744901 1.195163 1.598439
C -3.151954 1.855350 0.289964
C -1.481202 2.328753 2.006083
C -2.685251 2.666439 1.346654
C -3.359374 -1.355531 -1.037541
C -3.939775 -1.870137 -2.333826
H 1.198609 0.609276 -1.086162
H 3.471601 0.477008 0.970870
H 2.142678 1.669919 0.945211
H 2.102111 -1.535812 -1.995006
H 3.444968 -1.474122 -0.819986
H 4.237585 2.612256 -0.102036
H 2.900971 2.541546 -1.274720
H 2.887053 0.590308 -3.068183
H 4.208815 -0.601628 -3.045893
H 5.005711 1.700054 -2.338553
H 5.214114 0.503181 -1.034212
H -0.860627 -1.756803 0.525725
H -0.492920 -0.971562 -1.010400
H 1.243256 -2.822171 3.142730
H -0.199047 -1.858455 2.674285
H 0.248026 -3.319658 1.747011
H 0.196650 0.941389 2.096738
H -4.079782 2.087127 -0.242104
H -1.113009 2.949046 2.830164
H -3.257181 3.549365 1.650482
H -4.860677 -1.311110 -2.577216
H -4.176130 -2.939266 -2.237077
H -3.232126 -1.709382 -3.164440


